A0A5K4F8R2_SCHMA Loading...

Ribosomal RNA processing protein 1-like protein

AlphaFold DB , UniProt , Accession A0A5K4F8R2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 464 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
1M66Low89.6Confident95 Ų9560.6 Ų60.647%0.46830%0.296SS..  0-41.70-71.8-57.4-88.400114.9V3 L4 R5 Q45M1-V3 PolarHBondContact O-N 3.19Å; M1-L4 PolarHBondContact O-N 3.09Å; M1-R5 PolarHBondContact O-N 3.1Å; M1-Q45 HydrophobicContact SD-CG 4.25Å
2D83.2Confident90.1Very high99 Ų9955.7 Ų55.753%0.52927%0.272SS..Hα-helixtrans-67.2-33.2-172-65.9-35.1000115.6L4 R5 K6D2-L4 VanDerWaalsContact C-N 3.28Å; D2-L4 PolarHBondContact O-N 3.32Å; D2-R5 PolarHBondContact O-N 3.41Å; D2-R5 IonicContact OD1-NH1 2.7Å; D2-R5 PolarHBondContact OD1-NH1 3.08Å; D2-K6 WeakPolarHBondContact O-CB 3.46Å; D2-K6 VanDerWaalsContact O-CG 3.3Å; D2-K6 WeakPolarHBondContact O-CG 3.37Å; D2-K6 PolarHBondContact O-N 2.86Å
3V87.7Confident90.5Very high89 Ų8951.8 Ų51.854%0.53925%0.254SS..Hα-helixtrans-57.4-45.4175.2178.80000110.5M1 K6 L7 F35M1-V3 PolarHBondContact O-N 3.19Å; V3-K6 PolarHBondContact O-N 2.73Å; V3-L7 WeakPolarHBondContact O-CB 3.39Å; V3-L7 PolarHBondContact O-N 3.04Å; V3-F35 HydrophobicContact CB-CZ 4.46Å
4L89.8Confident90.7Very high7 Ų753.4 Ų53.44%0.03726%0.264CS..Hα-helixtrans-67.4-42.6-179.1-169.668.3000112.4M1 D2 K6 L7 A8 F35 W41 Q45 I49M1-L4 PolarHBondContact O-N 3.09Å; D2-L4 VanDerWaalsContact C-N 3.28Å; D2-L4 PolarHBondContact O-N 3.32Å; L4-K6 VanDerWaalsContact C-N 3.32Å; L4-K6 PolarHBondContact O-N 3.08Å; L4-L7 HydrophobicContact CD1-CD2 4.45Å; L4-L7 WeakPolarHBondContact O-CB 3.38Å; L4-L7 PolarHBondContact O-N 3.19Å; L4-A8 WeakPolarHBondContact O-CB 3.49Å; L4-A8 PolarHBondContact O-N 3Å; L4-F35 HydrophobicContact CB-CZ 4.15Å; L4-F35 HydrophobicContact CD1-CE2 4.39Å; L4-W41 HydrophobicContact CD1-CZ3 4.4Å; L4-Q45 VanDerWaalsContact CD2-CA 3.46Å; L4-Q45 HydrophobicContact CD2-CB 3.34Å; L4-Q45 HydrophobicContact CD2-CG 3.45Å; L4-Q45 VanDerWaalsContact CD2-CG 3.45Å; L4-I49 HydrophobicContact CD1-CD1 3.6Å; L4-I49 HydrophobicContact CD1-CG1 3.47Å; L4-I49 VanDerWaalsContact CD1-CG1 3.47Å; L4-I49 HydrophobicContact CG-CG1 4.49Å
5R88.8Confident91Very high105 Ų10558.6 Ų58.640%0.39629%0.287SS..Hα-helixtrans-61.4-41.7175.3-68.4177.5-177156.7-6.5111.4M1 D2 K9M1-R5 PolarHBondContact O-N 3.1Å; D2-R5 PolarHBondContact O-N 3.41Å; D2-R5 IonicContact OD1-NH1 2.7Å; D2-R5 PolarHBondContact OD1-NH1 3.08Å; R5-K9 WeakPolarHBondContact O-CB 3.35Å; R5-K9 VanDerWaalsContact O-CG 3.31Å; R5-K9 WeakPolarHBondContact O-CG 3.45Å; R5-K9 PolarHBondContact O-N 3.31Å
6K93.5Very high91.1Very high153 Ų15357.7 Ų57.767%0.66528%0.284SS*.Hα-helixtrans-62.6-44.2175.2-72.7173.7-177.1178.40111D2 V3 L4 K9 A10D2-K6 WeakPolarHBondContact O-CB 3.46Å; D2-K6 VanDerWaalsContact O-CG 3.3Å; D2-K6 WeakPolarHBondContact O-CG 3.37Å; D2-K6 PolarHBondContact O-N 2.86Å; V3-K6 PolarHBondContact O-N 2.73Å; L4-K6 VanDerWaalsContact C-N 3.32Å; L4-K6 PolarHBondContact O-N 3.08Å; K6-K9 PolarHBondContact O-N 3.16Å; K6-A10 WeakPolarHBondContact O-CB 3.49Å; K6-A10 PolarHBondContact O-N 3.46Å
7L95.3Very high91.4Very high9 Ų965.3 Ų65.35%0.04732%0.315CS..Hα-helixtrans-60.6-49.8176.4-178.367.9000111.9V3 L4 K9 A10 L11 A22 Q25 A26 L29V3-L7 WeakPolarHBondContact O-CB 3.39Å; V3-L7 PolarHBondContact O-N 3.04Å; L4-L7 HydrophobicContact CD1-CD2 4.45Å; L4-L7 WeakPolarHBondContact O-CB 3.38Å; L4-L7 PolarHBondContact O-N 3.19Å; L7-K9 VanDerWaalsContact C-N 3.32Å; L7-K9 PolarHBondContact O-N 2.88Å; L7-A10 CarbonylContact O-C 3.6Å; L7-A10 WeakPolarHBondContact O-CA 3.38Å; L7-A10 WeakPolarHBondContact O-CB 3.34Å; L7-A10 PolarHBondContact O-N 2.96Å; L7-L11 HydrophobicContact CG-CD1 4.38Å; L7-L11 WeakPolarHBondContact O-CG 3.32Å; L7-L11 PolarHBondContact O-N 3.15Å; L7-A22 HydrophobicContact CD1-CB 4.13Å; L7-A22 WeakPolarHBondContact CD1-O 3.5Å; L7-Q25 HydrophobicContact CD1-CB 3.81Å; L7-A26 HydrophobicContact CD2-CB 4.23Å; L7-L29 HydrophobicContact CD2-CD1 3.58Å
8A94Very high91.7Very high2 Ų265.1 Ų65.12%0.01732%0.319CS..Hα-helixtrans-60.5-40.717900000112.1L4 A10 L11 A12 F427L4-A8 WeakPolarHBondContact O-CB 3.49Å; L4-A8 PolarHBondContact O-N 3Å; A8-A10 VanDerWaalsContact C-N 3.33Å; A8-A10 PolarHBondContact O-N 3.48Å; A8-L11 PolarHBondContact O-N 2.87Å; A8-A12 PolarHBondContact O-N 3.39Å; A8-F427 HydrophobicContact CB-CE1 3.65Å; A8-F427 HydrophobicContact CB-CE2 4.23Å; A8-F427 HydrophobicContact CB-CZ 3.38Å
9K94.2Very high91.9Very high86 Ų8662.2 Ų62.237%0.37430%0.304SS..Hα-helixtrans-64-35.6172.7-73.6176.4179.6-178.80112.6R5 K6 L7 A12 S13R5-K9 WeakPolarHBondContact O-CB 3.35Å; R5-K9 VanDerWaalsContact O-CG 3.31Å; R5-K9 WeakPolarHBondContact O-CG 3.45Å; R5-K9 PolarHBondContact O-N 3.31Å; K6-K9 PolarHBondContact O-N 3.16Å; L7-K9 VanDerWaalsContact C-N 3.32Å; L7-K9 PolarHBondContact O-N 2.88Å; K9-A12 CarbonylContact O-C 3.59Å; K9-S13 PolarHBondContact O-N 2.97Å
10A96.7Very high92.1Very high22 Ų2263.1 Ų63.118%0.18230%0.304CS..Hα-helixtrans-71.6-37.2176.900000112.2K6 L7 A8 A12 S13 V18 A22K6-A10 WeakPolarHBondContact O-CB 3.49Å; K6-A10 PolarHBondContact O-N 3.46Å; L7-A10 CarbonylContact O-C 3.6Å; L7-A10 WeakPolarHBondContact O-CA 3.38Å; L7-A10 WeakPolarHBondContact O-CB 3.34Å; L7-A10 PolarHBondContact O-N 2.96Å; A8-A10 VanDerWaalsContact C-N 3.33Å; A8-A10 PolarHBondContact O-N 3.48Å; A10-A12 VanDerWaalsContact C-N 3.28Å; A10-A12 PolarHBondContact O-N 2.87Å; A10-S13 WeakPolarHBondContact O-CB 3.43Å; A10-S13 PolarHBondContact O-N 3.38Å; A10-S13 VanDerWaalsContact O-N 3.12Å; A10-V18 HydrophobicContact CB-CG1 4.09Å; A10-A22 HydrophobicContact CB-CB 3.7Å
11L96.9Very high92.3Very high0 Ų066.8 Ų66.80%032%0.318CS..Hα-helixtrans-61-37.3174-72.4171000112.2L7 A8 S13 R19 A22 Q23 I49 G52 L53 S56L7-L11 HydrophobicContact CG-CD1 4.38Å; L7-L11 WeakPolarHBondContact O-CG 3.32Å; L7-L11 PolarHBondContact O-N 3.15Å; A8-L11 PolarHBondContact O-N 2.87Å; L11-S13 VanDerWaalsContact C-N 3.31Å; L11-R19 VanDerWaalsContact O-CD 3.25Å; L11-R19 WeakPolarHBondContact O-CD 3.18Å; L11-R19 VanDerWaalsContact O-CG 3.31Å; L11-R19 WeakPolarHBondContact O-CG 3.33Å; L11-A22 HydrophobicContact CD2-CB 3.7Å; L11-A22 HydrophobicContact CG-CB 3.92Å; L11-Q23 HydrophobicContact CD2-CB 4.32Å; L11-Q23 HydrophobicContact CD2-CG 3.68Å; L11-I49 HydrophobicContact CD1-CG2 4.34Å; L11-G52 WeakPolarHBondContact CB-O 3.45Å; L11-L53 HydrophobicContact CD1-CD2 3.88Å; L11-L53 HydrophobicContact CD1-CG 4.16Å; L11-L53 HydrophobicContact CD2-CD2 3.65Å; L11-L53 HydrophobicContact CG-CD2 4.39Å; L11-S56 VanDerWaalsContact O-CA 3.28Å; L11-S56 WeakPolarHBondContact O-CA 3.21Å; L11-S56 WeakPolarHBondContact O-CB 3.41Å; L11-S56 PolarHBondContact O-OG 3.14Å
12A95Very high93.8Very high1 Ų162.3 Ų62.31%0.00830%0.296CS..THydrogen-bonded Turntrans-90.518.1175.900000113.9A8 K9 A10 F423A8-A12 PolarHBondContact O-N 3.39Å; K9-A12 CarbonylContact O-C 3.59Å; A10-A12 VanDerWaalsContact C-N 3.28Å; A10-A12 PolarHBondContact O-N 2.87Å; A12-F423 HydrophobicContact CB-CD1 3.53Å; A12-F423 HydrophobicContact CB-CE1 3.29Å; A12-F423 HydrophobicContact CB-CZ 4.24Å
13S95Very high94.5Very high5 Ų558 Ų584%0.03527%0.273CS..  trans-70.2146.1178.5-172.90000111.9K9 A10 L11 Q15 R19 R424K9-S13 PolarHBondContact O-N 2.97Å; A10-S13 WeakPolarHBondContact O-CB 3.43Å; A10-S13 PolarHBondContact O-N 3.38Å; A10-S13 VanDerWaalsContact O-N 3.12Å; L11-S13 VanDerWaalsContact C-N 3.31Å; S13-Q15 PolarHBondContact O-N 3.31Å; S13-Q15 PolarHBondContact OG-N 3.13Å; S13-R19 WeakPolarHBondContact O-CD 2.9Å; S13-R19 WeakPolarHBondContact O-CG 3.36Å; S13-R19 PolarHBondContact O-NH1 2.78Å; S13-R424 PolarHBondContact OG-NH2 2.91Å
14N93.8Very high94.9Very high75 Ų7561.3 Ų61.340%0.40128%0.28SS..SBendtrans-66-25.5173.1-65.5-8000112.2R19 S418 G420N14-R19 VanDerWaalsContact C-NH1 3.33Å; N14-R19 PolarHBondContact O-NH1 2.76Å; N14-S418 PolarHBondContact ND2-OG 2.98Å; N14-G420 WeakPolarHBondContact OD1-CA 3.42Å
15Q94.8Very high95.1Very high131 Ų13165.1 Ų65.161%0.61230%0.298SS*.  trans-84.9119.3-176.8-66.1-65.6-9.800111.7S13 K17 V18 R19S13-Q15 PolarHBondContact O-N 3.31Å; S13-Q15 PolarHBondContact OG-N 3.13Å; Q15-K17 VanDerWaalsContact C-N 3.34Å; Q15-K17 PolarHBondContact O-N 3.22Å; Q15-V18 HydrophobicContact CB-CB 4.12Å; Q15-V18 HydrophobicContact CB-CG2 3.76Å; Q15-V18 WeakPolarHBondContact O-CB 3.38Å; Q15-V18 PolarHBondContact O-N 3.15Å; Q15-V18 VanDerWaalsContact O-N 3.13Å; Q15-R19 PolarHBondContact O-N 3.07Å; Q15-R19 VanDerWaalsContact O-N 3.09Å
16D92.9Very high95.4Very high44 Ų4460.1 Ų60.124%0.23528%0.279CS..Hα-helixtrans-59.1-42.3-176.7-170.568.5000112.7V18 R19 R20 Q60D16-V18 VanDerWaalsContact C-N 3.3Å; D16-V18 PolarHBondContact O-N 3.31Å; D16-R19 PolarHBondContact O-N 3.17Å; D16-R19 VanDerWaalsContact O-N 3.16Å; D16-R19 IonicContact OD1-CZ 2.8Å; D16-R19 IonicContact OD1-NH2 3.59Å; D16-R19 PolarHBondContact OD1-NH2 3.16Å; D16-R20 WeakPolarHBondContact O-CG 3.02Å; D16-R20 PolarHBondContact O-N 2.69Å; D16-R20 IonicContact OD2-CZ 2.66Å; D16-R20 IonicContact OD2-NE 3.08Å; D16-R20 PolarHBondContact OD2-NE 3.41Å; D16-R20 IonicContact OD2-NH2 3.77Å; D16-Q60 PolarHBondContact OD1-NE2 3.46Å
17K95.5Very high95.5Very high187 Ų18757 Ų5781%0.81327%0.266SS*.Hα-helixtrans-56.7-43176.6-66.8-174.4178.9-178.30112.2Q15 K21Q15-K17 VanDerWaalsContact C-N 3.34Å; Q15-K17 PolarHBondContact O-N 3.22Å; K17-K21 PolarHBondContact O-N 3.14Å; K17-K21 VanDerWaalsContact O-N 3.09Å
18V96.7Very high95.4Very high62 Ų6260.8 Ų60.838%0.37629%0.289SS..Hα-helixtrans-66.2-44.6178.6178.70000110.3A10 Q15 D16 K21 A22A10-V18 HydrophobicContact CB-CG1 4.09Å; Q15-V18 HydrophobicContact CB-CB 4.12Å; Q15-V18 HydrophobicContact CB-CG2 3.76Å; Q15-V18 WeakPolarHBondContact O-CB 3.38Å; Q15-V18 PolarHBondContact O-N 3.15Å; Q15-V18 VanDerWaalsContact O-N 3.13Å; D16-V18 VanDerWaalsContact C-N 3.3Å; D16-V18 PolarHBondContact O-N 3.31Å; V18-K21 PolarHBondContact O-N 3.36Å; V18-A22 WeakPolarHBondContact O-CB 3.44Å; V18-A22 PolarHBondContact O-N 3.48Å
19R96.5Very high95.4Very high9 Ų962.3 Ų62.33%0.03430%0.296CS..Hα-helixtrans-61.3-46.8177.2-65.1-162-60-88.80.8112L11 S13 N14 Q15 D16 K21 A22 Q23 S56L11-R19 VanDerWaalsContact O-CD 3.25Å; L11-R19 WeakPolarHBondContact O-CD 3.18Å; L11-R19 VanDerWaalsContact O-CG 3.31Å; L11-R19 WeakPolarHBondContact O-CG 3.33Å; S13-R19 WeakPolarHBondContact O-CD 2.9Å; S13-R19 WeakPolarHBondContact O-CG 3.36Å; S13-R19 PolarHBondContact O-NH1 2.78Å; N14-R19 VanDerWaalsContact C-NH1 3.33Å; N14-R19 PolarHBondContact O-NH1 2.76Å; Q15-R19 PolarHBondContact O-N 3.07Å; Q15-R19 VanDerWaalsContact O-N 3.09Å; D16-R19 PolarHBondContact O-N 3.17Å; D16-R19 VanDerWaalsContact O-N 3.16Å; D16-R19 IonicContact OD1-CZ 2.8Å; D16-R19 IonicContact OD1-NH2 3.59Å; D16-R19 PolarHBondContact OD1-NH2 3.16Å; R19-K21 VanDerWaalsContact C-N 3.34Å; R19-K21 PolarHBondContact O-N 3.49Å; R19-A22 CarbonylContact O-C 3.58Å; R19-A22 PolarHBondContact O-N 3.46Å; R19-A22 VanDerWaalsContact O-N 3.17Å; R19-Q23 VanDerWaalsContact O-CG 3.3Å; R19-Q23 WeakPolarHBondContact O-CG 3.46Å; R19-Q23 PolarHBondContact O-N 3.21Å; R19-S56 WeakPolarHBondContact CD-OG 3.37Å
20R95.9Very high95.3Very high81 Ų8158.2 Ų58.231%0.30628%0.279SS..Hα-helixtrans-59.2-44.5178.4-72-171.7-175.3-1251.3111.8D16 Q23 K24D16-R20 WeakPolarHBondContact O-CG 3.02Å; D16-R20 PolarHBondContact O-N 2.69Å; D16-R20 IonicContact OD2-CZ 2.66Å; D16-R20 IonicContact OD2-NE 3.08Å; D16-R20 PolarHBondContact OD2-NE 3.41Å; D16-R20 IonicContact OD2-NH2 3.77Å; R20-Q23 PolarHBondContact O-N 3.28Å; R20-K24 WeakPolarHBondContact O-CG 3.25Å; R20-K24 PolarHBondContact O-N 3.27Å; R20-K24 VanDerWaalsContact O-N 3.11Å
21K96.8Very high95.1Very high140 Ų14059 Ų5961%0.60928%0.282SS*.Hα-helixtrans-61.5-45.3175.1-173175.5-179.6176.30111K17 V18 R19 Q23 K24 Q25K17-K21 PolarHBondContact O-N 3.14Å; K17-K21 VanDerWaalsContact O-N 3.09Å; V18-K21 PolarHBondContact O-N 3.36Å; R19-K21 VanDerWaalsContact C-N 3.34Å; R19-K21 PolarHBondContact O-N 3.49Å; K21-Q23 PolarHBondContact O-N 3.18Å; K21-K24 PolarHBondContact O-N 2.93Å; K21-Q25 WeakPolarHBondContact O-CG 3.31Å; K21-Q25 PolarHBondContact O-N 3.46Å
22A97.3Very high94.6Very high1 Ų164.3 Ų64.31%0.00831%0.306CS..Hα-helixtrans-63.8-37.5178.300000112.8L7 A10 L11 V18 R19 Q25 A26L7-A22 HydrophobicContact CD1-CB 4.13Å; L7-A22 WeakPolarHBondContact CD1-O 3.5Å; A10-A22 HydrophobicContact CB-CB 3.7Å; L11-A22 HydrophobicContact CD2-CB 3.7Å; L11-A22 HydrophobicContact CG-CB 3.92Å; V18-A22 WeakPolarHBondContact O-CB 3.44Å; V18-A22 PolarHBondContact O-N 3.48Å; R19-A22 CarbonylContact O-C 3.58Å; R19-A22 PolarHBondContact O-N 3.46Å; R19-A22 VanDerWaalsContact O-N 3.17Å; A22-Q25 PolarHBondContact O-N 3.06Å; A22-A26 WeakPolarHBondContact O-CB 3.36Å; A22-A26 PolarHBondContact O-N 3.06Å
23Q96.9Very high93.6Very high10 Ų1071.5 Ų71.55%0.04734%0.337CS..Hα-helixtrans-65.2-42.1175.1-70.8170.28.500112L11 R19 R20 K21 Q25 A26 K27 L53 S56 L73L11-Q23 HydrophobicContact CD2-CB 4.32Å; L11-Q23 HydrophobicContact CD2-CG 3.68Å; R19-Q23 VanDerWaalsContact O-CG 3.3Å; R19-Q23 WeakPolarHBondContact O-CG 3.46Å; R19-Q23 PolarHBondContact O-N 3.21Å; R20-Q23 PolarHBondContact O-N 3.28Å; K21-Q23 PolarHBondContact O-N 3.18Å; Q23-Q25 VanDerWaalsContact C-N 3.33Å; Q23-A26 PolarHBondContact O-N 3.25Å; Q23-K27 PolarHBondContact O-N 3.08Å; Q23-L53 HydrophobicContact CG-CD2 4.3Å; Q23-S56 PolarHBondContact NE2-OG 3.03Å; Q23-L73 HydrophobicContact CG-CD2 4.13Å
24K96Very high92.6Very high157 Ų15772.4 Ų72.468%0.68334%0.343SS*.Hα-helixtrans-61.1-43.5172.9-70.2-177.5178.5-171.30111.1R20 K21 K27 V28R20-K24 WeakPolarHBondContact O-CG 3.25Å; R20-K24 PolarHBondContact O-N 3.27Å; R20-K24 VanDerWaalsContact O-N 3.11Å; K21-K24 PolarHBondContact O-N 2.93Å; K24-K27 WeakPolarHBondContact O-CB 3.36Å; K24-K27 PolarHBondContact O-N 2.87Å; K24-V28 WeakPolarHBondContact O-CG2 3.48Å; K24-V28 PolarHBondContact O-N 3.47Å
25Q95Very high91.4Very high87 Ų8769.6 Ų69.641%0.40733%0.327SS..Hα-helixtrans-62.1-42.8175.7-73.1175.7-28.800112.1L7 K21 A22 Q23 K27 V28 L29L7-Q25 HydrophobicContact CD1-CB 3.81Å; K21-Q25 WeakPolarHBondContact O-CG 3.31Å; K21-Q25 PolarHBondContact O-N 3.46Å; A22-Q25 PolarHBondContact O-N 3.06Å; Q23-Q25 VanDerWaalsContact C-N 3.33Å; Q25-K27 VanDerWaalsContact C-N 3.33Å; Q25-K27 PolarHBondContact O-N 3.3Å; Q25-V28 PolarHBondContact O-N 2.96Å; Q25-L29 WeakPolarHBondContact O-CB 3.41Å; Q25-L29 VanDerWaalsContact O-CG 3.25Å; Q25-L29 WeakPolarHBondContact O-CG 3.39Å; Q25-L29 PolarHBondContact O-N 3.34Å
26A95.4Very high90.1Very high0 Ų068 Ų680%032%0.323CS..Hα-helixtrans-60.2-43.2176.100000111.6L7 A22 Q23 L29 L30 I49L7-A26 HydrophobicContact CD2-CB 4.23Å; A22-A26 WeakPolarHBondContact O-CB 3.36Å; A22-A26 PolarHBondContact O-N 3.06Å; Q23-A26 PolarHBondContact O-N 3.25Å; A26-L29 PolarHBondContact O-N 3.21Å; A26-L30 WeakPolarHBondContact O-CB 3.43Å; A26-L30 WeakPolarHBondContact O-CG 3.48Å; A26-L30 PolarHBondContact O-N 2.89Å; A26-I49 HydrophobicContact CB-CG2 4.39Å
27K95.3Very high88.6Confident89 Ų8969 Ų6939%0.38734%0.343SS..Hα-helixtrans-58-49.7174.6-169-178.1178.8-1780112Q23 K24 Q25 L29 L30 S31 N75 I76 S79Q23-K27 PolarHBondContact O-N 3.08Å; K24-K27 WeakPolarHBondContact O-CB 3.36Å; K24-K27 PolarHBondContact O-N 2.87Å; Q25-K27 VanDerWaalsContact C-N 3.33Å; Q25-K27 PolarHBondContact O-N 3.3Å; K27-L29 VanDerWaalsContact C-N 3.34Å; K27-L29 PolarHBondContact O-N 3.27Å; K27-L30 PolarHBondContact O-N 2.75Å; K27-S31 PolarHBondContact O-N 3.05Å; K27-S31 VanDerWaalsContact O-N 3.1Å; K27-N75 WeakPolarHBondContact CE-O 3.5Å; K27-I76 HydrophobicContact CB-CG1 4.16Å; K27-I76 HydrophobicContact CG-CG1 4.39Å; K27-S79 WeakPolarHBondContact CE-OG 3.28Å; K27-S79 VanDerWaalsContact CG-OG 3.29Å; K27-S79 WeakPolarHBondContact CG-OG 3.37Å
28V93.5Very high87Confident87 Ų8769.1 Ų69.153%0.52734%0.344SS..Hα-helixtrans-67.5-33.4-179.3172.20000112.4K24 Q25 S31K24-V28 WeakPolarHBondContact O-CG2 3.48Å; K24-V28 PolarHBondContact O-N 3.47Å; Q25-V28 PolarHBondContact O-N 2.96Å; V28-S31 PolarHBondContact O-OG 2.99Å
29L92.7Very high85.8Confident34 Ų3470.4 Ų70.418%0.17835%0.349CS..Hα-helixtrans-70.6-46.4177-73.8168.3000110.8L7 Q25 A26 K27 S31 K32 W41L7-L29 HydrophobicContact CD2-CD1 3.58Å; Q25-L29 WeakPolarHBondContact O-CB 3.41Å; Q25-L29 VanDerWaalsContact O-CG 3.25Å; Q25-L29 WeakPolarHBondContact O-CG 3.39Å; Q25-L29 PolarHBondContact O-N 3.34Å; A26-L29 PolarHBondContact O-N 3.21Å; K27-L29 VanDerWaalsContact C-N 3.34Å; K27-L29 PolarHBondContact O-N 3.27Å; L29-S31 VanDerWaalsContact C-N 3.25Å; L29-S31 PolarHBondContact O-N 3.39Å; L29-K32 WeakPolarHBondContact O-CB 3.16Å; L29-K32 PolarHBondContact O-N 3.24Å; L29-K32 VanDerWaalsContact O-N 3.14Å; L29-W41 HydrophobicContact CB-CH2 4.29Å; L29-W41 HydrophobicContact CB-CZ2 4.4Å; L29-W41 WeakPolarHBondContact O-CZ2 3.35Å
30L93Very high85.2Confident1 Ų176.1 Ų76.11%0.00538%0.38CS..Hα-helixtrans-72.1-16.6-178.5-68.9170.3000113.8A26 K27 W41 L46 I49 I76 I80 V85 Y89A26-L30 WeakPolarHBondContact O-CB 3.43Å; A26-L30 WeakPolarHBondContact O-CG 3.48Å; A26-L30 PolarHBondContact O-N 2.89Å; K27-L30 PolarHBondContact O-N 2.75Å; L30-W41 HydrophobicContact CD2-CD2 4.34Å; L30-W41 HydrophobicContact CD2-CE3 4.32Å; L30-W41 HydrophobicContact CD2-CH2 3.74Å; L30-W41 HydrophobicContact CD2-CZ2 3.79Å; L30-W41 HydrophobicContact CD2-CZ3 4.04Å; L30-W41 HydrophobicContact CG-CH2 4.4Å; L30-W41 HydrophobicContact CG-CZ2 4.46Å; L30-L46 HydrophobicContact CD2-CD2 3.35Å; L30-I49 HydrophobicContact CD1-CD1 4.43Å; L30-I49 HydrophobicContact CD1-CG2 4.4Å; L30-I49 HydrophobicContact CD2-CD1 4.03Å; L30-I49 HydrophobicContact CG-CD1 4.34Å; L30-I76 HydrophobicContact CB-CG2 4.4Å; L30-I76 HydrophobicContact CD1-CG2 3.48Å; L30-I76 VanDerWaalsContact CD1-CG2 3.48Å; L30-I80 HydrophobicContact CB-CD1 4.36Å; L30-I80 HydrophobicContact CB-CG1 4.09Å; L30-V85 HydrophobicContact CD2-CG1 4.34Å; L30-Y89 HydrophobicContact CD1-CD2 4.17Å; L30-Y89 HydrophobicContact CD1-CE2 4.05Å
31S91.4Very high84.8Confident37 Ų3772.8 Ų72.826%0.25937%0.367SS..THydrogen-bonded Turntrans-75.7-13.7171.467.80000113.1K27 V28 L29 S79K27-S31 PolarHBondContact O-N 3.05Å; K27-S31 VanDerWaalsContact O-N 3.1Å; V28-S31 PolarHBondContact O-OG 2.99Å; L29-S31 VanDerWaalsContact C-N 3.25Å; L29-S31 PolarHBondContact O-N 3.39Å; S31-S79 VanDerWaalsContact CA-O 3.28Å; S31-S79 WeakPolarHBondContact CA-O 3.43Å; S31-S79 WeakPolarHBondContact CB-O 3.39Å
32K86.9Confident84.6Confident113 Ų11369.2 Ų69.249%0.49136%0.357SS..SBendtrans-82.4137.8176-60.7-179.7-179.8-171.80110.2L29 S34L29-K32 WeakPolarHBondContact O-CB 3.16Å; L29-K32 PolarHBondContact O-N 3.24Å; L29-K32 VanDerWaalsContact O-N 3.14Å; K32-S34 VanDerWaalsContact C-N 3.31Å; K32-S34 PolarHBondContact O-N 2.98Å
33K74.2Confident84.5Confident152 Ų15271 Ų7166%0.66136%0.364SS*.SBendtrans-56.8-42.4176.2-67.3-174.3178-1770112.7
34S73.6Confident84.3Confident23 Ų2375.1 Ų75.116%0.16138%0.383CS..SBendtrans-119.9145.4176.6168.90000111K32 N36 G37 K38 D39K32-S34 VanDerWaalsContact C-N 3.31Å; K32-S34 PolarHBondContact O-N 2.98Å; S34-N36 PolarHBondContact OG-N 3.44Å; S34-G37 WeakPolarHBondContact OG-CA 3.45Å; S34-G37 PolarHBondContact OG-N 3.41Å; S34-K38 PolarHBondContact OG-N 3.17Å; S34-K38 VanDerWaalsContact OG-N 3.13Å; S34-D39 PolarHBondContact OG-N 2.92Å; S34-D39 PolarHBondContact OG-O 2.99Å
35F70.1Confident84.1Confident16 Ų1668.6 Ų68.67%0.0736%0.355CS..SBendtrans-63.9-43.1179.1178.5-115.7000112.1V3 L4 D39 W41V3-F35 HydrophobicContact CB-CZ 4.46Å; L4-F35 HydrophobicContact CB-CZ 4.15Å; L4-F35 HydrophobicContact CD1-CE2 4.39Å; F35-D39 PolarHBondContact N-O 2.84Å; F35-W41 HydrophobicContact CB-CD2 4.18Å; F35-W41 HydrophobicContact CB-CE3 4.46Å; F35-W41 HydrophobicContact CB-CZ2 4.22Å; F35-W41 HydrophobicContact CD2-CE3 4.22Å; F35-W41 AromaticContact CD2-CH2 3.31Å; F35-W41 HydrophobicContact CD2-CH2 3.31Å; F35-W41 AromaticContact CD2-CZ2 3.66Å; F35-W41 HydrophobicContact CD2-CZ2 3.66Å; F35-W41 AromaticContact CD2-CZ3 3.61Å; F35-W41 HydrophobicContact CD2-CZ3 3.61Å; F35-W41 AromaticContact CE2-CH2 3.86Å; F35-W41 HydrophobicContact CE2-CH2 3.86Å; F35-W41 HydrophobicContact CE2-CZ3 4.08Å; F35-W41 HydrophobicContact CG-CH2 4.3Å; F35-W41 HydrophobicContact CG-CZ2 4.41Å; F35-W41 HydrophobicContact CG-CZ3 4.35Å
36N66.1Low84.1Confident99 Ų9964.4 Ų64.453%0.52934%0.336SS..SBendtrans-122.79-176.2-76.4-18.5000113.4S34 K38S34-N36 PolarHBondContact OG-N 3.44Å; N36-K38 PolarHBondContact O-N 3.38Å
37G62.7Low84.1Confident64 Ų6465.7 Ų65.766%0.6634%0.343SS*.SBendtrans76.9-0.4-173.200000114.7S34S34-G37 WeakPolarHBondContact OG-CA 3.45Å; S34-G37 PolarHBondContact OG-N 3.41Å
38K61.3Low84.1Confident189 Ų18961.7 Ų61.782%0.82233%0.326SS*.SBendtrans-134.4-37.4177.6-66.9-173.2179.6-176.20112.7S34 N36S34-K38 PolarHBondContact OG-N 3.17Å; S34-K38 VanDerWaalsContact OG-N 3.13Å; N36-K38 PolarHBondContact O-N 3.38Å
39D72.4Confident84.2Confident90 Ų9057.5 Ų57.548%0.48130%0.301SS..SBendtrans-100.4134.6-177.2-52.9-29.9000111.5S34 F35S34-D39 PolarHBondContact OG-N 2.92Å; S34-D39 PolarHBondContact OG-O 2.99Å; F35-D39 PolarHBondContact N-O 2.84Å
40D82.1Confident84.5Confident129 Ų12955.9 Ų55.969%0.6929%0.293SS*.PPolyproline II helixtrans-71.4157.9169.5-68.3-24.1000111.2T42D40-T42 PolarHBondContact O-N 3.33Å
41W89.4Confident84.6Confident11 Ų1158.4 Ų58.44%0.04230%0.303CS..PPolyproline II helixtrans-69.1126.7177.1-7392.9000111.2L4 L29 L30 F35 Q45 L46 I49 V85L4-W41 HydrophobicContact CD1-CZ3 4.4Å; L29-W41 HydrophobicContact CB-CH2 4.29Å; L29-W41 HydrophobicContact CB-CZ2 4.4Å; L29-W41 WeakPolarHBondContact O-CZ2 3.35Å; L30-W41 HydrophobicContact CD2-CD2 4.34Å; L30-W41 HydrophobicContact CD2-CE3 4.32Å; L30-W41 HydrophobicContact CD2-CH2 3.74Å; L30-W41 HydrophobicContact CD2-CZ2 3.79Å; L30-W41 HydrophobicContact CD2-CZ3 4.04Å; L30-W41 HydrophobicContact CG-CH2 4.4Å; L30-W41 HydrophobicContact CG-CZ2 4.46Å; F35-W41 HydrophobicContact CB-CD2 4.18Å; F35-W41 HydrophobicContact CB-CE3 4.46Å; F35-W41 HydrophobicContact CB-CZ2 4.22Å; F35-W41 HydrophobicContact CD2-CE3 4.22Å; F35-W41 AromaticContact CD2-CH2 3.31Å; F35-W41 HydrophobicContact CD2-CH2 3.31Å; F35-W41 AromaticContact CD2-CZ2 3.66Å; F35-W41 HydrophobicContact CD2-CZ2 3.66Å; F35-W41 AromaticContact CD2-CZ3 3.61Å; F35-W41 HydrophobicContact CD2-CZ3 3.61Å; F35-W41 AromaticContact CE2-CH2 3.86Å; F35-W41 HydrophobicContact CE2-CH2 3.86Å; F35-W41 HydrophobicContact CE2-CZ3 4.08Å; F35-W41 HydrophobicContact CG-CH2 4.3Å; F35-W41 HydrophobicContact CG-CZ2 4.41Å; F35-W41 HydrophobicContact CG-CZ3 4.35Å; W41-Q45 HydrophobicContact CE3-CB 4.29Å; W41-L46 HydrophobicContact CB-CD1 4.22Å; W41-L46 HydrophobicContact CB-CG 4.45Å; W41-L46 HydrophobicContact CD2-CD2 4.25Å; W41-L46 HydrophobicContact CE3-CD2 3.88Å; W41-L46 HydrophobicContact CE3-CG 4.28Å; W41-L46 HydrophobicContact CZ3-CD2 4.34Å; W41-I49 HydrophobicContact CH2-CD1 3.99Å; W41-I49 HydrophobicContact CZ3-CD1 3.68Å; W41-V85 HydrophobicContact CB-CG2 3.89Å; W41-V85 HydrophobicContact CG-CG1 4.24Å; W41-V85 HydrophobicContact CG-CG2 3.82Å
42T91.9Very high84.9Confident65 Ų6556.7 Ų56.740%0.39929%0.291SS..PPolyproline II helixtrans-87152.7171.373.70000111.4D40 E44 Q45 L46D40-T42 PolarHBondContact O-N 3.33Å; T42-E44 VanDerWaalsContact C-N 3.3Å; T42-E44 PolarHBondContact O-N 2.86Å; T42-Q45 WeakPolarHBondContact O-CB 3.42Å; T42-Q45 PolarHBondContact O-N 3.12Å; T42-Q45 VanDerWaalsContact O-N 3.16Å; T42-Q45 VanDerWaalsContact OG1-CD 3.3Å; T42-Q45 WeakPolarHBondContact OG1-CG 3.38Å; T42-Q45 PolarHBondContact OG1-N 2.94Å; T42-L46 PolarHBondContact O-N 2.87Å
43Y93.9Very high85.4Confident39 Ų3951.3 Ų51.315%0.15327%0.268CS..Hα-helixtrans-57.7-42177.8-176.4-108.6000112.5Q45 L46 L47 Y88 A92 E95 P369Y43-Q45 VanDerWaalsContact C-N 3.28Å; Y43-Q45 PolarHBondContact O-N 2.92Å; Y43-L46 PolarHBondContact O-N 3.47Å; Y43-L47 WeakPolarHBondContact O-CB 3.5Å; Y43-L47 PolarHBondContact O-N 3.03Å; Y43-Y88 HydrophobicContact CD2-CG 4.28Å; Y43-A92 HydrophobicContact CE2-CB 4.03Å; Y43-E95 PolarHBondContact OH-OE2 3.13Å; Y43-P369 HydrophobicContact CD1-CG 4.47Å; Y43-P369 HydrophobicContact CG-CG 4.45Å
44E93Very high86.5Confident95 Ų9544.2 Ų44.244%0.44424%0.237SC..Hα-helixtrans-60.4-37177.9-63.3-173.5172.600112.9T42 L47 G48T42-E44 VanDerWaalsContact C-N 3.3Å; T42-E44 PolarHBondContact O-N 2.86Å; E44-L47 PolarHBondContact O-N 3.04Å; E44-G48 PolarHBondContact O-N 3.48Å
45Q93Very high87.6Confident20 Ų2043.9 Ų43.99%0.09323%0.232CC..Hα-helixtrans-65.3-44.9177.8-71.7170.5-4.800110.8M1 L4 W41 T42 Y43 G48 I49M1-Q45 HydrophobicContact SD-CG 4.25Å; L4-Q45 VanDerWaalsContact CD2-CA 3.46Å; L4-Q45 HydrophobicContact CD2-CB 3.34Å; L4-Q45 HydrophobicContact CD2-CG 3.45Å; L4-Q45 VanDerWaalsContact CD2-CG 3.45Å; W41-Q45 HydrophobicContact CE3-CB 4.29Å; T42-Q45 WeakPolarHBondContact O-CB 3.42Å; T42-Q45 PolarHBondContact O-N 3.12Å; T42-Q45 VanDerWaalsContact O-N 3.16Å; T42-Q45 VanDerWaalsContact OG1-CD 3.3Å; T42-Q45 WeakPolarHBondContact OG1-CG 3.38Å; T42-Q45 PolarHBondContact OG1-N 2.94Å; Y43-Q45 VanDerWaalsContact C-N 3.28Å; Y43-Q45 PolarHBondContact O-N 2.92Å; Q45-G48 PolarHBondContact O-N 3.37Å; Q45-I49 PolarHBondContact O-N 3.4Å; Q45-I49 VanDerWaalsContact O-N 3.08Å
46L95Very high88.8Confident0 Ų043.1 Ų43.10%023%0.229CC..Hα-helixtrans-66-38.3177.5-66.3169.7000111.7L30 W41 T42 Y43 I49 C50 V85 Y88 A92L30-L46 HydrophobicContact CD2-CD2 3.35Å; W41-L46 HydrophobicContact CB-CD1 4.22Å; W41-L46 HydrophobicContact CB-CG 4.45Å; W41-L46 HydrophobicContact CD2-CD2 4.25Å; W41-L46 HydrophobicContact CE3-CD2 3.88Å; W41-L46 HydrophobicContact CE3-CG 4.28Å; W41-L46 HydrophobicContact CZ3-CD2 4.34Å; T42-L46 PolarHBondContact O-N 2.87Å; Y43-L46 PolarHBondContact O-N 3.47Å; L46-I49 PolarHBondContact O-N 2.93Å; L46-C50 PolarHBondContact O-N 2.91Å; L46-C50 PolarHBondContact O-SG 2.88Å; L46-V85 HydrophobicContact CD1-CG1 4.38Å; L46-V85 HydrophobicContact CD2-CG1 4.24Å; L46-Y88 HydrophobicContact CD1-CD2 4.2Å; L46-Y88 HydrophobicContact CD1-CG 4.27Å; L46-A92 HydrophobicContact CB-CB 4.26Å
47L95.7Very high90.3Very high27 Ų2738.4 Ų38.414%0.14120%0.204CC..Hα-helixtrans-61.5-42.5172.5-170.567.3000112Y43 E44 I49 C50 K51 A92 E95Y43-L47 WeakPolarHBondContact O-CB 3.5Å; Y43-L47 PolarHBondContact O-N 3.03Å; E44-L47 PolarHBondContact O-N 3.04Å; L47-I49 VanDerWaalsContact C-N 3.34Å; L47-I49 PolarHBondContact O-N 3.04Å; L47-C50 PolarHBondContact O-N 3.47Å; L47-K51 WeakPolarHBondContact O-CB 3.35Å; L47-K51 PolarHBondContact O-N 3.39Å; L47-A92 HydrophobicContact CB-CB 4.37Å; L47-A92 HydrophobicContact CD1-CB 4.26Å; L47-E95 HydrophobicContact CD1-CB 4.38Å; L47-E95 HydrophobicContact CD1-CG 4.42Å
