A0A077ZMA8_TRITR Loading...

NatB MDM20 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZMA8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 320 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
1M43.4Very low55.3Low151 Ų151120.9 Ų120.974%0.74461%0.611SS**  01040-72.6-176.4-172.800109Y3M1-Y3 HydrophobicContact CB-CE2 4.47Å; M1-Y3 HydrophobicContact SD-CE2 4.49Å
2T42.4Very low58.1Low149 Ų149118.7 Ų118.791%0.91461%0.608SS**  trans-91.5102.2174.424.40000109.1
3Y45.8Very low60.5Low117 Ų117114.7 Ų114.746%0.45959%0.586SS.*  trans-74.2148167.9-81.1-88.4000109.7M1 Q5M1-Y3 HydrophobicContact CB-CE2 4.47Å; M1-Y3 HydrophobicContact SD-CE2 4.49Å; Y3-Q5 PolarHBondContact O-N 3.01Å
4P40.5Very low62.7Low85 Ų85106.6 Ų106.655%0.55255%0.545SS*.  trans-55.4129.2174.720.6-30.6000110.5N6 V7P4-N6 PolarHBondContact O-N 3.46Å; P4-V7 HydrophobicContact CG-CG2 3.95Å; P4-V7 PolarHBondContact O-N 3.15Å
5Q44.2Very low64.7Low193 Ų193101.1 Ų101.190%0.90252%0.516SS*.THydrogen-bonded Turntrans-61.7-6.8-172.6-71.6178.1-27.400114.7Y3Y3-Q5 PolarHBondContact O-N 3.01Å
6N41.8Very low66.5Low162 Ų16298.2 Ų98.287%0.86651%0.508SS*.THydrogen-bonded Turntrans-110.28.3-173.8-71.8-19.7000115.1P4P4-N6 PolarHBondContact O-N 3.46Å
7V49.8Very low67.9Low77 Ų7795.9 Ų95.947%0.46749%0.491SS..SBendtrans-95.1120.4172.2-178.50000107.8P4 Q9P4-V7 HydrophobicContact CG-CG2 3.95Å; P4-V7 PolarHBondContact O-N 3.15Å; V7-Q9 WeakPolarHBondContact O-CG 3.32Å; V7-Q9 PolarHBondContact O-N 2.91Å
8K56.2Low69.4Low204 Ų20490.7 Ų90.789%0.88747%0.465SS*.  trans-51103.7167.4-85.3-174176.9-178.70107.6S10K8-S10 PolarHBondContact O-N 3.31Å
9Q68.4Low70.7Confident54 Ų5490.7 Ų90.725%0.25247%0.466SS..  trans-67122.1-174.5-66.7-173.2-19.500107.6V7V7-Q9 WeakPolarHBondContact O-CG 3.32Å; V7-Q9 PolarHBondContact O-N 2.91Å
10S85.4Confident71.8Confident50 Ų5090.3 Ų90.335%0.3546%0.463SS..  trans-69.9153.6-176.5740000110.3K8 T12 Q13 Q14K8-S10 PolarHBondContact O-N 3.31Å; S10-T12 PolarHBondContact O-N 3.33Å; S10-Q13 WeakPolarHBondContact O-CB 3.45Å; S10-Q13 PolarHBondContact O-N 2.82Å; S10-Q13 VanDerWaalsContact OG-CG 3.31Å; S10-Q13 WeakPolarHBondContact OG-CG 3.36Å; S10-Q13 PolarHBondContact OG-N 2.91Å; S10-Q13 VanDerWaalsContact OG-N 3.15Å; S10-Q14 PolarHBondContact O-N 3.38Å; S10-Q14 VanDerWaalsContact O-N 3.12Å
11R90Very high72.8Confident88 Ų8886.1 Ų86.133%0.33244%0.442SS..Hα-helixtrans-47.5-45.9172175.8-179.2167.2-102.9-8.3111Q13 Q14 L15 F50 F54 D63R11-Q13 PolarHBondContact O-N 3.43Å; R11-Q14 PolarHBondContact O-N 3.06Å; R11-L15 HydrophobicContact CG-CD1 4Å; R11-L15 WeakPolarHBondContact O-CG 3.2Å; R11-L15 PolarHBondContact O-N 2.98Å; R11-L15 VanDerWaalsContact O-N 3.08Å; R11-F50 HydrophobicContact CG-CE2 4.22Å; R11-F50 HydrophobicContact CG-CZ 4.28Å; R11-F54 HydrophobicContact CB-CE1 3.98Å; R11-F54 HydrophobicContact CB-CE2 4.29Å; R11-F54 HydrophobicContact CB-CZ 3.83Å; R11-D63 IonicContact CZ-OD1 3.9Å; R11-D63 IonicContact CZ-OD2 2.67Å; R11-D63 IonicContact NE-OD1 2.65Å; R11-D63 IonicContact NE-OD2 2.94Å; R11-D63 PolarHBondContact NE-OD2 3.15Å; R11-D63 IonicContact NH2-OD1 3.75Å; R11-D63 PolarHBondContact NH2-OD1 3.38Å; R11-D63 IonicContact NH2-OD2 3.67Å; R11-D63 PolarHBondContact NH2-OD2 3.44Å