48G94.8Very high91.9Very high4 Ų436.7 Ų36.74%0.04118%0.178CC..Hα-helixtrans-60.1-40.8174.200000113.2E44 Q45 G52E44-G48 PolarHBondContact O-N 3.48Å; Q45-G48 PolarHBondContact O-N 3.37Å; G48-G52 PolarHBondContact O-N 3.25Å; G48-G52 VanDerWaalsContact O-N 3.09Å
49I96Very high93.4Very high0 Ų029.5 Ų29.50%015%0.147CC..Hα-helixtrans-65-50.7173.8-65.8170.8000110.2L4 L11 A26 L30 W41 Q45 L46 L47 K51 G52 L53L4-I49 HydrophobicContact CD1-CD1 3.6Å; L4-I49 HydrophobicContact CD1-CG1 3.47Å; L4-I49 VanDerWaalsContact CD1-CG1 3.47Å; L4-I49 HydrophobicContact CG-CG1 4.49Å; L11-I49 HydrophobicContact CD1-CG2 4.34Å; A26-I49 HydrophobicContact CB-CG2 4.39Å; L30-I49 HydrophobicContact CD1-CD1 4.43Å; L30-I49 HydrophobicContact CD1-CG2 4.4Å; L30-I49 HydrophobicContact CD2-CD1 4.03Å; L30-I49 HydrophobicContact CG-CD1 4.34Å; W41-I49 HydrophobicContact CH2-CD1 3.99Å; W41-I49 HydrophobicContact CZ3-CD1 3.68Å; Q45-I49 PolarHBondContact O-N 3.4Å; Q45-I49 VanDerWaalsContact O-N 3.08Å; L46-I49 PolarHBondContact O-N 2.93Å; L47-I49 VanDerWaalsContact C-N 3.34Å; L47-I49 PolarHBondContact O-N 3.04Å; I49-K51 VanDerWaalsContact C-N 3.29Å; I49-K51 PolarHBondContact O-N 2.84Å; I49-G52 CarbonylContact O-C 3.6Å; I49-G52 WeakPolarHBondContact O-CA 3.47Å; I49-G52 PolarHBondContact O-N 3.26Å; I49-L53 HydrophobicContact CG2-CD1 3.93Å; I49-L53 HydrophobicContact CG2-CG 4.11Å; I49-L53 WeakPolarHBondContact O-CG 3.39Å; I49-L53 PolarHBondContact O-N 3.3Å
50C97.3Very high94.5Very high0 Ų025.6 Ų25.60%013%0.126CC..Hα-helixtrans-58.2-42.2-178.1-680000111.6L46 L47 G52 L53 H54 Y89 A92 M93 T96L46-C50 PolarHBondContact O-N 2.91Å; L46-C50 PolarHBondContact O-SG 2.88Å; L47-C50 PolarHBondContact O-N 3.47Å; C50-G52 PolarHBondContact O-N 3.16Å; C50-L53 PolarHBondContact O-N 3.28Å; C50-H54 PolarHBondContact O-N 3.18Å; C50-Y89 VanDerWaalsContact SG-CE2 3.54Å; C50-A92 HydrophobicContact CB-CB 4.34Å; C50-M93 HydrophobicContact CB-CE 4.45Å; C50-T96 WeakPolarHBondContact CB-OG1 3.36Å
51K96.3Very high94.9Very high54 Ų5424.3 Ų24.324%0.23512%0.119CC..Hα-helixtrans-59.5-46.9171.4-171.6172.7177.7101.70111.5L47 I49 L53 H54 Y55 T96 E100 F423 F427L47-K51 WeakPolarHBondContact O-CB 3.35Å; L47-K51 PolarHBondContact O-N 3.39Å; I49-K51 VanDerWaalsContact C-N 3.29Å; I49-K51 PolarHBondContact O-N 2.84Å; K51-L53 VanDerWaalsContact C-N 3.31Å; K51-L53 PolarHBondContact O-N 2.81Å; K51-H54 WeakPolarHBondContact O-CB 3.45Å; K51-H54 PolarHBondContact O-N 3.05Å; K51-Y55 HydrophobicContact CG-CD2 3.94Å; K51-Y55 HydrophobicContact CG-CE2 3.78Å; K51-Y55 VanDerWaalsContact O-CD2 3.22Å; K51-Y55 WeakPolarHBondContact O-CD2 3.44Å; K51-Y55 PolarHBondContact O-N 3.03Å; K51-T96 HydrophobicContact CB-CG2 4.5Å; K51-E100 IonicContact NZ-OE1 3.54Å; K51-E100 PolarHBondContact NZ-OE1 3.2Å; K51-F423 HydrophobicContact CG-CZ 4.35Å; K51-F427 HydrophobicContact CB-CE2 4.41Å; K51-F427 HydrophobicContact CD-CD2 4.29Å; K51-F427 HydrophobicContact CD-CE2 3.88Å; K51-F427 HydrophobicContact CG-CE2 4.14Å
52G96.8Very high95Very high0 Ų030.8 Ų30.80%015%0.148CC..Hα-helixtrans-54.7-45173.300000113.1L11 G48 I49 C50 Y55 S56L11-G52 WeakPolarHBondContact CB-O 3.45Å; G48-G52 PolarHBondContact O-N 3.25Å; G48-G52 VanDerWaalsContact O-N 3.09Å; I49-G52 CarbonylContact O-C 3.6Å; I49-G52 WeakPolarHBondContact O-CA 3.47Å; I49-G52 PolarHBondContact O-N 3.26Å; C50-G52 PolarHBondContact O-N 3.16Å; G52-Y55 PolarHBondContact O-N 3.21Å; G52-S56 WeakPolarHBondContact O-CB 3.49Å; G52-S56 PolarHBondContact O-N 2.88Å
53L97.5Very high94.8Very high1 Ų134.1 Ų34.11%0.00516%0.162CC..Hα-helixtrans-65.1-41.5178-63.2173.5000112.1L11 Q23 I49 C50 K51 Y55 S56 L57 L73 I76 Y89 M93L11-L53 HydrophobicContact CD1-CD2 3.88Å; L11-L53 HydrophobicContact CD1-CG 4.16Å; L11-L53 HydrophobicContact CD2-CD2 3.65Å; L11-L53 HydrophobicContact CG-CD2 4.39Å; Q23-L53 HydrophobicContact CG-CD2 4.3Å; I49-L53 HydrophobicContact CG2-CD1 3.93Å; I49-L53 HydrophobicContact CG2-CG 4.11Å; I49-L53 WeakPolarHBondContact O-CG 3.39Å; I49-L53 PolarHBondContact O-N 3.3Å; C50-L53 PolarHBondContact O-N 3.28Å; K51-L53 VanDerWaalsContact C-N 3.31Å; K51-L53 PolarHBondContact O-N 2.81Å; L53-Y55 PolarHBondContact O-N 3.29Å; L53-S56 WeakPolarHBondContact O-CA 3.32Å; L53-S56 WeakPolarHBondContact O-CB 3.46Å; L53-S56 PolarHBondContact O-N 3.49Å; L53-S56 VanDerWaalsContact O-N 3.08Å; L53-L57 PolarHBondContact O-N 3.32Å; L53-L57 VanDerWaalsContact O-N 3.08Å; L53-L73 HydrophobicContact CB-CD1 4.37Å; L53-L73 HydrophobicContact CB-CD2 3.95Å; L53-L73 HydrophobicContact CD1-CD2 4.47Å; L53-L73 HydrophobicContact CD2-CD2 3.43Å; L53-L73 VanDerWaalsContact CD2-CD2 3.43Å; L53-L73 HydrophobicContact CG-CD2 4.11Å; L53-I76 HydrophobicContact CD1-CD1 3.85Å; L53-I76 HydrophobicContact CD2-CD1 3.98Å; L53-Y89 HydrophobicContact CD1-CE2 4.12Å; L53-Y89 WeakPolarHBondContact CD1-OH 3.38Å; L53-M93 HydrophobicContact CD1-CE 4.05Å
54H97.4Very high94.7Very high3 Ų338.4 Ų38.41%0.01419%0.187CC..Hα-helixtrans-55.9-51.4174176.1102.6000110.9C50 K51 S56 L57 W58 T96 E100 F112C50-H54 PolarHBondContact O-N 3.18Å; K51-H54 WeakPolarHBondContact O-CB 3.45Å; K51-H54 PolarHBondContact O-N 3.05Å; H54-S56 PolarHBondContact O-N 3.4Å; H54-L57 PolarHBondContact O-N 3.49Å; H54-L57 VanDerWaalsContact O-N 3.14Å; H54-W58 AromaticContact NE2-CE3 3.63Å; H54-W58 PolarHBondContact O-N 2.81Å; H54-T96 HydrophobicContact CB-CG2 3.71Å; H54-E100 VanDerWaalsContact CE1-CB 3.45Å; H54-E100 WeakPolarHBondContact CE1-CB 3.47Å; H54-F112 AromaticContact CD2-CE1 3.99Å; H54-F112 AromaticContact CE1-CD1 3.71Å; H54-F112 AromaticContact CE1-CE1 3.24Å; H54-F112 WeakPolarHBondContact CE1-CE1 3.38Å; H54-F112 AromaticContact CE1-CZ 3.6Å; H54-F112 AromaticContact CG-CE1 3.77Å; H54-F112 AromaticContact ND1-CD1 3.8Å; H54-F112 AromaticContact ND1-CE1 3.31Å; H54-F112 VanDerWaalsContact ND1-CE1 3.31Å; H54-F112 WeakPolarHBondContact ND1-CE1 3.4Å; H54-F112 AromaticContact NE2-CE1 3.65Å; H54-F112 AromaticContact NE2-CZ 3.58Å
55Y96.5Very high94.7Very high15 Ų1535.7 Ų35.76%0.05918%0.176CC..Hα-helixtrans-70.1-21.3177.7-74-77.3000112.9K51 G52 L53 W58 M59 E100 F419 F423K51-Y55 HydrophobicContact CG-CD2 3.94Å; K51-Y55 HydrophobicContact CG-CE2 3.78Å; K51-Y55 VanDerWaalsContact O-CD2 3.22Å; K51-Y55 WeakPolarHBondContact O-CD2 3.44Å; K51-Y55 PolarHBondContact O-N 3.03Å; G52-Y55 PolarHBondContact O-N 3.21Å; L53-Y55 PolarHBondContact O-N 3.29Å; Y55-W58 HydrophobicContact CD1-CB 4.2Å; Y55-W58 HydrophobicContact CD1-CD2 4.35Å; Y55-W58 HydrophobicContact CD1-CE3 4.42Å; Y55-W58 HydrophobicContact CD1-CG 4.25Å; Y55-W58 HydrophobicContact CE1-CD2 4.4Å; Y55-W58 HydrophobicContact CE1-CE3 4.2Å; Y55-W58 WeakPolarHBondContact O-CB 3.44Å; Y55-W58 PolarHBondContact O-N 3.42Å; Y55-M59 VanDerWaalsContact O-CG 3.31Å; Y55-M59 WeakPolarHBondContact O-CG 3.39Å; Y55-M59 PolarHBondContact O-N 3.42Å; Y55-E100 PolarHBondContact OH-OE2 3.35Å; Y55-F419 HydrophobicContact CD1-CE1 4.4Å; Y55-F419 AromaticContact CE1-CE1 3.86Å; Y55-F419 HydrophobicContact CE1-CE1 3.86Å; Y55-F423 HydrophobicContact CD1-CD2 4.11Å; Y55-F423 HydrophobicContact CD1-CE2 4.01Å; Y55-F423 HydrophobicContact CD1-CZ 4.5Å; Y55-F423 HydrophobicContact CD2-CD2 4.11Å; Y55-F423 HydrophobicContact CD2-CE1 4.24Å; Y55-F423 AromaticContact CD2-CE2 3.21Å; Y55-F423 HydrophobicContact CD2-CE2 3.21Å; Y55-F423 AromaticContact CD2-CZ 3.25Å; Y55-F423 HydrophobicContact CD2-CZ 3.25Å; Y55-F423 AromaticContact CE1-CD2 3.96Å; Y55-F423 HydrophobicContact CE1-CD2 3.96Å; Y55-F423 AromaticContact CE1-CE2 3.89Å; Y55-F423 HydrophobicContact CE1-CE2 3.89Å; Y55-F423 HydrophobicContact CE2-CD2 4.04Å; Y55-F423 AromaticContact CE2-CE2 3.14Å; Y55-F423 HydrophobicContact CE2-CE2 3.14Å; Y55-F423 AromaticContact CE2-CZ 3.66Å; Y55-F423 HydrophobicContact CE2-CZ 3.66Å; Y55-F423 HydrophobicContact CG-CD2 4.17Å; Y55-F423 HydrophobicContact CG-CE1 4.37Å; Y55-F423 AromaticContact CG-CE2 3.68Å; Y55-F423 HydrophobicContact CG-CE2 3.68Å; Y55-F423 AromaticContact CG-CZ 3.75Å; Y55-F423 HydrophobicContact CG-CZ 3.75Å; Y55-F423 AromaticContact CZ-CD2 3.92Å; Y55-F423 AromaticContact CZ-CE2 3.47Å; Y55-F423 VanDerWaalsContact CZ-CE2 3.47Å
56S96.8Very high94.7Very high0 Ų036.4 Ų36.40%018%0.178CC..Hα-helixtrans-62.8-44.3169.5-145.10000112.1L11 R19 Q23 G52 L53 H54L11-S56 VanDerWaalsContact O-CA 3.28Å; L11-S56 WeakPolarHBondContact O-CA 3.21Å; L11-S56 WeakPolarHBondContact O-CB 3.41Å; L11-S56 PolarHBondContact O-OG 3.14Å; R19-S56 WeakPolarHBondContact CD-OG 3.37Å; Q23-S56 PolarHBondContact NE2-OG 3.03Å; G52-S56 WeakPolarHBondContact O-CB 3.49Å; G52-S56 PolarHBondContact O-N 2.88Å; L53-S56 WeakPolarHBondContact O-CA 3.32Å; L53-S56 WeakPolarHBondContact O-CB 3.46Å; L53-S56 PolarHBondContact O-N 3.49Å; L53-S56 VanDerWaalsContact O-N 3.08Å; H54-S56 PolarHBondContact O-N 3.4Å
57L97.1Very high94.7Very high0 Ų041.8 Ų41.80%020%0.204CC..Hα-helixtrans-72.3-36.5174.4-177.759.9000111.5L53 H54 M59 Q60 T69 V70 L73 K111 F112 L115L53-L57 PolarHBondContact O-N 3.32Å; L53-L57 VanDerWaalsContact O-N 3.08Å; H54-L57 PolarHBondContact O-N 3.49Å; H54-L57 VanDerWaalsContact O-N 3.14Å; L57-M59 PolarHBondContact O-N 3.11Å; L57-Q60 WeakPolarHBondContact O-CB 3.49Å; L57-Q60 PolarHBondContact O-N 3.26Å; L57-T69 HydrophobicContact CB-CG2 4.46Å; L57-T69 HydrophobicContact CD1-CG2 3.99Å; L57-V70 HydrophobicContact CD1-CG2 4.03Å; L57-V70 HydrophobicContact CD2-CG2 3.9Å; L57-L73 HydrophobicContact CB-CD1 4.17Å; L57-K111 HydrophobicContact CD1-CB 4.35Å; L57-K111 HydrophobicContact CD1-CD 4.06Å; L57-K111 HydrophobicContact CD2-CB 4.45Å; L57-K111 HydrophobicContact CD2-CG 4.48Å; L57-K111 HydrophobicContact CG-CB 4.49Å; L57-K111 HydrophobicContact CG-CD 3.98Å; L57-K111 HydrophobicContact CG-CG 4.28Å; L57-K111 WeakPolarHBondContact O-CE 3.31Å; L57-K111 PolarHBondContact O-NZ 2.89Å; L57-F112 HydrophobicContact CB-CE1 4.24Å; L57-F112 HydrophobicContact CB-CZ 4.48Å; L57-F112 HydrophobicContact CD2-CD1 3.95Å; L57-F112 HydrophobicContact CD2-CE1 3.93Å; L57-F112 HydrophobicContact CG-CE1 4.23Å; L57-F112 HydrophobicContact CG-CZ 4.43Å; L57-L115 HydrophobicContact CD2-CB 3.9Å; L57-L115 HydrophobicContact CD2-CD2 3.8Å; L57-L115 HydrophobicContact CD2-CG 4.37Å
58W95.7Very high94.7Very high29 Ų2945.1 Ų45.111%0.1122%0.218CC..Hα-helixtrans-52-44.2175.1-172.8-68.2000112.1H54 Y55 Q60 N103 L104 K111 F112H54-W58 AromaticContact NE2-CE3 3.63Å; H54-W58 PolarHBondContact O-N 2.81Å; Y55-W58 HydrophobicContact CD1-CB 4.2Å; Y55-W58 HydrophobicContact CD1-CD2 4.35Å; Y55-W58 HydrophobicContact CD1-CE3 4.42Å; Y55-W58 HydrophobicContact CD1-CG 4.25Å; Y55-W58 HydrophobicContact CE1-CD2 4.4Å; Y55-W58 HydrophobicContact CE1-CE3 4.2Å; Y55-W58 WeakPolarHBondContact O-CB 3.44Å; Y55-W58 PolarHBondContact O-N 3.42Å; W58-Q60 PolarHBondContact O-N 3.09Å; W58-N103 WeakPolarHBondContact CH2-O 3.44Å; W58-L104 HydrophobicContact CE3-CD2 3.92Å; W58-L104 HydrophobicContact CH2-CD2 4.28Å; W58-L104 HydrophobicContact CZ3-CD2 3.52Å; W58-K111 PolarHBondContact O-NZ 3.48Å; W58-F112 HydrophobicContact CB-CZ 4.17Å; W58-F112 HydrophobicContact CE3-CE2 4.31Å; W58-F112 HydrophobicContact CE3-CZ 4.21Å
59M94Very high94.8Very high37 Ų3745 Ų4518%0.18222%0.217CC..THydrogen-bonded Turntrans-77.90.3-178.7-61.9-64.4163.800114.4Y55 L57 F419Y55-M59 VanDerWaalsContact O-CG 3.31Å; Y55-M59 WeakPolarHBondContact O-CG 3.39Å; Y55-M59 PolarHBondContact O-N 3.42Å; L57-M59 PolarHBondContact O-N 3.11Å; M59-F419 HydrophobicContact CE-CD1 4.3Å
60Q94.2Very high94.9Very high9 Ų945.1 Ų45.14%0.04222%0.217CC..  trans-96110.2176.7-171.559.8-94.100111.1D16 L57 W58 L65 K66 K111D16-Q60 PolarHBondContact OD1-NE2 3.46Å; L57-Q60 WeakPolarHBondContact O-CB 3.49Å; L57-Q60 PolarHBondContact O-N 3.26Å; W58-Q60 PolarHBondContact O-N 3.09Å; Q60-L65 HydrophobicContact CG-CB 3.8Å; Q60-K66 HydrophobicContact CB-CG 4.33Å; Q60-K66 HydrophobicContact CG-CB 4.46Å; Q60-K66 HydrophobicContact CG-CG 3.9Å; Q60-K66 WeakPolarHBondContact O-CE 3.4Å; Q60-K66 WeakPolarHBondContact O-CG 3.29Å; Q60-K111 PolarHBondContact O-NZ 2.85Å
61D91.3Very high94.8Very high101 Ų10148 Ų4854%0.5424%0.235SC..  trans-102.8-23.6-176.6-64.7-39.1000113.1K66D61-K66 VanDerWaalsContact C-CE 3.47Å; D61-K66 WeakPolarHBondContact O-CE 3.49Å; D61-K66 PolarHBondContact O-NZ 3.05Å
62K90.8Very high94.8Very high147 Ų14748.4 Ų48.464%0.63924%0.235SC*.SBendtrans-76.8126.3179-58.3-170.1-176.8-173.10111.3L64 L65 K66K62-L64 PolarHBondContact O-N 3.13Å; K62-L65 HydrophobicContact CB-CB 4.1Å; K62-L65 HydrophobicContact CB-CD1 3.99Å; K62-L65 HydrophobicContact CB-CG 3.96Å; K62-L65 HydrophobicContact CD-CD1 3.82Å; K62-L65 HydrophobicContact CD-CG 4.48Å; K62-L65 HydrophobicContact CG-CD1 4.3Å; K62-L65 CarbonylContact O-C 3.58Å; K62-L65 PolarHBondContact O-N 3.19Å; K62-L65 VanDerWaalsContact O-N 3.08Å; K62-K66 WeakPolarHBondContact O-CG 3.33Å; K62-K66 PolarHBondContact O-N 3.28Å
63L88.2Confident94.8Very high135 Ų13548.4 Ų48.471%0.70724%0.235SC*.Hα-helixtrans-51.1-60.3-173.1-67.8173.7000113.7L65 K66 E67L63-L65 PolarHBondContact O-N 2.93Å; L63-L65 VanDerWaalsContact O-N 3.15Å; L63-K66 HydrophobicContact CD2-CD 4.44Å; L63-K66 VanDerWaalsContact O-CB 3.3Å; L63-K66 WeakPolarHBondContact O-CB 3.49Å; L63-K66 PolarHBondContact O-N 3.24Å; L63-E67 PolarHBondContact O-N 3.04Å
64L90.6Very high94.8Very high129 Ų12948.3 Ų48.368%0.67524%0.235SC*.Hα-helixtrans-57-35.2179.2-63.3176.5000112.7K62 Q68K62-L64 PolarHBondContact O-N 3.13Å; L64-Q68 WeakPolarHBondContact O-CG 3.32Å; L64-Q68 PolarHBondContact O-N 3.4Å
65L93.3Very high94.8Very high39 Ų3951.3 Ų51.320%0.20425%0.251CS..Hα-helixtrans-75.6-24.9179.1-59-171.5000112.5Q60 K62 L63 T69Q60-L65 HydrophobicContact CG-CB 3.8Å; K62-L65 HydrophobicContact CB-CB 4.1Å; K62-L65 HydrophobicContact CB-CD1 3.99Å; K62-L65 HydrophobicContact CB-CG 3.96Å; K62-L65 HydrophobicContact CD-CD1 3.82Å; K62-L65 HydrophobicContact CD-CG 4.48Å; K62-L65 HydrophobicContact CG-CD1 4.3Å; K62-L65 CarbonylContact O-C 3.58Å; K62-L65 PolarHBondContact O-N 3.19Å; K62-L65 VanDerWaalsContact O-N 3.08Å; L63-L65 PolarHBondContact O-N 2.93Å; L63-L65 VanDerWaalsContact O-N 3.15Å; L65-T69 VanDerWaalsContact O-CB 3.26Å; L65-T69 WeakPolarHBondContact O-CB 3.42Å; L65-T69 PolarHBondContact O-N 2.89Å; L65-T69 PolarHBondContact O-OG1 3.27Å
66K93.8Very high94.8Very high35 Ų3550.7 Ų50.715%0.15225%0.249CC..Hα-helixtrans-63-50.4173.9-69.3167.8-179.3172.90109.4Q60 D61 K62 L63 T69 V70 K111Q60-K66 HydrophobicContact CB-CG 4.33Å; Q60-K66 HydrophobicContact CG-CB 4.46Å; Q60-K66 HydrophobicContact CG-CG 3.9Å; Q60-K66 WeakPolarHBondContact O-CE 3.4Å; Q60-K66 WeakPolarHBondContact O-CG 3.29Å; D61-K66 VanDerWaalsContact C-CE 3.47Å; D61-K66 WeakPolarHBondContact O-CE 3.49Å; D61-K66 PolarHBondContact O-NZ 3.05Å; K62-K66 WeakPolarHBondContact O-CG 3.33Å; K62-K66 PolarHBondContact O-N 3.28Å; L63-K66 HydrophobicContact CD2-CD 4.44Å; L63-K66 VanDerWaalsContact O-CB 3.3Å; L63-K66 WeakPolarHBondContact O-CB 3.49Å; L63-K66 PolarHBondContact O-N 3.24Å; K66-T69 WeakPolarHBondContact O-CA 3.44Å; K66-T69 WeakPolarHBondContact O-CB 3.49Å; K66-T69 PolarHBondContact O-N 3.13Å; K66-T69 VanDerWaalsContact O-N 3.09Å; K66-V70 WeakPolarHBondContact O-CG2 3.48Å; K66-V70 PolarHBondContact O-N 3.25Å; K66-K111 HydrophobicContact CB-CB 4.24Å; K66-K111 HydrophobicContact CD-CB 4.11Å; K66-K111 HydrophobicContact CD-CD 3.9Å; K66-K111 HydrophobicContact CD-CG 4.49Å; K66-K111 HydrophobicContact CG-CB 4.33Å; K66-K111 HydrophobicContact CG-CD 3.97Å
67E94.7Very high94.8Very high113 Ų11350.7 Ų50.753%0.52825%0.249SC..Hα-helixtrans-60-50.5178.2-63.1-179.6172.600111.8L63 T69 V70 V71 L114L63-E67 PolarHBondContact O-N 3.04Å; E67-T69 PolarHBondContact O-N 3.08Å; E67-V70 PolarHBondContact O-N 3.47Å; E67-V70 VanDerWaalsContact O-N 3.09Å; E67-V71 WeakPolarHBondContact O-CG2 3.46Å; E67-V71 PolarHBondContact O-N 3.22Å; E67-L114 HydrophobicContact CB-CD2 4.41Å; E67-L114 HydrophobicContact CG-CD2 3.86Å
68Q96Very high94.7Very high96 Ų9653.2 Ų53.245%0.44927%0.265SS..Hα-helixtrans-59.8-31.5175.5-70178.5100112.7L64 R72L64-Q68 WeakPolarHBondContact O-CG 3.32Å; L64-Q68 PolarHBondContact O-N 3.4Å; Q68-R72 WeakPolarHBondContact O-CG 3.47Å; Q68-R72 PolarHBondContact O-N 2.75Å; Q68-R72 PolarHBondContact O-NE 3.19Å
69T96.5Very high94.7Very high2 Ų253.1 Ų53.11%0.01227%0.268CS..Hα-helixtrans-69.7-48.3175.1-58.10000109.9L57 L65 K66 E67 V71 R72 L73L57-T69 HydrophobicContact CB-CG2 4.46Å; L57-T69 HydrophobicContact CD1-CG2 3.99Å; L65-T69 VanDerWaalsContact O-CB 3.26Å; L65-T69 WeakPolarHBondContact O-CB 3.42Å; L65-T69 PolarHBondContact O-N 2.89Å; L65-T69 PolarHBondContact O-OG1 3.27Å; K66-T69 WeakPolarHBondContact O-CA 3.44Å; K66-T69 WeakPolarHBondContact O-CB 3.49Å; K66-T69 PolarHBondContact O-N 3.13Å; K66-T69 VanDerWaalsContact O-N 3.09Å; E67-T69 PolarHBondContact O-N 3.08Å; T69-V71 VanDerWaalsContact C-N 3.33Å; T69-V71 PolarHBondContact O-N 2.99Å; T69-R72 WeakPolarHBondContact O-CB 3.46Å; T69-R72 PolarHBondContact O-N 3.06Å; T69-R72 VanDerWaalsContact O-N 3.1Å; T69-R72 PolarHBondContact OG1-NH2 3.41Å; T69-L73 HydrophobicContact CG2-CD1 4.28Å; T69-L73 HydrophobicContact CG2-CG 4.27Å; T69-L73 VanDerWaalsContact O-CG 3.32Å; T69-L73 WeakPolarHBondContact O-CG 3.39Å; T69-L73 PolarHBondContact O-N 3.09Å
70V97.7Very high94.7Very high2 Ų251.5 Ų51.51%0.01226%0.261CS..Hα-helixtrans-55-49.4176172.20000111L57 K66 E67 R72 L73 C74 L114 L115 E118L57-V70 HydrophobicContact CD1-CG2 4.03Å; L57-V70 HydrophobicContact CD2-CG2 3.9Å; K66-V70 WeakPolarHBondContact O-CG2 3.48Å; K66-V70 PolarHBondContact O-N 3.25Å; E67-V70 PolarHBondContact O-N 3.47Å; E67-V70 VanDerWaalsContact O-N 3.09Å; V70-R72 VanDerWaalsContact C-N 3.28Å; V70-R72 PolarHBondContact O-N 3.08Å; V70-L73 PolarHBondContact O-N 3.18Å; V70-L73 VanDerWaalsContact O-N 3.09Å; V70-C74 PolarHBondContact O-N 3.03Å; V70-C74 PolarHBondContact O-SG 2.85Å; V70-C74 VanDerWaalsContact O-SG 3.34Å; V70-L114 HydrophobicContact CB-CD2 4.43Å; V70-L114 HydrophobicContact CB-CG 4.5Å; V70-L114 HydrophobicContact CG1-CG 4.21Å; V70-L114 HydrophobicContact CG2-CD2 4.19Å; V70-L114 HydrophobicContact CG2-CG 4.29Å; V70-L115 HydrophobicContact CG1-CB 4.43Å; V70-L115 HydrophobicContact CG1-CD1 4.17Å; V70-L115 HydrophobicContact CG2-CB 4.17Å; V70-E118 HydrophobicContact CG1-CB 3.68Å; V70-E118 HydrophobicContact CG1-CG 4.12Å
71V96.3Very high94.6Very high62 Ų6257 Ų5738%0.37629%0.286SS..Hα-helixtrans-55.9-42.4177.5167.80000112E67 T69 N75 R122E67-V71 WeakPolarHBondContact O-CG2 3.46Å; E67-V71 PolarHBondContact O-N 3.22Å; T69-V71 VanDerWaalsContact C-N 3.33Å; T69-V71 PolarHBondContact O-N 2.99Å; V71-N75 VanDerWaalsContact O-CB 3.29Å; V71-N75 WeakPolarHBondContact O-CB 3.35Å; V71-N75 VanDerWaalsContact O-CG 3.27Å; V71-N75 PolarHBondContact O-N 3.35Å; V71-N75 PolarHBondContact O-ND2 2.82Å; V71-R122 PolarHBondContact O-NH1 3.15Å
72R95.9Very high94.7Very high61 Ų6155 Ų5523%0.2328%0.276CS..Hα-helixtrans-65.4-43176.7-80.2177.8-76.6140.4-9.6112.5Q68 T69 V70 N75Q68-R72 WeakPolarHBondContact O-CG 3.47Å; Q68-R72 PolarHBondContact O-N 2.75Å; Q68-R72 PolarHBondContact O-NE 3.19Å; T69-R72 WeakPolarHBondContact O-CB 3.46Å; T69-R72 PolarHBondContact O-N 3.06Å; T69-R72 VanDerWaalsContact O-N 3.1Å; T69-R72 PolarHBondContact OG1-NH2 3.41Å; V70-R72 VanDerWaalsContact C-N 3.28Å; V70-R72 PolarHBondContact O-N 3.08Å; R72-N75 PolarHBondContact O-N 2.97Å
73L97.4Very high94.8Very high0 Ų050.1 Ų50.10%026%0.26CS..Hα-helixtrans-64.3-48178.9-63.6-174.1000110.9Q23 L53 L57 T69 V70 N75 I76 L115Q23-L73 HydrophobicContact CG-CD2 4.13Å; L53-L73 HydrophobicContact CB-CD1 4.37Å; L53-L73 HydrophobicContact CB-CD2 3.95Å; L53-L73 HydrophobicContact CD1-CD2 4.47Å; L53-L73 HydrophobicContact CD2-CD2 3.43Å; L53-L73 VanDerWaalsContact CD2-CD2 3.43Å; L53-L73 HydrophobicContact CG-CD2 4.11Å; L57-L73 HydrophobicContact CB-CD1 4.17Å; T69-L73 HydrophobicContact CG2-CD1 4.28Å; T69-L73 HydrophobicContact CG2-CG 4.27Å; T69-L73 VanDerWaalsContact O-CG 3.32Å; T69-L73 WeakPolarHBondContact O-CG 3.39Å; T69-L73 PolarHBondContact O-N 3.09Å; V70-L73 PolarHBondContact O-N 3.18Å; V70-L73 VanDerWaalsContact O-N 3.09Å; L73-N75 PolarHBondContact O-N 2.87Å; L73-I76 VanDerWaalsContact O-CB 3.3Å; L73-I76 WeakPolarHBondContact O-CB 3.48Å; L73-I76 WeakPolarHBondContact O-CG1 3.2Å; L73-I76 PolarHBondContact O-N 3.32Å; L73-I76 VanDerWaalsContact O-N 3.12Å; L73-L115 HydrophobicContact CB-CD1 4.28Å; L73-L115 HydrophobicContact CD1-CD1 4.31Å
74C97.4Very high95.1Very high0 Ų045.7 Ų45.70%024%0.239CC..Hα-helixtrans-68.6-23.5179.8-58.90000112.7V70 I76 L77 P78 E118V70-C74 PolarHBondContact O-N 3.03Å; V70-C74 PolarHBondContact O-SG 2.85Å; V70-C74 VanDerWaalsContact O-SG 3.34Å; C74-I76 PolarHBondContact O-N 3.41Å; C74-L77 PolarHBondContact O-N 2.92Å; C74-P78 VanDerWaalsContact O-CD 3.29Å; C74-P78 WeakPolarHBondContact O-CD 3.44Å; C74-E118 HydrophobicContact CB-CG 3.89Å
75N96.2Very high95.3Very high66 Ų6639.9 Ų39.935%0.35321%0.209SC..THydrogen-bonded Turntrans-72.4-3.8173.2-87.7-22.5000114.5K27 V71 R72 L73 R122K27-N75 WeakPolarHBondContact CE-O 3.5Å; V71-N75 VanDerWaalsContact O-CB 3.29Å; V71-N75 WeakPolarHBondContact O-CB 3.35Å; V71-N75 VanDerWaalsContact O-CG 3.27Å; V71-N75 PolarHBondContact O-N 3.35Å; V71-N75 PolarHBondContact O-ND2 2.82Å; R72-N75 PolarHBondContact O-N 2.97Å; L73-N75 PolarHBondContact O-N 2.87Å; N75-R122 PolarHBondContact OD1-NH1 3.43Å
76I97Very high95.4Very high2 Ų238 Ų381%0.0120%0.199CC..THydrogen-bonded Turntrans-73.6-39.9170.6-63.3172.3000110K27 L30 L53 L73 C74 S79 I80 Y89K27-I76 HydrophobicContact CB-CG1 4.16Å; K27-I76 HydrophobicContact CG-CG1 4.39Å; L30-I76 HydrophobicContact CB-CG2 4.4Å; L30-I76 HydrophobicContact CD1-CG2 3.48Å; L30-I76 VanDerWaalsContact CD1-CG2 3.48Å; L53-I76 HydrophobicContact CD1-CD1 3.85Å; L53-I76 HydrophobicContact CD2-CD1 3.98Å; L73-I76 VanDerWaalsContact O-CB 3.3Å; L73-I76 WeakPolarHBondContact O-CB 3.48Å; L73-I76 WeakPolarHBondContact O-CG1 3.2Å; L73-I76 PolarHBondContact O-N 3.32Å; L73-I76 VanDerWaalsContact O-N 3.12Å; C74-I76 PolarHBondContact O-N 3.41Å; I76-S79 PolarHBondContact O-N 3.49Å; I76-S79 PolarHBondContact O-OG 2.99Å; I76-I80 WeakPolarHBondContact O-CG1 3.27Å; I76-Y89 HydrophobicContact CG2-CE1 4.2Å; I76-Y89 HydrophobicContact CG2-CE2 4.42Å
77L96.8Very high95.5Very high0 Ų036.9 Ų36.90%019%0.194CC..G310 helixtrans-57.2-48.9-174.6179.871.9000113C74 S79 I80 T86 Y89 F119 G123 F126C74-L77 PolarHBondContact O-N 2.92Å; L77-S79 PolarHBondContact O-N 3.49Å; L77-I80 PolarHBondContact O-N 3.28Å; L77-T86 HydrophobicContact CD1-CG2 3.77Å; L77-Y89 HydrophobicContact CB-CE1 4.22Å; L77-Y89 HydrophobicContact CD1-CD1 3.85Å; L77-Y89 HydrophobicContact CD1-CE1 4.33Å; L77-F119 HydrophobicContact CB-CE2 4.21Å; L77-F119 HydrophobicContact CD1-CZ 4.28Å; L77-F119 HydrophobicContact CD2-CE2 4.25Å; L77-F119 HydrophobicContact CD2-CZ 4.26Å; L77-G123 VanDerWaalsContact CD2-CA 3.47Å; L77-F126 HydrophobicContact CG-CD1 4.34Å
78P95.5Very high95.6Very high53 Ų5333.2 Ų33.234%0.34418%0.176SC..G310 helixtrans-70.2-14.3179.1-19.534.1000114.5C74 I80 F126C74-P78 VanDerWaalsContact O-CD 3.29Å; C74-P78 WeakPolarHBondContact O-CD 3.44Å; P78-I80 VanDerWaalsContact C-N 3.34Å; P78-F126 HydrophobicContact CB-CD2 3.88Å; P78-F126 HydrophobicContact CB-CE2 4.05Å; P78-F126 HydrophobicContact CB-CG 4.24Å; P78-F126 HydrophobicContact CG-CD2 4.5Å; P78-F126 HydrophobicContact CG-CG 4.43Å
79S94.7Very high95.6Very high26 Ų2628.6 Ų28.618%0.18215%0.154CC..G310 helixtrans-85.7-5.4178.356.40000114.1K27 S31 I76 L77 E81K27-S79 WeakPolarHBondContact CE-OG 3.28Å; K27-S79 VanDerWaalsContact CG-OG 3.29Å; K27-S79 WeakPolarHBondContact CG-OG 3.37Å; S31-S79 VanDerWaalsContact CA-O 3.28Å; S31-S79 WeakPolarHBondContact CA-O 3.43Å; S31-S79 WeakPolarHBondContact CB-O 3.39Å; I76-S79 PolarHBondContact O-N 3.49Å; I76-S79 PolarHBondContact O-OG 2.99Å; L77-S79 PolarHBondContact O-N 3.49Å; S79-E81 PolarHBondContact O-N 3.02Å
80I95.2Very high95.7Very high3 Ų328.5 Ų28.52%0.01515%0.154CC..  trans-83.9114.4178.5-53.6179.1000108.6L30 I76 L77 P78 D82 V85 T86 Y89 K131L30-I80 HydrophobicContact CB-CD1 4.36Å; L30-I80 HydrophobicContact CB-CG1 4.09Å; I76-I80 WeakPolarHBondContact O-CG1 3.27Å; L77-I80 PolarHBondContact O-N 3.28Å; P78-I80 VanDerWaalsContact C-N 3.34Å; I80-D82 WeakPolarHBondContact CG2-O 3.45Å; I80-V85 HydrophobicContact CD1-CG1 4.47Å; I80-V85 HydrophobicContact CG2-CB 3.76Å; I80-V85 HydrophobicContact CG2-CG1 3.56Å; I80-T86 WeakPolarHBondContact CG2-OG1 3.04Å; I80-Y89 HydrophobicContact CD1-CD1 3.67Å; I80-Y89 HydrophobicContact CD1-CE1 4.35Å; I80-Y89 HydrophobicContact CD1-CG 3.78Å; I80-K131 PolarHBondContact O-NZ 3.27Å
81E91.6Very high95.7Very high125 Ų12528.8 Ų28.858%0.58416%0.155SC*.  trans-72.8-44.9179.7-67.2-178-177.600111.8S79 K131S79-E81 PolarHBondContact O-N 3.02Å; E81-K131 VanDerWaalsContact C-NZ 3.28Å; E81-K131 VanDerWaalsContact O-CE 3.31Å; E81-K131 WeakPolarHBondContact O-CE 3.31Å; E81-K131 PolarHBondContact O-NZ 2.96Å
82D92.7Very high95.8Very high59 Ų5925.8 Ų25.832%0.31614%0.137SC..  trans-73.5134.8-176.5177.742000112.7I80 T84 V85 T86 K131I80-D82 WeakPolarHBondContact CG2-O 3.45Å; D82-T84 PolarHBondContact OD1-N 3.43Å; D82-T84 WeakPolarHBondContact OD2-CB 3.14Å; D82-T84 PolarHBondContact OD2-N 3.33Å; D82-V85 HydrophobicContact CB-CB 4.13Å; D82-V85 HydrophobicContact CB-CG2 3.99Å; D82-V85 WeakPolarHBondContact OD2-CG2 3.32Å; D82-V85 PolarHBondContact OD2-N 3.22Å; D82-T86 WeakPolarHBondContact O-CB 3.12Å; D82-T86 PolarHBondContact O-N 3.05Å; D82-T86 PolarHBondContact O-OG1 2.95Å; D82-K131 VanDerWaalsContact C-NZ 3.34Å; D82-K131 PolarHBondContact O-NZ 3.43Å
83S93.9Very high95.9Very high45 Ų4523 Ų2332%0.31513%0.126SC..Hα-helixtrans-69.4-40-178.9-70.80000111.9T86 L87S83-T86 WeakPolarHBondContact O-CB 3.23Å; S83-T86 PolarHBondContact O-N 2.86Å; S83-L87 PolarHBondContact O-N 3.39Å
84T93.6Very high95.9Very high42 Ų4223 Ų2326%0.25813%0.126SC..Hα-helixtrans-67.2-47.2179.7-540000110.9D82 T86 L87 Y88 C366D82-T84 PolarHBondContact OD1-N 3.43Å; D82-T84 WeakPolarHBondContact OD2-CB 3.14Å; D82-T84 PolarHBondContact OD2-N 3.33Å; T84-T86 VanDerWaalsContact C-N 3.3Å; T84-T86 PolarHBondContact O-N 3.47Å; T84-L87 PolarHBondContact O-N 3.28Å; T84-Y88 HydrophobicContact CG2-CD2 4.37Å; T84-Y88 HydrophobicContact CG2-CE1 4.37Å; T84-Y88 HydrophobicContact CG2-CE2 4.01Å; T84-Y88 PolarHBondContact O-N 3.49Å; T84-C366 PolarHBondContact OG1-SG 3.46Å
85V94.5Very high96Very high7 Ų724.2 Ų24.24%0.04213%0.132CC..Hα-helixtrans-60.3-40.3174179.10000111.4L30 W41 L46 I80 D82 L87 Y88 Y89L30-V85 HydrophobicContact CD2-CG1 4.34Å; W41-V85 HydrophobicContact CB-CG2 3.89Å; W41-V85 HydrophobicContact CG-CG1 4.24Å; W41-V85 HydrophobicContact CG-CG2 3.82Å; L46-V85 HydrophobicContact CD1-CG1 4.38Å; L46-V85 HydrophobicContact CD2-CG1 4.24Å; I80-V85 HydrophobicContact CD1-CG1 4.47Å; I80-V85 HydrophobicContact CG2-CB 3.76Å; I80-V85 HydrophobicContact CG2-CG1 3.56Å; D82-V85 HydrophobicContact CB-CB 4.13Å; D82-V85 HydrophobicContact CB-CG2 3.99Å; D82-V85 WeakPolarHBondContact OD2-CG2 3.32Å; D82-V85 PolarHBondContact OD2-N 3.22Å; V85-L87 VanDerWaalsContact C-N 3.3Å; V85-L87 PolarHBondContact O-N 3.18Å; V85-Y88 PolarHBondContact O-N 3.32Å; V85-Y89 WeakPolarHBondContact O-CB 3.35Å; V85-Y89 PolarHBondContact O-N 3.3Å