12T89.2Confident75.1Confident94 Ų9479 Ų7958%0.57741%0.408SS*.Hα-helixtrans-59.5-45.7177.4-500000112.2S10 Q14 L15 S16S10-T12 PolarHBondContact O-N 3.33Å; T12-Q14 VanDerWaalsContact C-N 3.34Å; T12-Q14 PolarHBondContact O-N 3.41Å; T12-L15 PolarHBondContact O-N 3.43Å; T12-S16 WeakPolarHBondContact O-CB 3.38Å; T12-S16 PolarHBondContact O-N 2.87Å; T12-S16 PolarHBondContact O-OG 2.95Å
13Q89.8Confident77.5Confident67 Ų6774.7 Ų74.731%0.31338%0.383SS..Hα-helixtrans-62.2-40.8180-76.1168.3-14.800112.2S10 R11 S16 R17S10-Q13 WeakPolarHBondContact O-CB 3.45Å; S10-Q13 PolarHBondContact O-N 2.82Å; S10-Q13 VanDerWaalsContact OG-CG 3.31Å; S10-Q13 WeakPolarHBondContact OG-CG 3.36Å; S10-Q13 PolarHBondContact OG-N 2.91Å; S10-Q13 VanDerWaalsContact OG-N 3.15Å; R11-Q13 PolarHBondContact O-N 3.43Å; Q13-S16 PolarHBondContact O-N 3.49Å; Q13-R17 WeakPolarHBondContact O-CG 3.27Å; Q13-R17 PolarHBondContact O-N 2.93Å; Q13-R17 VanDerWaalsContact O-N 3.12Å
14Q91.2Very high79.7Confident2 Ų271.2 Ų71.21%0.00937%0.373CS..Hα-helixtrans-66.2-44.8176.7-60.9-58.4-6.100112.4S10 R11 T12 S16 R17 L18 F50 M53 F54S10-Q14 PolarHBondContact O-N 3.38Å; S10-Q14 VanDerWaalsContact O-N 3.12Å; R11-Q14 PolarHBondContact O-N 3.06Å; T12-Q14 VanDerWaalsContact C-N 3.34Å; T12-Q14 PolarHBondContact O-N 3.41Å; Q14-S16 VanDerWaalsContact C-N 3.3Å; Q14-S16 PolarHBondContact O-N 3.41Å; Q14-R17 WeakPolarHBondContact O-CB 3.29Å; Q14-R17 PolarHBondContact O-N 3.05Å; Q14-R17 VanDerWaalsContact O-N 3.11Å; Q14-R17 VanDerWaalsContact OE1-NH1 3.13Å; Q14-L18 PolarHBondContact O-N 3.35Å; Q14-F50 HydrophobicContact CB-CD2 3.56Å; Q14-F50 HydrophobicContact CB-CE2 4.1Å; Q14-F50 HydrophobicContact CG-CD2 4.17Å; Q14-M53 HydrophobicContact CG-CE 3.92Å; Q14-M53 HydrophobicContact CG-SD 4.47Å; Q14-F54 HydrophobicContact CG-CE2 4.2Å
15L92.9Very high82.2Confident23 Ų2368.6 Ų68.612%0.1235%0.354CS..Hα-helixtrans-64.7-36.8177.8-65.3174.6000111.3R11 T12 R17 L18 N19 F50 D63 F67R11-L15 HydrophobicContact CG-CD1 4Å; R11-L15 WeakPolarHBondContact O-CG 3.2Å; R11-L15 PolarHBondContact O-N 2.98Å; R11-L15 VanDerWaalsContact O-N 3.08Å; T12-L15 PolarHBondContact O-N 3.43Å; L15-R17 VanDerWaalsContact C-N 3.3Å; L15-R17 PolarHBondContact O-N 3.49Å; L15-L18 HydrophobicContact CD2-CD1 4.45Å; L15-L18 PolarHBondContact O-N 3.09Å; L15-N19 VanDerWaalsContact O-CB 3.32Å; L15-N19 WeakPolarHBondContact O-CB 3.39Å; L15-N19 PolarHBondContact O-N 3.43Å; L15-N19 PolarHBondContact O-ND2 2.82Å; L15-F50 HydrophobicContact CD1-CE2 4.48Å; L15-F50 HydrophobicContact CD2-CD2 4.27Å; L15-F50 HydrophobicContact CD2-CE2 3.7Å; L15-F50 HydrophobicContact CD2-CZ 3.98Å; L15-F50 HydrophobicContact CG-CE2 3.83Å; L15-F50 HydrophobicContact CG-CZ 4.34Å; L15-D63 HydrophobicContact CD1-CB 4.39Å; L15-D63 HydrophobicContact CD2-CB 3.94Å; L15-F67 HydrophobicContact CD2-CE2 4.07Å
16S92.4Very high84.4Confident55 Ų5566 Ų6639%0.38534%0.342SS..Hα-helixtrans-59.7-40.6172.4-64.90000111.7T12 Q13 Q14 N19 I20T12-S16 WeakPolarHBondContact O-CB 3.38Å; T12-S16 PolarHBondContact O-N 2.87Å; T12-S16 PolarHBondContact O-OG 2.95Å; Q13-S16 PolarHBondContact O-N 3.49Å; Q14-S16 VanDerWaalsContact C-N 3.3Å; Q14-S16 PolarHBondContact O-N 3.41Å; S16-N19 PolarHBondContact O-N 3.29Å; S16-I20 WeakPolarHBondContact O-CD1 3.02Å; S16-I20 VanDerWaalsContact O-CG1 3.22Å; S16-I20 WeakPolarHBondContact O-CG1 3.42Å; S16-I20 PolarHBondContact O-N 3.15Å
17R91.6Very high86.7Confident60 Ų6062.9 Ų62.923%0.22633%0.325CS..Hα-helixtrans-64-47.6176.5-68.7170.169.4-166.34.4111.6Q13 Q14 L15 N19 I20 V21Q13-R17 WeakPolarHBondContact O-CG 3.27Å; Q13-R17 PolarHBondContact O-N 2.93Å; Q13-R17 VanDerWaalsContact O-N 3.12Å; Q14-R17 WeakPolarHBondContact O-CB 3.29Å; Q14-R17 PolarHBondContact O-N 3.05Å; Q14-R17 VanDerWaalsContact O-N 3.11Å; Q14-R17 VanDerWaalsContact OE1-NH1 3.13Å; L15-R17 VanDerWaalsContact C-N 3.3Å; L15-R17 PolarHBondContact O-N 3.49Å; R17-N19 PolarHBondContact O-N 3.43Å; R17-I20 PolarHBondContact O-N 3.41Å; R17-V21 WeakPolarHBondContact O-CG2 3.44Å; R17-V21 PolarHBondContact O-N 3.41Å
18L93.9Very high88.6Confident2 Ų262.1 Ų62.11%0.0133%0.333CS..Hα-helixtrans-59.8-44.3175.8-79.9167.7000111.8Q14 L15 I20 V21 G22 L46 M47 L64 F67Q14-L18 PolarHBondContact O-N 3.35Å; L15-L18 HydrophobicContact CD2-CD1 4.45Å; L15-L18 PolarHBondContact O-N 3.09Å; L18-I20 PolarHBondContact O-N 3.32Å; L18-V21 PolarHBondContact O-N 3Å; L18-G22 PolarHBondContact O-N 3.42Å; L18-L46 HydrophobicContact CD2-CB 3.46Å; L18-L46 VanDerWaalsContact CD2-CB 3.46Å; L18-L46 HydrophobicContact CD2-CD1 4.17Å; L18-L46 HydrophobicContact CD2-CG 4.48Å; L18-L46 HydrophobicContact CG-CB 4.01Å; L18-M47 HydrophobicContact CD1-CG 4.28Å; L18-M47 HydrophobicContact CD2-CG 3.76Å; L18-L64 HydrophobicContact CD1-CD2 4.23Å; L18-F67 HydrophobicContact CB-CD1 4.1Å; L18-F67 HydrophobicContact CB-CD2 4.26Å; L18-F67 HydrophobicContact CB-CE1 3.89Å; L18-F67 HydrophobicContact CB-CE2 4.05Å; L18-F67 HydrophobicContact CB-CG 4.28Å; L18-F67 HydrophobicContact CB-CZ 3.86Å; L18-F67 HydrophobicContact CD1-CD2 4.1Å; L18-F67 HydrophobicContact CD1-CE2 4.25Å
19N93.4Very high90.2Very high90 Ų9060.4 Ų60.448%0.48132%0.322SS..Hα-helixtrans-61.5-43.1176.8-81.2-47.8000112.6L15 S16 R17 S23 F67L15-N19 VanDerWaalsContact O-CB 3.32Å; L15-N19 WeakPolarHBondContact O-CB 3.39Å; L15-N19 PolarHBondContact O-N 3.43Å; L15-N19 PolarHBondContact O-ND2 2.82Å; S16-N19 PolarHBondContact O-N 3.29Å; R17-N19 PolarHBondContact O-N 3.43Å; N19-S23 WeakPolarHBondContact O-CB 3.48Å; N19-S23 PolarHBondContact O-N 2.88Å; N19-F67 WeakPolarHBondContact OD1-CE1 3.41Å; N19-F67 VanDerWaalsContact OD1-CZ 3.26Å; N19-F67 WeakPolarHBondContact OD1-CZ 3.35Å