86T96.2Very high96.1Very high0 Ų021.4 Ų21.40%012%0.117CC..Hα-helixtrans-60.2-43.4177-61.20000111L77 I80 D82 S83 T84 S90 F126 I127 K131 I134L77-T86 HydrophobicContact CD1-CG2 3.77Å; I80-T86 WeakPolarHBondContact CG2-OG1 3.04Å; D82-T86 WeakPolarHBondContact O-CB 3.12Å; D82-T86 PolarHBondContact O-N 3.05Å; D82-T86 PolarHBondContact O-OG1 2.95Å; S83-T86 WeakPolarHBondContact O-CB 3.23Å; S83-T86 PolarHBondContact O-N 2.86Å; T84-T86 VanDerWaalsContact C-N 3.3Å; T84-T86 PolarHBondContact O-N 3.47Å; T86-S90 WeakPolarHBondContact O-CB 3.44Å; T86-S90 PolarHBondContact O-N 3.09Å; T86-S90 PolarHBondContact O-OG 3.26Å; T86-F126 HydrophobicContact CG2-CE1 4.18Å; T86-I127 HydrophobicContact CG2-CD1 4.49Å; T86-K131 HydrophobicContact CG2-CD 4.48Å; T86-K131 PolarHBondContact OG1-NZ 3.43Å; T86-I134 HydrophobicContact CG2-CD1 3.85Å
87L96.2Very high96.1Very high11 Ų1121.4 Ų21.46%0.05812%0.117CC..Hα-helixtrans-67-51.6178.8-173.263.2000111.2S83 T84 V85 Y89 S90 Y91 F138S83-L87 PolarHBondContact O-N 3.39Å; T84-L87 PolarHBondContact O-N 3.28Å; V85-L87 VanDerWaalsContact C-N 3.3Å; V85-L87 PolarHBondContact O-N 3.18Å; L87-Y89 VanDerWaalsContact C-N 3.29Å; L87-Y89 PolarHBondContact O-N 2.96Å; L87-S90 WeakPolarHBondContact O-CA 3.19Å; L87-S90 WeakPolarHBondContact O-CB 3.42Å; L87-S90 PolarHBondContact O-N 3.32Å; L87-Y91 HydrophobicContact CD1-CD2 3.91Å; L87-Y91 HydrophobicContact CD1-CE2 3.7Å; L87-Y91 HydrophobicContact CD2-CE2 4.4Å; L87-Y91 HydrophobicContact CG-CD2 3.9Å; L87-Y91 HydrophobicContact CG-CE2 3.88Å; L87-Y91 WeakPolarHBondContact O-CD2 3.5Å; L87-Y91 PolarHBondContact O-N 3.12Å; L87-F138 HydrophobicContact CD1-CB 4.5Å
88Y96.1Very high96.1Very high35 Ų3521.6 Ų21.614%0.13712%0.119CC..Hα-helixtrans-59.7-39.2178.1-73.7-4000112.5Y43 L46 T84 V85 S90 Y91 A92 V367Y43-Y88 HydrophobicContact CD2-CG 4.28Å; L46-Y88 HydrophobicContact CD1-CD2 4.2Å; L46-Y88 HydrophobicContact CD1-CG 4.27Å; T84-Y88 HydrophobicContact CG2-CD2 4.37Å; T84-Y88 HydrophobicContact CG2-CE1 4.37Å; T84-Y88 HydrophobicContact CG2-CE2 4.01Å; T84-Y88 PolarHBondContact O-N 3.49Å; V85-Y88 PolarHBondContact O-N 3.32Å; Y88-S90 VanDerWaalsContact C-N 3.32Å; Y88-S90 PolarHBondContact O-N 2.88Å; Y88-Y91 PolarHBondContact O-N 3.15Å; Y88-A92 WeakPolarHBondContact O-CB 3.26Å; Y88-A92 PolarHBondContact O-N 3.41Å; Y88-V367 PolarHBondContact OH-O 2.9Å
89Y97.1Very high96.2Very high0 Ų022.6 Ų22.60%012%0.115CC..Hα-helixtrans-63.1-39.9174.3179.4-109.4000111.7L30 C50 L53 I76 L77 I80 V85 L87 A92 M93 F119L30-Y89 HydrophobicContact CD1-CD2 4.17Å; L30-Y89 HydrophobicContact CD1-CE2 4.05Å; C50-Y89 VanDerWaalsContact SG-CE2 3.54Å; L53-Y89 HydrophobicContact CD1-CE2 4.12Å; L53-Y89 WeakPolarHBondContact CD1-OH 3.38Å; I76-Y89 HydrophobicContact CG2-CE1 4.2Å; I76-Y89 HydrophobicContact CG2-CE2 4.42Å; L77-Y89 HydrophobicContact CB-CE1 4.22Å; L77-Y89 HydrophobicContact CD1-CD1 3.85Å; L77-Y89 HydrophobicContact CD1-CE1 4.33Å; I80-Y89 HydrophobicContact CD1-CD1 3.67Å; I80-Y89 HydrophobicContact CD1-CE1 4.35Å; I80-Y89 HydrophobicContact CD1-CG 3.78Å; V85-Y89 WeakPolarHBondContact O-CB 3.35Å; V85-Y89 PolarHBondContact O-N 3.3Å; L87-Y89 VanDerWaalsContact C-N 3.29Å; L87-Y89 PolarHBondContact O-N 2.96Å; Y89-A92 PolarHBondContact O-N 3.45Å; Y89-M93 HydrophobicContact CE2-CE 4.24Å; Y89-M93 WeakPolarHBondContact O-CB 3.44Å; Y89-M93 PolarHBondContact O-N 3.5Å; Y89-M93 WeakPolarHBondContact OH-CE 3.39Å; Y89-F119 HydrophobicContact CD1-CE2 4.3Å; Y89-F119 HydrophobicContact CD1-CZ 4.18Å; Y89-F119 AromaticContact CE1-CE2 3.68Å; Y89-F119 HydrophobicContact CE1-CE2 3.68Å; Y89-F119 HydrophobicContact CE1-CZ 4.01Å
90S97.8Very high96.3Very high0 Ų022 Ų220%011%0.11CC..Hα-helixtrans-64.9-48.5176.4-57.70000111.8T86 L87 Y88 A92 M93 F94T86-S90 WeakPolarHBondContact O-CB 3.44Å; T86-S90 PolarHBondContact O-N 3.09Å; T86-S90 PolarHBondContact O-OG 3.26Å; L87-S90 WeakPolarHBondContact O-CA 3.19Å; L87-S90 WeakPolarHBondContact O-CB 3.42Å; L87-S90 PolarHBondContact O-N 3.32Å; Y88-S90 VanDerWaalsContact C-N 3.32Å; Y88-S90 PolarHBondContact O-N 2.88Å; S90-A92 PolarHBondContact O-N 3.33Å; S90-M93 PolarHBondContact O-N 3.44Å; S90-F94 WeakPolarHBondContact O-CD2 3.31Å; S90-F94 WeakPolarHBondContact O-CG 3.31Å; S90-F94 PolarHBondContact O-N 3.32Å
91Y98Very high96.4Very high7 Ų722.8 Ų22.83%0.02711%0.113CC..Hα-helixtrans-56.6-48.1173.6-91.1-93000111.6L87 Y88 M93 F94 E95 S137 A141 T144 K145L87-Y91 HydrophobicContact CD1-CD2 3.91Å; L87-Y91 HydrophobicContact CD1-CE2 3.7Å; L87-Y91 HydrophobicContact CD2-CE2 4.4Å; L87-Y91 HydrophobicContact CG-CD2 3.9Å; L87-Y91 HydrophobicContact CG-CE2 3.88Å; L87-Y91 WeakPolarHBondContact O-CD2 3.5Å; L87-Y91 PolarHBondContact O-N 3.12Å; Y88-Y91 PolarHBondContact O-N 3.15Å; Y91-M93 VanDerWaalsContact C-N 3.35Å; Y91-M93 PolarHBondContact O-N 2.72Å; Y91-F94 PolarHBondContact O-N 2.89Å; Y91-E95 VanDerWaalsContact O-CB 3.27Å; Y91-E95 WeakPolarHBondContact O-CB 3.26Å; Y91-E95 PolarHBondContact O-N 3.43Å; Y91-S137 WeakPolarHBondContact CE2-O 3.5Å; Y91-S137 PolarHBondContact OH-O 3.01Å; Y91-A141 HydrophobicContact CD1-CB 3.87Å; Y91-A141 HydrophobicContact CD2-CB 3.5Å; Y91-A141 VanDerWaalsContact CD2-CB 3.5Å; Y91-A141 HydrophobicContact CE1-CB 3.79Å; Y91-A141 HydrophobicContact CE2-CB 3.41Å; Y91-A141 VanDerWaalsContact CE2-CB 3.41Å; Y91-A141 HydrophobicContact CG-CB 3.73Å; Y91-A141 VanDerWaalsContact CZ-CA 3.47Å; Y91-A141 PolarHBondContact OH-N 3.36Å; Y91-T144 HydrophobicContact CE1-CG2 4.5Å; Y91-K145 HydrophobicContact CD1-CD 4.44Å; Y91-K145 HydrophobicContact CD1-CG 3.95Å
92A97.8Very high96.5Very high0 Ų021.1 Ų21.10%011%0.108CC..Hα-helixtrans-63.5-37.8-18000000112.7Y43 L46 L47 C50 Y88 Y89 S90 T96Y43-A92 HydrophobicContact CE2-CB 4.03Å; L46-A92 HydrophobicContact CB-CB 4.26Å; L47-A92 HydrophobicContact CB-CB 4.37Å; L47-A92 HydrophobicContact CD1-CB 4.26Å; C50-A92 HydrophobicContact CB-CB 4.34Å; Y88-A92 WeakPolarHBondContact O-CB 3.26Å; Y88-A92 PolarHBondContact O-N 3.41Å; Y89-A92 PolarHBondContact O-N 3.45Å; S90-A92 PolarHBondContact O-N 3.33Å; A92-T96 VanDerWaalsContact O-CB 3.3Å; A92-T96 WeakPolarHBondContact O-CB 3.33Å; A92-T96 PolarHBondContact O-N 2.85Å; A92-T96 PolarHBondContact O-OG1 3.17Å
93M98.3Very high96.6Very high2 Ų223.3 Ų23.31%0.0112%0.12CC..Hα-helixtrans-67.3-48.2176.7-175.76269.300111.4C50 L53 Y89 S90 Y91 E95 T96 L97 F119C50-M93 HydrophobicContact CB-CE 4.45Å; L53-M93 HydrophobicContact CD1-CE 4.05Å; Y89-M93 HydrophobicContact CE2-CE 4.24Å; Y89-M93 WeakPolarHBondContact O-CB 3.44Å; Y89-M93 PolarHBondContact O-N 3.5Å; Y89-M93 WeakPolarHBondContact OH-CE 3.39Å; S90-M93 PolarHBondContact O-N 3.44Å; Y91-M93 VanDerWaalsContact C-N 3.35Å; Y91-M93 PolarHBondContact O-N 2.72Å; M93-E95 VanDerWaalsContact C-N 3.35Å; M93-E95 PolarHBondContact O-N 3.01Å; M93-T96 PolarHBondContact O-N 3.49Å; M93-L97 WeakPolarHBondContact O-CG 3.43Å; M93-L97 PolarHBondContact O-N 2.66Å; M93-F119 HydrophobicContact CB-CD1 4.41Å; M93-F119 HydrophobicContact CB-CE1 3.78Å; M93-F119 HydrophobicContact CB-CE2 4.18Å; M93-F119 HydrophobicContact CB-CZ 3.65Å; M93-F119 HydrophobicContact CE-CE2 4.37Å; M93-F119 HydrophobicContact CG-CD1 3.92Å; M93-F119 HydrophobicContact CG-CD2 4Å; M93-F119 HydrophobicContact CG-CE1 3.78Å; M93-F119 HydrophobicContact CG-CE2 3.86Å; M93-F119 HydrophobicContact CG-CG 4.02Å; M93-F119 HydrophobicContact CG-CZ 3.76Å
94F98.2Very high96.7Very high0 Ų022.3 Ų22.30%011%0.11CC..Hα-helixtrans-63.2-41.3177-66.9-47.5000111.9S90 Y91 L97 A98 F119 F138 A141 I142 K145 I146 F161S90-F94 WeakPolarHBondContact O-CD2 3.31Å; S90-F94 WeakPolarHBondContact O-CG 3.31Å; S90-F94 PolarHBondContact O-N 3.32Å; Y91-F94 PolarHBondContact O-N 2.89Å; F94-L97 PolarHBondContact O-N 3.32Å; F94-A98 PolarHBondContact O-N 3.33Å; F94-F119 HydrophobicContact CD1-CD1 4.36Å; F94-F119 AromaticContact CE1-CD1 3.69Å; F94-F119 HydrophobicContact CE1-CD1 3.69Å; F94-F119 HydrophobicContact CE1-CE1 4.1Å; F94-F119 HydrophobicContact CE2-CE1 4.25Å; F94-F119 AromaticContact CZ-CD1 3.81Å; F94-F119 HydrophobicContact CZ-CD1 3.81Å; F94-F119 AromaticContact CZ-CE1 3.91Å; F94-F119 HydrophobicContact CZ-CE1 3.91Å; F94-F138 HydrophobicContact CE2-CD2 4.29Å; F94-F138 AromaticContact CE2-CE2 3.74Å; F94-F138 HydrophobicContact CE2-CE2 3.74Å; F94-F138 HydrophobicContact CE2-CZ 4.1Å; F94-F138 AromaticContact CZ-CE2 3.9Å; F94-F138 HydrophobicContact CZ-CE2 3.9Å; F94-F138 AromaticContact CZ-CZ 3.86Å; F94-F138 HydrophobicContact CZ-CZ 3.86Å; F94-A141 HydrophobicContact CD2-CB 3.92Å; F94-A141 HydrophobicContact CE2-CB 4.28Å; F94-I142 HydrophobicContact CD1-CG1 4.5Å; F94-I142 HydrophobicContact CD2-CG1 3.96Å; F94-I142 HydrophobicContact CE1-CG1 4.05Å; F94-I142 HydrophobicContact CE2-CD1 4.23Å; F94-I142 HydrophobicContact CE2-CG1 3.45Å; F94-I142 VanDerWaalsContact CE2-CG1 3.45Å; F94-I142 HydrophobicContact CG-CG1 4.47Å; F94-I142 HydrophobicContact CZ-CD1 3.98Å; F94-I142 HydrophobicContact CZ-CG1 3.5Å; F94-K145 HydrophobicContact CB-CB 3.94Å; F94-I146 HydrophobicContact CB-CD1 3.88Å; F94-I146 HydrophobicContact CB-CG1 4.11Å; F94-I146 HydrophobicContact CD1-CD1 3.55Å; F94-I146 HydrophobicContact CE1-CD1 4.45Å; F94-I146 HydrophobicContact CG-CD1 4.05Å; F94-F161 HydrophobicContact CD1-CE1 4.43Å; F94-F161 HydrophobicContact CD1-CZ 4.25Å; F94-F161 HydrophobicContact CE1-CE1 4.08Å; F94-F161 HydrophobicContact CE1-CZ 4.09Å
95E98Very high96.8Very high26 Ų2622.6 Ų22.612%0.12111%0.111CC..Hα-helixtrans-61.8-43.8174.2-171.3-178.2136.600111.5Y43 L47 Y91 M93 L97 A98 R99 K145Y43-E95 PolarHBondContact OH-OE2 3.13Å; L47-E95 HydrophobicContact CD1-CB 4.38Å; L47-E95 HydrophobicContact CD1-CG 4.42Å; Y91-E95 VanDerWaalsContact O-CB 3.27Å; Y91-E95 WeakPolarHBondContact O-CB 3.26Å; Y91-E95 PolarHBondContact O-N 3.43Å; M93-E95 VanDerWaalsContact C-N 3.35Å; M93-E95 PolarHBondContact O-N 3.01Å; E95-L97 VanDerWaalsContact C-N 3.34Å; E95-L97 PolarHBondContact O-N 3.39Å; E95-A98 PolarHBondContact O-N 3.11Å; E95-R99 HydrophobicContact CG-CG 4.1Å; E95-R99 WeakPolarHBondContact O-CB 3.44Å; E95-R99 VanDerWaalsContact O-CG 3.29Å; E95-R99 WeakPolarHBondContact O-CG 3.28Å; E95-R99 PolarHBondContact O-N 3.19Å; E95-R99 WeakPolarHBondContact OE1-CD 3.46Å; E95-R99 IonicContact OE1-CZ 2.74Å; E95-R99 IonicContact OE1-NH1 3.26Å; E95-R99 PolarHBondContact OE1-NH1 2.72Å; E95-K145 HydrophobicContact CB-CB 4.39Å; E95-K145 HydrophobicContact CB-CD 3.93Å; E95-K145 HydrophobicContact CB-CG 4.17Å; E95-K145 HydrophobicContact CG-CD 4.16Å; E95-K145 WeakPolarHBondContact OE2-CE 3.44Å; E95-K145 IonicContact OE2-NZ 2.63Å; E95-K145 PolarHBondContact OE2-NZ 3.12Å
96T98Very high96.7Very high6 Ų631.1 Ų31.14%0.03714%0.143CC..Hα-helixtrans-62.8-41.5178-59.20000111.3C50 K51 H54 A92 M93 E100C50-T96 WeakPolarHBondContact CB-OG1 3.36Å; K51-T96 HydrophobicContact CB-CG2 4.5Å; H54-T96 HydrophobicContact CB-CG2 3.71Å; A92-T96 VanDerWaalsContact O-CB 3.3Å; A92-T96 WeakPolarHBondContact O-CB 3.33Å; A92-T96 PolarHBondContact O-N 2.85Å; A92-T96 PolarHBondContact O-OG1 3.17Å; M93-T96 PolarHBondContact O-N 3.49Å; T96-E100 HydrophobicContact CG2-CG 4.33Å; T96-E100 WeakPolarHBondContact O-CB 3.43Å; T96-E100 WeakPolarHBondContact O-CG 3.19Å; T96-E100 PolarHBondContact O-N 3.17Å
97L98Very high96.5Very high2 Ų240.7 Ų40.71%0.0118%0.179CC..Hα-helixtrans-61.8-46.1176.4-75.9171.7000111.7M93 F94 E95 W101 F112 L115 L157M93-L97 WeakPolarHBondContact O-CG 3.43Å; M93-L97 PolarHBondContact O-N 2.66Å; F94-L97 PolarHBondContact O-N 3.32Å; E95-L97 VanDerWaalsContact C-N 3.34Å; E95-L97 PolarHBondContact O-N 3.39Å; L97-W101 WeakPolarHBondContact O-CB 3.36Å; L97-W101 PolarHBondContact O-N 2.88Å; L97-F112 HydrophobicContact CD2-CD1 4.39Å; L97-L115 HydrophobicContact CD2-CD2 4.02Å; L97-L115 HydrophobicContact CD2-CG 4.4Å; L97-L157 HydrophobicContact CB-CD2 4.11Å
98A97.7Very high96.4Very high4 Ų443.4 Ų43.43%0.03319%0.189CC..Hα-helixtrans-64.6-53178.700000111.8F94 E95 E100 W101 K145 I146 H153 L157F94-A98 PolarHBondContact O-N 3.33Å; E95-A98 PolarHBondContact O-N 3.11Å; A98-E100 VanDerWaalsContact C-N 3.3Å; A98-E100 PolarHBondContact O-N 3.25Å; A98-W101 VanDerWaalsContact O-CB 3.31Å; A98-W101 WeakPolarHBondContact O-CB 3.21Å; A98-W101 PolarHBondContact O-N 3.15Å; A98-W101 VanDerWaalsContact O-N 3.12Å; A98-K145 VanDerWaalsContact CB-O 3.23Å; A98-K145 WeakPolarHBondContact CB-O 3.03Å; A98-I146 HydrophobicContact CB-CG1 4.32Å; A98-H153 PolarHBondContact O-CE1 2.83Å; A98-H153 PolarHBondContact O-NE2 3.16Å; A98-L157 HydrophobicContact CB-CD2 4.16Å
99R96.5Very high96.3Very high74 Ų7443.2 Ų43.228%0.27919%0.191SC..Hα-helixtrans-60.2-35.9-175.4-74.317766.5171.90.4113.9E95E95-R99 HydrophobicContact CG-CG 4.1Å; E95-R99 WeakPolarHBondContact O-CB 3.44Å; E95-R99 VanDerWaalsContact O-CG 3.29Å; E95-R99 WeakPolarHBondContact O-CG 3.28Å; E95-R99 PolarHBondContact O-N 3.19Å; E95-R99 WeakPolarHBondContact OE1-CD 3.46Å; E95-R99 IonicContact OE1-CZ 2.74Å; E95-R99 IonicContact OE1-NH1 3.26Å; E95-R99 PolarHBondContact OE1-NH1 2.72Å
100E96.4Very high96.3Very high13 Ų1348.4 Ų48.46%0.06122%0.219CC..Hα-helixtrans-93.2-5.5-177.4-57.4-74167.400112.5K51 H54 Y55 T96 A98 D102 N103K51-E100 IonicContact NZ-OE1 3.54Å; K51-E100 PolarHBondContact NZ-OE1 3.2Å; H54-E100 VanDerWaalsContact CE1-CB 3.45Å; H54-E100 WeakPolarHBondContact CE1-CB 3.47Å; Y55-E100 PolarHBondContact OH-OE2 3.35Å; T96-E100 HydrophobicContact CG2-CG 4.33Å; T96-E100 WeakPolarHBondContact O-CB 3.43Å; T96-E100 WeakPolarHBondContact O-CG 3.19Å; T96-E100 PolarHBondContact O-N 3.17Å; A98-E100 VanDerWaalsContact C-N 3.3Å; A98-E100 PolarHBondContact O-N 3.25Å; E100-D102 PolarHBondContact O-N 3.15Å; E100-N103 WeakPolarHBondContact O-CB 3.37Å; E100-N103 PolarHBondContact O-N 3.27Å; E100-N103 VanDerWaalsContact O-N 3.16Å
101W97.3Very high96.2Very high21 Ų2148.9 Ų48.98%0.0822%0.221CC..Hα-helixtrans-59.7-47.7-173.3-170.4-96000113L97 A98 N103 L104 V109 F112 M113 A154 L157L97-W101 WeakPolarHBondContact O-CB 3.36Å; L97-W101 PolarHBondContact O-N 2.88Å; A98-W101 VanDerWaalsContact O-CB 3.31Å; A98-W101 WeakPolarHBondContact O-CB 3.21Å; A98-W101 PolarHBondContact O-N 3.15Å; A98-W101 VanDerWaalsContact O-N 3.12Å; W101-N103 PolarHBondContact O-N 3Å; W101-L104 HydrophobicContact CD2-CD1 4.16Å; W101-L104 HydrophobicContact CE3-CD1 3.74Å; W101-L104 HydrophobicContact CZ3-CD1 4.11Å; W101-L104 VanDerWaalsContact O-CB 3.31Å; W101-L104 WeakPolarHBondContact O-CB 3.47Å; W101-L104 WeakPolarHBondContact O-CG 3.37Å; W101-L104 PolarHBondContact O-N 3.09Å; W101-V109 HydrophobicContact CH2-CG1 3.81Å; W101-V109 HydrophobicContact CZ2-CG1 3.81Å; W101-F112 HydrophobicContact CZ3-CB 4.16Å; W101-M113 HydrophobicContact CH2-CG 3.67Å; W101-A154 HydrophobicContact CB-CB 3.76Å; W101-A154 HydrophobicContact CG-CB 4.05Å; W101-L157 HydrophobicContact CD2-CB 3.52Å; W101-L157 HydrophobicContact CD2-CD1 4.25Å; W101-L157 HydrophobicContact CD2-CD2 4.46Å; W101-L157 HydrophobicContact CD2-CG 4.28Å; W101-L157 HydrophobicContact CE3-CB 3.85Å; W101-L157 HydrophobicContact CE3-CD1 3.66Å; W101-L157 HydrophobicContact CE3-CD2 4.22Å; W101-L157 HydrophobicContact CE3-CG 4.11Å; W101-L157 HydrophobicContact CG-CB 3.82Å; W101-L157 HydrophobicContact CH2-CB 4.34Å; W101-L157 HydrophobicContact CH2-CD1 3.95Å; W101-L157 HydrophobicContact CZ2-CB 4.08Å; W101-L157 HydrophobicContact CZ3-CB 4.27Å; W101-L157 HydrophobicContact CZ3-CD1 3.5Å; W101-L157 HydrophobicContact CZ3-CG 4.38Å; W101-L157 VanDerWaalsContact NE1-N 3.19Å
102D95.5Very high96.1Very high90 Ų9048.6 Ų48.648%0.48122%0.22SC..THydrogen-bonded Turntrans-70.4-12.8-176.5-58.9-33.2000112.3E100 H153 A154E100-D102 PolarHBondContact O-N 3.15Å; D102-H153 IonicContact OD2-CE1 3.91Å; D102-H153 PolarHBondContact OD2-CE1 2.87Å; D102-H153 IonicContact OD2-CG 2.8Å; D102-H153 IonicContact OD2-ND1 2.95Å; D102-H153 PolarHBondContact OD2-ND1 2.76Å; D102-A154 WeakPolarHBondContact OD1-CA 3.47Å; D102-A154 PolarHBondContact OD1-N 2.7Å; D102-A154 VanDerWaalsContact OD1-N 3.15Å; D102-A154 PolarHBondContact OD2-N 3Å
103N94.7Very high96.1Very high105 Ų10551.1 Ų51.156%0.56123%0.232SC*.THydrogen-bonded Turntrans-87.9-6.4174.5-61.3-38.8000113W58 E100 W101W58-N103 WeakPolarHBondContact CH2-O 3.44Å; E100-N103 WeakPolarHBondContact O-CB 3.37Å; E100-N103 PolarHBondContact O-N 3.27Å; E100-N103 VanDerWaalsContact O-N 3.16Å; W101-N103 PolarHBondContact O-N 3Å
104L95.1Very high96.1Very high23 Ų2353.7 Ų53.712%0.1225%0.246CC..  trans-77.4130.8-179.8-63.8174.2000110.9W58 W101 R108 V109 F112W58-L104 HydrophobicContact CE3-CD2 3.92Å; W58-L104 HydrophobicContact CH2-CD2 4.28Å; W58-L104 HydrophobicContact CZ3-CD2 3.52Å; W101-L104 HydrophobicContact CD2-CD1 4.16Å; W101-L104 HydrophobicContact CE3-CD1 3.74Å; W101-L104 HydrophobicContact CZ3-CD1 4.11Å; W101-L104 VanDerWaalsContact O-CB 3.31Å; W101-L104 WeakPolarHBondContact O-CB 3.47Å; W101-L104 WeakPolarHBondContact O-CG 3.37Å; W101-L104 PolarHBondContact O-N 3.09Å; L104-R108 HydrophobicContact CD2-CB 4.43Å; L104-V109 HydrophobicContact CB-CG2 4.24Å; L104-F112 HydrophobicContact CD1-CB 3.94Å; L104-F112 HydrophobicContact CD1-CD2 3.74Å; L104-F112 HydrophobicContact CD1-CE2 4.5Å; L104-F112 HydrophobicContact CD1-CG 3.97Å; L104-F112 HydrophobicContact CD2-CD2 3.4Å; L104-F112 HydrophobicContact CD2-CE2 3.33Å; L104-F112 HydrophobicContact CD2-CG 4.24Å; L104-F112 HydrophobicContact CD2-CZ 4.12Å; L104-F112 HydrophobicContact CG-CD2 4.25Å
105D94.7Very high96Very high49 Ų4953.8 Ų53.826%0.26225%0.247SC..  trans-78.5156.8164.263.6111.9000111.2W107 R108 V109D105-W107 PolarHBondContact O-N 3.42Å; D105-W107 VanDerWaalsContact O-N 3.08Å; D105-W107 WeakPolarHBondContact OD1-CB 3.33Å; D105-W107 PolarHBondContact OD1-N 3.31Å; D105-R108 PolarHBondContact O-N 3.46Å; D105-R108 IonicContact OD1-NH1 2.71Å; D105-R108 PolarHBondContact OD1-NH1 3.33Å; D105-R108 WeakPolarHBondContact OD2-CD 3.32Å; D105-R108 WeakPolarHBondContact OD2-CG 3.17Å; D105-R108 IonicContact OD2-CZ 3.44Å; D105-R108 IonicContact OD2-NE 3.84Å; D105-R108 IonicContact OD2-NH1 2.74Å; D105-R108 PolarHBondContact OD2-NH1 3.21Å; D105-V109 WeakPolarHBondContact O-CG2 3.31Å
106Y93Very high96Very high185 Ų18552.6 Ų52.673%0.72524%0.241SC*.G310 helixtrans-47.6-41.2-177.8-177.7-103.7000113.7R108 V109Y106-R108 PolarHBondContact O-N 3.38Å; Y106-V109 PolarHBondContact O-N 3.29Å
107W91.6Very high96Very high202 Ų20255.2 Ų55.277%0.76525%0.25SS*.G310 helixtrans-71-13.5-176.8-49.9104.6000114.5D105D105-W107 PolarHBondContact O-N 3.42Å; D105-W107 VanDerWaalsContact O-N 3.08Å; D105-W107 WeakPolarHBondContact OD1-CB 3.33Å; D105-W107 PolarHBondContact OD1-N 3.31Å
108R93.8Very high96Very high68 Ų6857.6 Ų57.626%0.25726%0.261SS..G310 helixtrans-105.2-15.1-177.9-68-172.5175.172.79.8113.3L104 D105 Y106 D110 K111 F112L104-R108 HydrophobicContact CD2-CB 4.43Å; D105-R108 PolarHBondContact O-N 3.46Å; D105-R108 IonicContact OD1-NH1 2.71Å; D105-R108 PolarHBondContact OD1-NH1 3.33Å; D105-R108 WeakPolarHBondContact OD2-CD 3.32Å; D105-R108 WeakPolarHBondContact OD2-CG 3.17Å; D105-R108 IonicContact OD2-CZ 3.44Å; D105-R108 IonicContact OD2-NE 3.84Å; D105-R108 IonicContact OD2-NH1 2.74Å; D105-R108 PolarHBondContact OD2-NH1 3.21Å; Y106-R108 PolarHBondContact O-N 3.38Å; R108-D110 VanDerWaalsContact C-N 3.35Å; R108-D110 PolarHBondContact O-N 2.93Å; R108-K111 WeakPolarHBondContact O-CG 3.45Å; R108-F112 HydrophobicContact CB-CE2 4.39Å; R108-F112 VanDerWaalsContact O-CD2 3.29Å; R108-F112 WeakPolarHBondContact O-CD2 3.36Å
109V95.7Very high96Very high30 Ų3057.5 Ų57.518%0.18226%0.26CS..Hα-helixtrans-59-43.1-170.7-178.10000112.3W101 L104 D105 Y106 K111 F112 M113W101-V109 HydrophobicContact CH2-CG1 3.81Å; W101-V109 HydrophobicContact CZ2-CG1 3.81Å; L104-V109 HydrophobicContact CB-CG2 4.24Å; D105-V109 WeakPolarHBondContact O-CG2 3.31Å; Y106-V109 PolarHBondContact O-N 3.29Å; V109-K111 PolarHBondContact O-N 2.89Å; V109-F112 PolarHBondContact O-N 2.99Å; V109-M113 HydrophobicContact CG1-CE 4.08Å; V109-M113 HydrophobicContact CG1-CG 4.01Å; V109-M113 HydrophobicContact CG1-SD 4.15Å; V109-M113 PolarHBondContact O-N 3.25Å
110D95.6Very high96Very high110 Ų11054 Ų5459%0.58825%0.247SC*.Hα-helixtrans-56.9-42.8-173.3-64-40.9000114.2R108 F112 M113 L114R108-D110 VanDerWaalsContact C-N 3.35Å; R108-D110 PolarHBondContact O-N 2.93Å; D110-F112 VanDerWaalsContact C-N 3.28Å; D110-F112 PolarHBondContact O-N 3.3Å; D110-M113 HydrophobicContact CB-CE 4.43Å; D110-M113 WeakPolarHBondContact O-CB 3.26Å; D110-M113 PolarHBondContact O-N 3.29Å; D110-M113 WeakPolarHBondContact OD1-CE 3.38Å; D110-L114 PolarHBondContact O-N 3.23Å
111K95.8Very high96Very high10 Ų1054.1 Ų54.14%0.04325%0.248CC..Hα-helixtrans-69.1-29.1179.460.4178.8178.8-175.60112.5L57 W58 Q60 K66 R108 V109 L115L57-K111 HydrophobicContact CD1-CB 4.35Å; L57-K111 HydrophobicContact CD1-CD 4.06Å; L57-K111 HydrophobicContact CD2-CB 4.45Å; L57-K111 HydrophobicContact CD2-CG 4.48Å; L57-K111 HydrophobicContact CG-CB 4.49Å; L57-K111 HydrophobicContact CG-CD 3.98Å; L57-K111 HydrophobicContact CG-CG 4.28Å; L57-K111 WeakPolarHBondContact O-CE 3.31Å; L57-K111 PolarHBondContact O-NZ 2.89Å; W58-K111 PolarHBondContact O-NZ 3.48Å; Q60-K111 PolarHBondContact O-NZ 2.85Å; K66-K111 HydrophobicContact CB-CB 4.24Å; K66-K111 HydrophobicContact CD-CB 4.11Å; K66-K111 HydrophobicContact CD-CD 3.9Å; K66-K111 HydrophobicContact CD-CG 4.49Å; K66-K111 HydrophobicContact CG-CB 4.33Å; K66-K111 HydrophobicContact CG-CD 3.97Å; R108-K111 WeakPolarHBondContact O-CG 3.45Å; V109-K111 PolarHBondContact O-N 2.89Å; K111-L115 PolarHBondContact O-N 2.99Å
112F97.4Very high95.8Very high1 Ų154.8 Ų54.80%0.00425%0.251CS..Hα-helixtrans-80.3-31.3175.3-69.7-73.7000111.9H54 L57 W58 L97 W101 L104 R108 V109 D110 L114 L115 G116H54-F112 AromaticContact CD2-CE1 3.99Å; H54-F112 AromaticContact CE1-CD1 3.71Å; H54-F112 AromaticContact CE1-CE1 3.24Å; H54-F112 WeakPolarHBondContact CE1-CE1 3.38Å; H54-F112 AromaticContact CE1-CZ 3.6Å; H54-F112 AromaticContact CG-CE1 3.77Å; H54-F112 AromaticContact ND1-CD1 3.8Å; H54-F112 AromaticContact ND1-CE1 3.31Å; H54-F112 VanDerWaalsContact ND1-CE1 3.31Å; H54-F112 WeakPolarHBondContact ND1-CE1 3.4Å; H54-F112 AromaticContact NE2-CE1 3.65Å; H54-F112 AromaticContact NE2-CZ 3.58Å; L57-F112 HydrophobicContact CB-CE1 4.24Å; L57-F112 HydrophobicContact CB-CZ 4.48Å; L57-F112 HydrophobicContact CD2-CD1 3.95Å; L57-F112 HydrophobicContact CD2-CE1 3.93Å; L57-F112 HydrophobicContact CG-CE1 4.23Å; L57-F112 HydrophobicContact CG-CZ 4.43Å; W58-F112 HydrophobicContact CB-CZ 4.17Å; W58-F112 HydrophobicContact CE3-CE2 4.31Å; W58-F112 HydrophobicContact CE3-CZ 4.21Å; L97-F112 HydrophobicContact CD2-CD1 4.39Å; W101-F112 HydrophobicContact CZ3-CB 4.16Å; L104-F112 HydrophobicContact CD1-CB 3.94Å; L104-F112 HydrophobicContact CD1-CD2 3.74Å; L104-F112 HydrophobicContact CD1-CE2 4.5Å; L104-F112 HydrophobicContact CD1-CG 3.97Å; L104-F112 HydrophobicContact CD2-CD2 3.4Å; L104-F112 HydrophobicContact CD2-CE2 3.33Å; L104-F112 HydrophobicContact CD2-CG 4.24Å; L104-F112 HydrophobicContact CD2-CZ 4.12Å; L104-F112 HydrophobicContact CG-CD2 4.25Å; R108-F112 HydrophobicContact CB-CE2 4.39Å; R108-F112 VanDerWaalsContact O-CD2 3.29Å; R108-F112 WeakPolarHBondContact O-CD2 3.36Å; V109-F112 PolarHBondContact O-N 2.99Å; D110-F112 VanDerWaalsContact C-N 3.28Å; D110-F112 PolarHBondContact O-N 3.3Å; F112-L114 VanDerWaalsContact C-N 3.34Å; F112-L115 HydrophobicContact CD1-CD2 4.29Å; F112-L115 PolarHBondContact O-N 3.03Å; F112-G116 PolarHBondContact O-N 2.85Å
113M97.4Very high95.9Very high52 Ų5250.5 Ų50.526%0.25623%0.228SC..Hα-helixtrans-60.1-44.7165.9-73.2-166.5-64.300111.3W101 V109 D110 G116 R117 H160W101-M113 HydrophobicContact CH2-CG 3.67Å; V109-M113 HydrophobicContact CG1-CE 4.08Å; V109-M113 HydrophobicContact CG1-CG 4.01Å; V109-M113 HydrophobicContact CG1-SD 4.15Å; V109-M113 PolarHBondContact O-N 3.25Å; D110-M113 HydrophobicContact CB-CE 4.43Å; D110-M113 WeakPolarHBondContact O-CB 3.26Å; D110-M113 PolarHBondContact O-N 3.29Å; D110-M113 WeakPolarHBondContact OD1-CE 3.38Å; M113-G116 PolarHBondContact O-N 3Å; M113-R117 PolarHBondContact O-N 3.31Å; M113-H160 PolarHBondContact O-NE2 3.15Å; M113-H160 HydrophobicContact SD-CB 4.48Å
114L97.1Very high95.9Very high57 Ų5745.7 Ų45.730%0.29820%0.202SC..Hα-helixtrans-62.4-42.9175.1-178.363.2000111.8E67 V70 D110 F112 R117 E118E67-L114 HydrophobicContact CB-CD2 4.41Å; E67-L114 HydrophobicContact CG-CD2 3.86Å; V70-L114 HydrophobicContact CB-CD2 4.43Å; V70-L114 HydrophobicContact CB-CG 4.5Å; V70-L114 HydrophobicContact CG1-CG 4.21Å; V70-L114 HydrophobicContact CG2-CD2 4.19Å; V70-L114 HydrophobicContact CG2-CG 4.29Å; D110-L114 PolarHBondContact O-N 3.23Å; F112-L114 VanDerWaalsContact C-N 3.34Å; L114-R117 PolarHBondContact O-N 2.8Å; L114-E118 PolarHBondContact O-N 3Å
115L98Very high95.8Very high2 Ų248.5 Ų48.51%0.0122%0.215CC..Hα-helixtrans-59.2-48.1174.9178.560.1000111.7L57 V70 L73 L97 K111 F112 R117 E118 F119L57-L115 HydrophobicContact CD2-CB 3.9Å; L57-L115 HydrophobicContact CD2-CD2 3.8Å; L57-L115 HydrophobicContact CD2-CG 4.37Å; V70-L115 HydrophobicContact CG1-CB 4.43Å; V70-L115 HydrophobicContact CG1-CD1 4.17Å; V70-L115 HydrophobicContact CG2-CB 4.17Å; L73-L115 HydrophobicContact CB-CD1 4.28Å; L73-L115 HydrophobicContact CD1-CD1 4.31Å; L97-L115 HydrophobicContact CD2-CD2 4.02Å; L97-L115 HydrophobicContact CD2-CG 4.4Å; K111-L115 PolarHBondContact O-N 2.99Å; F112-L115 HydrophobicContact CD1-CD2 4.29Å; F112-L115 PolarHBondContact O-N 3.03Å; L115-R117 VanDerWaalsContact C-N 3.27Å; L115-R117 PolarHBondContact O-N 3.16Å; L115-E118 PolarHBondContact O-N 3.45Å; L115-F119 WeakPolarHBondContact O-CB 3.16Å; L115-F119 PolarHBondContact O-N 2.99Å
116G97.6Very high95.8Very high0 Ų047.7 Ų47.70%021%0.209CC..Hα-helixtrans-57.9-40.9175.600000112.1F112 M113 F120F112-G116 PolarHBondContact O-N 2.85Å; M113-G116 PolarHBondContact O-N 3Å; G116-F120 VanDerWaalsContact O-CB 3.32Å; G116-F120 WeakPolarHBondContact O-CB 3.32Å; G116-F120 PolarHBondContact O-N 2.97Å; G116-F120 VanDerWaalsContact O-N 3.09Å