20I93Very high91.3Very high82 Ų8258.7 Ų58.742%0.42132%0.315SS..Hα-helixtrans-63-49.4177.8-69.7163.2000110S16 R17 L18 S23 L24S16-I20 WeakPolarHBondContact O-CD1 3.02Å; S16-I20 VanDerWaalsContact O-CG1 3.22Å; S16-I20 WeakPolarHBondContact O-CG1 3.42Å; S16-I20 PolarHBondContact O-N 3.15Å; R17-I20 PolarHBondContact O-N 3.41Å; L18-I20 PolarHBondContact O-N 3.32Å; I20-S23 PolarHBondContact O-N 3.36Å; I20-L24 HydrophobicContact CG2-CD1 4.1Å; I20-L24 VanDerWaalsContact O-CG 3.28Å; I20-L24 WeakPolarHBondContact O-CG 3.46Å; I20-L24 PolarHBondContact O-N 3.04Å
21V93.5Very high91.4Very high4 Ų462.8 Ų62.82%0.02433%0.327CS..Hα-helixtrans-64.3-46.3-179.9175.30000111.1R17 L18 S23 L24 L25 L35 L40 P43 L46R17-V21 WeakPolarHBondContact O-CG2 3.44Å; R17-V21 PolarHBondContact O-N 3.41Å; L18-V21 PolarHBondContact O-N 3Å; V21-S23 PolarHBondContact O-N 3.14Å; V21-L24 PolarHBondContact O-N 3.18Å; V21-L25 HydrophobicContact CG1-CD1 4Å; V21-L25 HydrophobicContact CG1-CG 4.48Å; V21-L25 WeakPolarHBondContact O-CG 3.16Å; V21-L25 PolarHBondContact O-N 3.1Å; V21-L25 VanDerWaalsContact O-N 3.08Å; V21-L35 HydrophobicContact CG1-CD1 4.19Å; V21-L35 HydrophobicContact CG1-CD2 4.17Å; V21-L40 HydrophobicContact CG2-CB 4.49Å; V21-L40 HydrophobicContact CG2-CD1 4.49Å; V21-P43 HydrophobicContact CG1-CG 3.91Å; V21-L46 HydrophobicContact CB-CD1 4.32Å; V21-L46 HydrophobicContact CG2-CD1 3.85Å
22G92.1Very high91.2Very high2 Ų262.2 Ų62.22%0.02133%0.334CS..Hα-helixtrans-57.4-47.4176.600000112L18 L24 L25 E26L18-G22 PolarHBondContact O-N 3.42Å; G22-L24 PolarHBondContact O-N 3.45Å; G22-L25 PolarHBondContact O-N 3.05Å; G22-E26 WeakPolarHBondContact O-CB 3.47Å; G22-E26 VanDerWaalsContact O-CG 3.31Å; G22-E26 WeakPolarHBondContact O-CG 3.22Å; G22-E26 PolarHBondContact O-N 2.89Å
23S91.8Very high91.1Very high57 Ų5762.6 Ų62.640%0.39934%0.341SS..Hα-helixtrans-63.2-38.3178.1-172.40000112.9N19 I20 V21 N27N19-S23 WeakPolarHBondContact O-CB 3.48Å; N19-S23 PolarHBondContact O-N 2.88Å; I20-S23 PolarHBondContact O-N 3.36Å; V21-S23 PolarHBondContact O-N 3.14Å; S23-N27 VanDerWaalsContact O-CB 3.32Å; S23-N27 WeakPolarHBondContact O-CB 3.47Å; S23-N27 PolarHBondContact O-N 3.42Å; S23-N27 VanDerWaalsContact O-N 3.14Å; S23-N27 PolarHBondContact O-ND2 3.25Å; S23-N27 PolarHBondContact OG-ND2 2.91Å
24L93.1Very high91.1Very high44 Ų4463.3 Ų63.323%0.2334%0.344CS..Hα-helixtrans-64.4-40.5176.2-72.4171.5000112.3I20 V21 G22 G28 Y29 V30 L40I20-L24 HydrophobicContact CG2-CD1 4.1Å; I20-L24 VanDerWaalsContact O-CG 3.28Å; I20-L24 WeakPolarHBondContact O-CG 3.46Å; I20-L24 PolarHBondContact O-N 3.04Å; V21-L24 PolarHBondContact O-N 3.18Å; G22-L24 PolarHBondContact O-N 3.45Å; L24-G28 PolarHBondContact O-N 3.5Å; L24-Y29 HydrophobicContact CD2-CD2 4.23Å; L24-Y29 PolarHBondContact O-N 2.96Å; L24-V30 HydrophobicContact CB-CG2 4.29Å; L24-V30 HydrophobicContact CD2-CG2 4.36Å; L24-V30 PolarHBondContact O-N 3.41Å; L24-L40 HydrophobicContact CD1-CD1 3.89Å