117R97.6Very high95.9Very high62 Ų6238.9 Ų38.923%0.23417%0.174CC..Hα-helixtrans-63.2-56176.6-175.2-178.8-67.5-906.6113.8M113 L114 L115 F119 F120 T121 L164 E167 E168M113-R117 PolarHBondContact O-N 3.31Å; L114-R117 PolarHBondContact O-N 2.8Å; L115-R117 VanDerWaalsContact C-N 3.27Å; L115-R117 PolarHBondContact O-N 3.16Å; R117-F119 VanDerWaalsContact C-N 3.3Å; R117-F119 PolarHBondContact O-N 2.95Å; R117-F120 PolarHBondContact O-N 3.46Å; R117-T121 WeakPolarHBondContact O-CB 3.18Å; R117-T121 PolarHBondContact O-N 3.08Å; R117-T121 PolarHBondContact O-OG1 3.16Å; R117-L164 HydrophobicContact CB-CD1 3.74Å; R117-L164 HydrophobicContact CG-CD1 3.98Å; R117-E167 IonicContact CZ-OE2 3.18Å; R117-E167 IonicContact NH1-OE2 2.67Å; R117-E167 PolarHBondContact NH1-OE2 2.77Å; R117-E167 IonicContact NH2-OE2 2.7Å; R117-E167 PolarHBondContact NH2-OE2 3.02Å; R117-E168 IonicContact NH1-OE1 2.76Å; R117-E168 PolarHBondContact NH1-OE1 3.02Å
118E96.9Very high95.9Very high52 Ų5229.3 Ų29.324%0.24314%0.139CC..Hα-helixtrans-66.2-38.5-175.1-168.664.2-168.700111V70 C74 L114 L115 R122V70-E118 HydrophobicContact CG1-CB 3.68Å; V70-E118 HydrophobicContact CG1-CG 4.12Å; C74-E118 HydrophobicContact CB-CG 3.89Å; L114-E118 PolarHBondContact O-N 3Å; L115-E118 PolarHBondContact O-N 3.45Å; E118-R122 HydrophobicContact CG-CG 4.42Å; E118-R122 WeakPolarHBondContact O-CB 3.36Å; E118-R122 WeakPolarHBondContact O-CG 3.4Å; E118-R122 PolarHBondContact O-N 3.17Å; E118-R122 IonicContact OE1-CZ 3.77Å; E118-R122 IonicContact OE1-NE 3.57Å; E118-R122 PolarHBondContact OE1-NE 3.02Å; E118-R122 IonicContact OE1-NH2 2.9Å; E118-R122 PolarHBondContact OE1-NH2 3.18Å
119F97.9Very high95.9Very high1 Ų130.2 Ų30.20%0.00415%0.154CC..Hα-helixtrans-65-47.1178.3-167.5-97.6000112.2L77 Y89 M93 F94 L115 R117 G123L77-F119 HydrophobicContact CB-CE2 4.21Å; L77-F119 HydrophobicContact CD1-CZ 4.28Å; L77-F119 HydrophobicContact CD2-CE2 4.25Å; L77-F119 HydrophobicContact CD2-CZ 4.26Å; Y89-F119 HydrophobicContact CD1-CE2 4.3Å; Y89-F119 HydrophobicContact CD1-CZ 4.18Å; Y89-F119 AromaticContact CE1-CE2 3.68Å; Y89-F119 HydrophobicContact CE1-CE2 3.68Å; Y89-F119 HydrophobicContact CE1-CZ 4.01Å; M93-F119 HydrophobicContact CB-CD1 4.41Å; M93-F119 HydrophobicContact CB-CE1 3.78Å; M93-F119 HydrophobicContact CB-CE2 4.18Å; M93-F119 HydrophobicContact CB-CZ 3.65Å; M93-F119 HydrophobicContact CE-CE2 4.37Å; M93-F119 HydrophobicContact CG-CD1 3.92Å; M93-F119 HydrophobicContact CG-CD2 4Å; M93-F119 HydrophobicContact CG-CE1 3.78Å; M93-F119 HydrophobicContact CG-CE2 3.86Å; M93-F119 HydrophobicContact CG-CG 4.02Å; M93-F119 HydrophobicContact CG-CZ 3.76Å; F94-F119 HydrophobicContact CD1-CD1 4.36Å; F94-F119 AromaticContact CE1-CD1 3.69Å; F94-F119 HydrophobicContact CE1-CD1 3.69Å; F94-F119 HydrophobicContact CE1-CE1 4.1Å; F94-F119 HydrophobicContact CE2-CE1 4.25Å; F94-F119 AromaticContact CZ-CD1 3.81Å; F94-F119 HydrophobicContact CZ-CD1 3.81Å; F94-F119 AromaticContact CZ-CE1 3.91Å; F94-F119 HydrophobicContact CZ-CE1 3.91Å; L115-F119 WeakPolarHBondContact O-CB 3.16Å; L115-F119 PolarHBondContact O-N 2.99Å; R117-F119 VanDerWaalsContact C-N 3.3Å; R117-F119 PolarHBondContact O-N 2.95Å; F119-G123 PolarHBondContact O-N 3.25Å
120F97.2Very high95.7Very high0 Ų036.3 Ų36.30%018%0.178CC..Hα-helixtrans-61.4-47.9176.1174.9-108.6000111.9G116 R117 G123 L124 I142 F161 L164 I165 E168G116-F120 VanDerWaalsContact O-CB 3.32Å; G116-F120 WeakPolarHBondContact O-CB 3.32Å; G116-F120 PolarHBondContact O-N 2.97Å; G116-F120 VanDerWaalsContact O-N 3.09Å; R117-F120 PolarHBondContact O-N 3.46Å; F120-G123 PolarHBondContact O-N 2.79Å; F120-L124 HydrophobicContact CD1-CD1 4.04Å; F120-L124 HydrophobicContact CD1-CG 4.49Å; F120-L124 HydrophobicContact CD2-CG 4.26Å; F120-L124 HydrophobicContact CE1-CD1 3.35Å; F120-L124 HydrophobicContact CE1-CG 4.12Å; F120-L124 HydrophobicContact CE2-CD1 3.87Å; F120-L124 HydrophobicContact CE2-CD2 4.11Å; F120-L124 HydrophobicContact CE2-CG 3.82Å; F120-L124 HydrophobicContact CZ-CD1 3.28Å; F120-L124 HydrophobicContact CZ-CD2 4.22Å; F120-L124 HydrophobicContact CZ-CG 3.8Å; F120-L124 PolarHBondContact O-N 3.12Å; F120-I142 HydrophobicContact CD2-CD1 3.33Å; F120-I142 HydrophobicContact CE2-CD1 3.25Å; F120-F161 HydrophobicContact CB-CE1 4.46Å; F120-L164 HydrophobicContact CB-CD1 4.36Å; F120-L164 HydrophobicContact CB-CD2 4.31Å; F120-L164 HydrophobicContact CD1-CD1 4.31Å; F120-L164 HydrophobicContact CD1-CD2 3.2Å; F120-L164 HydrophobicContact CD1-CG 4.02Å; F120-L164 HydrophobicContact CE1-CD2 3.47Å; F120-L164 VanDerWaalsContact CE1-CD2 3.47Å; F120-L164 HydrophobicContact CE1-CG 4.5Å; F120-L164 HydrophobicContact CG-CD2 3.8Å; F120-L164 HydrophobicContact CZ-CD2 4.28Å; F120-I165 HydrophobicContact CE1-CG1 4.17Å; F120-I165 HydrophobicContact CZ-CG1 3.89Å; F120-E168 HydrophobicContact CD1-CB 4.28Å; F120-E168 HydrophobicContact CD1-CG 4.19Å; F120-E168 HydrophobicContact CE1-CB 3.88Å; F120-E168 HydrophobicContact CE1-CG 4.26Å
121T95.4Very high95.6Very high16 Ų1632.1 Ų32.110%0.09816%0.155CC..Hα-helixtrans-62.9-48.2-176.9-53.60000111.2R117 L124 Q125 E168R117-T121 WeakPolarHBondContact O-CB 3.18Å; R117-T121 PolarHBondContact O-N 3.08Å; R117-T121 PolarHBondContact O-OG1 3.16Å; T121-L124 PolarHBondContact O-N 3.05Å; T121-Q125 WeakPolarHBondContact O-CG 3.42Å; T121-Q125 PolarHBondContact O-N 3.44Å; T121-Q125 VanDerWaalsContact O-N 3.07Å; T121-E168 WeakPolarHBondContact CG2-OE2 3.36Å; T121-E168 PolarHBondContact OG1-OE2 2.78Å
122R95Very high95.6Very high35 Ų3534.7 Ų34.713%0.13217%0.172CC..Hα-helixtrans-65.7-39.2176.4-71.2-165.2-167.5170.56.5112.2V71 N75 E118 Q125 F126V71-R122 PolarHBondContact O-NH1 3.15Å; N75-R122 PolarHBondContact OD1-NH1 3.43Å; E118-R122 HydrophobicContact CG-CG 4.42Å; E118-R122 WeakPolarHBondContact O-CB 3.36Å; E118-R122 WeakPolarHBondContact O-CG 3.4Å; E118-R122 PolarHBondContact O-N 3.17Å; E118-R122 IonicContact OE1-CZ 3.77Å; E118-R122 IonicContact OE1-NE 3.57Å; E118-R122 PolarHBondContact OE1-NE 3.02Å; E118-R122 IonicContact OE1-NH2 2.9Å; E118-R122 PolarHBondContact OE1-NH2 3.18Å; R122-Q125 PolarHBondContact O-N 2.74Å; R122-F126 WeakPolarHBondContact O-CB 3.5Å; R122-F126 PolarHBondContact O-N 3.38Å
123G95.8Very high95.4Very high0 Ų043 Ų430%021%0.211CC..Hα-helixtrans-60.1-49.5176.200000111.7L77 F119 F120 Q125 F126 I127L77-G123 VanDerWaalsContact CD2-CA 3.47Å; F119-G123 PolarHBondContact O-N 3.25Å; F120-G123 PolarHBondContact O-N 2.79Å; G123-Q125 PolarHBondContact O-N 2.89Å; G123-F126 PolarHBondContact O-N 2.88Å; G123-I127 WeakPolarHBondContact O-CB 3.42Å; G123-I127 VanDerWaalsContact O-CG1 3.26Å; G123-I127 WeakPolarHBondContact O-CG1 3.34Å; G123-I127 PolarHBondContact O-N 3.01Å
124L94.8Very high95.4Very high4 Ų441.5 Ų41.52%0.02120%0.204CC..Hα-helixtrans-55.3-50.1174.7-79.1-174.5000112F120 T121 S128 F138 I139 L169F120-L124 HydrophobicContact CD1-CD1 4.04Å; F120-L124 HydrophobicContact CD1-CG 4.49Å; F120-L124 HydrophobicContact CD2-CG 4.26Å; F120-L124 HydrophobicContact CE1-CD1 3.35Å; F120-L124 HydrophobicContact CE1-CG 4.12Å; F120-L124 HydrophobicContact CE2-CD1 3.87Å; F120-L124 HydrophobicContact CE2-CD2 4.11Å; F120-L124 HydrophobicContact CE2-CG 3.82Å; F120-L124 HydrophobicContact CZ-CD1 3.28Å; F120-L124 HydrophobicContact CZ-CD2 4.22Å; F120-L124 HydrophobicContact CZ-CG 3.8Å; F120-L124 PolarHBondContact O-N 3.12Å; T121-L124 PolarHBondContact O-N 3.05Å; L124-S128 WeakPolarHBondContact O-CB 3.39Å; L124-S128 PolarHBondContact O-N 3.22Å; L124-S128 VanDerWaalsContact O-N 3.07Å; L124-S128 PolarHBondContact O-OG 3.42Å; L124-F138 HydrophobicContact CD2-CE1 4.21Å; L124-F138 HydrophobicContact CG-CE1 4.45Å; L124-I139 HydrophobicContact CD2-CD1 3.59Å; L124-L169 HydrophobicContact CD1-CD2 4.29Å
125Q93.6Very high95.3Very high82 Ų8238.9 Ų38.938%0.38319%0.19SC..Hα-helixtrans-65.8-49.8-177.5-70.4173.2-3.600112.1T121 R122 G123 C129T121-Q125 WeakPolarHBondContact O-CG 3.42Å; T121-Q125 PolarHBondContact O-N 3.44Å; T121-Q125 VanDerWaalsContact O-N 3.07Å; R122-Q125 PolarHBondContact O-N 2.74Å; G123-Q125 PolarHBondContact O-N 2.89Å; Q125-C129 WeakPolarHBondContact O-CB 3.2Å; Q125-C129 PolarHBondContact O-N 2.96Å; Q125-C129 PolarHBondContact O-SG 3.11Å
126F94.5Very high95.3Very high32 Ų3241.1 Ų41.114%0.1421%0.205CC..Hα-helixtrans-65.8-51.7-177.5169.4-111.7000111.7L77 P78 T86 R122 G123 C129 K130 K131L77-F126 HydrophobicContact CG-CD1 4.34Å; P78-F126 HydrophobicContact CB-CD2 3.88Å; P78-F126 HydrophobicContact CB-CE2 4.05Å; P78-F126 HydrophobicContact CB-CG 4.24Å; P78-F126 HydrophobicContact CG-CD2 4.5Å; P78-F126 HydrophobicContact CG-CG 4.43Å; T86-F126 HydrophobicContact CG2-CE1 4.18Å; R122-F126 WeakPolarHBondContact O-CB 3.5Å; R122-F126 PolarHBondContact O-N 3.38Å; G123-F126 PolarHBondContact O-N 2.88Å; F126-C129 PolarHBondContact O-N 2.63Å; F126-K130 HydrophobicContact CD2-CB 4.15Å; F126-K130 HydrophobicContact CD2-CG 4.04Å; F126-K130 HydrophobicContact CE2-CB 3.89Å; F126-K130 HydrophobicContact CE2-CG 3.99Å; F126-K130 HydrophobicContact CZ-CB 4.47Å; F126-K130 WeakPolarHBondContact O-CB 3.36Å; F126-K130 PolarHBondContact O-N 3Å; F126-K131 HydrophobicContact CE1-CD 4.29Å; F126-K131 HydrophobicContact CZ-CD 4.37Å
127I95.4Very high95.2Very high0 Ų042.9 Ų42.90%022%0.217CC..Hα-helixtrans-68.4-43.7-174.6-64.2171.9000110T86 G123 C129 K131 I134 L135 F138T86-I127 HydrophobicContact CG2-CD1 4.49Å; G123-I127 WeakPolarHBondContact O-CB 3.42Å; G123-I127 VanDerWaalsContact O-CG1 3.26Å; G123-I127 WeakPolarHBondContact O-CG1 3.34Å; G123-I127 PolarHBondContact O-N 3.01Å; I127-C129 PolarHBondContact O-N 2.8Å; I127-K131 HydrophobicContact CG2-CB 4.49Å; I127-K131 VanDerWaalsContact CG2-O 3.27Å; I127-K131 WeakPolarHBondContact CG2-O 3.29Å; I127-K131 CarbonylContact O-C 3.52Å; I127-K131 WeakPolarHBondContact O-CA 3.1Å; I127-K131 PolarHBondContact O-N 3.3Å; I127-K131 VanDerWaalsContact O-O 3.11Å; I127-I134 HydrophobicContact CG1-CD1 4.49Å; I127-I134 HydrophobicContact CG2-CD1 4.28Å; I127-I134 HydrophobicContact CG2-CG1 3.64Å; I127-L135 HydrophobicContact CG2-CB 4.01Å; I127-L135 HydrophobicContact CG2-CD1 4.13Å; I127-F138 HydrophobicContact CD1-CB 3.8Å; I127-F138 HydrophobicContact CD1-CD1 3.95Å; I127-F138 HydrophobicContact CD1-CD2 3.2Å; I127-F138 HydrophobicContact CD1-CE1 4.36Å; I127-F138 HydrophobicContact CD1-CE2 3.67Å; I127-F138 HydrophobicContact CD1-CG 3.35Å; I127-F138 HydrophobicContact CD1-CZ 4.23Å
128S92.4Very high95.2Very high2 Ų239.9 Ų39.91%0.01421%0.206CC..Hα-helixtrans-58.7-34.8177-61.60000112.4L124 K175L124-S128 WeakPolarHBondContact O-CB 3.39Å; L124-S128 PolarHBondContact O-N 3.22Å; L124-S128 VanDerWaalsContact O-N 3.07Å; L124-S128 PolarHBondContact O-OG 3.42Å; S128-K175 WeakPolarHBondContact O-CE 3.36Å; S128-K175 PolarHBondContact O-NZ 2.88Å
129C92Very high95.2Very high86 Ų8637.4 Ų37.458%0.58119%0.194SC*.Hα-helixtrans-89.1-39.7-176.6-69.70000114Q125 F126 I127Q125-C129 WeakPolarHBondContact O-CB 3.2Å; Q125-C129 PolarHBondContact O-N 2.96Å; Q125-C129 PolarHBondContact O-SG 3.11Å; F126-C129 PolarHBondContact O-N 2.63Å; I127-C129 PolarHBondContact O-N 2.8Å
130K93.4Very high95.2Very high159 Ų15939.3 Ų39.369%0.69120%0.203SC*.Hα-helixtrans-109.1-25-169.9-65-63.6-173179.20114.3F126F126-K130 HydrophobicContact CD2-CB 4.15Å; F126-K130 HydrophobicContact CD2-CG 4.04Å; F126-K130 HydrophobicContact CE2-CB 3.89Å; F126-K130 HydrophobicContact CE2-CG 3.99Å; F126-K130 HydrophobicContact CZ-CB 4.47Å; F126-K130 WeakPolarHBondContact O-CB 3.36Å; F126-K130 PolarHBondContact O-N 3Å
131K93.2Very high95.2Very high21 Ų2139.3 Ų39.39%0.09120%0.203CC..  trans-139.860.2-176.2-59-174.7179-1770110.6I80 E81 D82 T86 F126 I127 E133 I134I80-K131 PolarHBondContact O-NZ 3.27Å; E81-K131 VanDerWaalsContact C-NZ 3.28Å; E81-K131 VanDerWaalsContact O-CE 3.31Å; E81-K131 WeakPolarHBondContact O-CE 3.31Å; E81-K131 PolarHBondContact O-NZ 2.96Å; D82-K131 VanDerWaalsContact C-NZ 3.34Å; D82-K131 PolarHBondContact O-NZ 3.43Å; T86-K131 HydrophobicContact CG2-CD 4.48Å; T86-K131 PolarHBondContact OG1-NZ 3.43Å; F126-K131 HydrophobicContact CE1-CD 4.29Å; F126-K131 HydrophobicContact CZ-CD 4.37Å; I127-K131 HydrophobicContact CG2-CB 4.49Å; I127-K131 VanDerWaalsContact CG2-O 3.27Å; I127-K131 WeakPolarHBondContact CG2-O 3.29Å; I127-K131 CarbonylContact O-C 3.52Å; I127-K131 WeakPolarHBondContact O-CA 3.1Å; I127-K131 PolarHBondContact O-N 3.3Å; I127-K131 VanDerWaalsContact O-O 3.11Å; K131-E133 PolarHBondContact O-N 3.3Å; K131-E133 VanDerWaalsContact O-N 3.07Å; K131-I134 HydrophobicContact CB-CD1 3.95Å; K131-I134 HydrophobicContact CB-CG1 3.87Å; K131-I134 HydrophobicContact CD-CD1 3.92Å; K131-I134 WeakPolarHBondContact O-CG1 3.32Å; K131-I134 PolarHBondContact O-N 2.72Å
132P94.2Very high95.3Very high64 Ų6438.6 Ų38.642%0.41620%0.199SC..G310 helixtrans-60-24.1-174.225.8-35000113I134 L135P132-I134 PolarHBondContact O-N 3.18Å; P132-L135 WeakPolarHBondContact O-CB 3.17Å; P132-L135 PolarHBondContact O-N 3.02Å
133E94.9Very high95.4Very high177 Ų17737.6 Ų37.683%0.82720%0.195SC*.G310 helixtrans-67.7-34.3-176-46.8-158.7-14300112.9K131K131-E133 PolarHBondContact O-N 3.3Å; K131-E133 VanDerWaalsContact O-N 3.07Å
134I96.1Very high95.4Very high19 Ų1939.2 Ų39.210%0.09721%0.206CC..G310 helixtrans-90.8-0.7177.369.7175.3000112.8T86 I127 K131 P132 S137 F138T86-I134 HydrophobicContact CG2-CD1 3.85Å; I127-I134 HydrophobicContact CG1-CD1 4.49Å; I127-I134 HydrophobicContact CG2-CD1 4.28Å; I127-I134 HydrophobicContact CG2-CG1 3.64Å; K131-I134 HydrophobicContact CB-CD1 3.95Å; K131-I134 HydrophobicContact CB-CG1 3.87Å; K131-I134 HydrophobicContact CD-CD1 3.92Å; K131-I134 WeakPolarHBondContact O-CG1 3.32Å; K131-I134 PolarHBondContact O-N 2.72Å; P132-I134 PolarHBondContact O-N 3.18Å; I134-S137 PolarHBondContact O-N 3.3Å; I134-F138 WeakPolarHBondContact O-CB 3.44Å; I134-F138 PolarHBondContact O-N 3.48Å
135L96.6Very high95.5Very high2 Ų241.3 Ų41.31%0.0122%0.215CC..Hα-helixtrans-57.4-45.6-177.8179.465.5000112.4I127 P132 S137 F138 I139 L177I127-L135 HydrophobicContact CG2-CB 4.01Å; I127-L135 HydrophobicContact CG2-CD1 4.13Å; P132-L135 WeakPolarHBondContact O-CB 3.17Å; P132-L135 PolarHBondContact O-N 3.02Å; L135-S137 PolarHBondContact O-N 3.02Å; L135-F138 PolarHBondContact O-N 3.34Å; L135-I139 HydrophobicContact CD1-CG1 4.35Å; L135-I139 WeakPolarHBondContact O-CG1 3.4Å; L135-I139 PolarHBondContact O-N 3.29Å; L135-L177 HydrophobicContact CD2-CD2 4.25Å; L135-L177 HydrophobicContact CD2-CG 4.48Å
136P96.2Very high95.7Very high49 Ų4937.5 Ų37.532%0.31820%0.197SC..Hα-helixtrans-57.7-47.2176.4-23.835.4000112.4F138 I139 E140 L181P136-F138 VanDerWaalsContact C-N 3.33Å; P136-F138 PolarHBondContact O-N 2.97Å; P136-I139 PolarHBondContact O-N 2.92Å; P136-E140 WeakPolarHBondContact O-CB 3.34Å; P136-E140 PolarHBondContact O-N 2.95Å; P136-L181 HydrophobicContact CB-CD1 4.26Å; P136-L181 HydrophobicContact CG-CD1 4.2Å
137S97.1Very high95.8Very high37 Ų3736 Ų3626%0.25919%0.19SC..Hα-helixtrans-67.9-31179.5-51.80000112.9Y91 I134 L135 E140 A141Y91-S137 WeakPolarHBondContact CE2-O 3.5Å; Y91-S137 PolarHBondContact OH-O 3.01Å; I134-S137 PolarHBondContact O-N 3.3Å; L135-S137 PolarHBondContact O-N 3.02Å; S137-E140 WeakPolarHBondContact O-CB 3.48Å; S137-A141 PolarHBondContact O-N 3.09Å
138F97.4Very high95.8Very high0 Ų037.6 Ų37.60%020%0.199CC..Hα-helixtrans-66.9-42.1172.7173.5-98.9000111.8L87 F94 L124 I127 I134 L135 P136 A141 I142L87-F138 HydrophobicContact CD1-CB 4.5Å; F94-F138 HydrophobicContact CE2-CD2 4.29Å; F94-F138 AromaticContact CE2-CE2 3.74Å; F94-F138 HydrophobicContact CE2-CE2 3.74Å; F94-F138 HydrophobicContact CE2-CZ 4.1Å; F94-F138 AromaticContact CZ-CE2 3.9Å; F94-F138 HydrophobicContact CZ-CE2 3.9Å; F94-F138 AromaticContact CZ-CZ 3.86Å; F94-F138 HydrophobicContact CZ-CZ 3.86Å; L124-F138 HydrophobicContact CD2-CE1 4.21Å; L124-F138 HydrophobicContact CG-CE1 4.45Å; I127-F138 HydrophobicContact CD1-CB 3.8Å; I127-F138 HydrophobicContact CD1-CD1 3.95Å; I127-F138 HydrophobicContact CD1-CD2 3.2Å; I127-F138 HydrophobicContact CD1-CE1 4.36Å; I127-F138 HydrophobicContact CD1-CE2 3.67Å; I127-F138 HydrophobicContact CD1-CG 3.35Å; I127-F138 HydrophobicContact CD1-CZ 4.23Å; I134-F138 WeakPolarHBondContact O-CB 3.44Å; I134-F138 PolarHBondContact O-N 3.48Å; L135-F138 PolarHBondContact O-N 3.34Å; P136-F138 VanDerWaalsContact C-N 3.33Å; P136-F138 PolarHBondContact O-N 2.97Å; F138-A141 WeakPolarHBondContact O-CB 3.45Å; F138-A141 PolarHBondContact O-N 2.91Å; F138-I142 HydrophobicContact CE1-CD1 4.35Å
139I97.1Very high95.9Very high0 Ų042.8 Ų42.80%023%0.226CC..Hα-helixtrans-64.8-45.8174.2-63-59.7000110L124 L135 P136 A141 I142 F143 L181 V182 Y185L124-I139 HydrophobicContact CD2-CD1 3.59Å; L135-I139 HydrophobicContact CD1-CG1 4.35Å; L135-I139 WeakPolarHBondContact O-CG1 3.4Å; L135-I139 PolarHBondContact O-N 3.29Å; P136-I139 PolarHBondContact O-N 2.92Å; I139-A141 PolarHBondContact O-N 3.39Å; I139-I142 WeakPolarHBondContact O-CB 3.43Å; I139-I142 PolarHBondContact O-N 3.21Å; I139-I142 VanDerWaalsContact O-N 3.11Å; I139-F143 HydrophobicContact CG2-CD2 4.1Å; I139-F143 HydrophobicContact CG2-CE2 3.88Å; I139-F143 WeakPolarHBondContact O-CD2 3.23Å; I139-L181 HydrophobicContact CG1-CD1 4.47Å; I139-L181 HydrophobicContact CG2-CB 4.25Å; I139-V182 HydrophobicContact CD1-CG2 4.02Å; I139-V182 HydrophobicContact CG2-CG2 3.74Å; I139-Y185 HydrophobicContact CG2-CD2 3.78Å; I139-Y185 HydrophobicContact CG2-CE2 3.98Å
140E96.9Very high96Very high40 Ų4041 Ų4119%0.18721%0.211CC..Hα-helixtrans-52.3-43.7174.7-169.4-169.7162.200111.5P136 S137 I142 F143 T144 Y185 S371P136-E140 WeakPolarHBondContact O-CB 3.34Å; P136-E140 PolarHBondContact O-N 2.95Å; S137-E140 WeakPolarHBondContact O-CB 3.48Å; E140-I142 PolarHBondContact O-N 3.42Å; E140-I142 VanDerWaalsContact O-N 3.07Å; E140-F143 CarbonylContact O-C 3.57Å; E140-F143 PolarHBondContact O-N 2.66Å; E140-T144 PolarHBondContact O-N 2.87Å; E140-T144 PolarHBondContact O-OG1 3.38Å; E140-Y185 HydrophobicContact CB-CE1 4.42Å; E140-Y185 WeakPolarHBondContact CB-OH 3.47Å; E140-Y185 HydrophobicContact CG-CE1 4.16Å; E140-S371 PolarHBondContact OE1-OG 3.28Å
141A97.1Very high96Very high0 Ų035.7 Ų35.70%019%0.189CC..Hα-helixtrans-52.2-37.4-179.900000113.3Y91 F94 S137 F138 I139 K145Y91-A141 HydrophobicContact CD1-CB 3.87Å; Y91-A141 HydrophobicContact CD2-CB 3.5Å; Y91-A141 VanDerWaalsContact CD2-CB 3.5Å; Y91-A141 HydrophobicContact CE1-CB 3.79Å; Y91-A141 HydrophobicContact CE2-CB 3.41Å; Y91-A141 VanDerWaalsContact CE2-CB 3.41Å; Y91-A141 HydrophobicContact CG-CB 3.73Å; Y91-A141 VanDerWaalsContact CZ-CA 3.47Å; Y91-A141 PolarHBondContact OH-N 3.36Å; F94-A141 HydrophobicContact CD2-CB 3.92Å; F94-A141 HydrophobicContact CE2-CB 4.28Å; S137-A141 PolarHBondContact O-N 3.09Å; F138-A141 WeakPolarHBondContact O-CB 3.45Å; F138-A141 PolarHBondContact O-N 2.91Å; I139-A141 PolarHBondContact O-N 3.39Å; A141-K145 VanDerWaalsContact O-CB 3.28Å; A141-K145 WeakPolarHBondContact O-CB 3.29Å; A141-K145 WeakPolarHBondContact O-CG 3.34Å; A141-K145 PolarHBondContact O-N 3.27Å
142I97.3Very high96Very high1 Ų140.9 Ų40.91%0.00522%0.218CC..Hα-helixtrans-69.5-43.2179.3-60.3163.9000110.2F94 F120 F138 I139 E140 I146 L147 F161F94-I142 HydrophobicContact CD1-CG1 4.5Å; F94-I142 HydrophobicContact CD2-CG1 3.96Å; F94-I142 HydrophobicContact CE1-CG1 4.05Å; F94-I142 HydrophobicContact CE2-CD1 4.23Å; F94-I142 HydrophobicContact CE2-CG1 3.45Å; F94-I142 VanDerWaalsContact CE2-CG1 3.45Å; F94-I142 HydrophobicContact CG-CG1 4.47Å; F94-I142 HydrophobicContact CZ-CD1 3.98Å; F94-I142 HydrophobicContact CZ-CG1 3.5Å; F120-I142 HydrophobicContact CD2-CD1 3.33Å; F120-I142 HydrophobicContact CE2-CD1 3.25Å; F138-I142 HydrophobicContact CE1-CD1 4.35Å; I139-I142 WeakPolarHBondContact O-CB 3.43Å; I139-I142 PolarHBondContact O-N 3.21Å; I139-I142 VanDerWaalsContact O-N 3.11Å; E140-I142 PolarHBondContact O-N 3.42Å; E140-I142 VanDerWaalsContact O-N 3.07Å; I142-I146 CarbonylContact O-C 2.96Å; I142-I146 WeakPolarHBondContact O-CA 3.44Å; I142-I146 WeakPolarHBondContact O-CB 3.28Å; I142-I146 PolarHBondContact O-N 3.24Å; I142-L147 HydrophobicContact CG2-CD1 4.11Å; I142-L147 HydrophobicContact CG2-CG 4.27Å; I142-L147 PolarHBondContact O-N 3.24Å; I142-F161 HydrophobicContact CG2-CD1 3.78Å; I142-F161 HydrophobicContact CG2-CE1 4.03Å
143F97.1Very high96Very high14 Ų1439.5 Ų39.56%0.06121%0.206CC..Hα-helixtrans-72.8-32.2179.1-72.4-82.8000112.8I139 E140 L147 N148 V182 Y185 L186 L189I139-F143 HydrophobicContact CG2-CD2 4.1Å; I139-F143 HydrophobicContact CG2-CE2 3.88Å; I139-F143 WeakPolarHBondContact O-CD2 3.23Å; E140-F143 CarbonylContact O-C 3.57Å; E140-F143 PolarHBondContact O-N 2.66Å; F143-L147 HydrophobicContact CD1-CB 3.8Å; F143-L147 HydrophobicContact CD1-CD1 4.32Å; F143-L147 HydrophobicContact CE1-CB 4.18Å; F143-L147 HydrophobicContact CE1-CD1 3.93Å; F143-L147 HydrophobicContact CG-CB 4.44Å; F143-L147 HydrophobicContact CZ-CD1 4.23Å; F143-L147 CarbonylContact O-C 3.54Å; F143-L147 VanDerWaalsContact O-O 3.12Å; F143-N148 VanDerWaalsContact O-CA 3.26Å; F143-N148 WeakPolarHBondContact O-CA 3.45Å; F143-N148 PolarHBondContact O-N 3.21Å; F143-N148 VanDerWaalsContact O-N 3.12Å; F143-V182 HydrophobicContact CE2-CG1 4.45Å; F143-V182 HydrophobicContact CE2-CG2 4.41Å; F143-V182 HydrophobicContact CZ-CG1 4.1Å; F143-Y185 HydrophobicContact CB-CD1 4.17Å; F143-Y185 HydrophobicContact CB-CG 4.41Å; F143-Y185 HydrophobicContact CD1-CG 4.47Å; F143-Y185 VanDerWaalsContact CD2-CB 3.45Å; F143-Y185 HydrophobicContact CD2-CD1 4.22Å; F143-Y185 AromaticContact CD2-CD2 3.92Å; F143-Y185 HydrophobicContact CD2-CD2 3.92Å; F143-Y185 AromaticContact CD2-CG 3.62Å; F143-Y185 HydrophobicContact CD2-CG 3.62Å; F143-Y185 VanDerWaalsContact CE2-CB 3.43Å; F143-Y185 HydrophobicContact CE2-CD2 4.11Å; F143-Y185 AromaticContact CE2-CG 3.96Å; F143-Y185 HydrophobicContact CE2-CG 3.96Å; F143-Y185 HydrophobicContact CG-CD1 4.16Å; F143-Y185 AromaticContact CG-CG 3.91Å; F143-Y185 HydrophobicContact CG-CG 3.91Å; F143-L186 HydrophobicContact CE1-CD2 3.81Å; F143-L186 HydrophobicContact CE1-CG 3.93Å; F143-L186 HydrophobicContact CZ-CD2 4.13Å; F143-L186 HydrophobicContact CZ-CG 3.89Å; F143-L189 HydrophobicContact CD1-CD2 4.29Å; F143-L189 HydrophobicContact CE1-CD2 4.31Å
144T96.5Very high96.1Very high35 Ų3531.1 Ų31.122%0.21517%0.168CC..Hα-helixtrans-75.3-44176.7-57.80000111.5Y91 E140 N148 S371Y91-T144 HydrophobicContact CE1-CG2 4.5Å; E140-T144 PolarHBondContact O-N 2.87Å; E140-T144 PolarHBondContact O-OG1 3.38Å; T144-N148 PolarHBondContact O-ND2 3.34Å; T144-S371 PolarHBondContact OG1-OG 3.11Å
145K96.9Very high96.1Very high48 Ų4832 Ų3221%0.20917%0.173CC..Hα-helixtrans-96.3-31.1-171.5-59-59.5-175.81700114.8Y91 F94 E95 A98 A141Y91-K145 HydrophobicContact CD1-CD 4.44Å; Y91-K145 HydrophobicContact CD1-CG 3.95Å; F94-K145 HydrophobicContact CB-CB 3.94Å; E95-K145 HydrophobicContact CB-CB 4.39Å; E95-K145 HydrophobicContact CB-CD 3.93Å; E95-K145 HydrophobicContact CB-CG 4.17Å; E95-K145 HydrophobicContact CG-CD 4.16Å; E95-K145 WeakPolarHBondContact OE2-CE 3.44Å; E95-K145 IonicContact OE2-NZ 2.63Å; E95-K145 PolarHBondContact OE2-NZ 3.12Å; A98-K145 VanDerWaalsContact CB-O 3.23Å; A98-K145 WeakPolarHBondContact CB-O 3.03Å; A141-K145 VanDerWaalsContact O-CB 3.28Å; A141-K145 WeakPolarHBondContact O-CB 3.29Å; A141-K145 WeakPolarHBondContact O-CG 3.34Å; A141-K145 PolarHBondContact O-N 3.27Å
146I97.4Very high96Very high2 Ų233.6 Ų33.61%0.0119%0.191CC..THydrogen-bonded Turntrans-113.8-64.2-178.1-63.2175.3000110.9F94 A98 I142 N148 L157 K158 F161F94-I146 HydrophobicContact CB-CD1 3.88Å; F94-I146 HydrophobicContact CB-CG1 4.11Å; F94-I146 HydrophobicContact CD1-CD1 3.55Å; F94-I146 HydrophobicContact CE1-CD1 4.45Å; F94-I146 HydrophobicContact CG-CD1 4.05Å; A98-I146 HydrophobicContact CB-CG1 4.32Å; I142-I146 CarbonylContact O-C 2.96Å; I142-I146 WeakPolarHBondContact O-CA 3.44Å; I142-I146 WeakPolarHBondContact O-CB 3.28Å; I142-I146 PolarHBondContact O-N 3.24Å; I146-N148 PolarHBondContact O-N 3.18Å; I146-L157 HydrophobicContact CD1-CD2 4.07Å; I146-L157 HydrophobicContact CG1-CD2 3.98Å; I146-L157 HydrophobicContact CG2-CD2 3.93Å; I146-L157 HydrophobicContact CG2-CG 3.8Å; I146-K158 WeakPolarHBondContact O-CE 3.4Å; I146-K158 WeakPolarHBondContact O-CG 3.49Å; I146-F161 HydrophobicContact CD1-CD1 4.31Å; I146-F161 HydrophobicContact CD1-CD2 4.18Å; I146-F161 HydrophobicContact CD1-CE1 3.78Å; I146-F161 HydrophobicContact CD1-CE2 3.65Å; I146-F161 HydrophobicContact CD1-CG 4.49Å; I146-F161 HydrophobicContact CD1-CZ 3.42Å; I146-F161 VanDerWaalsContact CD1-CZ 3.42Å; I146-F161 HydrophobicContact CG2-CB 4.28Å; I146-F161 HydrophobicContact CG2-CD1 4.45Å; I146-F161 HydrophobicContact CG2-CD2 4.04Å; I146-F161 HydrophobicContact CG2-CG 3.98Å
147L96.9Very high96.1Very high1 Ų131.3 Ų31.31%0.00518%0.176CC..SBendtrans-8547.7-175.5-62177.7000112.1I142 F143 K158 F161 I165 L189 Y199I142-L147 HydrophobicContact CG2-CD1 4.11Å; I142-L147 HydrophobicContact CG2-CG 4.27Å; I142-L147 PolarHBondContact O-N 3.24Å; F143-L147 HydrophobicContact CD1-CB 3.8Å; F143-L147 HydrophobicContact CD1-CD1 4.32Å; F143-L147 HydrophobicContact CE1-CB 4.18Å; F143-L147 HydrophobicContact CE1-CD1 3.93Å; F143-L147 HydrophobicContact CG-CB 4.44Å; F143-L147 HydrophobicContact CZ-CD1 4.23Å; F143-L147 CarbonylContact O-C 3.54Å; F143-L147 VanDerWaalsContact O-O 3.12Å; L147-K158 HydrophobicContact CD2-CB 4.17Å; L147-K158 HydrophobicContact CD2-CG 4.35Å; L147-F161 HydrophobicContact CD1-CB 4.4Å; L147-F161 HydrophobicContact CD2-CB 3.97Å; L147-F161 HydrophobicContact CG-CB 4.27Å; L147-I165 HydrophobicContact CD1-CD1 3.54Å; L147-L189 HydrophobicContact CB-CD2 4.22Å; L147-L189 WeakPolarHBondContact O-CD1 3.32Å; L147-L189 WeakPolarHBondContact O-CD2 3.38Å; L147-Y199 WeakPolarHBondContact CA-OH 3.31Å; L147-Y199 HydrophobicContact CD2-CE2 4Å; L147-Y199 PolarHBondContact O-OH 2.92Å
148N95.1Very high96.1Very high32 Ų3229.6 Ų29.617%0.17116%0.164CC..SBendtrans-83.3179176.156.634.6000111.8F143 T144 I146 D150 K158 Y199F143-N148 VanDerWaalsContact O-CA 3.26Å; F143-N148 WeakPolarHBondContact O-CA 3.45Å; F143-N148 PolarHBondContact O-N 3.21Å; F143-N148 VanDerWaalsContact O-N 3.12Å; T144-N148 PolarHBondContact O-ND2 3.34Å; I146-N148 PolarHBondContact O-N 3.18Å; N148-D150 VanDerWaalsContact C-N 3.27Å; N148-D150 PolarHBondContact O-N 3.07Å; N148-D150 WeakPolarHBondContact OD1-CB 3.5Å; N148-D150 PolarHBondContact OD1-N 3.02Å; N148-K158 VanDerWaalsContact OD1-CE 3.23Å; N148-K158 WeakPolarHBondContact OD1-CE 3.47Å; N148-K158 PolarHBondContact OD1-NZ 3.2Å; N148-Y199 VanDerWaalsContact O-CE1 3.32Å; N148-Y199 WeakPolarHBondContact O-CE1 3.42Å; N148-Y199 PolarHBondContact O-OH 2.61Å
149N94Very high96.1Very high111 Ų11131.8 Ų31.859%0.59418%0.175SC*.SBendtrans-77.3-6.2-179.463.3-9.7000114.2I151N149-I151 PolarHBondContact O-N 2.89Å; N149-I151 VanDerWaalsContact O-N 3.17Å