25L92.2Very high91Very high31 Ų3163.2 Ų63.216%0.16234%0.344CS..Hα-helixtrans-72.6-49.1179.4-68.1174000111.8V21 G22 N27 G28 P32 L35 P43V21-L25 HydrophobicContact CG1-CD1 4Å; V21-L25 HydrophobicContact CG1-CG 4.48Å; V21-L25 WeakPolarHBondContact O-CG 3.16Å; V21-L25 PolarHBondContact O-N 3.1Å; V21-L25 VanDerWaalsContact O-N 3.08Å; G22-L25 PolarHBondContact O-N 3.05Å; L25-N27 VanDerWaalsContact C-N 3.33Å; L25-N27 PolarHBondContact O-N 3.41Å; L25-G28 PolarHBondContact O-N 3.15Å; L25-P32 HydrophobicContact CD2-CG 4.04Å; L25-L35 HydrophobicContact CD1-CD1 4.29Å; L25-L35 HydrophobicContact CD2-CD1 4.21Å; L25-L35 HydrophobicContact CD2-CD2 4.39Å; L25-L35 HydrophobicContact CD2-CG 4.41Å; L25-P43 HydrophobicContact CD1-CG 3.53Å
26E89.6Confident90.8Very high139 Ų13965.8 Ų65.865%0.6537%0.368SS*.Hα-helixtrans-63-37.7-177.9-74175176.200112.5G22 G28 L70G22-E26 WeakPolarHBondContact O-CB 3.47Å; G22-E26 VanDerWaalsContact O-CG 3.31Å; G22-E26 WeakPolarHBondContact O-CG 3.22Å; G22-E26 PolarHBondContact O-N 2.89Å; E26-G28 VanDerWaalsContact C-N 3.26Å; E26-G28 PolarHBondContact O-N 3.45Å; E26-L70 HydrophobicContact CG-CD2 4.18Å
27N91.3Very high90.6Very high96 Ų9667.9 Ų67.951%0.51338%0.383SS..THydrogen-bonded Turntrans-83.4-0.1177-67.2-64.4000113.4S23 L25 Y29S23-N27 VanDerWaalsContact O-CB 3.32Å; S23-N27 WeakPolarHBondContact O-CB 3.47Å; S23-N27 PolarHBondContact O-N 3.42Å; S23-N27 VanDerWaalsContact O-N 3.14Å; S23-N27 PolarHBondContact O-ND2 3.25Å; S23-N27 PolarHBondContact OG-ND2 2.91Å; L25-N27 VanDerWaalsContact C-N 3.33Å; L25-N27 PolarHBondContact O-N 3.41Å; N27-Y29 VanDerWaalsContact C-N 3.26Å; N27-Y29 HydrophobicContact CB-CD2 3.52Å; N27-Y29 HydrophobicContact CB-CE2 3.34Å; N27-Y29 HydrophobicContact CB-CG 4.39Å; N27-Y29 PolarHBondContact O-N 3.45Å
28G88.8Confident90.4Very high61 Ų6169.6 Ų69.663%0.62940%0.396SS*.THydrogen-bonded Turntrans67.820.617800000114.7L24 L25 E26 V30L24-G28 PolarHBondContact O-N 3.5Å; L25-G28 PolarHBondContact O-N 3.15Å; E26-G28 VanDerWaalsContact C-N 3.26Å; E26-G28 PolarHBondContact O-N 3.45Å; G28-V30 VanDerWaalsContact C-N 3.26Å; G28-V30 PolarHBondContact O-N 2.97Å
29Y90.6Very high90.1Very high168 Ų16872.2 Ų72.266%0.65942%0.423SS*.SBendtrans-70.6-26.5176.4-67.3-56.7000112.5L24 N27L24-Y29 HydrophobicContact CD2-CD2 4.23Å; L24-Y29 PolarHBondContact O-N 2.96Å; N27-Y29 VanDerWaalsContact C-N 3.26Å; N27-Y29 HydrophobicContact CB-CD2 3.52Å; N27-Y29 HydrophobicContact CB-CE2 3.34Å; N27-Y29 HydrophobicContact CB-CG 4.39Å; N27-Y29 PolarHBondContact O-N 3.45Å