150D94.4Very high96.1Very high49 Ų4932.9 Ų32.926%0.26218%0.18SC..  trans-71109.7176.5-175.6-15.5000110.1N148 N152 H153 K158N148-D150 VanDerWaalsContact C-N 3.27Å; N148-D150 PolarHBondContact O-N 3.07Å; N148-D150 WeakPolarHBondContact OD1-CB 3.5Å; N148-D150 PolarHBondContact OD1-N 3.02Å; D150-N152 VanDerWaalsContact C-N 3.32Å; D150-N152 PolarHBondContact O-N 3.34Å; D150-N152 PolarHBondContact OD1-N 2.89Å; D150-H153 HydrophobicContact CB-CB 4.49Å; D150-H153 PolarHBondContact OD1-N 2.93Å; D150-H153 VanDerWaalsContact OD1-N 3.13Å; D150-H153 WeakPolarHBondContact OD2-CB 3.4Å; D150-K158 WeakPolarHBondContact O-CE 3.3Å; D150-K158 PolarHBondContact O-NZ 3.46Å
151I93.6Very high96.1Very high47 Ų4731 Ų3124%0.24117%0.171CC..SBendtrans-80.7-10.5-177.164.7-178.9000114.4N149 V155 L193 P194N149-I151 PolarHBondContact O-N 2.89Å; N149-I151 VanDerWaalsContact O-N 3.17Å; I151-V155 WeakPolarHBondContact O-CG2 3.44Å; I151-L193 HydrophobicContact CG2-CD2 3.9Å; I151-P194 HydrophobicContact CD1-CG 3.84Å; I151-P194 HydrophobicContact CG2-CG 3.81Å
152N93.5Very high96.1Very high130 Ų13031.2 Ų31.270%0.69517%0.173SC*.SBendtrans-106.3-30.3-171.3-64-44.1000112.3D150D150-N152 VanDerWaalsContact C-N 3.32Å; D150-N152 PolarHBondContact O-N 3.34Å; D150-N152 PolarHBondContact OD1-N 2.89Å
153H94.7Very high96.1Very high35 Ų3533.8 Ų33.816%0.16219%0.188CC..SBendtrans-86.3134.9-179.2-178.847.2000112.9A98 D102 D150 V155 K158A98-H153 PolarHBondContact O-CE1 2.83Å; A98-H153 PolarHBondContact O-NE2 3.16Å; D102-H153 IonicContact OD2-CE1 3.91Å; D102-H153 PolarHBondContact OD2-CE1 2.87Å; D102-H153 IonicContact OD2-CG 2.8Å; D102-H153 IonicContact OD2-ND1 2.95Å; D102-H153 PolarHBondContact OD2-ND1 2.76Å; D150-H153 HydrophobicContact CB-CB 4.49Å; D150-H153 PolarHBondContact OD1-N 2.93Å; D150-H153 VanDerWaalsContact OD1-N 3.13Å; D150-H153 WeakPolarHBondContact OD2-CB 3.4Å; H153-V155 PolarHBondContact O-N 2.94Å; H153-V155 VanDerWaalsContact O-N 3.12Å; H153-K158 PolarHBondContact O-NZ 2.82Å
154A95.9Very high96Very high2 Ų233.1 Ų33.12%0.01719%0.186CC..SBendtrans51.437.5171.500000114.3W101 D102 G156 L157 K158W101-A154 HydrophobicContact CB-CB 3.76Å; W101-A154 HydrophobicContact CG-CB 4.05Å; D102-A154 WeakPolarHBondContact OD1-CA 3.47Å; D102-A154 PolarHBondContact OD1-N 2.7Å; D102-A154 VanDerWaalsContact OD1-N 3.15Å; D102-A154 PolarHBondContact OD2-N 3Å; A154-G156 VanDerWaalsContact C-N 3.28Å; A154-G156 PolarHBondContact O-N 3.49Å; A154-L157 HydrophobicContact CB-CB 4.09Å; A154-L157 HydrophobicContact CB-CD2 4.43Å; A154-L157 WeakPolarHBondContact O-CB 3.1Å; A154-L157 PolarHBondContact O-N 3.17Å; A154-K158 PolarHBondContact O-N 3.5Å
155V95.7Very high96.1Very high36 Ų3631.5 Ų31.522%0.21818%0.176CC..Hα-helixtrans-58.1-40.5-174.2-177.20000111.9I151 H153 L157 K158 I159 I198I151-V155 WeakPolarHBondContact O-CG2 3.44Å; H153-V155 PolarHBondContact O-N 2.94Å; H153-V155 VanDerWaalsContact O-N 3.12Å; V155-L157 VanDerWaalsContact C-N 3.32Å; V155-L157 PolarHBondContact O-N 3.07Å; V155-K158 WeakPolarHBondContact O-CB 3.37Å; V155-K158 PolarHBondContact O-N 2.98Å; V155-I159 HydrophobicContact CG1-CD1 3.99Å; V155-I159 HydrophobicContact CG1-CG1 4.49Å; V155-I159 WeakPolarHBondContact O-CG1 3.44Å; V155-I159 PolarHBondContact O-N 2.72Å; V155-I198 HydrophobicContact CG1-CG2 4.29Å
156G95.9Very high96Very high37 Ų3729.8 Ų29.838%0.38117%0.172SC..Hα-helixtrans-61-39.7175.700000112.8A154 I159 H160A154-G156 VanDerWaalsContact C-N 3.28Å; A154-G156 PolarHBondContact O-N 3.49Å; G156-I159 PolarHBondContact O-N 2.9Å; G156-H160 WeakPolarHBondContact O-CB 3.34Å; G156-H160 PolarHBondContact O-N 3.48Å
157L97.4Very high95.9Very high0 Ų033.7 Ų33.70%019%0.19CC..Hα-helixtrans-65.7-43.2176.6-174.760.6000111L97 A98 W101 I146 A154 V155 H160 F161L97-L157 HydrophobicContact CB-CD2 4.11Å; A98-L157 HydrophobicContact CB-CD2 4.16Å; W101-L157 HydrophobicContact CD2-CB 3.52Å; W101-L157 HydrophobicContact CD2-CD1 4.25Å; W101-L157 HydrophobicContact CD2-CD2 4.46Å; W101-L157 HydrophobicContact CD2-CG 4.28Å; W101-L157 HydrophobicContact CE3-CB 3.85Å; W101-L157 HydrophobicContact CE3-CD1 3.66Å; W101-L157 HydrophobicContact CE3-CD2 4.22Å; W101-L157 HydrophobicContact CE3-CG 4.11Å; W101-L157 HydrophobicContact CG-CB 3.82Å; W101-L157 HydrophobicContact CH2-CB 4.34Å; W101-L157 HydrophobicContact CH2-CD1 3.95Å; W101-L157 HydrophobicContact CZ2-CB 4.08Å; W101-L157 HydrophobicContact CZ3-CB 4.27Å; W101-L157 HydrophobicContact CZ3-CD1 3.5Å; W101-L157 HydrophobicContact CZ3-CG 4.38Å; W101-L157 VanDerWaalsContact NE1-N 3.19Å; I146-L157 HydrophobicContact CD1-CD2 4.07Å; I146-L157 HydrophobicContact CG1-CD2 3.98Å; I146-L157 HydrophobicContact CG2-CD2 3.93Å; I146-L157 HydrophobicContact CG2-CG 3.8Å; A154-L157 HydrophobicContact CB-CB 4.09Å; A154-L157 HydrophobicContact CB-CD2 4.43Å; A154-L157 WeakPolarHBondContact O-CB 3.1Å; A154-L157 PolarHBondContact O-N 3.17Å; V155-L157 VanDerWaalsContact C-N 3.32Å; V155-L157 PolarHBondContact O-N 3.07Å; L157-H160 WeakPolarHBondContact O-CB 3.33Å; L157-H160 PolarHBondContact O-N 3.22Å; L157-F161 HydrophobicContact CD1-CD2 3.66Å; L157-F161 HydrophobicContact CD1-CE2 3.58Å; L157-F161 HydrophobicContact CG-CD2 4.02Å; L157-F161 HydrophobicContact CG-CE2 4.23Å; L157-F161 WeakPolarHBondContact O-CD2 3.35Å; L157-F161 PolarHBondContact O-N 2.96Å
158K97.5Very high95.8Very high1 Ų133.9 Ų33.90%0.00419%0.191CC..Hα-helixtrans-58.9-48177.6-73.1175.4160101.90111.5I146 L147 N148 D150 H153 A154 V155 H160 F161 C162 Y199I146-K158 WeakPolarHBondContact O-CE 3.4Å; I146-K158 WeakPolarHBondContact O-CG 3.49Å; L147-K158 HydrophobicContact CD2-CB 4.17Å; L147-K158 HydrophobicContact CD2-CG 4.35Å; N148-K158 VanDerWaalsContact OD1-CE 3.23Å; N148-K158 WeakPolarHBondContact OD1-CE 3.47Å; N148-K158 PolarHBondContact OD1-NZ 3.2Å; D150-K158 WeakPolarHBondContact O-CE 3.3Å; D150-K158 PolarHBondContact O-NZ 3.46Å; H153-K158 PolarHBondContact O-NZ 2.82Å; A154-K158 PolarHBondContact O-N 3.5Å; V155-K158 WeakPolarHBondContact O-CB 3.37Å; V155-K158 PolarHBondContact O-N 2.98Å; K158-H160 PolarHBondContact O-N 3.08Å; K158-F161 PolarHBondContact O-N 3.24Å; K158-C162 PolarHBondContact O-N 3.44Å; K158-C162 PolarHBondContact O-SG 2.93Å; K158-C162 VanDerWaalsContact O-SG 3.33Å; K158-Y199 HydrophobicContact CB-CD2 3.81Å; K158-Y199 HydrophobicContact CB-CE2 3.61Å; K158-Y199 HydrophobicContact CB-CG 4.48Å; K158-Y199 HydrophobicContact CD-CD1 3.99Å; K158-Y199 HydrophobicContact CD-CD2 4.28Å; K158-Y199 HydrophobicContact CD-CE1 3.68Å; K158-Y199 HydrophobicContact CD-CE2 4.02Å; K158-Y199 HydrophobicContact CD-CG 4.27Å; K158-Y199 HydrophobicContact CG-CE2 4.1Å
159I96.8Very high95.7Very high47 Ų4732.7 Ų32.724%0.24118%0.184CC..Hα-helixtrans-62.9-42.5177.2-64.5169000111.1V155 G156 C162 T163 I198V155-I159 HydrophobicContact CG1-CD1 3.99Å; V155-I159 HydrophobicContact CG1-CG1 4.49Å; V155-I159 WeakPolarHBondContact O-CG1 3.44Å; V155-I159 PolarHBondContact O-N 2.72Å; G156-I159 PolarHBondContact O-N 2.9Å; I159-C162 PolarHBondContact O-N 3.09Å; I159-T163 PolarHBondContact O-N 2.91Å; I159-T163 VanDerWaalsContact O-N 3.08Å; I159-T163 PolarHBondContact O-OG1 2.89Å; I159-T163 VanDerWaalsContact O-OG1 3.06Å; I159-I198 HydrophobicContact CD1-CD1 4.37Å; I159-I198 HydrophobicContact CD1-CG1 4.18Å; I159-I198 HydrophobicContact CD1-CG2 4.28Å
160H97.3Very high95.6Very high23 Ų2330.4 Ų30.411%0.10618%0.176CC..Hα-helixtrans-58.8-48.8174.5175.256.1000111.5M113 G156 L157 K158 C162 T163 L164M113-H160 PolarHBondContact O-NE2 3.15Å; M113-H160 HydrophobicContact SD-CB 4.48Å; G156-H160 WeakPolarHBondContact O-CB 3.34Å; G156-H160 PolarHBondContact O-N 3.48Å; L157-H160 WeakPolarHBondContact O-CB 3.33Å; L157-H160 PolarHBondContact O-N 3.22Å; K158-H160 PolarHBondContact O-N 3.08Å; H160-C162 VanDerWaalsContact C-N 3.34Å; H160-C162 PolarHBondContact O-N 2.9Å; H160-T163 WeakPolarHBondContact O-CB 3.13Å; H160-T163 PolarHBondContact O-N 3.09Å; H160-T163 VanDerWaalsContact O-N 3.09Å; H160-L164 WeakPolarHBondContact O-CB 3.48Å; H160-L164 PolarHBondContact O-N 2.92Å
161F97.7Very high95.5Very high0 Ų032.8 Ų32.80%018%0.184CC..Hα-helixtrans-63-37.3177.5-95.2-105000112.5F94 F120 I142 I146 L147 L157 K158 T163 L164 I165F94-F161 HydrophobicContact CD1-CE1 4.43Å; F94-F161 HydrophobicContact CD1-CZ 4.25Å; F94-F161 HydrophobicContact CE1-CE1 4.08Å; F94-F161 HydrophobicContact CE1-CZ 4.09Å; F120-F161 HydrophobicContact CB-CE1 4.46Å; I142-F161 HydrophobicContact CG2-CD1 3.78Å; I142-F161 HydrophobicContact CG2-CE1 4.03Å; I146-F161 HydrophobicContact CD1-CD1 4.31Å; I146-F161 HydrophobicContact CD1-CD2 4.18Å; I146-F161 HydrophobicContact CD1-CE1 3.78Å; I146-F161 HydrophobicContact CD1-CE2 3.65Å; I146-F161 HydrophobicContact CD1-CG 4.49Å; I146-F161 HydrophobicContact CD1-CZ 3.42Å; I146-F161 VanDerWaalsContact CD1-CZ 3.42Å; I146-F161 HydrophobicContact CG2-CB 4.28Å; I146-F161 HydrophobicContact CG2-CD1 4.45Å; I146-F161 HydrophobicContact CG2-CD2 4.04Å; I146-F161 HydrophobicContact CG2-CG 3.98Å; L147-F161 HydrophobicContact CD1-CB 4.4Å; L147-F161 HydrophobicContact CD2-CB 3.97Å; L147-F161 HydrophobicContact CG-CB 4.27Å; L157-F161 HydrophobicContact CD1-CD2 3.66Å; L157-F161 HydrophobicContact CD1-CE2 3.58Å; L157-F161 HydrophobicContact CG-CD2 4.02Å; L157-F161 HydrophobicContact CG-CE2 4.23Å; L157-F161 WeakPolarHBondContact O-CD2 3.35Å; L157-F161 PolarHBondContact O-N 2.96Å; K158-F161 PolarHBondContact O-N 3.24Å; F161-T163 VanDerWaalsContact C-N 3.29Å; F161-T163 PolarHBondContact O-N 3.2Å; F161-L164 HydrophobicContact CD1-CD2 4.33Å; F161-L164 PolarHBondContact O-N 3.07Å; F161-I165 WeakPolarHBondContact O-CB 3.33Å; F161-I165 WeakPolarHBondContact O-CG1 3.01Å; F161-I165 PolarHBondContact O-N 2.64Å
162C97.5Very high95Very high5 Ų540.6 Ų40.63%0.03422%0.216CC..Hα-helixtrans-60.2-41172.6-69.60000112.2K158 I159 H160 G166 L206K158-C162 PolarHBondContact O-N 3.44Å; K158-C162 PolarHBondContact O-SG 2.93Å; K158-C162 VanDerWaalsContact O-SG 3.33Å; I159-C162 PolarHBondContact O-N 3.09Å; H160-C162 VanDerWaalsContact C-N 3.34Å; H160-C162 PolarHBondContact O-N 2.9Å; C162-G166 PolarHBondContact O-N 3.07Å; C162-L206 HydrophobicContact CB-CD2 4.31Å
163T96.5Very high94.6Very high54 Ų5440.1 Ų40.133%0.33121%0.213SC..Hα-helixtrans-68.3-50.1179.2-56.70000110.8I159 H160 F161 I165 G166 E167I159-T163 PolarHBondContact O-N 2.91Å; I159-T163 VanDerWaalsContact O-N 3.08Å; I159-T163 PolarHBondContact O-OG1 2.89Å; I159-T163 VanDerWaalsContact O-OG1 3.06Å; H160-T163 WeakPolarHBondContact O-CB 3.13Å; H160-T163 PolarHBondContact O-N 3.09Å; H160-T163 VanDerWaalsContact O-N 3.09Å; F161-T163 VanDerWaalsContact C-N 3.29Å; F161-T163 PolarHBondContact O-N 3.2Å; T163-I165 PolarHBondContact O-N 2.7Å; T163-G166 PolarHBondContact O-N 2.67Å; T163-E167 WeakPolarHBondContact O-CG 3.24Å; T163-E167 PolarHBondContact O-N 3.48Å
164L95.9Very high94.3Very high0 Ų039.7 Ų39.70%021%0.213CC..Hα-helixtrans-58-46.8178.3156.1161.3000112.4R117 F120 H160 F161 G166 E167 E168R117-L164 HydrophobicContact CB-CD1 3.74Å; R117-L164 HydrophobicContact CG-CD1 3.98Å; F120-L164 HydrophobicContact CB-CD1 4.36Å; F120-L164 HydrophobicContact CB-CD2 4.31Å; F120-L164 HydrophobicContact CD1-CD1 4.31Å; F120-L164 HydrophobicContact CD1-CD2 3.2Å; F120-L164 HydrophobicContact CD1-CG 4.02Å; F120-L164 HydrophobicContact CE1-CD2 3.47Å; F120-L164 VanDerWaalsContact CE1-CD2 3.47Å; F120-L164 HydrophobicContact CE1-CG 4.5Å; F120-L164 HydrophobicContact CG-CD2 3.8Å; F120-L164 HydrophobicContact CZ-CD2 4.28Å; H160-L164 WeakPolarHBondContact O-CB 3.48Å; H160-L164 PolarHBondContact O-N 2.92Å; F161-L164 HydrophobicContact CD1-CD2 4.33Å; F161-L164 PolarHBondContact O-N 3.07Å; L164-G166 PolarHBondContact O-N 3.38Å; L164-E167 PolarHBondContact O-N 3.41Å; L164-E168 HydrophobicContact CD2-CG 4.5Å; L164-E168 HydrophobicContact CG-CG 4.04Å; L164-E168 WeakPolarHBondContact O-CB 3.16Å; L164-E168 VanDerWaalsContact O-CG 3.31Å; L164-E168 WeakPolarHBondContact O-CG 3.26Å; L164-E168 PolarHBondContact O-N 3.45Å
165I97Very high94.1Very high1 Ų144.3 Ų44.31%0.00523%0.233CC..Hα-helixtrans-61.3-39-179.1-71.9170.7000109.6F120 L147 F161 T163 E167 L169 V182 L206F120-I165 HydrophobicContact CE1-CG1 4.17Å; F120-I165 HydrophobicContact CZ-CG1 3.89Å; L147-I165 HydrophobicContact CD1-CD1 3.54Å; F161-I165 WeakPolarHBondContact O-CB 3.33Å; F161-I165 WeakPolarHBondContact O-CG1 3.01Å; F161-I165 PolarHBondContact O-N 2.64Å; T163-I165 PolarHBondContact O-N 2.7Å; I165-E167 PolarHBondContact O-N 2.87Å; I165-L169 HydrophobicContact CG2-CD1 3.5Å; I165-L169 HydrophobicContact CG2-CG 3.84Å; I165-L169 WeakPolarHBondContact O-CB 3.17Å; I165-L169 VanDerWaalsContact O-CG 3.28Å; I165-L169 WeakPolarHBondContact O-CG 3.2Å; I165-L169 PolarHBondContact O-N 3.31Å; I165-L169 VanDerWaalsContact O-N 3.09Å; I165-V182 HydrophobicContact CG2-CG1 3.66Å; I165-L206 HydrophobicContact CB-CD1 4.37Å; I165-L206 HydrophobicContact CB-CD2 3.98Å; I165-L206 HydrophobicContact CG2-CD1 4.09Å; I165-L206 HydrophobicContact CG2-CD2 3.86Å
166G95.7Very high93.8Very high12 Ų1245 Ų4512%0.12423%0.234CC..Hα-helixtrans-66.1-22.7176.900000114.6C162 T163 L164 P170 L206C162-G166 PolarHBondContact O-N 3.07Å; T163-G166 PolarHBondContact O-N 2.67Å; L164-G166 PolarHBondContact O-N 3.38Å; G166-P170 WeakPolarHBondContact O-CD 3.43Å; G166-P170 VanDerWaalsContact O-CG 3.31Å; G166-P170 WeakPolarHBondContact O-CG 3.08Å; G166-L206 VanDerWaalsContact CA-CD1 3.49Å
167E95.1Very high93.6Very high84 Ų8447.2 Ų47.239%0.39324%0.237SC..Hα-helixtrans-94.6-34.6178.6-69.4170.8179.900112.9R117 T163 L164 I165R117-E167 IonicContact CZ-OE2 3.18Å; R117-E167 IonicContact NH1-OE2 2.67Å; R117-E167 PolarHBondContact NH1-OE2 2.77Å; R117-E167 IonicContact NH2-OE2 2.7Å; R117-E167 PolarHBondContact NH2-OE2 3.02Å; T163-E167 WeakPolarHBondContact O-CG 3.24Å; T163-E167 PolarHBondContact O-N 3.48Å; L164-E167 PolarHBondContact O-N 3.41Å; I165-E167 PolarHBondContact O-N 2.87Å
168E94.2Very high93.4Very high6 Ų647.2 Ų47.23%0.02824%0.237CC..Hα-helixtrans-83.6-40.2-175.5-64.3-55.2138.100112.4R117 F120 T121 L164 K171 V174R117-E168 IonicContact NH1-OE1 2.76Å; R117-E168 PolarHBondContact NH1-OE1 3.02Å; F120-E168 HydrophobicContact CD1-CB 4.28Å; F120-E168 HydrophobicContact CD1-CG 4.19Å; F120-E168 HydrophobicContact CE1-CB 3.88Å; F120-E168 HydrophobicContact CE1-CG 4.26Å; T121-E168 WeakPolarHBondContact CG2-OE2 3.36Å; T121-E168 PolarHBondContact OG1-OE2 2.78Å; L164-E168 HydrophobicContact CD2-CG 4.5Å; L164-E168 HydrophobicContact CG-CG 4.04Å; L164-E168 WeakPolarHBondContact O-CB 3.16Å; L164-E168 VanDerWaalsContact O-CG 3.31Å; L164-E168 WeakPolarHBondContact O-CG 3.26Å; L164-E168 PolarHBondContact O-N 3.45Å; E168-K171 WeakPolarHBondContact O-CB 3.45Å; E168-K171 WeakPolarHBondContact O-CG 3.32Å; E168-K171 PolarHBondContact O-N 3.01Å; E168-K171 VanDerWaalsContact O-N 3.17Å; E168-K171 IonicContact OE1-NZ 3.02Å; E168-K171 PolarHBondContact OE1-NZ 2.95Å; E168-K171 WeakPolarHBondContact OE2-CD 3.49Å; E168-K171 WeakPolarHBondContact OE2-CE 3.49Å; E168-K171 IonicContact OE2-NZ 3Å; E168-K171 PolarHBondContact OE2-NZ 2.89Å; E168-V174 WeakPolarHBondContact O-CG2 3.31Å
169L93.6Very high93.2Very high6 Ų647.3 Ų47.33%0.03124%0.238CC..THydrogen-bonded Turntrans-61.7-36.6-178.2-71.6-173.8000115.2L124 I165 K171 V174 V179 V182 I210 L213L124-L169 HydrophobicContact CD1-CD2 4.29Å; I165-L169 HydrophobicContact CG2-CD1 3.5Å; I165-L169 HydrophobicContact CG2-CG 3.84Å; I165-L169 WeakPolarHBondContact O-CB 3.17Å; I165-L169 VanDerWaalsContact O-CG 3.28Å; I165-L169 WeakPolarHBondContact O-CG 3.2Å; I165-L169 PolarHBondContact O-N 3.31Å; I165-L169 VanDerWaalsContact O-N 3.09Å; L169-K171 PolarHBondContact O-N 3.26Å; L169-V174 HydrophobicContact CD2-CG1 4Å; L169-V179 HydrophobicContact CB-CG2 4.35Å; L169-V179 HydrophobicContact CD2-CG2 4.36Å; L169-V182 HydrophobicContact CD1-CB 4.06Å; L169-V182 HydrophobicContact CD1-CG1 3.81Å; L169-V182 HydrophobicContact CD1-CG2 4.37Å; L169-I210 HydrophobicContact CD1-CD1 3.89Å; L169-I210 HydrophobicContact CD1-CG1 4.32Å; L169-L213 HydrophobicContact CB-CD2 4.43Å
170P92.2Very high93Very high64 Ų6446.6 Ų46.642%0.41623%0.233SC..THydrogen-bonded Turntrans-70.2-7.9177.1-21.234.2000114.8G166 L213G166-P170 WeakPolarHBondContact O-CD 3.43Å; G166-P170 VanDerWaalsContact O-CG 3.31Å; G166-P170 WeakPolarHBondContact O-CG 3.08Å; P170-L213 HydrophobicContact CB-CD1 3.92Å; P170-L213 HydrophobicContact CB-CD2 4.41Å; P170-L213 HydrophobicContact CG-CD1 4.3Å; P170-L213 HydrophobicContact CG-CD2 4.17Å
171K92.2Very high92.9Very high99 Ų9946.5 Ų46.543%0.4323%0.234SC..SBendtrans-68.7141.6-177.7-64.5-177.7-178.6176.90110.3E168 L169 N173 V174E168-K171 WeakPolarHBondContact O-CB 3.45Å; E168-K171 WeakPolarHBondContact O-CG 3.32Å; E168-K171 PolarHBondContact O-N 3.01Å; E168-K171 VanDerWaalsContact O-N 3.17Å; E168-K171 IonicContact OE1-NZ 3.02Å; E168-K171 PolarHBondContact OE1-NZ 2.95Å; E168-K171 WeakPolarHBondContact OE2-CD 3.49Å; E168-K171 WeakPolarHBondContact OE2-CE 3.49Å; E168-K171 IonicContact OE2-NZ 3Å; E168-K171 PolarHBondContact OE2-NZ 2.89Å; L169-K171 PolarHBondContact O-N 3.26Å; K171-N173 PolarHBondContact O-N 2.86Å; K171-V174 HydrophobicContact CB-CG2 4.45Å; K171-V174 PolarHBondContact O-N 2.88Å; K171-V174 VanDerWaalsContact O-N 3.11Å
172K82.5Confident92.7Very high210 Ų21046.6 Ų46.691%0.91323%0.234SC*.THydrogen-bonded Turntrans-56.2-24.7-175.1-65.7-175.4178.8-1780114.7V174K172-V174 VanDerWaalsContact C-N 3.33Å
173N85.7Confident92.6Very high120 Ų12046.3 Ų46.364%0.64223%0.232SC*.THydrogen-bonded Turntrans-87.2-0.1-175.1-59.4-12.5000113.5K171K171-N173 PolarHBondContact O-N 2.86Å
174V88.9Confident92.5Very high26 Ų2646.3 Ų46.316%0.15823%0.228CC..SBendtrans-94.6128.1-179.1-1790000109.9E168 L169 K171 K172E168-V174 WeakPolarHBondContact O-CG2 3.31Å; L169-V174 HydrophobicContact CD2-CG1 4Å; K171-V174 HydrophobicContact CB-CG2 4.45Å; K171-V174 PolarHBondContact O-N 2.88Å; K171-V174 VanDerWaalsContact O-N 3.11Å; K172-V174 VanDerWaalsContact C-N 3.33Å
175K90Very high92.5Very high99 Ų9948.3 Ų48.343%0.4324%0.236SC..  trans-66.8141.5176.5-69.7-169.9175.9-179.90110.5S128 L177 S178S128-K175 WeakPolarHBondContact O-CE 3.36Å; S128-K175 PolarHBondContact O-NZ 2.88Å; K175-L177 PolarHBondContact O-N 3.38Å; K175-S178 WeakPolarHBondContact O-CB 3.22Å; K175-S178 PolarHBondContact O-N 3.28Å; K175-S178 PolarHBondContact O-OG 3.19Å
176M90.6Very high92.5Very high50 Ų5048.3 Ų48.325%0.24624%0.236CC..Hα-helixtrans-60.4-30-179.9-168.356.761.800112.8S178 V179 Q180 H217 C220M176-S178 VanDerWaalsContact C-N 3.26Å; M176-S178 PolarHBondContact O-N 3.41Å; M176-V179 WeakPolarHBondContact O-CA 3.44Å; M176-V179 WeakPolarHBondContact O-CB 3.3Å; M176-V179 PolarHBondContact O-N 3.14Å; M176-V179 HydrophobicContact SD-CB 3.95Å; M176-V179 HydrophobicContact SD-CG1 4.29Å; M176-V179 HydrophobicContact SD-CG2 4.14Å; M176-Q180 PolarHBondContact O-N 3.31Å; M176-H217 HydrophobicContact CE-CB 3.57Å; M176-C220 HydrophobicContact CG-CB 3.72Å; M176-C220 HydrophobicContact SD-CB 3.72Å
177L91.4Very high92.4Very high85 Ų8547.7 Ų47.745%0.44523%0.23SC..Hα-helixtrans-55.6-39.9173.9-177.260.6000112.3L135 K175 V179 Q180 L181L135-L177 HydrophobicContact CD2-CD2 4.25Å; L135-L177 HydrophobicContact CD2-CG 4.48Å; K175-L177 PolarHBondContact O-N 3.38Å; L177-V179 VanDerWaalsContact C-N 3.3Å; L177-V179 PolarHBondContact O-N 3.23Å; L177-Q180 PolarHBondContact O-N 3.02Å; L177-L181 HydrophobicContact CD1-CD1 4.36Å; L177-L181 HydrophobicContact CD1-CG 4.34Å; L177-L181 HydrophobicContact CG-CD1 4.07Å; L177-L181 VanDerWaalsContact O-CG 3.31Å; L177-L181 WeakPolarHBondContact O-CG 3.33Å; L177-L181 PolarHBondContact O-N 3.26Å
178S92.9Very high92.4Very high0 Ų046.5 Ų46.50%023%0.228CC..Hα-helixtrans-63-38.8176-50.50000111.7K175 M176 V182K175-S178 WeakPolarHBondContact O-CB 3.22Å; K175-S178 PolarHBondContact O-N 3.28Å; K175-S178 PolarHBondContact O-OG 3.19Å; M176-S178 VanDerWaalsContact C-N 3.26Å; M176-S178 PolarHBondContact O-N 3.41Å; S178-V182 WeakPolarHBondContact O-CB 3.42Å; S178-V182 WeakPolarHBondContact O-CG2 3.48Å; S178-V182 PolarHBondContact O-N 2.87Å
179V93.5Very high92.4Very high3 Ų346.8 Ų46.82%0.01823%0.23CC..Hα-helixtrans-65.3-44177.7-1770000110.6L169 M176 L177 F183 I210 L213 I214L169-V179 HydrophobicContact CB-CG2 4.35Å; L169-V179 HydrophobicContact CD2-CG2 4.36Å; M176-V179 WeakPolarHBondContact O-CA 3.44Å; M176-V179 WeakPolarHBondContact O-CB 3.3Å; M176-V179 PolarHBondContact O-N 3.14Å; M176-V179 HydrophobicContact SD-CB 3.95Å; M176-V179 HydrophobicContact SD-CG1 4.29Å; M176-V179 HydrophobicContact SD-CG2 4.14Å; L177-V179 VanDerWaalsContact C-N 3.3Å; L177-V179 PolarHBondContact O-N 3.23Å; V179-F183 VanDerWaalsContact O-CB 3.29Å; V179-F183 WeakPolarHBondContact O-CB 3.35Å; V179-F183 PolarHBondContact O-N 3.25Å; V179-I210 HydrophobicContact CG1-CG2 3.87Å; V179-L213 HydrophobicContact CG1-CD2 4.04Å; V179-L213 HydrophobicContact CG2-CD2 4.35Å; V179-I214 HydrophobicContact CG1-CG1 4.28Å
180Q92.9Very high92.4Very high32 Ų3246.5 Ų46.515%0.1523%0.229CC..Hα-helixtrans-61.1-50.6177.9-69.5168.3-31.900111.8M176 L177 F183 Q184 C220 C221 I225M176-Q180 PolarHBondContact O-N 3.31Å; L177-Q180 PolarHBondContact O-N 3.02Å; Q180-F183 PolarHBondContact O-N 3.31Å; Q180-Q184 WeakPolarHBondContact O-CG 3.27Å; Q180-Q184 PolarHBondContact O-N 3.42Å; Q180-C220 VanDerWaalsContact CG-SG 3.53Å; Q180-C221 PolarHBondContact NE2-O 3.42Å; Q180-I225 HydrophobicContact CB-CD1 4.4Å; Q180-I225 HydrophobicContact CG-CD1 4.26Å
181L94.1Very high92.5Very high21 Ų2144.9 Ų44.911%0.1122%0.22CC..Hα-helixtrans-60.2-51.1-179.8-71.2169.5000111.3P136 I139 L177 F183 Q184 Y185P136-L181 HydrophobicContact CB-CD1 4.26Å; P136-L181 HydrophobicContact CG-CD1 4.2Å; I139-L181 HydrophobicContact CG1-CD1 4.47Å; I139-L181 HydrophobicContact CG2-CB 4.25Å; L177-L181 HydrophobicContact CD1-CD1 4.36Å; L177-L181 HydrophobicContact CD1-CG 4.34Å; L177-L181 HydrophobicContact CG-CD1 4.07Å; L177-L181 VanDerWaalsContact O-CG 3.31Å; L177-L181 WeakPolarHBondContact O-CG 3.33Å; L177-L181 PolarHBondContact O-N 3.26Å; L181-F183 PolarHBondContact O-N 2.95Å; L181-Q184 PolarHBondContact O-N 3.26Å; L181-Y185 WeakPolarHBondContact O-CD2 3.4Å; L181-Y185 PolarHBondContact O-N 3.5Å
182V95.4Very high92.4Very high1 Ų143.3 Ų43.31%0.00622%0.222CC..Hα-helixtrans-57.9-40.8177.9169.10000111I139 F143 I165 L169 S178 Y185 L186 I210I139-V182 HydrophobicContact CD1-CG2 4.02Å; I139-V182 HydrophobicContact CG2-CG2 3.74Å; F143-V182 HydrophobicContact CE2-CG1 4.45Å; F143-V182 HydrophobicContact CE2-CG2 4.41Å; F143-V182 HydrophobicContact CZ-CG1 4.1Å; I165-V182 HydrophobicContact CG2-CG1 3.66Å; L169-V182 HydrophobicContact CD1-CB 4.06Å; L169-V182 HydrophobicContact CD1-CG1 3.81Å; L169-V182 HydrophobicContact CD1-CG2 4.37Å; S178-V182 WeakPolarHBondContact O-CB 3.42Å; S178-V182 WeakPolarHBondContact O-CG2 3.48Å; S178-V182 PolarHBondContact O-N 2.87Å; V182-Y185 PolarHBondContact O-N 3.44Å; V182-L186 HydrophobicContact CG1-CD1 3.72Å; V182-L186 HydrophobicContact CG1-CG 4.26Å; V182-L186 WeakPolarHBondContact O-CB 3.44Å; V182-L186 WeakPolarHBondContact O-CD1 3.29Å; V182-L186 WeakPolarHBondContact O-CG 3.36Å; V182-L186 PolarHBondContact O-N 3.39Å; V182-I210 HydrophobicContact CG1-CD1 4.05Å
183F95.2Very high93Very high0 Ų033.5 Ų33.50%018%0.179CC..Hα-helixtrans-64.1-45178.4-165.2-114.4000112.2V179 Q180 L181 Y185 L186 L187 I207 I210 T211 I214 I225 V246 L250V179-F183 VanDerWaalsContact O-CB 3.29Å; V179-F183 WeakPolarHBondContact O-CB 3.35Å; V179-F183 PolarHBondContact O-N 3.25Å; Q180-F183 PolarHBondContact O-N 3.31Å; L181-F183 PolarHBondContact O-N 2.95Å; F183-Y185 PolarHBondContact O-N 2.69Å; F183-L186 PolarHBondContact O-N 3.02Å; F183-L187 HydrophobicContact CD1-CD1 3.87Å; F183-L187 HydrophobicContact CD1-CG 4.43Å; F183-L187 HydrophobicContact CE1-CD1 3.72Å; F183-L187 HydrophobicContact CE1-CD2 4.43Å; F183-L187 HydrophobicContact CE1-CG 4.27Å; F183-L187 HydrophobicContact CZ-CD1 4.37Å; F183-L187 HydrophobicContact CZ-CD2 4.27Å; F183-L187 HydrophobicContact CZ-CG 4.5Å; F183-L187 VanDerWaalsContact O-CG 3.27Å; F183-L187 WeakPolarHBondContact O-CG 3.18Å; F183-L187 PolarHBondContact O-N 3.46Å; F183-I207 HydrophobicContact CE2-CB 4.42Å; F183-I207 HydrophobicContact CE2-CG2 3.82Å; F183-I207 HydrophobicContact CZ-CG2 4.26Å; F183-I210 HydrophobicContact CB-CG2 4.02Å; F183-I210 HydrophobicContact CD2-CB 3.75Å; F183-I210 HydrophobicContact CD2-CD1 4.46Å; F183-I210 HydrophobicContact CD2-CG2 3.35Å; F183-I210 HydrophobicContact CE2-CB 4.13Å; F183-I210 HydrophobicContact CE2-CG2 4.03Å; F183-I210 HydrophobicContact CG-CG2 3.92Å; F183-T211 WeakPolarHBondContact CZ-OG1 3.48Å; F183-I214 HydrophobicContact CB-CD1 4.44Å; F183-I214 HydrophobicContact CD1-CD1 3.93Å; F183-I214 HydrophobicContact CD2-CD1 4.39Å; F183-I214 HydrophobicContact CE1-CD1 4.23Å; F183-I214 HydrophobicContact CG-CD1 4Å; F183-I225 HydrophobicContact CD1-CB 4.42Å; F183-I225 HydrophobicContact CD1-CD1 3.85Å; F183-I225 HydrophobicContact CD1-CG1 4.07Å; F183-I225 HydrophobicContact CD1-CG2 3.48Å; F183-I225 VanDerWaalsContact CD1-CG2 3.48Å; F183-I225 HydrophobicContact CE1-CG2 3.48Å; F183-I225 VanDerWaalsContact CE1-CG2 3.48Å; F183-V246 HydrophobicContact CE1-CG1 4.35Å; F183-V246 HydrophobicContact CZ-CG1 3.72Å; F183-L250 HydrophobicContact CE1-CD1 3.9Å; F183-L250 HydrophobicContact CZ-CD1 4.35Å
184Q94.4Very high93.2Very high53 Ų5330.4 Ų30.425%0.24817%0.166CC..Hα-helixtrans-57.7-49.3175-72.2174.4-31.800111.9Q180 L181 L186 L187 V188 G224 I225Q180-Q184 WeakPolarHBondContact O-CG 3.27Å; Q180-Q184 PolarHBondContact O-N 3.42Å; L181-Q184 PolarHBondContact O-N 3.26Å; Q184-L186 VanDerWaalsContact C-N 3.33Å; Q184-L186 PolarHBondContact O-N 3.43Å; Q184-L187 PolarHBondContact O-N 2.91Å; Q184-V188 PolarHBondContact O-N 2.89Å; Q184-G224 PolarHBondContact NE2-O 2.97Å; Q184-I225 HydrophobicContact CG-CG1 3.95Å
185Y95.9Very high93.2Very high43 Ų4334.9 Ų34.917%0.16918%0.183CC..Hα-helixtrans-61.6-39.2178-78.2-71.1000112.7I139 E140 F143 L181 V182 F183 L187 V188 L189 I374I139-Y185 HydrophobicContact CG2-CD2 3.78Å; I139-Y185 HydrophobicContact CG2-CE2 3.98Å; E140-Y185 HydrophobicContact CB-CE1 4.42Å; E140-Y185 WeakPolarHBondContact CB-OH 3.47Å; E140-Y185 HydrophobicContact CG-CE1 4.16Å; F143-Y185 HydrophobicContact CB-CD1 4.17Å; F143-Y185 HydrophobicContact CB-CG 4.41Å; F143-Y185 HydrophobicContact CD1-CG 4.47Å; F143-Y185 VanDerWaalsContact CD2-CB 3.45Å; F143-Y185 HydrophobicContact CD2-CD1 4.22Å; F143-Y185 AromaticContact CD2-CD2 3.92Å; F143-Y185 HydrophobicContact CD2-CD2 3.92Å; F143-Y185 AromaticContact CD2-CG 3.62Å; F143-Y185 HydrophobicContact CD2-CG 3.62Å; F143-Y185 VanDerWaalsContact CE2-CB 3.43Å; F143-Y185 HydrophobicContact CE2-CD2 4.11Å; F143-Y185 AromaticContact CE2-CG 3.96Å; F143-Y185 HydrophobicContact CE2-CG 3.96Å; F143-Y185 HydrophobicContact CG-CD1 4.16Å; F143-Y185 AromaticContact CG-CG 3.91Å; F143-Y185 HydrophobicContact CG-CG 3.91Å; L181-Y185 WeakPolarHBondContact O-CD2 3.4Å; L181-Y185 PolarHBondContact O-N 3.5Å; V182-Y185 PolarHBondContact O-N 3.44Å; F183-Y185 PolarHBondContact O-N 2.69Å; Y185-L187 VanDerWaalsContact C-N 3.34Å; Y185-L187 PolarHBondContact O-N 3.46Å; Y185-V188 PolarHBondContact O-N 2.85Å; Y185-L189 VanDerWaalsContact O-CB 3.26Å; Y185-L189 WeakPolarHBondContact O-CB 3.43Å; Y185-L189 PolarHBondContact O-N 2.71Å; Y185-I374 HydrophobicContact CE1-CD1 4.28Å