30V90.9Very high90Very high17 Ų1770 Ų7010%0.10341%0.411CS..SBendtrans-143.7140.4-176.8-173.80000108.4L24 G28 E34 L35 L38L24-V30 HydrophobicContact CB-CG2 4.29Å; L24-V30 HydrophobicContact CD2-CG2 4.36Å; L24-V30 PolarHBondContact O-N 3.41Å; G28-V30 VanDerWaalsContact C-N 3.26Å; G28-V30 PolarHBondContact O-N 2.97Å; V30-E34 HydrophobicContact CG1-CB 3.55Å; V30-L35 HydrophobicContact CG1-CD2 4.08Å; V30-L35 HydrophobicContact CG1-CG 4.5Å; V30-L38 HydrophobicContact CG1-CD1 3.93Å; V30-L38 HydrophobicContact CG2-CD1 3.78Å
31K88.2Confident89.9Confident137 Ų13767.9 Ų67.960%0.59640%0.404SS*.  trans-83.8152.8168.9-65.7178.6-179.1175.60110.5S33 E34K31-S33 PolarHBondContact O-N 2.76Å; K31-S33 VanDerWaalsContact O-N 3.1Å; K31-E34 HydrophobicContact CB-CG 4.22Å; K31-E34 PolarHBondContact N-OE2 3.28Å; K31-E34 WeakPolarHBondContact O-CB 3.21Å; K31-E34 PolarHBondContact O-N 3.04Å
32P85.9Confident89.8Confident76 Ų7670.1 Ų70.149%0.49441%0.414SS..G310 helixtrans-48.5-43.5175.3-28.834.8000113.1L25 E34 L35L25-P32 HydrophobicContact CD2-CG 4.04Å; P32-E34 PolarHBondContact O-N 3.34Å; P32-L35 WeakPolarHBondContact O-CB 3.42Å; P32-L35 WeakPolarHBondContact O-CG 3.29Å; P32-L35 PolarHBondContact O-N 2.95Å; P32-L35 VanDerWaalsContact O-N 3.16Å
33S86Confident89.8Confident102 Ų10270.2 Ų70.271%0.71341%0.414SS*.G310 helixtrans-60.3-19.7177.257.50000115.7K31K31-S33 PolarHBondContact O-N 2.76Å; K31-S33 VanDerWaalsContact O-N 3.1Å
34E89.5Confident89.9Confident82 Ų8267.8 Ų67.838%0.38340%0.398SS..G310 helixtrans-93.6-13.7-176.8-66.8167.7168.600112.3V30 K31 P32 A36 S37 L38V30-E34 HydrophobicContact CG1-CB 3.55Å; K31-E34 HydrophobicContact CB-CG 4.22Å; K31-E34 PolarHBondContact N-OE2 3.28Å; K31-E34 WeakPolarHBondContact O-CB 3.21Å; K31-E34 PolarHBondContact O-N 3.04Å; P32-E34 PolarHBondContact O-N 3.34Å; E34-A36 VanDerWaalsContact C-N 3.33Å; E34-A36 PolarHBondContact O-N 3.34Å; E34-S37 WeakPolarHBondContact O-CB 3.41Å; E34-S37 PolarHBondContact O-N 3.18Å; E34-S37 VanDerWaalsContact O-N 3.07Å; E34-S37 PolarHBondContact O-OG 2.88Å; E34-L38 PolarHBondContact O-N 3.09Å
35L89.8Confident89.9Confident0 Ų069.9 Ų69.90%041%0.406CS..THydrogen-bonded Turntrans-57.5-43.9-177.3-69.8175.7000112.6V21 L25 V30 P32 S37 L38 G39 L40V21-L35 HydrophobicContact CG1-CD1 4.19Å; V21-L35 HydrophobicContact CG1-CD2 4.17Å; L25-L35 HydrophobicContact CD1-CD1 4.29Å; L25-L35 HydrophobicContact CD2-CD1 4.21Å; L25-L35 HydrophobicContact CD2-CD2 4.39Å; L25-L35 HydrophobicContact CD2-CG 4.41Å; V30-L35 HydrophobicContact CG1-CD2 4.08Å; V30-L35 HydrophobicContact CG1-CG 4.5Å; P32-L35 WeakPolarHBondContact O-CB 3.42Å; P32-L35 WeakPolarHBondContact O-CG 3.29Å; P32-L35 PolarHBondContact O-N 2.95Å; P32-L35 VanDerWaalsContact O-N 3.16Å; L35-S37 VanDerWaalsContact C-N 3.25Å; L35-S37 PolarHBondContact O-N 3.16Å; L35-L38 PolarHBondContact O-N 2.98Å; L35-G39 PolarHBondContact O-N 3.11Å; L35-L40 CarbonylContact C-O 3.4Å; L35-L40 HydrophobicContact CB-CB 4.37Å; L35-L40 HydrophobicContact CD2-CB 4.27Å; L35-L40 HydrophobicContact CD2-CD1 4.19Å; L35-L40 PolarHBondContact O-N 3.02Å
36A88.3Confident89.9Confident77 Ų7768.6 Ų68.664%0.63640%0.399SS*.G310 helixtrans-59.7-36.6178.600000112.2E34 L38 G39E34-A36 VanDerWaalsContact C-N 3.33Å; E34-A36 PolarHBondContact O-N 3.34Å; A36-L38 PolarHBondContact O-N 3.17Å; A36-G39 PolarHBondContact O-N 2.93Å; A36-G39 VanDerWaalsContact O-N 3.07Å
37S89Confident90.2Very high99 Ų9962 Ų6269%0.69237%0.369SS*.G310 helixtrans-66.7-25.6178.377.70000113.2E34 L35 G39E34-S37 WeakPolarHBondContact O-CB 3.41Å; E34-S37 PolarHBondContact O-N 3.18Å; E34-S37 VanDerWaalsContact O-N 3.07Å; E34-S37 PolarHBondContact O-OG 2.88Å; L35-S37 VanDerWaalsContact C-N 3.25Å; L35-S37 PolarHBondContact O-N 3.16Å; S37-G39 VanDerWaalsContact C-N 3.33Å
38L87.5Confident90.4Very high95 Ų9558.3 Ų58.350%0.49735%0.349SS..G310 helixtrans-89.51.4175.8-61.2176.4000112.9V30 E34 L35 A36 L40V30-L38 HydrophobicContact CG1-CD1 3.93Å; V30-L38 HydrophobicContact CG2-CD1 3.78Å; E34-L38 PolarHBondContact O-N 3.09Å; L35-L38 PolarHBondContact O-N 2.98Å; A36-L38 PolarHBondContact O-N 3.17Å; L38-L40 VanDerWaalsContact C-N 3.25Å; L38-L40 HydrophobicContact CB-CD1 4.11Å; L38-L40 HydrophobicContact CB-CG 4.06Å; L38-L40 HydrophobicContact CD1-CD1 4.33Å; L38-L40 PolarHBondContact O-N 2.67Å
39G88.4Confident90.6Very high57 Ų5759 Ų5959%0.58834%0.338SS*.THydrogen-bonded Turntrans63.732.2-173.400000112.7L35 A36 S37L35-G39 PolarHBondContact O-N 3.11Å; A36-G39 PolarHBondContact O-N 2.93Å; A36-G39 VanDerWaalsContact O-N 3.07Å; S37-G39 VanDerWaalsContact C-N 3.33Å
40L90.2Very high90.8Very high43 Ų4351 Ų5123%0.22531%0.307CS..  trans-104.7138.9173.4-60.4176.1000109.2V21 L24 L35 L38V21-L40 HydrophobicContact CG2-CB 4.49Å; V21-L40 HydrophobicContact CG2-CD1 4.49Å; L24-L40 HydrophobicContact CD1-CD1 3.89Å; L35-L40 CarbonylContact C-O 3.4Å; L35-L40 HydrophobicContact CB-CB 4.37Å; L35-L40 HydrophobicContact CD2-CB 4.27Å; L35-L40 HydrophobicContact CD2-CD1 4.19Å; L35-L40 PolarHBondContact O-N 3.02Å; L38-L40 VanDerWaalsContact C-N 3.25Å; L38-L40 HydrophobicContact CB-CD1 4.11Å; L38-L40 HydrophobicContact CB-CG 4.06Å; L38-L40 HydrophobicContact CD1-CD1 4.33Å; L38-L40 PolarHBondContact O-N 2.67Å
41S91Very high91Very high38 Ų3850.1 Ų50.127%0.26630%0.302SS..  trans-79.4153.4174.1-62.80000110.7E45S41-E45 WeakPolarHBondContact CB-OE2 3.39Å
42E91.1Very high91.3Very high51 Ų5146.8 Ų46.824%0.23829%0.29CS..  trans-60.3148.2173.7-69.7-62.7144.900111.2S44 E45 L46E42-S44 PolarHBondContact O-N 3.28Å; E42-E45 HydrophobicContact CB-CG 4.22Å; E42-E45 PolarHBondContact O-N 3.13Å; E42-E45 VanDerWaalsContact O-N 3.09Å; E42-L46 PolarHBondContact O-N 2.97Å; E42-L46 VanDerWaalsContact O-N 3.13Å