186L95.9Very high92.9Very high0 Ų039 Ų390%020%0.204CC..Hα-helixtrans-64.2-37.4176.9-74166.3000112.7F143 V182 F183 Q184 L189 L190 V203 L206 I207 I210F143-L186 HydrophobicContact CE1-CD2 3.81Å; F143-L186 HydrophobicContact CE1-CG 3.93Å; F143-L186 HydrophobicContact CZ-CD2 4.13Å; F143-L186 HydrophobicContact CZ-CG 3.89Å; V182-L186 HydrophobicContact CG1-CD1 3.72Å; V182-L186 HydrophobicContact CG1-CG 4.26Å; V182-L186 WeakPolarHBondContact O-CB 3.44Å; V182-L186 WeakPolarHBondContact O-CD1 3.29Å; V182-L186 WeakPolarHBondContact O-CG 3.36Å; V182-L186 PolarHBondContact O-N 3.39Å; F183-L186 PolarHBondContact O-N 3.02Å; Q184-L186 VanDerWaalsContact C-N 3.33Å; Q184-L186 PolarHBondContact O-N 3.43Å; L186-L189 PolarHBondContact O-N 3.3Å; L186-L190 WeakPolarHBondContact O-CB 3.26Å; L186-L190 PolarHBondContact O-N 2.9Å; L186-V203 HydrophobicContact CD2-CG1 4.09Å; L186-L206 HydrophobicContact CD1-CD2 3.62Å; L186-L206 HydrophobicContact CD1-CG 3.75Å; L186-L206 HydrophobicContact CD2-CD2 3.74Å; L186-L206 HydrophobicContact CD2-CG 4.47Å; L186-L206 HydrophobicContact CG-CD2 4.34Å; L186-I207 HydrophobicContact CB-CD1 4.15Å; L186-I207 HydrophobicContact CB-CG1 3.79Å; L186-I207 HydrophobicContact CD1-CG1 4.42Å; L186-I210 HydrophobicContact CD1-CD1 3.43Å; L186-I210 VanDerWaalsContact CD1-CD1 3.43Å
187L94.7Very high92.9Very high0 Ų038.2 Ų38.20%020%0.2CC..Hα-helixtrans-65.5-46178.2-68.4171.5000111.2F183 Q184 Y185 L190 A191 I207 I225 L229 I232 L243 V246F183-L187 HydrophobicContact CD1-CD1 3.87Å; F183-L187 HydrophobicContact CD1-CG 4.43Å; F183-L187 HydrophobicContact CE1-CD1 3.72Å; F183-L187 HydrophobicContact CE1-CD2 4.43Å; F183-L187 HydrophobicContact CE1-CG 4.27Å; F183-L187 HydrophobicContact CZ-CD1 4.37Å; F183-L187 HydrophobicContact CZ-CD2 4.27Å; F183-L187 HydrophobicContact CZ-CG 4.5Å; F183-L187 VanDerWaalsContact O-CG 3.27Å; F183-L187 WeakPolarHBondContact O-CG 3.18Å; F183-L187 PolarHBondContact O-N 3.46Å; Q184-L187 PolarHBondContact O-N 2.91Å; Y185-L187 VanDerWaalsContact C-N 3.34Å; Y185-L187 PolarHBondContact O-N 3.46Å; L187-L190 PolarHBondContact O-N 2.72Å; L187-A191 PolarHBondContact O-N 2.58Å; L187-A191 VanDerWaalsContact O-N 3.16Å; L187-I207 HydrophobicContact CD2-CD1 4.37Å; L187-I207 HydrophobicContact CD2-CG2 4.28Å; L187-I225 HydrophobicContact CD1-CG2 4.09Å; L187-L229 HydrophobicContact CD1-CD1 4.22Å; L187-L229 HydrophobicContact CD1-CD2 3.57Å; L187-L229 HydrophobicContact CD1-CG 3.65Å; L187-L229 HydrophobicContact CD2-CD2 3.67Å; L187-L229 HydrophobicContact CG-CD2 4.11Å; L187-I232 HydrophobicContact CB-CD1 3.84Å; L187-L243 HydrophobicContact CD2-CD2 3.77Å; L187-V246 HydrophobicContact CD2-CG1 4.39Å
188V94Very high93Very high59 Ų5939.4 Ų39.436%0.35821%0.206SC..Hα-helixtrans-61.6-46.2175.31770000110.5Q184 Y185 L190 A191 S192 I232Q184-V188 PolarHBondContact O-N 2.89Å; Y185-V188 PolarHBondContact O-N 2.85Å; V188-L190 PolarHBondContact O-N 2.71Å; V188-A191 WeakPolarHBondContact O-CB 3.32Å; V188-A191 PolarHBondContact O-N 3.06Å; V188-S192 PolarHBondContact O-N 3.41Å; V188-I232 HydrophobicContact CG2-CD1 4Å
189L94.8Very high93.1Very high11 Ų1139.4 Ų39.46%0.05821%0.206CC..Hα-helixtrans-58.7-50.2177.6175.264.8000111.4F143 L147 Y185 L186 A191 S192 L193 Y199 V203F143-L189 HydrophobicContact CD1-CD2 4.29Å; F143-L189 HydrophobicContact CE1-CD2 4.31Å; L147-L189 HydrophobicContact CB-CD2 4.22Å; L147-L189 WeakPolarHBondContact O-CD1 3.32Å; L147-L189 WeakPolarHBondContact O-CD2 3.38Å; Y185-L189 VanDerWaalsContact O-CB 3.26Å; Y185-L189 WeakPolarHBondContact O-CB 3.43Å; Y185-L189 PolarHBondContact O-N 2.71Å; L186-L189 PolarHBondContact O-N 3.3Å; L189-A191 PolarHBondContact O-N 3.32Å; L189-S192 PolarHBondContact O-N 2.92Å; L189-S192 PolarHBondContact O-OG 2.91Å; L189-L193 HydrophobicContact CD1-CD1 4.36Å; L189-L193 HydrophobicContact CD1-CD2 4.38Å; L189-L193 HydrophobicContact CD1-CG 4.29Å; L189-L193 HydrophobicContact CG-CD1 4.14Å; L189-L193 HydrophobicContact CG-CG 4.48Å; L189-L193 WeakPolarHBondContact O-CG 3.29Å; L189-L193 PolarHBondContact O-N 3.26Å; L189-Y199 WeakPolarHBondContact CD2-OH 3.1Å; L189-V203 HydrophobicContact CD2-CG1 4.4Å; L189-V203 HydrophobicContact CD2-CG2 3.92Å
190L94.3Very high93.2Very high1 Ų139.3 Ų39.31%0.00521%0.206CC..Hα-helixtrans-57-40.2179.9-177.965.6000111.4L186 L187 V188 S192 L193 V203 L204 I207 Y239 L243L186-L190 WeakPolarHBondContact O-CB 3.26Å; L186-L190 PolarHBondContact O-N 2.9Å; L187-L190 PolarHBondContact O-N 2.72Å; V188-L190 PolarHBondContact O-N 2.71Å; L190-S192 PolarHBondContact O-N 2.95Å; L190-L193 PolarHBondContact O-N 2.8Å; L190-V203 HydrophobicContact CB-CG1 4.03Å; L190-V203 HydrophobicContact CD1-CG1 4.23Å; L190-L204 HydrophobicContact CD1-CB 4.48Å; L190-L204 HydrophobicContact CD2-CD1 4.03Å; L190-I207 HydrophobicContact CB-CD1 3.81Å; L190-I207 HydrophobicContact CD2-CD1 3.62Å; L190-I207 HydrophobicContact CG-CD1 4.24Å; L190-Y239 HydrophobicContact CD1-CD1 4.02Å; L190-Y239 HydrophobicContact CD1-CD2 3.77Å; L190-Y239 HydrophobicContact CD1-CE1 4.24Å; L190-Y239 HydrophobicContact CD1-CE2 4Å; L190-Y239 HydrophobicContact CD1-CG 3.78Å; L190-Y239 HydrophobicContact CD2-CG 4.32Å; L190-Y239 HydrophobicContact CG-CD1 4.48Å; L190-Y239 HydrophobicContact CG-CD2 3.98Å; L190-Y239 HydrophobicContact CG-CG 3.88Å; L190-Y239 WeakPolarHBondContact O-CD2 3.12Å; L190-L243 HydrophobicContact CD2-CD2 4.04Å; L190-L243 HydrophobicContact CD2-CG 4.4Å
191A92.6Very high93.2Very high29 Ų2943.7 Ų43.724%0.2423%0.226CC..Hα-helixtrans-62.9-29.6179.200000113.4L187 V188 L189 I232 S237L187-A191 PolarHBondContact O-N 2.58Å; L187-A191 VanDerWaalsContact O-N 3.16Å; V188-A191 WeakPolarHBondContact O-CB 3.32Å; V188-A191 PolarHBondContact O-N 3.06Å; L189-A191 PolarHBondContact O-N 3.32Å; A191-I232 HydrophobicContact CB-CG2 3.54Å; A191-S237 WeakPolarHBondContact CA-OG 3.3Å; A191-S237 PolarHBondContact O-OG 3.24Å
192S91.8Very high93.3Very high66 Ų6643.6 Ų43.646%0.46223%0.227SC..Hα-helixtrans-86.2-11.118072.30000114.9V188 L189 L190V188-S192 PolarHBondContact O-N 3.41Å; L189-S192 PolarHBondContact O-N 2.92Å; L189-S192 PolarHBondContact O-OG 2.91Å; L190-S192 PolarHBondContact O-N 2.95Å
193L93.2Very high93.4Very high4 Ų443.6 Ų43.62%0.02123%0.227CC..SBendtrans-86.3149.5-174.3-70.8174.2000112.9I151 L189 L190 Y199 A200 V203 S238 Y239I151-L193 HydrophobicContact CG2-CD2 3.9Å; L189-L193 HydrophobicContact CD1-CD1 4.36Å; L189-L193 HydrophobicContact CD1-CD2 4.38Å; L189-L193 HydrophobicContact CD1-CG 4.29Å; L189-L193 HydrophobicContact CG-CD1 4.14Å; L189-L193 HydrophobicContact CG-CG 4.48Å; L189-L193 WeakPolarHBondContact O-CG 3.29Å; L189-L193 PolarHBondContact O-N 3.26Å; L190-L193 PolarHBondContact O-N 2.8Å; L193-Y199 HydrophobicContact CD1-CD1 4.06Å; L193-Y199 HydrophobicContact CD1-CE1 4.02Å; L193-Y199 HydrophobicContact CD2-CD1 3.82Å; L193-Y199 HydrophobicContact CD2-CE1 3.75Å; L193-A200 HydrophobicContact CB-CB 4.1Å; L193-A200 HydrophobicContact CD1-CB 3.99Å; L193-V203 HydrophobicContact CD1-CB 4.46Å; L193-V203 HydrophobicContact CD1-CG2 4.09Å; L193-S238 PolarHBondContact O-OG 2.82Å; L193-S238 VanDerWaalsContact O-OG 3.07Å; L193-Y239 HydrophobicContact CB-CE2 4.27Å; L193-Y239 WeakPolarHBondContact O-CE2 3.42Å
194P91.3Very high93.4Very high55 Ų5545.8 Ų45.836%0.35724%0.238SC..PPolyproline II helixtrans-70.1156.3172.829.8-35.1000111.8I151 N197 Y239I151-P194 HydrophobicContact CD1-CG 3.84Å; I151-P194 HydrophobicContact CG2-CG 3.81Å; P194-N197 HydrophobicContact CG-CB 4.38Å; P194-Y239 PolarHBondContact O-OH 3.45Å
195K87.8Confident93.4Very high121 Ų12145.2 Ų45.253%0.52624%0.24SC..THydrogen-bonded Turntrans-66155.5173.4-66.3-172.3173.3171.10111.3N197 S238 Y239K195-N197 PolarHBondContact O-N 3.17Å; K195-N197 VanDerWaalsContact O-N 3.17Å; K195-S238 WeakPolarHBondContact CE-O 3.5Å; K195-Y239 WeakPolarHBondContact CA-OH 3.18Å
196H85Confident93.5Very high185 Ų18543.3 Ų43.386%0.85623%0.233SC*.THydrogen-bonded Turntrans61.321.8169.9-52.5-70.2000115.7
197N90.9Very high93.5Very high34 Ų3443.3 Ų43.318%0.18223%0.233CC..  trans-93.9139.6172.7-167.9-57.8000111.2P194 K195 Y199 A200 H201P194-N197 HydrophobicContact CG-CB 4.38Å; K195-N197 PolarHBondContact O-N 3.17Å; K195-N197 VanDerWaalsContact O-N 3.17Å; N197-Y199 PolarHBondContact O-N 3.32Å; N197-Y199 WeakPolarHBondContact OD1-CB 3.27Å; N197-Y199 PolarHBondContact OD1-N 3.27Å; N197-A200 HydrophobicContact CB-CB 4.31Å; N197-A200 PolarHBondContact O-N 3.15Å; N197-A200 VanDerWaalsContact O-N 3.13Å; N197-H201 PolarHBondContact O-N 3.26Å
198I93.1Very high93.5Very high110 Ų11046.3 Ų46.356%0.56425%0.251SS*.Hα-helixtrans-58.6-34.5176.9-170.3161.4000113.1V155 I159 H201 S202V155-I198 HydrophobicContact CG1-CG2 4.29Å; I159-I198 HydrophobicContact CD1-CD1 4.37Å; I159-I198 HydrophobicContact CD1-CG1 4.18Å; I159-I198 HydrophobicContact CD1-CG2 4.28Å; I198-H201 PolarHBondContact O-N 3.19Å; I198-S202 PolarHBondContact O-N 3.39Å; I198-S202 PolarHBondContact O-OG 3.34Å
199Y94.9Very high93.5Very high0 Ų049.8 Ų49.80%026%0.258CS..Hα-helixtrans-65.5-45.5175.3175.1-143.5000111L147 N148 K158 L189 L193 N197 H201 S202 V203L147-Y199 WeakPolarHBondContact CA-OH 3.31Å; L147-Y199 HydrophobicContact CD2-CE2 4Å; L147-Y199 PolarHBondContact O-OH 2.92Å; N148-Y199 VanDerWaalsContact O-CE1 3.32Å; N148-Y199 WeakPolarHBondContact O-CE1 3.42Å; N148-Y199 PolarHBondContact O-OH 2.61Å; K158-Y199 HydrophobicContact CB-CD2 3.81Å; K158-Y199 HydrophobicContact CB-CE2 3.61Å; K158-Y199 HydrophobicContact CB-CG 4.48Å; K158-Y199 HydrophobicContact CD-CD1 3.99Å; K158-Y199 HydrophobicContact CD-CD2 4.28Å; K158-Y199 HydrophobicContact CD-CE1 3.68Å; K158-Y199 HydrophobicContact CD-CE2 4.02Å; K158-Y199 HydrophobicContact CD-CG 4.27Å; K158-Y199 HydrophobicContact CG-CE2 4.1Å; L189-Y199 WeakPolarHBondContact CD2-OH 3.1Å; L193-Y199 HydrophobicContact CD1-CD1 4.06Å; L193-Y199 HydrophobicContact CD1-CE1 4.02Å; L193-Y199 HydrophobicContact CD2-CD1 3.82Å; L193-Y199 HydrophobicContact CD2-CE1 3.75Å; N197-Y199 PolarHBondContact O-N 3.32Å; N197-Y199 WeakPolarHBondContact OD1-CB 3.27Å; N197-Y199 PolarHBondContact OD1-N 3.27Å; Y199-H201 VanDerWaalsContact C-N 3.3Å; Y199-H201 PolarHBondContact O-N 3.1Å; Y199-S202 WeakPolarHBondContact O-CA 3.25Å; Y199-S202 WeakPolarHBondContact O-CB 3.47Å; Y199-S202 PolarHBondContact O-N 3.09Å; Y199-V203 HydrophobicContact CD2-CG2 3.93Å; Y199-V203 HydrophobicContact CE2-CG2 3.56Å; Y199-V203 WeakPolarHBondContact O-CG2 3.39Å; Y199-V203 PolarHBondContact O-N 2.83Å
200A94.6Very high93.4Very high1 Ų149.4 Ų49.41%0.00826%0.256CS..Hα-helixtrans-63.9-35.9177.100000112.3L193 N197 S202 V203 L204 Y239L193-A200 HydrophobicContact CB-CB 4.1Å; L193-A200 HydrophobicContact CD1-CB 3.99Å; N197-A200 HydrophobicContact CB-CB 4.31Å; N197-A200 PolarHBondContact O-N 3.15Å; N197-A200 VanDerWaalsContact O-N 3.13Å; A200-S202 VanDerWaalsContact C-N 3.32Å; A200-S202 PolarHBondContact O-N 2.89Å; A200-V203 PolarHBondContact O-N 2.97Å; A200-L204 WeakPolarHBondContact O-CB 3.49Å; A200-L204 PolarHBondContact O-N 2.85Å; A200-Y239 HydrophobicContact CB-CE2 4.2Å; A200-Y239 WeakPolarHBondContact CB-OH 3.34Å
201H94.4Very high93.4Very high123 Ų12350 Ų5057%0.56926%0.26SS*.Hα-helixtrans-61.9-39.6171.1179.8-89000112.3N197 I198 Y199 L204 S205N197-H201 PolarHBondContact O-N 3.26Å; I198-H201 PolarHBondContact O-N 3.19Å; Y199-H201 VanDerWaalsContact C-N 3.3Å; Y199-H201 PolarHBondContact O-N 3.1Å; H201-L204 PolarHBondContact O-N 2.72Å; H201-S205 WeakPolarHBondContact O-CB 3.08Å; H201-S205 PolarHBondContact O-N 3.05Å; H201-S205 PolarHBondContact O-OG 2.83Å
202S95.9Very high93.3Very high20 Ų2054.2 Ų54.214%0.1427%0.272CS..Hα-helixtrans-66.1-43176.9-56.70000111.6I198 Y199 A200 S205 L206I198-S202 PolarHBondContact O-N 3.39Å; I198-S202 PolarHBondContact O-OG 3.34Å; Y199-S202 WeakPolarHBondContact O-CA 3.25Å; Y199-S202 WeakPolarHBondContact O-CB 3.47Å; Y199-S202 PolarHBondContact O-N 3.09Å; A200-S202 VanDerWaalsContact C-N 3.32Å; A200-S202 PolarHBondContact O-N 2.89Å; S202-S205 PolarHBondContact O-N 3.41Å; S202-L206 PolarHBondContact O-N 3.5Å
203V96.5Very high93.3Very high0 Ų051.8 Ų51.80%025%0.254CS..Hα-helixtrans-62.3-46.51741730000111.2L186 L189 L190 L193 Y199 A200 S205 L206 I207L186-V203 HydrophobicContact CD2-CG1 4.09Å; L189-V203 HydrophobicContact CD2-CG1 4.4Å; L189-V203 HydrophobicContact CD2-CG2 3.92Å; L190-V203 HydrophobicContact CB-CG1 4.03Å; L190-V203 HydrophobicContact CD1-CG1 4.23Å; L193-V203 HydrophobicContact CD1-CB 4.46Å; L193-V203 HydrophobicContact CD1-CG2 4.09Å; Y199-V203 HydrophobicContact CD2-CG2 3.93Å; Y199-V203 HydrophobicContact CE2-CG2 3.56Å; Y199-V203 WeakPolarHBondContact O-CG2 3.39Å; Y199-V203 PolarHBondContact O-N 2.83Å; A200-V203 PolarHBondContact O-N 2.97Å; V203-S205 VanDerWaalsContact C-N 3.32Å; V203-S205 PolarHBondContact O-N 3.31Å; V203-L206 WeakPolarHBondContact O-CB 3.28Å; V203-L206 PolarHBondContact O-N 2.82Å; V203-I207 HydrophobicContact CG1-CD1 3.84Å; V203-I207 HydrophobicContact CG1-CG1 4.47Å; V203-I207 WeakPolarHBondContact O-CG1 3.21Å; V203-I207 PolarHBondContact O-N 3.26Å
204L94.9Very high93.2Very high47 Ų4751.6 Ų51.625%0.24625%0.253CS..Hα-helixtrans-62.3-39.7177.8-178.662.9000112.3L190 A200 H201 L206 I207 T208 A242L190-L204 HydrophobicContact CD1-CB 4.48Å; L190-L204 HydrophobicContact CD2-CD1 4.03Å; A200-L204 WeakPolarHBondContact O-CB 3.49Å; A200-L204 PolarHBondContact O-N 2.85Å; H201-L204 PolarHBondContact O-N 2.72Å; L204-L206 VanDerWaalsContact C-N 3.34Å; L204-I207 PolarHBondContact O-N 3.26Å; L204-T208 WeakPolarHBondContact O-CB 3.43Å; L204-T208 PolarHBondContact O-N 2.7Å; L204-T208 PolarHBondContact O-OG1 2.94Å; L204-A242 HydrophobicContact CD1-CB 3.85Å
205S95.6Very high93.1Very high41 Ų4156.6 Ų56.629%0.28727%0.265SS..Hα-helixtrans-62.5-42.4174.8-64.50000111.3H201 S202 V203 T208 R209H201-S205 WeakPolarHBondContact O-CB 3.08Å; H201-S205 PolarHBondContact O-N 3.05Å; H201-S205 PolarHBondContact O-OG 2.83Å; S202-S205 PolarHBondContact O-N 3.41Å; V203-S205 VanDerWaalsContact C-N 3.32Å; V203-S205 PolarHBondContact O-N 3.31Å; S205-T208 PolarHBondContact O-N 3.25Å; S205-R209 WeakPolarHBondContact O-CG 3.34Å; S205-R209 PolarHBondContact O-N 3.12Å
206L96.6Very high93Very high3 Ų359.5 Ų59.52%0.01627%0.273CS..Hα-helixtrans-65.6-46.8176.2177.957.4000112.1C162 I165 G166 L186 S202 V203 L204 T208 R209 I210C162-L206 HydrophobicContact CB-CD2 4.31Å; I165-L206 HydrophobicContact CB-CD1 4.37Å; I165-L206 HydrophobicContact CB-CD2 3.98Å; I165-L206 HydrophobicContact CG2-CD1 4.09Å; I165-L206 HydrophobicContact CG2-CD2 3.86Å; G166-L206 VanDerWaalsContact CA-CD1 3.49Å; L186-L206 HydrophobicContact CD1-CD2 3.62Å; L186-L206 HydrophobicContact CD1-CG 3.75Å; L186-L206 HydrophobicContact CD2-CD2 3.74Å; L186-L206 HydrophobicContact CD2-CG 4.47Å; L186-L206 HydrophobicContact CG-CD2 4.34Å; S202-L206 PolarHBondContact O-N 3.5Å; V203-L206 WeakPolarHBondContact O-CB 3.28Å; V203-L206 PolarHBondContact O-N 2.82Å; L204-L206 VanDerWaalsContact C-N 3.34Å; L206-T208 VanDerWaalsContact C-N 3.27Å; L206-T208 PolarHBondContact O-N 3.36Å; L206-R209 WeakPolarHBondContact O-CB 3.4Å; L206-R209 PolarHBondContact O-N 3.34Å; L206-I210 HydrophobicContact CD1-CD1 3.84Å; L206-I210 HydrophobicContact CD1-CG1 4.03Å; L206-I210 HydrophobicContact CG-CD1 3.91Å; L206-I210 HydrophobicContact CG-CG1 4.48Å; L206-I210 WeakPolarHBondContact O-CG1 3.35Å; L206-I210 PolarHBondContact O-N 3.07Å
207I96.2Very high92.9Very high0 Ų054.3 Ų54.30%025%0.249CC..Hα-helixtrans-54-47.8174.8-73165.6000109.8F183 L186 L187 L190 V203 L204 R209 I210 T211 V246F183-I207 HydrophobicContact CE2-CB 4.42Å; F183-I207 HydrophobicContact CE2-CG2 3.82Å; F183-I207 HydrophobicContact CZ-CG2 4.26Å; L186-I207 HydrophobicContact CB-CD1 4.15Å; L186-I207 HydrophobicContact CB-CG1 3.79Å; L186-I207 HydrophobicContact CD1-CG1 4.42Å; L187-I207 HydrophobicContact CD2-CD1 4.37Å; L187-I207 HydrophobicContact CD2-CG2 4.28Å; L190-I207 HydrophobicContact CB-CD1 3.81Å; L190-I207 HydrophobicContact CD2-CD1 3.62Å; L190-I207 HydrophobicContact CG-CD1 4.24Å; V203-I207 HydrophobicContact CG1-CD1 3.84Å; V203-I207 HydrophobicContact CG1-CG1 4.47Å; V203-I207 WeakPolarHBondContact O-CG1 3.21Å; V203-I207 PolarHBondContact O-N 3.26Å; L204-I207 PolarHBondContact O-N 3.26Å; I207-R209 VanDerWaalsContact C-N 3.31Å; I207-R209 PolarHBondContact O-N 3.28Å; I207-I210 PolarHBondContact O-N 2.94Å; I207-T211 PolarHBondContact O-N 3.47Å; I207-T211 PolarHBondContact O-OG1 3.2Å; I207-V246 HydrophobicContact CG2-CG2 3.75Å
208T94.4Very high92.2Very high62 Ų6257.1 Ų57.138%0.3827%0.269SS..Hα-helixtrans-60.5-39.6178.5-56.50000112.4L204 S205 L206 K212L204-T208 WeakPolarHBondContact O-CB 3.43Å; L204-T208 PolarHBondContact O-N 2.7Å; L204-T208 PolarHBondContact O-OG1 2.94Å; S205-T208 PolarHBondContact O-N 3.25Å; L206-T208 VanDerWaalsContact C-N 3.27Å; L206-T208 PolarHBondContact O-N 3.36Å; T208-K212 WeakPolarHBondContact O-CG 3.46Å; T208-K212 PolarHBondContact O-N 2.9Å
209R94.3Very high91.4Very high133 Ų13360.4 Ų60.450%0.50228%0.282SS..Hα-helixtrans-64.9-44.8175.3-71.7175-175.1-165.22.3111.4S205 L206 I207 K212 L213S205-R209 WeakPolarHBondContact O-CG 3.34Å; S205-R209 PolarHBondContact O-N 3.12Å; L206-R209 WeakPolarHBondContact O-CB 3.4Å; L206-R209 PolarHBondContact O-N 3.34Å; I207-R209 VanDerWaalsContact C-N 3.31Å; I207-R209 PolarHBondContact O-N 3.28Å; R209-K212 WeakPolarHBondContact O-CB 3.46Å; R209-K212 PolarHBondContact O-N 3.22Å; R209-L213 PolarHBondContact O-N 3.29Å
210I93.9Very high90.7Very high3 Ų360.4 Ų60.42%0.01528%0.282CS..Hα-helixtrans-69.2-39179.7-63.8171.1000111.4L169 V179 V182 F183 L186 L206 I207 K212 L213 I214L169-I210 HydrophobicContact CD1-CD1 3.89Å; L169-I210 HydrophobicContact CD1-CG1 4.32Å; V179-I210 HydrophobicContact CG1-CG2 3.87Å; V182-I210 HydrophobicContact CG1-CD1 4.05Å; F183-I210 HydrophobicContact CB-CG2 4.02Å; F183-I210 HydrophobicContact CD2-CB 3.75Å; F183-I210 HydrophobicContact CD2-CD1 4.46Å; F183-I210 HydrophobicContact CD2-CG2 3.35Å; F183-I210 HydrophobicContact CE2-CB 4.13Å; F183-I210 HydrophobicContact CE2-CG2 4.03Å; F183-I210 HydrophobicContact CG-CG2 3.92Å; L186-I210 HydrophobicContact CD1-CD1 3.43Å; L186-I210 VanDerWaalsContact CD1-CD1 3.43Å; L206-I210 HydrophobicContact CD1-CD1 3.84Å; L206-I210 HydrophobicContact CD1-CG1 4.03Å; L206-I210 HydrophobicContact CG-CD1 3.91Å; L206-I210 HydrophobicContact CG-CG1 4.48Å; L206-I210 WeakPolarHBondContact O-CG1 3.35Å; L206-I210 PolarHBondContact O-N 3.07Å; I207-I210 PolarHBondContact O-N 2.94Å; I210-K212 PolarHBondContact O-N 2.96Å; I210-L213 WeakPolarHBondContact O-CA 3.39Å; I210-L213 WeakPolarHBondContact O-CB 3.35Å; I210-L213 PolarHBondContact O-N 2.88Å; I210-I214 HydrophobicContact CG2-CD1 3.86Å; I210-I214 HydrophobicContact CG2-CG1 4.16Å; I210-I214 WeakPolarHBondContact O-CG1 3.19Å; I210-I214 PolarHBondContact O-N 2.9Å
211T93.1Very high90.3Very high14 Ų1463.6 Ų63.69%0.08630%0.303CS..Hα-helixtrans-57.5-40.4172.9-53.40000111.2F183 I207 L213 R215 N249 L250F183-T211 WeakPolarHBondContact CZ-OG1 3.48Å; I207-T211 PolarHBondContact O-N 3.47Å; I207-T211 PolarHBondContact O-OG1 3.2Å; T211-L213 VanDerWaalsContact C-N 3.35Å; T211-R215 PolarHBondContact O-N 3.08Å; T211-R215 VanDerWaalsContact O-N 3.13Å; T211-N249 HydrophobicContact CG2-CB 4.25Å; T211-L250 HydrophobicContact CG2-CD2 4.24Å; T211-L250 HydrophobicContact CG2-CG 4.5Å
212K91.9Very high89.9Confident116 Ų11658 Ų5850%0.50428%0.277SS..Hα-helixtrans-66-35.6173.9-70.7173.6-177.4179.70112.5T208 R209 I210 R216T208-K212 WeakPolarHBondContact O-CG 3.46Å; T208-K212 PolarHBondContact O-N 2.9Å; R209-K212 WeakPolarHBondContact O-CB 3.46Å; R209-K212 PolarHBondContact O-N 3.22Å; I210-K212 PolarHBondContact O-N 2.96Å; K212-R216 WeakPolarHBondContact O-CG 3.37Å
213L91.3Very high89.5Confident15 Ų1562.1 Ų62.18%0.07930%0.298CS..Hα-helixtrans-65.7-51.5176-176.866.8000111L169 P170 V179 R209 I210 T211 R215 R216 H217L169-L213 HydrophobicContact CB-CD2 4.43Å; P170-L213 HydrophobicContact CB-CD1 3.92Å; P170-L213 HydrophobicContact CB-CD2 4.41Å; P170-L213 HydrophobicContact CG-CD1 4.3Å; P170-L213 HydrophobicContact CG-CD2 4.17Å; V179-L213 HydrophobicContact CG1-CD2 4.04Å; V179-L213 HydrophobicContact CG2-CD2 4.35Å; R209-L213 PolarHBondContact O-N 3.29Å; I210-L213 WeakPolarHBondContact O-CA 3.39Å; I210-L213 WeakPolarHBondContact O-CB 3.35Å; I210-L213 PolarHBondContact O-N 2.88Å; T211-L213 VanDerWaalsContact C-N 3.35Å; L213-R215 PolarHBondContact O-N 3.25Å; L213-R216 WeakPolarHBondContact O-CB 3.49Å; L213-R216 PolarHBondContact O-N 2.86Å; L213-H217 PolarHBondContact O-CD2 3.08Å; L213-H217 VanDerWaalsContact O-CD2 3.25Å; L213-H217 PolarHBondContact O-N 3.49Å
214I90.5Very high89.1Confident0 Ų063.7 Ų63.70%032%0.315CS..Hα-helixtrans-56.2-39.5178.2-69.2172.5000111.2V179 F183 I210 R216 H217 C220 L222 I225 L250 R257V179-I214 HydrophobicContact CG1-CG1 4.28Å; F183-I214 HydrophobicContact CB-CD1 4.44Å; F183-I214 HydrophobicContact CD1-CD1 3.93Å; F183-I214 HydrophobicContact CD2-CD1 4.39Å; F183-I214 HydrophobicContact CE1-CD1 4.23Å; F183-I214 HydrophobicContact CG-CD1 4Å; I210-I214 HydrophobicContact CG2-CD1 3.86Å; I210-I214 HydrophobicContact CG2-CG1 4.16Å; I210-I214 WeakPolarHBondContact O-CG1 3.19Å; I210-I214 PolarHBondContact O-N 2.9Å; I214-R216 PolarHBondContact O-N 3.49Å; I214-H217 PolarHBondContact O-N 3.03Å; I214-C220 HydrophobicContact CG2-CB 4.36Å; I214-L222 HydrophobicContact CG2-CD2 3.4Å; I214-L222 VanDerWaalsContact CG2-CD2 3.4Å; I214-I225 HydrophobicContact CD1-CD1 4.11Å; I214-L250 HydrophobicContact CG2-CD2 4.19Å; I214-R257 PolarHBondContact O-NH2 2.91Å
215R88.6Confident88.8Confident160 Ų16061.6 Ų61.660%0.60430%0.303SS*.Hα-helixtrans-60.8-29.8176-171.4178.165.6120.61.6113.6T211 L213 T253T211-R215 PolarHBondContact O-N 3.08Å; T211-R215 VanDerWaalsContact O-N 3.13Å; L213-R215 PolarHBondContact O-N 3.25Å; R215-T253 HydrophobicContact CB-CG2 4.3Å; R215-T253 HydrophobicContact CG-CG2 4.16Å
216R86.5Confident88.6Confident182 Ų18261 Ų6169%0.68730%0.297SS*.Hα-helixtrans-84.4-13.8179.6-68.2174.8-179.9169.7-1.4113.6K212 L213 I214K212-R216 WeakPolarHBondContact O-CG 3.37Å; L213-R216 WeakPolarHBondContact O-CB 3.49Å; L213-R216 PolarHBondContact O-N 2.86Å; I214-R216 PolarHBondContact O-N 3.49Å
217H83.1Confident88.3Confident77 Ų7768.5 Ų68.536%0.35633%0.329SS..  trans-118.399.8-175.4-67.6-69.4000110.9M176 L213 I214 Q219 C220 R257M176-H217 HydrophobicContact CE-CB 3.57Å; L213-H217 PolarHBondContact O-CD2 3.08Å; L213-H217 VanDerWaalsContact O-CD2 3.25Å; L213-H217 PolarHBondContact O-N 3.49Å; I214-H217 PolarHBondContact O-N 3.03Å; H217-Q219 PolarHBondContact O-N 3Å; H217-C220 PolarHBondContact O-N 3.04Å; H217-R257 PolarHBondContact O-NH2 2.77Å
218P75.6Confident88.1Confident93 Ų9369.8 Ų69.860%0.60434%0.338SS*.THydrogen-bonded Turntrans-59-30.6-177.8-24.133.6000113.8C220 R257P218-C220 PolarHBondContact O-N 3.43Å; P218-C220 VanDerWaalsContact O-N 3.15Å; P218-R257 VanDerWaalsContact O-CZ 3.3Å; P218-R257 PolarHBondContact O-NH1 3.18Å; P218-R257 VanDerWaalsContact O-NH1 3.15Å
219Q77Confident87.9Confident178 Ų17866.9 Ų66.983%0.83232%0.32SS*.THydrogen-bonded Turntrans-69.8-7-175.5-61-70.2-0.100114.8H217 C221H217-Q219 PolarHBondContact O-N 3Å; Q219-C221 PolarHBondContact O-N 3.04Å
220C80.5Confident87.7Confident1 Ų165.5 Ų65.51%0.00732%0.319CS..  trans-79.5108.9-178.6-176.20000110.6M176 Q180 I214 H217 P218 L222 R257M176-C220 HydrophobicContact CG-CB 3.72Å; M176-C220 HydrophobicContact SD-CB 3.72Å; Q180-C220 VanDerWaalsContact CG-SG 3.53Å; I214-C220 HydrophobicContact CG2-CB 4.36Å; H217-C220 PolarHBondContact O-N 3.04Å; P218-C220 PolarHBondContact O-N 3.43Å; P218-C220 VanDerWaalsContact O-N 3.15Å; C220-L222 WeakPolarHBondContact O-CG 3.39Å; C220-L222 PolarHBondContact O-N 3.44Å; C220-R257 PolarHBondContact O-NH1 3.04Å
221C85Confident87.6Confident67 Ų6769.8 Ų69.845%0.45334%0.342SS..  trans-56.8132.1168.6166.30000110.1Q180 Q219 D223Q180-C221 PolarHBondContact NE2-O 3.42Å; Q219-C221 PolarHBondContact O-N 3.04Å; C221-D223 PolarHBondContact SG-OD2 3.49Å
222L87.2Confident87.4Confident5 Ų570 Ų703%0.02634%0.342CS..  trans-107.9-12.1-174.8-59.8-178.1000112.8I214 C220 G224 I225 M226 L254I214-L222 HydrophobicContact CG2-CD2 3.4Å; I214-L222 VanDerWaalsContact CG2-CD2 3.4Å; C220-L222 WeakPolarHBondContact O-CG 3.39Å; C220-L222 PolarHBondContact O-N 3.44Å; L222-G224 PolarHBondContact O-N 3.06Å; L222-I225 HydrophobicContact CD2-CD1 4.42Å; L222-I225 WeakPolarHBondContact O-CA 3.37Å; L222-I225 WeakPolarHBondContact O-CB 3.48Å; L222-I225 PolarHBondContact O-N 3.36Å; L222-M226 HydrophobicContact CB-CG 4.44Å; L222-M226 HydrophobicContact CB-SD 4.21Å; L222-M226 WeakPolarHBondContact O-CG 3.45Å; L222-M226 PolarHBondContact O-N 3.19Å; L222-L254 HydrophobicContact CD1-CB 4.24Å
223D86.7Confident87.4Confident107 Ų10765.7 Ų65.757%0.57233%0.325SS*.Hα-helixtrans-60.4-47.6-167.6-50.4-45.9000111.9C221 I225 M226 K227C221-D223 PolarHBondContact SG-OD2 3.49Å; D223-I225 VanDerWaalsContact C-N 3.27Å; D223-I225 PolarHBondContact O-N 2.85Å; D223-M226 PolarHBondContact O-N 3.2Å; D223-K227 WeakPolarHBondContact O-CB 3.26Å; D223-K227 PolarHBondContact O-N 3.46Å
224G88.1Confident87.3Confident34 Ų3469.5 Ų69.535%0.35135%0.352SS..Hα-helixtrans-64.7-29.8176.600000113.5Q184 L222 C228Q184-G224 PolarHBondContact NE2-O 2.97Å; L222-G224 PolarHBondContact O-N 3.06Å; G224-C228 VanDerWaalsContact O-CB 3.32Å; G224-C228 WeakPolarHBondContact O-CB 3.33Å; G224-C228 PolarHBondContact O-N 3.09Å
225I89.7Confident87.1Confident2 Ų274.5 Ų74.51%0.0137%0.374CS..Hα-helixtrans-75.4-43.4177.8-67.7165.8000109.8Q180 F183 Q184 L187 I214 L222 D223 C228 L229 L250Q180-I225 HydrophobicContact CB-CD1 4.4Å; Q180-I225 HydrophobicContact CG-CD1 4.26Å; F183-I225 HydrophobicContact CD1-CB 4.42Å; F183-I225 HydrophobicContact CD1-CD1 3.85Å; F183-I225 HydrophobicContact CD1-CG1 4.07Å; F183-I225 HydrophobicContact CD1-CG2 3.48Å; F183-I225 VanDerWaalsContact CD1-CG2 3.48Å; F183-I225 HydrophobicContact CE1-CG2 3.48Å; F183-I225 VanDerWaalsContact CE1-CG2 3.48Å; Q184-I225 HydrophobicContact CG-CG1 3.95Å; L187-I225 HydrophobicContact CD1-CG2 4.09Å; I214-I225 HydrophobicContact CD1-CD1 4.11Å; L222-I225 HydrophobicContact CD2-CD1 4.42Å; L222-I225 WeakPolarHBondContact O-CA 3.37Å; L222-I225 WeakPolarHBondContact O-CB 3.48Å; L222-I225 PolarHBondContact O-N 3.36Å; D223-I225 VanDerWaalsContact C-N 3.27Å; D223-I225 PolarHBondContact O-N 2.85Å; I225-C228 WeakPolarHBondContact O-CB 3.42Å; I225-C228 PolarHBondContact O-N 3.34Å; I225-L229 HydrophobicContact CG2-CD1 4.15Å; I225-L229 WeakPolarHBondContact O-CG 3.3Å; I225-L229 PolarHBondContact O-N 2.91Å; I225-L250 HydrophobicContact CG2-CD1 3.91Å
226M89.9Confident86.8Confident30 Ų3074.2 Ų74.215%0.14839%0.385CS..Hα-helixtrans-65.1-46179.7-71.3179.959.800111.2L222 D223 C228 L229 E230 K251 L254L222-M226 HydrophobicContact CB-CG 4.44Å; L222-M226 HydrophobicContact CB-SD 4.21Å; L222-M226 WeakPolarHBondContact O-CG 3.45Å; L222-M226 PolarHBondContact O-N 3.19Å; D223-M226 PolarHBondContact O-N 3.2Å; M226-C228 VanDerWaalsContact C-N 3.27Å; M226-C228 PolarHBondContact O-N 2.9Å; M226-L229 WeakPolarHBondContact O-CB 3.4Å; M226-L229 PolarHBondContact O-N 3.3Å; M226-L229 VanDerWaalsContact O-N 3.09Å; M226-E230 WeakPolarHBondContact O-CG 3.47Å; M226-E230 PolarHBondContact O-N 3.26Å; M226-K251 HydrophobicContact CE-CG 4.01Å; M226-L254 HydrophobicContact CE-CD1 4.4Å; M226-L254 HydrophobicContact SD-CD1 3.67Å
227K91.6Very high86.7Confident160 Ų16066.6 Ų66.670%0.69636%0.359SS*.Hα-helixtrans-58.7-39.6174-172.5175.4-177.9176.40112.4D223 N231D223-K227 WeakPolarHBondContact O-CB 3.26Å; D223-K227 PolarHBondContact O-N 3.46Å; K227-N231 PolarHBondContact O-N 3.34Å
228C90.7Very high87Confident27 Ų2765 Ų6518%0.18236%0.357CS..Hα-helixtrans-63.9-45.3174.8-177.40000111.5G224 I225 M226 N231 I232G224-C228 VanDerWaalsContact O-CB 3.32Å; G224-C228 WeakPolarHBondContact O-CB 3.33Å; G224-C228 PolarHBondContact O-N 3.09Å; I225-C228 WeakPolarHBondContact O-CB 3.42Å; I225-C228 PolarHBondContact O-N 3.34Å; M226-C228 VanDerWaalsContact C-N 3.27Å; M226-C228 PolarHBondContact O-N 2.9Å; C228-N231 PolarHBondContact O-N 3.46Å; C228-I232 WeakPolarHBondContact O-CD1 3.31Å; C228-I232 VanDerWaalsContact O-CG1 3.26Å; C228-I232 WeakPolarHBondContact O-CG1 3.48Å; C228-I232 PolarHBondContact O-N 2.91Å
229L90.2Very high87.6Confident0 Ų062 Ų620%033%0.334CS..Hα-helixtrans-62-42.4176.7-78.9170.2000112.7L187 I225 M226 N231 I232 L233 L243 V246 D247 L250L187-L229 HydrophobicContact CD1-CD1 4.22Å; L187-L229 HydrophobicContact CD1-CD2 3.57Å; L187-L229 HydrophobicContact CD1-CG 3.65Å; L187-L229 HydrophobicContact CD2-CD2 3.67Å; L187-L229 HydrophobicContact CG-CD2 4.11Å; I225-L229 HydrophobicContact CG2-CD1 4.15Å; I225-L229 WeakPolarHBondContact O-CG 3.3Å; I225-L229 PolarHBondContact O-N 2.91Å; M226-L229 WeakPolarHBondContact O-CB 3.4Å; M226-L229 PolarHBondContact O-N 3.3Å; M226-L229 VanDerWaalsContact O-N 3.09Å; L229-N231 PolarHBondContact O-N 2.86Å; L229-I232 PolarHBondContact O-N 3.02Å; L229-L233 VanDerWaalsContact O-CB 3.31Å; L229-L233 WeakPolarHBondContact O-CB 3.13Å; L229-L233 VanDerWaalsContact O-CG 3.25Å; L229-L233 WeakPolarHBondContact O-CG 3.31Å; L229-L233 PolarHBondContact O-N 3.44Å; L229-L243 HydrophobicContact CD2-CD2 4.25Å; L229-V246 HydrophobicContact CD1-CG1 4.33Å; L229-D247 HydrophobicContact CD1-CB 4.48Å; L229-L250 HydrophobicContact CD1-CD1 3.47Å; L229-L250 VanDerWaalsContact CD1-CD1 3.47Å
230E90.8Very high88.2Confident105 Ų10558.4 Ų58.449%0.49131%0.313SS..Hα-helixtrans-60.5-45.1177.9-73.9172.117600111.5M226 I232 L233 S234M226-E230 WeakPolarHBondContact O-CG 3.47Å; M226-E230 PolarHBondContact O-N 3.26Å; E230-I232 VanDerWaalsContact C-N 3.3Å; E230-I232 PolarHBondContact O-N 3.19Å; E230-L233 PolarHBondContact O-N 3.25Å; E230-S234 PolarHBondContact O-N 2.85Å
231N90.7Very high88.7Confident93 Ų9364.2 Ų64.250%0.49734%0.343SS..Hα-helixtrans-65.1-31.5175.7-171.911.4000113K227 C228 L229 S234K227-N231 PolarHBondContact O-N 3.34Å; C228-N231 PolarHBondContact O-N 3.46Å; L229-N231 PolarHBondContact O-N 2.86Å; N231-S234 PolarHBondContact O-OG 2.76Å
232I90.3Very high89Confident17 Ų1762 Ų629%0.08733%0.33CS..Hα-helixtrans-76.9-38.9175.8-65.8164.7000110.8L187 V188 A191 C228 L229 E230 S234 K235 L243L187-I232 HydrophobicContact CB-CD1 3.84Å; V188-I232 HydrophobicContact CG2-CD1 4Å; A191-I232 HydrophobicContact CB-CG2 3.54Å; C228-I232 WeakPolarHBondContact O-CD1 3.31Å; C228-I232 VanDerWaalsContact O-CG1 3.26Å; C228-I232 WeakPolarHBondContact O-CG1 3.48Å; C228-I232 PolarHBondContact O-N 2.91Å; L229-I232 PolarHBondContact O-N 3.02Å; E230-I232 VanDerWaalsContact C-N 3.3Å; E230-I232 PolarHBondContact O-N 3.19Å; I232-S234 VanDerWaalsContact C-N 3.32Å; I232-S234 PolarHBondContact O-N 2.8Å; I232-K235 PolarHBondContact O-N 3.08Å; I232-L243 HydrophobicContact CG2-CD1 3.6Å
233L90.7Very high89.2Confident27 Ų2761.8 Ų61.814%0.14133%0.329CS..Hα-helixtrans-74-21.4-177.6-75.3173.8000113.8L229 E230 R240 L243 K244 D247L229-L233 VanDerWaalsContact O-CB 3.31Å; L229-L233 WeakPolarHBondContact O-CB 3.13Å; L229-L233 VanDerWaalsContact O-CG 3.25Å; L229-L233 WeakPolarHBondContact O-CG 3.31Å; L229-L233 PolarHBondContact O-N 3.44Å; E230-L233 PolarHBondContact O-N 3.25Å; L233-R240 HydrophobicContact CD2-CG 4.25Å; L233-L243 HydrophobicContact CD2-CB 3.83Å; L233-K244 HydrophobicContact CD2-CG 3.82Å; L233-D247 HydrophobicContact CD1-CB 4.04Å
234S89.3Confident89.5Confident94 Ų9461 Ų6166%0.65732%0.321SS*.THydrogen-bonded Turntrans-70.4-21.6170.565.40000112.5E230 N231 I232E230-S234 PolarHBondContact O-N 2.85Å; N231-S234 PolarHBondContact O-OG 2.76Å; I232-S234 VanDerWaalsContact C-N 3.32Å; I232-S234 PolarHBondContact O-N 2.8Å
235K87.2Confident89.7Confident105 Ų10568.1 Ų68.146%0.45734%0.337SS..SBendtrans-95.3151.1176.9-60.1178.8-174.6-178.50111I232 S237I232-K235 PolarHBondContact O-N 3.08Å; K235-S237 PolarHBondContact O-N 3.23Å
236D82.1Confident89.8Confident155 Ų15568.6 Ų68.683%0.82934%0.34SS*.  trans-71.2114.9172-80.7-37.1000110.3
237S85.4Confident89.9Confident21 Ų2167.9 Ų67.915%0.14734%0.336CS..  trans-123.4140.4176.2176.50000110.6A191 K235 Y239 R240A191-S237 WeakPolarHBondContact CA-OG 3.3Å; A191-S237 PolarHBondContact O-OG 3.24Å; K235-S237 PolarHBondContact O-N 3.23Å; S237-Y239 PolarHBondContact O-N 3.26Å; S237-Y239 VanDerWaalsContact O-N 3.14Å; S237-Y239 PolarHBondContact OG-N 2.94Å; S237-R240 WeakPolarHBondContact O-CB 3.36Å; S237-R240 PolarHBondContact O-N 2.9Å; S237-R240 VanDerWaalsContact O-N 3.15Å
238S87.8Confident89.9Confident44 Ų4463.6 Ų63.631%0.30832%0.324SS..THydrogen-bonded Turntrans-50.6-34.3169.752.10000112.9L193 K195L193-S238 PolarHBondContact O-OG 2.82Å; L193-S238 VanDerWaalsContact O-OG 3.07Å; K195-S238 WeakPolarHBondContact CE-O 3.5Å
239Y89.9Confident89.9Confident31 Ų3165.6 Ų65.612%0.12233%0.333CS..THydrogen-bonded Turntrans-101.317.1-175.6-67.4-78.6000114.1L190 L193 P194 K195 A200 S237 N241 A242 L243L190-Y239 HydrophobicContact CD1-CD1 4.02Å; L190-Y239 HydrophobicContact CD1-CD2 3.77Å; L190-Y239 HydrophobicContact CD1-CE1 4.24Å; L190-Y239 HydrophobicContact CD1-CE2 4Å; L190-Y239 HydrophobicContact CD1-CG 3.78Å; L190-Y239 HydrophobicContact CD2-CG 4.32Å; L190-Y239 HydrophobicContact CG-CD1 4.48Å; L190-Y239 HydrophobicContact CG-CD2 3.98Å; L190-Y239 HydrophobicContact CG-CG 3.88Å; L190-Y239 WeakPolarHBondContact O-CD2 3.12Å; L193-Y239 HydrophobicContact CB-CE2 4.27Å; L193-Y239 WeakPolarHBondContact O-CE2 3.42Å; P194-Y239 PolarHBondContact O-OH 3.45Å; K195-Y239 WeakPolarHBondContact CA-OH 3.18Å; A200-Y239 HydrophobicContact CB-CE2 4.2Å; A200-Y239 WeakPolarHBondContact CB-OH 3.34Å; S237-Y239 PolarHBondContact O-N 3.26Å; S237-Y239 VanDerWaalsContact O-N 3.14Å; S237-Y239 PolarHBondContact OG-N 2.94Å; Y239-N241 VanDerWaalsContact C-N 3.26Å; Y239-N241 PolarHBondContact O-N 3.2Å; Y239-N241 VanDerWaalsContact O-N 3.09Å; Y239-A242 WeakPolarHBondContact O-CA 3.43Å; Y239-A242 WeakPolarHBondContact O-CB 3.5Å; Y239-A242 PolarHBondContact O-N 3.06Å; Y239-L243 PolarHBondContact O-N 2.97Å
240R88.8Confident89.9Confident102 Ų10265.6 Ų65.639%0.38533%0.333SS..Hα-helixtrans-48-42.9-177-169.8176.1-173.1-164.4-0.1114L233 S237 L243 K244L233-R240 HydrophobicContact CD2-CG 4.25Å; S237-R240 WeakPolarHBondContact O-CB 3.36Å; S237-R240 PolarHBondContact O-N 2.9Å; S237-R240 VanDerWaalsContact O-N 3.15Å; R240-L243 PolarHBondContact O-N 3.18Å; R240-K244 HydrophobicContact CG-CD 4.47Å; R240-K244 WeakPolarHBondContact O-CB 3.42Å; R240-K244 VanDerWaalsContact O-CG 3.32Å; R240-K244 WeakPolarHBondContact O-CG 3.48Å; R240-K244 PolarHBondContact O-N 2.94Å
241N91Very high89.9Confident122 Ų12264.9 Ų64.965%0.65233%0.328SS*.Hα-helixtrans-66.5-37.8178.9-70.1-18.7000113.1Y239 R245Y239-N241 VanDerWaalsContact C-N 3.26Å; Y239-N241 PolarHBondContact O-N 3.2Å; Y239-N241 VanDerWaalsContact O-N 3.09Å; N241-R245 WeakPolarHBondContact O-CG 3.46Å; N241-R245 PolarHBondContact O-N 3.33Å
242A91.1Very high89.9Confident21 Ų2167.3 Ų67.317%0.17433%0.33CS..Hα-helixtrans-69.4-42.8175.800000110.8L204 Y239 R245 V246L204-A242 HydrophobicContact CD1-CB 3.85Å; Y239-A242 WeakPolarHBondContact O-CA 3.43Å; Y239-A242 WeakPolarHBondContact O-CB 3.5Å; Y239-A242 PolarHBondContact O-N 3.06Å; A242-R245 WeakPolarHBondContact O-CB 3.31Å; A242-R245 PolarHBondContact O-N 3.27Å; A242-R245 VanDerWaalsContact O-N 3.15Å; A242-V246 PolarHBondContact O-N 3.32Å
243L91.9Very high89.8Confident1 Ų167 Ų671%0.00533%0.329CS..Hα-helixtrans-64-40.7176.7-67.9170.1000112.2L187 L190 L229 I232 L233 Y239 R240 R245 V246 D247L187-L243 HydrophobicContact CD2-CD2 3.77Å; L190-L243 HydrophobicContact CD2-CD2 4.04Å; L190-L243 HydrophobicContact CD2-CG 4.4Å; L229-L243 HydrophobicContact CD2-CD2 4.25Å; I232-L243 HydrophobicContact CG2-CD1 3.6Å; L233-L243 HydrophobicContact CD2-CB 3.83Å; Y239-L243 PolarHBondContact O-N 2.97Å; R240-L243 PolarHBondContact O-N 3.18Å; L243-R245 VanDerWaalsContact C-N 3.3Å; L243-R245 PolarHBondContact O-N 3.33Å; L243-V246 WeakPolarHBondContact O-CB 3.48Å; L243-V246 PolarHBondContact O-N 3.16Å; L243-V246 VanDerWaalsContact O-N 3.08Å; L243-D247 PolarHBondContact O-N 2.87Å
244K92.2Very high89.7Confident91 Ų9167.8 Ų67.840%0.39633%0.333SS..Hα-helixtrans-59.5-38.1171.4-76.8-179.1177.4-176.10112.4L233 R240 V246 D247 T248L233-K244 HydrophobicContact CD2-CG 3.82Å; R240-K244 HydrophobicContact CG-CD 4.47Å; R240-K244 WeakPolarHBondContact O-CB 3.42Å; R240-K244 VanDerWaalsContact O-CG 3.32Å; R240-K244 WeakPolarHBondContact O-CG 3.48Å; R240-K244 PolarHBondContact O-N 2.94Å; K244-V246 VanDerWaalsContact C-N 3.34Å; K244-D247 PolarHBondContact O-N 2.86Å; K244-T248 WeakPolarHBondContact O-CB 3.43Å; K244-T248 WeakPolarHBondContact O-CG2 3.36Å; K244-T248 PolarHBondContact O-N 3.05Å; K244-T248 PolarHBondContact O-OG1 2.65Å
245R92.2Very high89.6Confident183 Ų18365.6 Ų65.669%0.69132%0.321SS*.Hα-helixtrans-65.7-37.3173.9-72173.4-179.7-178.50.6111.6N241 A242 L243 T248 N249N241-R245 WeakPolarHBondContact O-CG 3.46Å; N241-R245 PolarHBondContact O-N 3.33Å; A242-R245 WeakPolarHBondContact O-CB 3.31Å; A242-R245 PolarHBondContact O-N 3.27Å; A242-R245 VanDerWaalsContact O-N 3.15Å; L243-R245 VanDerWaalsContact C-N 3.3Å; L243-R245 PolarHBondContact O-N 3.33Å; R245-T248 WeakPolarHBondContact CA-OG1 3.36Å; R245-T248 PolarHBondContact O-OG1 2.74Å; R245-N249 WeakPolarHBondContact O-CB 3.49Å; R245-N249 PolarHBondContact O-N 3.35Å; R245-N249 PolarHBondContact O-ND2 3.09Å
246V92.1Very high89.6Confident11 Ų1165.2 Ų65.27%0.06732%0.324CS..Hα-helixtrans-66.2-48.9175.1174.10000110.3F183 L187 I207 L229 A242 L243 K244 T248 N249 L250F183-V246 HydrophobicContact CE1-CG1 4.35Å; F183-V246 HydrophobicContact CZ-CG1 3.72Å; L187-V246 HydrophobicContact CD2-CG1 4.39Å; I207-V246 HydrophobicContact CG2-CG2 3.75Å; L229-V246 HydrophobicContact CD1-CG1 4.33Å; A242-V246 PolarHBondContact O-N 3.32Å; L243-V246 WeakPolarHBondContact O-CB 3.48Å; L243-V246 PolarHBondContact O-N 3.16Å; L243-V246 VanDerWaalsContact O-N 3.08Å; K244-V246 VanDerWaalsContact C-N 3.34Å; V246-T248 PolarHBondContact O-N 3.31Å; V246-N249 PolarHBondContact O-N 2.78Å; V246-N249 VanDerWaalsContact O-N 3.16Å; V246-L250 HydrophobicContact CG1-CD1 3.82Å; V246-L250 HydrophobicContact CG1-CG 4.35Å; V246-L250 WeakPolarHBondContact O-CG 3.38Å; V246-L250 PolarHBondContact O-N 3.3Å
247D91.5Very high89.7Confident15 Ų1560.5 Ų60.58%0.0829%0.294CS..Hα-helixtrans-54.9-51.7177.5177.659.9000112.3L229 L233 L243 K244 N249 L250 K251L229-D247 HydrophobicContact CD1-CB 4.48Å; L233-D247 HydrophobicContact CD1-CB 4.04Å; L243-D247 PolarHBondContact O-N 2.87Å; K244-D247 PolarHBondContact O-N 2.86Å; D247-N249 VanDerWaalsContact C-N 3.3Å; D247-N249 PolarHBondContact O-N 3.39Å; D247-L250 PolarHBondContact O-N 3.17Å; D247-L250 VanDerWaalsContact O-N 3.12Å; D247-K251 WeakPolarHBondContact O-CG 3.43Å; D247-K251 PolarHBondContact O-N 3.23Å; D247-K251 WeakPolarHBondContact OD1-CE 3.47Å; D247-K251 IonicContact OD1-NZ 3.31Å; D247-K251 PolarHBondContact OD1-NZ 2.83Å; D247-K251 WeakPolarHBondContact OD2-CE 3.46Å; D247-K251 IonicContact OD2-NZ 2.76Å; D247-K251 PolarHBondContact OD2-NZ 3.42Å
248T92.5Very high89.7Confident71 Ų7164.8 Ų64.844%0.43631%0.312SS..Hα-helixtrans-60.3-36.8177.449.10000113.3K244 R245 V246 R252K244-T248 WeakPolarHBondContact O-CB 3.43Å; K244-T248 WeakPolarHBondContact O-CG2 3.36Å; K244-T248 PolarHBondContact O-N 3.05Å; K244-T248 PolarHBondContact O-OG1 2.65Å; R245-T248 WeakPolarHBondContact CA-OG1 3.36Å; R245-T248 PolarHBondContact O-OG1 2.74Å; V246-T248 PolarHBondContact O-N 3.31Å; T248-R252 WeakPolarHBondContact O-CB 3.29Å; T248-R252 PolarHBondContact O-N 3.12Å; T248-R252 VanDerWaalsContact O-N 3.08Å
249N90.8Very high89.4Confident68 Ų6865.7 Ų65.736%0.36432%0.322SS..Hα-helixtrans-70.5-35.8175.8-79.3-56.4000112.5T211 R245 V246 D247 R252 T253T211-N249 HydrophobicContact CG2-CB 4.25Å; R245-N249 WeakPolarHBondContact O-CB 3.49Å; R245-N249 PolarHBondContact O-N 3.35Å; R245-N249 PolarHBondContact O-ND2 3.09Å; V246-N249 PolarHBondContact O-N 2.78Å; V246-N249 VanDerWaalsContact O-N 3.16Å; D247-N249 VanDerWaalsContact C-N 3.3Å; D247-N249 PolarHBondContact O-N 3.39Å; N249-R252 PolarHBondContact OD1-NH1 3.07Å; N249-R252 VanDerWaalsContact OD1-NH1 3.1Å; N249-T253 WeakPolarHBondContact O-CB 3.28Å; N249-T253 PolarHBondContact O-N 3.31Å; N249-T253 PolarHBondContact O-OG1 3.06Å
250L90.3Very high88.9Confident1 Ų168.7 Ų68.71%0.00534%0.344CS..Hα-helixtrans-71.2-44.6176.7-69171.1000111.5F183 T211 I214 I225 L229 V246 D247 R252 T253 L254F183-L250 HydrophobicContact CE1-CD1 3.9Å; F183-L250 HydrophobicContact CZ-CD1 4.35Å; T211-L250 HydrophobicContact CG2-CD2 4.24Å; T211-L250 HydrophobicContact CG2-CG 4.5Å; I214-L250 HydrophobicContact CG2-CD2 4.19Å; I225-L250 HydrophobicContact CG2-CD1 3.91Å; L229-L250 HydrophobicContact CD1-CD1 3.47Å; L229-L250 VanDerWaalsContact CD1-CD1 3.47Å; V246-L250 HydrophobicContact CG1-CD1 3.82Å; V246-L250 HydrophobicContact CG1-CG 4.35Å; V246-L250 WeakPolarHBondContact O-CG 3.38Å; V246-L250 PolarHBondContact O-N 3.3Å; D247-L250 PolarHBondContact O-N 3.17Å; D247-L250 VanDerWaalsContact O-N 3.12Å; L250-R252 VanDerWaalsContact C-N 3.33Å; L250-R252 PolarHBondContact O-N 2.79Å; L250-T253 CarbonylContact O-C 3.59Å; L250-T253 WeakPolarHBondContact O-CA 3.19Å; L250-T253 VanDerWaalsContact O-CB 3.28Å; L250-T253 WeakPolarHBondContact O-CB 3.36Å; L250-T253 PolarHBondContact O-N 2.74Å; L250-L254 PolarHBondContact O-N 3.38Å
251K90.3Very high88Confident89 Ų8966.9 Ų66.939%0.38735%0.347SS..Hα-helixtrans-57.7-44.1173.4-74.5174.2176162.20112.2M226 D247 T253 L254 A255M226-K251 HydrophobicContact CE-CG 4.01Å; D247-K251 WeakPolarHBondContact O-CG 3.43Å; D247-K251 PolarHBondContact O-N 3.23Å; D247-K251 WeakPolarHBondContact OD1-CE 3.47Å; D247-K251 IonicContact OD1-NZ 3.31Å; D247-K251 PolarHBondContact OD1-NZ 2.83Å; D247-K251 WeakPolarHBondContact OD2-CE 3.46Å; D247-K251 IonicContact OD2-NZ 2.76Å; D247-K251 PolarHBondContact OD2-NZ 3.42Å; K251-T253 VanDerWaalsContact C-N 3.28Å; K251-T253 PolarHBondContact O-N 2.64Å; K251-L254 PolarHBondContact O-N 3.32Å; K251-A255 PolarHBondContact O-N 3.34Å
252R90.6Very high86.7Confident145 Ų14565.2 Ų65.255%0.54734%0.341SS..Hα-helixtrans-60.8-38.3172.8-171.8-175.4-64.1126.8-0.7112.1T248 N249 L250 N256T248-R252 WeakPolarHBondContact O-CB 3.29Å; T248-R252 PolarHBondContact O-N 3.12Å; T248-R252 VanDerWaalsContact O-N 3.08Å; N249-R252 PolarHBondContact OD1-NH1 3.07Å; N249-R252 VanDerWaalsContact OD1-NH1 3.1Å; L250-R252 VanDerWaalsContact C-N 3.33Å; L250-R252 PolarHBondContact O-N 2.79Å; R252-N256 WeakPolarHBondContact O-CB 3.32Å; R252-N256 PolarHBondContact O-N 3.37Å; R252-N256 VanDerWaalsContact O-N 3.08Å; R252-N256 PolarHBondContact O-OD1 3.03Å
253T88Confident85.3Confident10 Ų1067 Ų676%0.06136%0.356CS..Hα-helixtrans-65.9-40.8177.6-58.70000111.2R215 N249 L250 K251 N256 R257R215-T253 HydrophobicContact CB-CG2 4.3Å; R215-T253 HydrophobicContact CG-CG2 4.16Å; N249-T253 WeakPolarHBondContact O-CB 3.28Å; N249-T253 PolarHBondContact O-N 3.31Å; N249-T253 PolarHBondContact O-OG1 3.06Å; L250-T253 CarbonylContact O-C 3.59Å; L250-T253 WeakPolarHBondContact O-CA 3.19Å; L250-T253 VanDerWaalsContact O-CB 3.28Å; L250-T253 WeakPolarHBondContact O-CB 3.36Å; L250-T253 PolarHBondContact O-N 2.74Å; K251-T253 VanDerWaalsContact C-N 3.28Å; K251-T253 PolarHBondContact O-N 2.64Å; T253-N256 PolarHBondContact O-N 2.87Å; T253-R257 WeakPolarHBondContact O-CG 3.47Å; T253-R257 PolarHBondContact O-N 2.93Å
254L87.9Confident83.8Confident43 Ų4371.9 Ų71.923%0.22539%0.386CS..Hα-helixtrans-64.6-49.9177-173.5150.5000111.2L222 M226 L250 K251 N256 R257 E258L222-L254 HydrophobicContact CD1-CB 4.24Å; M226-L254 HydrophobicContact CE-CD1 4.4Å; M226-L254 HydrophobicContact SD-CD1 3.67Å; L250-L254 PolarHBondContact O-N 3.38Å; K251-L254 PolarHBondContact O-N 3.32Å; L254-N256 VanDerWaalsContact C-N 3.27Å; L254-N256 PolarHBondContact O-N 3.46Å; L254-R257 WeakPolarHBondContact O-CA 3.39Å; L254-R257 WeakPolarHBondContact O-CB 3.4Å; L254-R257 PolarHBondContact O-N 3.37Å; L254-E258 VanDerWaalsContact CD2-CD 3.46Å; L254-E258 HydrophobicContact CD2-CG 4.27Å; L254-E258 WeakPolarHBondContact CD2-OE1 3.46Å; L254-E258 PolarHBondContact O-N 2.87Å; L254-E258 VanDerWaalsContact O-N 3.08Å
255A88Confident81.7Confident48 Ų4874 Ų7440%0.39740%0.402SS..Hα-helixtrans-57.2-38.8176.500000112.7K251 R257 E258 A259K251-A255 PolarHBondContact O-N 3.34Å; A255-R257 VanDerWaalsContact C-N 3.32Å; A255-R257 PolarHBondContact O-N 3.4Å; A255-E258 PolarHBondContact O-N 3.21Å; A255-A259 WeakPolarHBondContact O-CB 3.43Å; A255-A259 PolarHBondContact O-N 3.45Å
256N86.8Confident79.8Confident97 Ų9772.9 Ų72.952%0.51940%0.404SS..Hα-helixtrans-67.1-31.2175.7-70.9-4.1000113R252 T253 L254 T260R252-N256 WeakPolarHBondContact O-CB 3.32Å; R252-N256 PolarHBondContact O-N 3.37Å; R252-N256 VanDerWaalsContact O-N 3.08Å; R252-N256 PolarHBondContact O-OD1 3.03Å; T253-N256 PolarHBondContact O-N 2.87Å; L254-N256 VanDerWaalsContact C-N 3.27Å; L254-N256 PolarHBondContact O-N 3.46Å; N256-T260 PolarHBondContact O-N 3.24Å; N256-T260 PolarHBondContact O-OG1 3.26Å
257R85Confident77.4Confident56 Ų5680.6 Ų80.621%0.21144%0.439CS..Hα-helixtrans-71.3-43.5176.9-71.3172.8-176.2-176.40.9110.9I214 H217 P218 C220 T253 L254 A255 T260 S261I214-R257 PolarHBondContact O-NH2 2.91Å; H217-R257 PolarHBondContact O-NH2 2.77Å; P218-R257 VanDerWaalsContact O-CZ 3.3Å; P218-R257 PolarHBondContact O-NH1 3.18Å; P218-R257 VanDerWaalsContact O-NH1 3.15Å; C220-R257 PolarHBondContact O-NH1 3.04Å; T253-R257 WeakPolarHBondContact O-CG 3.47Å; T253-R257 PolarHBondContact O-N 2.93Å; L254-R257 WeakPolarHBondContact O-CA 3.39Å; L254-R257 WeakPolarHBondContact O-CB 3.4Å; L254-R257 PolarHBondContact O-N 3.37Å; A255-R257 VanDerWaalsContact C-N 3.32Å; A255-R257 PolarHBondContact O-N 3.4Å; R257-T260 PolarHBondContact O-N 3.46Å; R257-T260 VanDerWaalsContact O-N 3.16Å; R257-S261 PolarHBondContact O-N 3.48Å
258E84Confident74.5Confident111 Ų11185.9 Ų85.952%0.51947%0.472SS..Hα-helixtrans-62.5-42.8176.2-66.2172.6161.400111.8L254 A255 T260 S261 V262L254-E258 VanDerWaalsContact CD2-CD 3.46Å; L254-E258 HydrophobicContact CD2-CG 4.27Å; L254-E258 WeakPolarHBondContact CD2-OE1 3.46Å; L254-E258 PolarHBondContact O-N 2.87Å; L254-E258 VanDerWaalsContact O-N 3.08Å; A255-E258 PolarHBondContact O-N 3.21Å; E258-T260 PolarHBondContact O-N 3.31Å; E258-S261 PolarHBondContact O-N 3.16Å; E258-S261 PolarHBondContact O-OG 3.08Å; E258-V262 WeakPolarHBondContact O-CG2 3.25Å; E258-V262 PolarHBondContact O-N 3.35Å; E258-V262 VanDerWaalsContact O-N 3.13Å
259A83.3Confident71.7Confident64 Ų6487.6 Ų87.653%0.52948%0.484SS..Hα-helixtrans-62.3-30.9175.100000112.9A255 A263A255-A259 WeakPolarHBondContact O-CB 3.43Å; A255-A259 PolarHBondContact O-N 3.45Å; A259-A263 PolarHBondContact O-N 2.89Å
260T78.5Confident69.1Low94 Ų9489.8 Ų89.858%0.57750%0.5SS*.Hα-helixtrans-77.3-36.9178.3-51.40000111.5N256 R257 E258 A263 T264N256-T260 PolarHBondContact O-N 3.24Å; N256-T260 PolarHBondContact O-OG1 3.26Å; R257-T260 PolarHBondContact O-N 3.46Å; R257-T260 VanDerWaalsContact O-N 3.16Å; E258-T260 PolarHBondContact O-N 3.31Å; T260-A263 PolarHBondContact O-N 3.34Å; T260-T264 PolarHBondContact O-N 3.26Å; T260-T264 PolarHBondContact O-OG1 2.94Å
261S69Low66.5Low63 Ų6398.7 Ų98.744%0.44155%0.547SS..Hα-helixtrans-65.9-42.6175.952.90000111.9R257 E258 A263 T264 D265R257-S261 PolarHBondContact O-N 3.48Å; E258-S261 PolarHBondContact O-N 3.16Å; E258-S261 PolarHBondContact O-OG 3.08Å; S261-A263 VanDerWaalsContact C-N 3.31Å; S261-A263 PolarHBondContact O-N 3.12Å; S261-T264 PolarHBondContact O-N 3.13Å; S261-T264 VanDerWaalsContact O-N 3.09Å; S261-D265 PolarHBondContact O-N 3.46Å
262V65.4Low63.6Low87 Ų8799.4 Ų99.453%0.52756%0.562SS.*Hα-helixtrans-61.9-38.7178.5176.40000111.9E258 T264 D265E258-V262 WeakPolarHBondContact O-CG2 3.25Å; E258-V262 PolarHBondContact O-N 3.35Å; E258-V262 VanDerWaalsContact O-N 3.13Å; V262-T264 PolarHBondContact O-N 3.09Å; V262-D265 PolarHBondContact O-N 3.29Å
263A61Low61Low59 Ų5998.5 Ų98.549%0.48857%0.573SS.*Hα-helixtrans-68.9-17.117800000114.2A259 T260 S261A259-A263 PolarHBondContact O-N 2.89Å; T260-A263 PolarHBondContact O-N 3.34Å; S261-A263 VanDerWaalsContact C-N 3.31Å; S261-A263 PolarHBondContact O-N 3.12Å
264T59.3Low58.6Low103 Ų103106.4 Ų106.463%0.63261%0.609SS**Hα-helixtrans-90.7-24.9-179.2-33.90000111.9T260 S261 V262T260-T264 PolarHBondContact O-N 3.26Å; T260-T264 PolarHBondContact O-OG1 2.94Å; S261-T264 PolarHBondContact O-N 3.13Å; S261-T264 VanDerWaalsContact O-N 3.09Å; V262-T264 PolarHBondContact O-N 3.09Å
265D49.5Very low56.2Low137 Ų137110.2 Ų110.273%0.73364%0.639SS**Hα-helixtrans-86.4-14.4179.2-72.9-27.3000113.6S261 V262S261-D265 PolarHBondContact O-N 3.46Å; V262-D265 PolarHBondContact O-N 3.29Å
266E50.9Low53.7Low159 Ų159114 Ų11474%0.74366%0.662SS**THydrogen-bonded Turntrans-88.77.1178.3-75.2-171.6159.600115
267Q41.7Very low51.4Low172 Ų172114.6 Ų114.680%0.80467%0.672SS**SBendtrans-113.241.6178.7-72.4-173800114.5
268V32.3Very low49.1Very low126 Ų126120.8 Ų120.876%0.76470%0.703SS**  trans-155.2108.9158.1-177.80000106.8
269P33.6Very low46.9Very low108 Ų108120.7 Ų120.770%0.70171%0.71SS**  -155.3141.792.131.5-8.4000117.5
270T34.7Very low44.6Very low113 Ų113123 Ų12369%0.69372%0.718SS**  trans63.896.6130.2-45.30000118.9C272T270-C272 HydrophobicContact CG2-CB 4.14Å
271L35.7Very low42.6Very low188 Ų188124.5 Ų124.598%0.98472%0.722SS**  trans-99.995.9145.6-81.7167.2000108.6
272C29.8Very low41.1Very low104 Ų104128.3 Ų128.370%0.70374%0.736SS**  trans-126124.1159.3-70.70000106.3T270T270-C272 HydrophobicContact CG2-CB 4.14Å
273T37Very low39.8Very low127 Ų127130 Ų13078%0.77975%0.746SS**  trans176.9104.3136.5-60.50000109.1
274E36.3Very low38.4Very low176 Ų176132 Ų13282%0.82276%0.755SS**  trans49114.8136.2-54.5177.3170.300122.3
275S38.8Very low37.3Very low122 Ų122134.7 Ų134.785%0.85377%0.765SS**  -174.6115.1114.933.70000112.7
276S35.2Very low36.5Very low127 Ų127133 Ų13389%0.88876%0.76SS**  trans16.6158.6152.7-97.70000125.6
277P38.8Very low35.6Very low110 Ų110130.1 Ų130.171%0.71476%0.757SS**  trans-120.4171.1-144.243.6-31.7000115.3
278E36.6Very low35.3Very low186 Ų186127.7 Ų127.787%0.86975%0.749SS**  trans-169104.3145.9-106.5171.5-174.400108.3
279T36.7Very low35.2Very low110 Ų110127.8 Ų127.868%0.67575%0.745SS**  104.7127.181-42.50000111.6
280T35Very low35.4Very low113 Ų113130.9 Ų130.969%0.69376%0.755SS**  trans67.2134.8155.447.10000117.9
281N36.5Very low35.1Very low124 Ų124130.7 Ų130.766%0.66376%0.758SS**  cis-173.7147.117.6-106.8-21.7000109.2
282I38.8Very low35.3Very low143 Ų143126.7 Ų126.773%0.73375%0.746SS**  trans58.7131.8130.2-57.3169.4000117.6
283V37Very low35.6Very low122 Ų122130.9 Ų130.974%0.73976%0.755SS**  cis-172.6153.25137.80000105.7
284P33.1Very low35.4Very low103 Ų103128.5 Ų128.567%0.66976%0.756SS**  trans-100.9160.7-178.538.3-32000113.7
285N36.1Very low35.3Very low159 Ų159123.8 Ų123.885%0.8576%0.755SS**  trans157.8151.4156-86.7-14.2000108.8
286T32.9Very low35.3Very low100 Ų100124.4 Ų124.461%0.61376%0.756SS**  cis178.3145.1-6-80.30000105.6
287C31.7Very low35.5Very low100 Ų100124.1 Ų124.168%0.67675%0.754SS**  trans62.4155.6157.1-75.50000118.1
288D34.3Very low35.1Very low120 Ų120127.7 Ų127.764%0.64276%0.761SS**  cis-168.4154.6-2-106.5-26000106.6
289N31.8Very low35.1Very low129 Ų129125.8 Ų125.869%0.6976%0.756SS**  trans44.7126144.5-54.9-39.2000120.4
290L36.3Very low35.1Very low172 Ų172129.1 Ų129.190%0.90176%0.761SS**  171.9147.5104.6-87.9162.2000111.9
291S30Very low34.9Very low110 Ų110130.1 Ų130.177%0.76976%0.761SS**  trans-67.3165.4-174.9-46.30000115
292S37.8Very low35Very low104 Ų104128 Ų12873%0.72777%0.769SS**  116.1123.4129.4-148.50000118.1
293E36.2Very low34.7Very low191 Ų191130.2 Ų130.289%0.89377%0.773SS**  trans74.5134.2142.6-65.8-92.2138.400121.1
294G34.3Very low34.7Very low77 Ų77134 Ų13479%0.79478%0.78SS**  trans144.3109.3156.500000115.5
295G33.7Very low34.8Very low78 Ų78139 Ų13980%0.80479%0.791SS**  trans-74-168.8-176.600000117.9
296P38.3Very low34.5Very low134 Ų134139 Ų13987%0.8779%0.789SS**  trans-107.1165.9-143.539.8-34.9000115.6
297S38.8Very low34.6Very low122 Ų122139.4 Ų139.485%0.85379%0.793SS**  trans-152.6131.8162.343.20000112.8
298E30.5Very low34.7Very low184 Ų184143.4 Ų143.486%0.8680%0.799SS**  trans-62.8158.9178.9-56.9176129.100113.8
299L37.3Very low34.5Very low147 Ų147143.6 Ų143.677%0.7781%0.805SS**  trans-174.6114.1132.5-97.4152.2000111.8
300K36.7Very low34.6Very low179 Ų179147.5 Ų147.578%0.77882%0.816SS**  trans38.6152.5132.7-62.9-179.9-172.7171.50120.4
301I31.8Very low34.2Very low135 Ų135148.3 Ų148.369%0.69281%0.812SS**  cis-176.4144-7.4-98.7162.7000103.7
302G37.5Very low34.3Very low80 Ų80153.7 Ų153.783%0.82582%0.815SS**  trans-160.4111164.500000112.8
303K33.6Very low34Very low189 Ų189157.4 Ų157.482%0.82282%0.818SS**  trans-89.2148.1-165.6-64.7168.7174.6169.10114.1
304K35.5Very low33.4Very low201 Ų201158.2 Ų158.287%0.87482%0.819SS**  trans173.5103.4130.3-98.2168.2-179.9177.90110.1
305K35.1Very low33.3Very low209 Ų209160 Ų16091%0.90982%0.817SS**  84109.190-83.6-167.6177.4-175.80115.9
306I30.3Very low33.3Very low159 Ų159164.1 Ų164.182%0.81582%0.817SS**  trans-68.7163.3171.9-49.8155.7000108.6
307P34.4Very low32.8Very low107 Ų107164.5 Ų164.570%0.69582%0.816SS**  -166.7177.564.944.8-18.4000123.9
308K34.4Very low32.7Very low185 Ų185167.7 Ų167.780%0.80482%0.815SS**  trans101.396.3155-63.3177.2-177.3176.40116.8
309V30.2Very low32.6Very low124 Ų124167.7 Ų167.775%0.75281%0.812SS**  75.9105.786.7174.10000113.2
310F33.6Very low32.3Very low211 Ų211172.7 Ų172.793%0.92582%0.821SS**  trans-150.2113.1136.5-102.9-78.3000109.6
311K28.9Very low31.8Very low188 Ų188171.2 Ų171.282%0.81782%0.82SS**  trans-79.1141.6168-66176.8176.3177.20108.3
312R31.4Very low31.7Very low224 Ų224170.8 Ų170.885%0.84583%0.828SS**  trans-179.7124.9130.8-99.1164.3173.2-172.2-0.8114.3
313K31.1Very low31.5Very low181 Ų181171.1 Ų171.179%0.78782%0.823SS**  trans74.2101.7141.3-63-177.7177.9-1730120.4
314K24.9Very low31.1Very low208 Ų208171 Ų17190%0.90483%0.825SS**  trans-74.8152.2138.4-75.7179.7175.31770109.3
315P31.3Very low30.9Very low116 Ų116168 Ų16875%0.75382%0.824SS**  trans-142.6151131.234.5-18.6000116.1
316M32.8Very low30.7Very low164 Ų164162.4 Ų162.481%0.80881%0.811SS**  trans63.4101.3145.8-71.8-178.394.800121
317V29.3Very low30.7Very low141 Ų141161.9 Ų161.986%0.85581%0.81SS**  trans-60.5123.7143.5175.20000109
318K35.1Very low30.4Very low190 Ų190162.4 Ų162.483%0.82681%0.814SS**  trans-102.1111.5164.2-106.2-179.4179175.90109.2
319K28.6Very low30.4Very low183 Ų183160.4 Ų160.480%0.79682%0.817SS**  trans-64.7126.7169.5-149.6171.7-174.6176.50108.4
320R31.7Very low30.2Very low253 Ų253162 Ų16296%0.95582%0.821SS**  trans-125.9114.8155.1-102.8-174.3-178.6173.10.2108
321L27.2Very low30.1Very low147 Ų147156 Ų15677%0.7781%0.81SS**  trans-84135.9170.4-13587.7000107.7
322C29.7Very low30.2Very low126 Ų126156.2 Ų156.285%0.85181%0.814SS**  trans-159.199.1146-88.30000104.5
323A32Very low29.9Very low87 Ų87154.9 Ų154.972%0.71982%0.815SS**  56.983.498.200000111.2
324E25.8Very low29.8Very low187 Ų187152 Ų15287%0.87482%0.818SS**  65.6105.694.5-82.5-176.3170.300114.4
325T30.7Very low29.9Very low138 Ų138149.3 Ų149.385%0.84781%0.813SS**  -161.499.4126.50.50000110.3
326S31Very low30Very low91 Ų91152.4 Ų152.464%0.63682%0.817SS**  trans11122.6142.557.30000120.2
327N29.7Very low29.7Very low149 Ų149148.8 Ų148.880%0.79781%0.813SS**  170.6121.7105.4-86.5-21.9000111.4
328P28.9Very low29.9Very low118 Ų118148.8 Ų148.877%0.76681%0.809SS**  trans-100.9137.6161.334.5-23.6000110.4
329V34.2Very low29.8Very low143 Ų143144 Ų14487%0.86780%0.799SS**  trans-120.8111.5163.5177.70000108
330N26.3Very low29.7Very low158 Ų158144.2 Ų144.285%0.84580%0.801SS**  trans-69.9140.2161.2-70.6-32000109.5
331A32.2Very low29.8Very low84 Ų84138.8 Ų138.869%0.69480%0.795SS**  trans-172.995.3147.200000106.1
332E29.5Very low29.8Very low193 Ų193139.3 Ų139.390%0.90279%0.794SS**  86.1110.2101.6-82.7-178.4168.800112.9
333F25.4Very low29.9Very low196 Ų196142.8 Ų142.886%0.8680%0.797SS**  trans-58.1136.9160.8-94.1-103000110
334S30.5Very low29.9Very low121 Ų121143.4 Ų143.485%0.84680%0.797SS**  trans-141.7120.3148.5-84.10000109.1
335N26.6Very low29.8Very low150 Ų150140.8 Ų140.880%0.80280%0.798SS**  trans-64.8135.7171.3-64.1-48.8000109.2
336Q32.8Very low29.9Very low181 Ų181139.7 Ų139.785%0.84679%0.793SS**  trans-142.4109.8151.6-150.4158.720.200108.7
337A27.3Very low29.9Very low88 Ų88145 Ų14573%0.72780%0.804SS**  trans-82.2137.7165.200000108.2
338D32.9Very low29.7Very low141 Ų141148.4 Ų148.475%0.75481%0.806SS**  trans-157.997.4156.3-86.7-31.7000105
339S32Very low29.8Very low91 Ų91152 Ų15264%0.63682%0.815SS**  78.8111.787.974.10000113.5
340F27.5Very low29.4Very low187 Ų187153.4 Ų153.482%0.8281%0.809SS**  trans45.3132.2142.2-75.1-98.3000118.6
341V33.3Very low29.7Very low139 Ų139150.8 Ų150.884%0.84280%0.804SS**  -154.5132.378.4162.60000110.6
342E27.5Very low29.6Very low157 Ų157155.5 Ų155.573%0.73481%0.811SS**  trans-64.2142.2164.6-70.917412700111.4
343E32.8Very low29.5Very low199 Ų199153.6 Ų153.693%0.9381%0.806SS**  trans-141.5133.4147.8-151.6169.3-165.800111.3
344S31.1Very low29.6Very low101 Ų101150.3 Ų150.371%0.70681%0.807SS**  trans-90.5146.6-157.7-52.50000112.9
345C23.5Very low29.3Very low132 Ų132150.8 Ų150.889%0.89281%0.805SS**  trans-67.2155.1160.8-87.40000111.4
346P32.1Very low29.5Very low115 Ų115153 Ų15375%0.74781%0.81SS**  trans-131.5130.4141.732.1-16.9000115.1
347K32.2Very low29.2Very low201 Ų201149.6 Ų149.687%0.87481%0.807SS**  60.498.9127.8-64.5178.1179.6176.20120.5
348R24.3Very low29.4Very low221 Ų221149.7 Ų149.783%0.83481%0.808SS**  -0.4124.9127.4-159.8179.3-157.8177.46116.9
349M31.7Very low29.1Very low194 Ų194150.9 Ų150.996%0.95681%0.814SS**  trans-131.3131.7153.9-132.9168.6166.800108.7
350K25.5Very low28.9Very low172 Ų172155.1 Ų155.175%0.74882%0.824SS**  trans-95.9144.7178.7-78.7176.2170.4-178.50109.5
351S32.9Very low28.8Very low104 Ų104152.8 Ų152.873%0.72783%0.829SS**  trans-166.8107.214652.50000107.3
352E30.6Very low28.6Very low182 Ų182151.5 Ų151.585%0.8582%0.822SS**  71.891103.5-72.5176.7176.500112
353I26.1Very low28.6Very low154 Ų154148.7 Ų148.779%0.7983%0.826SS**  4810596.8-54.1176.4000113.6
354S28.8Very low28.6Very low126 Ų126144.8 Ų144.888%0.88182%0.815SS**  trans-145.6120.3133.9-75.50000108.3
355T24.4Very low28.5Very low132 Ų132145.2 Ų145.281%0.8182%0.815SS**  trans-76.5132.1172.538.70000110.6
356E29.8Very low29Very low195 Ų195141.9 Ų141.991%0.91179%0.793SS**  trans-154.8145.4144.9-126.1171.2-171.500111.7
357S26.4Very low29Very low111 Ų111142 Ų14278%0.77679%0.791SS**  trans-82.5152-161.445.20000115.4
358A31.4Very low29.4Very low90 Ų90134.7 Ų134.774%0.74476%0.763SS**  trans158.5102.714000000107.6
359D26.8Very low29.8Very low166 Ų166127.6 Ų127.689%0.88875%0.746SS**  50.8103.596.4-81.8-23.2000113.3
360E28.5Very low29.9Very low179 Ų179126.3 Ų126.384%0.83674%0.743SS**  179.7108116.5-165.7156.9-168.400109.9T362E360-T362 PolarHBondContact O-N 3.39Å
361C24.3Very low30.1Very low138 Ų138119.3 Ų119.393%0.93272%0.716SS**  trans-72.7105.7172.1-84.40000109.9
362T29.1Very low29.9Very low113 Ų113119.4 Ų119.469%0.69371%0.713SS**  trans-104.5101.9164.8-41.40000109.9E360 V364E360-T362 PolarHBondContact O-N 3.39Å; T362-V364 PolarHBondContact O-N 3.43Å
363A29.2Very low30Very low98 Ų98122 Ų12281%0.8172%0.715SS**  trans-68.1109.6170.100000109.6
364V31.5Very low30.3Very low117 Ų117120.8 Ų120.871%0.70971%0.709SS**  trans-89.3120.9176-178.70000109.3T362 C366T362-V364 PolarHBondContact O-N 3.43Å; V364-C366 PolarHBondContact O-N 3.39Å
365P29.8Very low30.3Very low109 Ų109122.8 Ų122.871%0.70870%0.702SS**  trans-77.9110.9178.130.4-29.5000109.4V367P365-V367 PolarHBondContact O-N 3.11Å; P365-V367 VanDerWaalsContact O-N 3.12Å
366C33.3Very low30.5Very low62 Ų62122.1 Ų122.142%0.41970%0.703SS.*  trans-73.9101.4168.5-73.60000109.3T84 V364 V368T84-C366 PolarHBondContact OG1-SG 3.46Å; V364-C366 PolarHBondContact O-N 3.39Å; C366-V368 PolarHBondContact O-N 3.32Å
367V33Very low30.4Very low118 Ų118116.8 Ų116.872%0.71569%0.693SS**  trans-70.896.8170.7-178.90000108.4Y88 P365Y88-V367 PolarHBondContact OH-O 2.9Å; P365-V367 PolarHBondContact O-N 3.11Å; P365-V367 VanDerWaalsContact O-N 3.12Å
368V39.1Very low30.4Very low48 Ų48116.8 Ų116.829%0.29169%0.691SS.*  trans-68.2130.9169.3-177.30000108.2C366 D370C366-V368 PolarHBondContact O-N 3.32Å; V368-D370 PolarHBondContact O-N 3.32Å
369P34.2Very low30.2Very low71 Ų71118.7 Ų118.746%0.46169%0.689SS.*SBendtrans-65.9117.1176.924.6-30.4000110.2Y43 S371Y43-P369 HydrophobicContact CD1-CG 4.47Å; Y43-P369 HydrophobicContact CG-CG 4.45Å; P369-S371 PolarHBondContact O-N 3.04Å
370D32.4Very low30.5Very low167 Ų167121.4 Ų121.489%0.89369%0.688SS**SBendtrans29.372.6172.1-65.2-24.1000115.7V368V368-D370 PolarHBondContact O-N 3.32Å
371S31.5Very low30.3Very low26 Ų26121.6 Ų121.618%0.18269%0.689CS.*  trans-94.6133.9156.3-164.20000107.5E140 T144 P369 R373E140-S371 PolarHBondContact OE1-OG 3.28Å; T144-S371 PolarHBondContact OG1-OG 3.11Å; P369-S371 PolarHBondContact O-N 3.04Å; S371-R373 PolarHBondContact O-N 3.02Å
372P28.8Very low30.8Very low105 Ų105121 Ų12168%0.68269%0.687SS**  trans-61.1108.6174.626.5-33000108.3I374P372-I374 PolarHBondContact O-N 3.48Å
373R31.5Very low31Very low236 Ų236125.3 Ų125.389%0.89170%0.696SS**  trans-46.6128.1168.7-72.2-176.6-178.9-176.30.8107.2S371 F375S371-R373 PolarHBondContact O-N 3.02Å; R373-F375 PolarHBondContact O-N 3.46Å
374I32.2Very low31Very low129 Ų129126.4 Ų126.466%0.66270%0.695SS**SBendtrans-46.8111171.8-66.2173.5000108Y185 P372Y185-I374 HydrophobicContact CE1-CD1 4.28Å; P372-I374 PolarHBondContact O-N 3.48Å
375F29.9Very low31Very low168 Ų168128.4 Ų128.474%0.73770%0.701SS**  trans-5.4112.2179.1-75.5-94.1000117.7R373R373-F375 PolarHBondContact O-N 3.46Å
376S28.1Very low30.9Very low118 Ų118129.3 Ų129.383%0.82570%0.704SS**  trans-125109.8156.2-175.10000110
377A27Very low30.8Very low84 Ų84129.8 Ų129.869%0.69472%0.72SS**  trans36.3125.7147.600000123
378C27.4Very low30.6Very low110 Ų110132 Ų13274%0.74372%0.722SS**  trans77.5115.4135-60.70000121.8
379D26.8Very low30.3Very low131 Ų131139.8 Ų139.870%0.70175%0.753SS**  trans52.8120.6133.2-49.1-34.6000120.7
380Y32.5Very low30.2Very low222 Ų222143.2 Ų143.287%0.87177%0.766SS**  176.8131.598-101.6-84.6000111
381E25.4Very low30Very low184 Ų184140.6 Ų140.686%0.8676%0.76SS**  trans-66.3140.2162-76-166.7136.100110.8
382S34.3Very low30.4Very low125 Ų125144.9 Ų144.987%0.87479%0.787SS**  trans-169.4141.5132.122.30000111.7
383K32Very low30.5Very low204 Ų204147.5 Ų147.589%0.88780%0.796SS**  trans-72.5170.5-167.1-94.2177.7-177.3172.80114.9
384P29.8Very low30.7Very low121 Ų121142.4 Ų142.479%0.78679%0.791SS**  trans-91.8159.6-151.437.1-33.6000112.9
385N31.4Very low30.5Very low159 Ų159141.4 Ų141.485%0.8580%0.795SS**  trans-128.1141.8162.3-148-3.4000112.6
386V29.1Very low30.9Very low127 Ų127140.5 Ų140.577%0.7780%0.796SS**  trans-70.6143.4-168.8172.70000111.2
387G31.4Very low31.2Very low72 Ų72140.2 Ų140.274%0.74280%0.795SS**  trans-161.688.6171.500000111.2
388Q28.6Very low31.4Very low164 Ų164139.4 Ų139.477%0.76679%0.794SS**  trans-54.3135.9169.7-75.3161.1-44.200111
389F31.3Very low31.8Very low212 Ų212141 Ų14193%0.9380%0.8SS**  trans-135.8126.5148-107.9-83.4000111.3
390I33.3Very low32.2Very low144 Ų144140.5 Ų140.574%0.73881%0.805SS**PPolyproline II helixtrans-80.8134.3-168.2-68.1160.2000109.2
391S28.5Very low32.4Very low111 Ų111134.4 Ų134.478%0.77680%0.8SS**PPolyproline II helixtrans-85.7137.3162.4-65.50000109.7
392P38.2Very low33Very low116 Ų116131 Ų13175%0.75380%0.796SS**PPolyproline II helixtrans-95118.3161.430.6-21.3000110.2
393N30.8Very low33Very low161 Ų161134 Ų13486%0.86180%0.797SS**PPolyproline II helixtrans-66.7134155.8-86.7-32.2000108.6
394V36.2Very low33.2Very low128 Ų128134 Ų13478%0.77680%0.8SS**  trans-124.7115.9159.2177.70000107.8
395S29.2Very low33.2Very low109 Ų109137.2 Ų137.276%0.76280%0.802SS**  trans-117.3121.9169.138.10000107.1
396I37.2Very low33.3Very low148 Ų148135.5 Ų135.576%0.75980%0.801SS**  trans-140.2124.3162.9-62.8-174000109
397S34.4Very low33.2Very low113 Ų113135.5 Ų135.579%0.7980%0.801SS**  trans-22.2153157.951.20000115.9
398G32.6Very low33.4Very low66 Ų66137.5 Ų137.568%0.6880%0.804SS**  cis149.6139.436.600000104.2
399T34.6Very low33.5Very low143 Ų143137.6 Ų137.688%0.87781%0.81SS**  172.3140.8109.2-520000107.2
400P35.3Very low33.6Very low121 Ų121133.2 Ų133.279%0.78680%0.8SS**  trans-104.9163.3-179.338.8-30.9000113
401A35.8Very low33.5Very low94 Ų94132.7 Ų132.778%0.77781%0.806SS**  trans159.8158.8138.300000113.5
402S38.5Very low33.8Very low112 Ų112131.7 Ų131.778%0.78380%0.799SS**  trans79.289.7179.865.40000115.6
403E33.9Very low33.6Very low188 Ų188130 Ų13088%0.87979%0.791SS**  65.4106.576.4-67.9-170159.800113.4
404E36.3Very low34Very low206 Ų206132 Ų13296%0.96380%0.795SS**  -162.9148.1120.8-109.2-179.9-172.700111.9
405K31.4Very low34.2Very low187 Ų187135.9 Ų135.981%0.81380%0.795SS**  trans-109.7136.1-155.1173.8-176.8-176.4179.40109
406C31.7Very low34.5Very low124 Ų124142.4 Ų142.484%0.83880%0.803SS**  -173.7132.9127-108.40000113.6
407T28.8Very low35Very low126 Ų126139.9 Ų139.977%0.77379%0.794SS**  trans-74.4139.4179.7460000112.7
408S35.7Very low35.7Very low115 Ų115136.7 Ų136.780%0.80477%0.772SS**  trans-165.4127.9132.4470000110.7
409N30.8Very low36.6Very low166 Ų166138.5 Ų138.589%0.88876%0.762SS**  trans-78.8132.6179.4-68.3-42.1000110.4
410T33Very low37.3Very low119 Ų119131.8 Ų131.873%0.7372%0.721SS**  trans-152.8126.5155.2-44.50000109.2S412T410-S412 PolarHBondContact O-N 3.1Å
411P30.3Very low38.1Very low133 Ų133132.8 Ų132.886%0.86471%0.713SS**  trans-79.495178.931.8-29.3000108.4
412S35Very low39.1Very low90 Ų90130.9 Ų130.963%0.62969%0.691SS**  trans-103.3108.7-177.5-174.90000111.3T410T410-S412 PolarHBondContact O-N 3.1Å
413S34.7Very low39.6Very low82 Ų82126.1 Ų126.157%0.57366%0.656SS**  trans27.5113.9152.364.70000117.4R415S413-R415 VanDerWaalsContact C-N 3.25Å; S413-R415 PolarHBondContact O-N 3.49Å
414E37.9Very low40.6Very low202 Ų202123 Ų12394%0.94464%0.637SS**  trans-59.384169.7-158.1168.8-158.100110.2R416E414-R416 PolarHBondContact O-N 2.83Å
415R40.9Very low41.5Very low210 Ų210122.3 Ų122.379%0.79263%0.631SS**  trans-65.8101177.1-80.3-173.8-158.8160.96.6108.4S413 V417S413-R415 VanDerWaalsContact C-N 3.25Å; S413-R415 PolarHBondContact O-N 3.49Å; R415-V417 PolarHBondContact O-N 2.93Å
416R36.6Very low42.4Very low246 Ų246121.7 Ų121.793%0.92863%0.628SS**  trans-49.3105.2168.2-166.1171.9177.2149.8-1.1109.6E414 S418E414-R416 PolarHBondContact O-N 2.83Å; R416-S418 PolarHBondContact O-N 3.3Å
417V46.9Very low43Very low94 Ų94117 Ų11757%0.5759%0.593SS**  trans-66.9120.9179.5-153.80000107.5R415 F419 K421 V422R415-V417 PolarHBondContact O-N 2.93Å; V417-F419 PolarHBondContact O-N 3.44Å; V417-K421 HydrophobicContact CG1-CB 4.05Å; V417-K421 HydrophobicContact CG1-CD 4.15Å; V417-V422 HydrophobicContact CB-CG2 4.44Å
418S49.4Very low44.1Very low47 Ų47115.2 Ų115.233%0.32958%0.579SS.*  trans-59.3132.7178.961.80000110N14 R416 G420 K421N14-S418 PolarHBondContact ND2-OG 2.98Å; R416-S418 PolarHBondContact O-N 3.3Å; S418-G420 PolarHBondContact O-N 2.86Å; S418-K421 WeakPolarHBondContact O-CB 3.15Å; S418-K421 PolarHBondContact O-N 3.35Å
419F50.9Low44.6Very low104 Ų104110.9 Ų110.946%0.45655%0.548SS..Hα-helixtrans-54.7-30.9-174.8-170.3-92.5000112.4Y55 M59 V417 K421 V422 F423Y55-F419 HydrophobicContact CD1-CE1 4.4Å; Y55-F419 AromaticContact CE1-CE1 3.86Å; Y55-F419 HydrophobicContact CE1-CE1 3.86Å; M59-F419 HydrophobicContact CE-CD1 4.3Å; V417-F419 PolarHBondContact O-N 3.44Å; F419-K421 PolarHBondContact O-N 3.14Å; F419-V422 CarbonylContact O-C 3.11Å; F419-V422 WeakPolarHBondContact O-CA 3.48Å; F419-V422 WeakPolarHBondContact O-CB 3.3Å; F419-V422 PolarHBondContact O-N 3.24Å; F419-F423 HydrophobicContact CD1-CB 4.37Å; F419-F423 HydrophobicContact CE1-CB 4.32Å; F419-F423 HydrophobicContact CE1-CD2 4.37Å; F419-F423 WeakPolarHBondContact O-CB 3.46Å; F419-F423 PolarHBondContact O-N 3.37Å
420G48.6Very low45.2Very low2 Ų2105.6 Ų105.62%0.02153%0.528CS..Hα-helixtrans-57.9-31.4172.400000114.5N14 S418 R424N14-G420 WeakPolarHBondContact OD1-CA 3.42Å; S418-G420 PolarHBondContact O-N 2.86Å; G420-R424 WeakPolarHBondContact O-CB 3.47Å; G420-R424 WeakPolarHBondContact O-CG 3.49Å; G420-R424 PolarHBondContact O-N 2.95Å; G420-R424 VanDerWaalsContact O-N 3.08Å
421K53.9Low45.8Very low142 Ų142108.4 Ų108.462%0.61753%0.525SS*.Hα-helixtrans-72-40.9171.4-71.1-176.6176.31780111.5V417 S418 F419 R424 K425V417-K421 HydrophobicContact CG1-CB 4.05Å; V417-K421 HydrophobicContact CG1-CD 4.15Å; S418-K421 WeakPolarHBondContact O-CB 3.15Å; S418-K421 PolarHBondContact O-N 3.35Å; F419-K421 PolarHBondContact O-N 3.14Å; K421-R424 PolarHBondContact O-N 3.24Å; K421-K425 PolarHBondContact O-N 2.93Å
422V56.1Low46.2Very low53 Ų53107.6 Ų107.632%0.32152%0.521SS..Hα-helixtrans-64.7-44176.6-178.50000110.8V417 F419 K425 K426V417-V422 HydrophobicContact CB-CG2 4.44Å; F419-V422 CarbonylContact O-C 3.11Å; F419-V422 WeakPolarHBondContact O-CA 3.48Å; F419-V422 WeakPolarHBondContact O-CB 3.3Å; F419-V422 PolarHBondContact O-N 3.24Å; V422-K425 PolarHBondContact O-N 3.35Å; V422-K426 HydrophobicContact CG1-CD 4.32Å; V422-K426 PolarHBondContact O-N 3.25Å
423F49.8Very low46.4Very low12 Ų12109.1 Ų109.15%0.05352%0.521CS..Hα-helixtrans-61.5-45.8176.4-172.7-96.4000111.5A12 K51 Y55 F419 K425 K426 F427A12-F423 HydrophobicContact CB-CD1 3.53Å; A12-F423 HydrophobicContact CB-CE1 3.29Å; A12-F423 HydrophobicContact CB-CZ 4.24Å; K51-F423 HydrophobicContact CG-CZ 4.35Å; Y55-F423 HydrophobicContact CD1-CD2 4.11Å; Y55-F423 HydrophobicContact CD1-CE2 4.01Å; Y55-F423 HydrophobicContact CD1-CZ 4.5Å; Y55-F423 HydrophobicContact CD2-CD2 4.11Å; Y55-F423 HydrophobicContact CD2-CE1 4.24Å; Y55-F423 AromaticContact CD2-CE2 3.21Å; Y55-F423 HydrophobicContact CD2-CE2 3.21Å; Y55-F423 AromaticContact CD2-CZ 3.25Å; Y55-F423 HydrophobicContact CD2-CZ 3.25Å; Y55-F423 AromaticContact CE1-CD2 3.96Å; Y55-F423 HydrophobicContact CE1-CD2 3.96Å; Y55-F423 AromaticContact CE1-CE2 3.89Å; Y55-F423 HydrophobicContact CE1-CE2 3.89Å; Y55-F423 HydrophobicContact CE2-CD2 4.04Å; Y55-F423 AromaticContact CE2-CE2 3.14Å; Y55-F423 HydrophobicContact CE2-CE2 3.14Å; Y55-F423 AromaticContact CE2-CZ 3.66Å; Y55-F423 HydrophobicContact CE2-CZ 3.66Å; Y55-F423 HydrophobicContact CG-CD2 4.17Å; Y55-F423 HydrophobicContact CG-CE1 4.37Å; Y55-F423 AromaticContact CG-CE2 3.68Å; Y55-F423 HydrophobicContact CG-CE2 3.68Å; Y55-F423 AromaticContact CG-CZ 3.75Å; Y55-F423 HydrophobicContact CG-CZ 3.75Å; Y55-F423 AromaticContact CZ-CD2 3.92Å; Y55-F423 AromaticContact CZ-CE2 3.47Å; Y55-F423 VanDerWaalsContact CZ-CE2 3.47Å; F419-F423 HydrophobicContact CD1-CB 4.37Å; F419-F423 HydrophobicContact CE1-CB 4.32Å; F419-F423 HydrophobicContact CE1-CD2 4.37Å; F419-F423 WeakPolarHBondContact O-CB 3.46Å; F419-F423 PolarHBondContact O-N 3.37Å; F423-K425 PolarHBondContact O-N 3.29Å; F423-K426 PolarHBondContact O-N 3.45Å; F423-F427 HydrophobicContact CE1-CB 4.24Å; F423-F427 AromaticContact CE1-CD2 3.59Å; F423-F427 HydrophobicContact CE1-CD2 3.59Å; F423-F427 HydrophobicContact CE1-CE2 4.29Å; F423-F427 HydrophobicContact CE1-CG 4.19Å; F423-F427 HydrophobicContact CE2-CD2 4.2Å; F423-F427 AromaticContact CZ-CD2 3.37Å; F423-F427 HydrophobicContact CZ-CD2 3.37Å; F423-F427 AromaticContact CZ-CE2 3.96Å; F423-F427 HydrophobicContact CZ-CE2 3.96Å; F423-F427 HydrophobicContact CZ-CG 4.33Å; F423-F427 VanDerWaalsContact O-CB 3.26Å; F423-F427 WeakPolarHBondContact O-CB 3.16Å; F423-F427 PolarHBondContact O-N 3.34Å
424R54Low46.4Very low123 Ų123109.1 Ų109.146%0.46452%0.521SS..Hα-helixtrans-59.6-32.7175.6-80.1-176.8-165.2-152.65.3113.4S13 G420 K421S13-R424 PolarHBondContact OG-NH2 2.91Å; G420-R424 WeakPolarHBondContact O-CB 3.47Å; G420-R424 WeakPolarHBondContact O-CG 3.49Å; G420-R424 PolarHBondContact O-N 2.95Å; G420-R424 VanDerWaalsContact O-N 3.08Å; K421-R424 PolarHBondContact O-N 3.24Å
425K54.2Low46.4Very low192 Ų192106.6 Ų106.684%0.83551%0.513SS*.Hα-helixtrans-79.9-31.8179.4-164.1173.2-178.5176.90112.6K421 V422 F423K421-K425 PolarHBondContact O-N 2.93Å; V422-K425 PolarHBondContact O-N 3.35Å; F423-K425 PolarHBondContact O-N 3.29Å
426K52Low46.4Very low174 Ų174101.2 Ų101.276%0.75750%0.504SS*.Hα-helixtrans-101.3-7.6-177.6-72.7-173.2174.6-178.10115.3V422 F423 N428V422-K426 HydrophobicContact CG1-CD 4.32Å; V422-K426 PolarHBondContact O-N 3.25Å; F423-K426 PolarHBondContact O-N 3.45Å; K426-N428 PolarHBondContact O-N 3.4Å
427F42.9Very low46.6Very low25 Ų2594.9 Ų94.911%0.1149%0.494CS..  trans-65101.7178.7-175.4-96.9000110.7A8 K51 F423A8-F427 HydrophobicContact CB-CE1 3.65Å; A8-F427 HydrophobicContact CB-CE2 4.23Å; A8-F427 HydrophobicContact CB-CZ 3.38Å; K51-F427 HydrophobicContact CB-CE2 4.41Å; K51-F427 HydrophobicContact CD-CD2 4.29Å; K51-F427 HydrophobicContact CD-CE2 3.88Å; K51-F427 HydrophobicContact CG-CE2 4.14Å; F423-F427 HydrophobicContact CE1-CB 4.24Å; F423-F427 AromaticContact CE1-CD2 3.59Å; F423-F427 HydrophobicContact CE1-CD2 3.59Å; F423-F427 HydrophobicContact CE1-CE2 4.29Å; F423-F427 HydrophobicContact CE1-CG 4.19Å; F423-F427 HydrophobicContact CE2-CD2 4.2Å; F423-F427 AromaticContact CZ-CD2 3.37Å; F423-F427 HydrophobicContact CZ-CD2 3.37Å; F423-F427 AromaticContact CZ-CE2 3.96Å; F423-F427 HydrophobicContact CZ-CE2 3.96Å; F423-F427 HydrophobicContact CZ-CG 4.33Å; F423-F427 VanDerWaalsContact O-CB 3.26Å; F423-F427 WeakPolarHBondContact O-CB 3.16Å; F423-F427 PolarHBondContact O-N 3.34Å
428N52Low46.3Very low89 Ų8996 Ų9648%0.47650%0.504SS..  trans-116.5110.6167.6-167.3-10.9000108K426 A430K426-N428 PolarHBondContact O-N 3.4Å; N428-A430 PolarHBondContact O-N 3.27Å; N428-A430 PolarHBondContact OD1-N 3.41Å
429S46.8Very low46Very low23 Ų23100.6 Ų100.616%0.16153%0.529CS..THydrogen-bonded Turntrans-67.5-17-176.954.70000113.4
430A42.3Very low45.9Very low55 Ų55100.4 Ų100.446%0.45554%0.541SS..THydrogen-bonded Turntrans-105.79.5-173.500000114N428 C432N428-A430 PolarHBondContact O-N 3.27Å; N428-A430 PolarHBondContact OD1-N 3.41Å; A430-C432 PolarHBondContact O-N 2.95Å; A430-C432 VanDerWaalsContact O-N 3.15Å
431R46.4Very low45.9Very low179 Ų179106.5 Ų106.568%0.67558%0.578SS**  trans-82.694.2176.9-107.6-175.2179.3173.8-0.8110.8I433R431-I433 HydrophobicContact CB-CG1 4.49Å; R431-I433 PolarHBondContact O-N 3.26Å
432C38.3Very low45.4Very low115 Ų115106.8 Ų106.878%0.77758%0.584SS**  trans-61.5114.8151.1-73.70000107.7A430A430-C432 PolarHBondContact O-N 2.95Å; A430-C432 VanDerWaalsContact O-N 3.15Å
433I40.3Very low44.7Very low122 Ų122109.6 Ų109.663%0.62660%0.604SS**  trans-104.5118.3169-60.9171.8000103.5R431R431-I433 HydrophobicContact CB-CG1 4.49Å; R431-I433 PolarHBondContact O-N 3.26Å
434S33.7Very low44.5Very low83 Ų83113.5 Ų113.558%0.5864%0.638SS**  trans-51.8142.5177.751.30000110.5T436S434-T436 PolarHBondContact O-N 3.38Å; S434-T436 PolarHBondContact OG-OG1 3.24Å
435L38.7Very low44Very low149 Ų149117 Ų11778%0.7866%0.657SS**SBendtrans-66.15.8177.8-80.5154000114
436T39.9Very low43.1Very low96 Ų96111.5 Ų111.559%0.58965%0.654SS**SBendtrans-99117.917343.90000109.5S434S434-T436 PolarHBondContact O-N 3.38Å; S434-T436 PolarHBondContact OG-OG1 3.24Å
437P41.7Very low42.8Very low113 Ų113111.3 Ų111.373%0.73466%0.66SS**PPolyproline II helixtrans-62.5133.3170.526.2-31.2000108.4V439P437-V439 PolarHBondContact O-N 3.38Å
438P40.8Very low42.6Very low119 Ų119117.5 Ų117.577%0.77369%0.693SS**PPolyproline II helixtrans-63.3128.8165.627.3-30.3000107.1S440P438-S440 PolarHBondContact O-N 2.7Å
439V43.8Very low41.8Very low142 Ų142124.6 Ų124.686%0.86171%0.714SS**  trans-53.2102.2173.9177.20000107.7P437 V441P437-V439 PolarHBondContact O-N 3.38Å; V439-V441 PolarHBondContact O-N 3.4Å; V439-V441 VanDerWaalsContact O-N 3.16Å
440S48Very low41.2Very low101 Ų101128.9 Ų128.971%0.70674%0.743SS**  trans-74109.5175.361.80000107.4P438 I442P438-S440 PolarHBondContact O-N 2.7Å; S440-I442 PolarHBondContact O-N 3.48Å; S440-I442 VanDerWaalsContact O-N 3.11Å
441V47.7Very low41Very low129 Ų129134 Ų13478%0.78276%0.763SS**PPolyproline II helixtrans-49.2117.5162-178.40000107.3V439 P443V439-V441 PolarHBondContact O-N 3.4Å; V439-V441 VanDerWaalsContact O-N 3.16Å; V441-P443 WeakPolarHBondContact O-CD 3.33Å
442I43.3Very low40.6Very low148 Ų148135.4 Ų135.476%0.75977%0.774SS**PPolyproline II helixtrans-57.1121.8176.5-61.6167.6000107S440 A444S440-I442 PolarHBondContact O-N 3.48Å; S440-I442 VanDerWaalsContact O-N 3.11Å; I442-A444 PolarHBondContact O-N 2.94Å; I442-A444 VanDerWaalsContact O-N 3.11Å
443P41.7Very low40.6Very low113 Ų113136 Ų13673%0.73478%0.776SS**PPolyproline II helixtrans-64.7117.2174-14.527.7000108.5V441 K445V441-P443 WeakPolarHBondContact O-CD 3.33Å; P443-K445 PolarHBondContact O-N 3.13Å
444A45.6Very low40.5Very low93 Ų93136.8 Ų136.877%0.76979%0.787SS**SBendtrans-64.9123.7168.300000108.4I442I442-A444 PolarHBondContact O-N 2.94Å; I442-A444 VanDerWaalsContact O-N 3.11Å
445K44.6Very low41Very low197 Ų197137.5 Ų137.586%0.85780%0.797SS**  trans96.185.9177.3-55.8168.7178.71780114.9P443P443-K445 PolarHBondContact O-N 3.13Å
446G34.6Very low41Very low76 Ų76137.6 Ų137.678%0.78480%0.799SS**  trans-72.6131.5156.500000110.6L448G446-L448 PolarHBondContact O-N 3.36Å; G446-L448 VanDerWaalsContact O-N 3.14Å
447I45.3Very low40.8Very low170 Ų170141.8 Ų141.887%0.87281%0.812SS**SBendtrans-78.816.9-173.1-68.4167.5000112.8
448L38.4Very low40.7Very low155 Ų155140.9 Ų140.981%0.81281%0.814SS**SBendtrans-134.2115.1-175.7-88.6144000111.9G446G446-L448 PolarHBondContact O-N 3.36Å; G446-L448 VanDerWaalsContact O-N 3.14Å
449R36.8Very low40.5Very low239 Ų239145.1 Ų145.190%0.90282%0.82SS**  trans86.484.1167.8-58.1-178.3177.2-163.2-2.1117.1
450S34Very low40.4Very low112 Ų112142.5 Ų142.578%0.78381%0.813SS**  trans-66.9117.7142.551.80000109
451N38.5Very low39.9Very low162 Ų162145 Ų14587%0.86682%0.819SS**  trans-172.999.7152.3-91.9-13.3000107.3
452K36.4Very low39.4Very low209 Ų209145.1 Ų145.191%0.90982%0.82SS**  trans-120.5124.7159-95.9-171.3176.5-176.10107.3
453P39.6Very low39Very low128 Ų128142.7 Ų142.783%0.83182%0.815SS**  trans-84.8153.116934.3-29.1000110.7
454V38Very low38.9Very low138 Ų138150.8 Ų150.884%0.83684%0.84SS**  trans-68137.8170.1175.50000109.9
455A42.9Very low38.6Very low98 Ų98153.7 Ų153.781%0.8184%0.843SS**  trans-173141144.800000111.4
456D39.5Very low38.3Very low151 Ų151151.4 Ų151.481%0.80784%0.842SS**  trans-67.2165.5-168.4-73.5-55.7000117.6
457E34.9Very low38.5Very low185 Ų185155.6 Ų155.686%0.86485%0.846SS**  trans-32138.8161.8-55.1-178.2146.500116
458A39.5Very low38.1Very low94 Ų94154.7 Ų154.778%0.77784%0.844SS**  -178.3116.2123.100000111.7
459K38Very low38.1Very low208 Ų208154.7 Ų154.790%0.90485%0.846SS**  trans20.5126.9137.2-64.2174.8178.91730118.6
460A40.6Very low38.2Very low87 Ų87149.1 Ų149.172%0.71984%0.843SS**  143.4123.4106.700000112.5
461N37.4Very low38.5Very low153 Ų153151.7 Ų151.782%0.81885%0.847SS**  trans37.7123137-58.7-16.4000119.3
462V36.9Very low38.5Very low132 Ų132150.9 Ų150.980%0.885%0.845SS**  165.3136.697.9167.50000108.3
463S35.3Very low38.6Very low96 Ų96146.1 Ų146.167%0.67184%0.84SS**  trans-54.2147.4173.147.30000116.5
464F41.1Very low38.5Very low283 Ų283147.7 Ų147.7100%1.24184%0.841SS**  -140.70129.6-106-78.5000109.5

Retrieved 464 of 464 residues in 541.6 ms (Link to these results)

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