43P92.7Very high91.6Very high4 Ų446.7 Ų46.73%0.02628%0.284CS..Hα-helixtrans-52.6-41.9177.7-25.832.6000112.8V21 L25 E45 L46 M47 L70V21-P43 HydrophobicContact CG1-CG 3.91Å; L25-P43 HydrophobicContact CD1-CG 3.53Å; P43-E45 VanDerWaalsContact C-N 3.35Å; P43-E45 PolarHBondContact O-N 2.87Å; P43-L46 PolarHBondContact O-N 2.94Å; P43-M47 HydrophobicContact CB-CE 3.82Å; P43-M47 WeakPolarHBondContact O-CG 3.35Å; P43-M47 PolarHBondContact O-N 3.01Å; P43-L70 HydrophobicContact CB-CB 3.86Å; P43-L70 HydrophobicContact CB-CD1 4.16Å; P43-L70 HydrophobicContact CG-CB 4.11Å; P43-L70 HydrophobicContact CG-CD1 4.4Å
44S93.4Very high91.9Very high7 Ų743.5 Ų43.55%0.04926%0.257CS..Hα-helixtrans-62.8-39.4-179.567.40000112.4E42 M47 V48 F79 R82E42-S44 PolarHBondContact O-N 3.28Å; S44-M47 PolarHBondContact O-N 3.21Å; S44-V48 WeakPolarHBondContact O-CG2 3.47Å; S44-V48 PolarHBondContact O-N 3.35Å; S44-F79 WeakPolarHBondContact O-CE2 3.35Å; S44-R82 VanDerWaalsContact CB-NH2 3.31Å; S44-R82 PolarHBondContact OG-NH2 3.48Å
45E92.7Very high92Very high88 Ų8839.6 Ų39.641%0.41124%0.239SC..Hα-helixtrans-66.9-42.5176-65.5179.6166.600111.8S41 E42 P43 M47 V48 L49S41-E45 WeakPolarHBondContact CB-OE2 3.39Å; E42-E45 HydrophobicContact CB-CG 4.22Å; E42-E45 PolarHBondContact O-N 3.13Å; E42-E45 VanDerWaalsContact O-N 3.09Å; P43-E45 VanDerWaalsContact C-N 3.35Å; P43-E45 PolarHBondContact O-N 2.87Å; E45-M47 VanDerWaalsContact C-N 3.3Å; E45-M47 PolarHBondContact O-N 3.18Å; E45-V48 PolarHBondContact O-N 3.42Å; E45-L49 WeakPolarHBondContact O-CG 3.21Å; E45-L49 PolarHBondContact O-N 3.17Å
46L93.4Very high92Very high4 Ų440.1 Ų40.12%0.02124%0.243CC..Hα-helixtrans-63-38.1177.2-67.3178.3000111.9L18 V21 E42 P43 F50L18-L46 HydrophobicContact CD2-CB 3.46Å; L18-L46 VanDerWaalsContact CD2-CB 3.46Å; L18-L46 HydrophobicContact CD2-CD1 4.17Å; L18-L46 HydrophobicContact CD2-CG 4.48Å; L18-L46 HydrophobicContact CG-CB 4.01Å; V21-L46 HydrophobicContact CB-CD1 4.32Å; V21-L46 HydrophobicContact CG2-CD1 3.85Å; E42-L46 PolarHBondContact O-N 2.97Å; E42-L46 VanDerWaalsContact O-N 3.13Å; P43-L46 PolarHBondContact O-N 2.94Å; L46-F50 WeakPolarHBondContact O-CB 3.35Å; L46-F50 PolarHBondContact O-N 3.14Å
47M95.2Very high92Very high0 Ų043.5 Ų43.50%024%0.239CC..Hα-helixtrans-69.2-40.8176.2-69.1-175.2-128.100112.4L18 P43 S44 E45 F50 F51 L64 F67 L68 L70 V71 F79L18-M47 HydrophobicContact CD1-CG 4.28Å; L18-M47 HydrophobicContact CD2-CG 3.76Å; P43-M47 HydrophobicContact CB-CE 3.82Å; P43-M47 WeakPolarHBondContact O-CG 3.35Å; P43-M47 PolarHBondContact O-N 3.01Å; S44-M47 PolarHBondContact O-N 3.21Å; E45-M47 VanDerWaalsContact C-N 3.3Å; E45-M47 PolarHBondContact O-N 3.18Å; M47-F50 WeakPolarHBondContact O-CB 3.48Å; M47-F50 PolarHBondContact O-N 3.03Å; M47-F51 WeakPolarHBondContact O-CB 3.35Å; M47-F51 PolarHBondContact O-N 2.95Å; M47-L64 HydrophobicContact CB-CD2 4.15Å; M47-L64 HydrophobicContact CG-CD2 3.96Å; M47-F67 HydrophobicContact CE-CB 3.62Å; M47-F67 WeakPolarHBondContact CE-O 3.46Å; M47-F67 HydrophobicContact SD-CB 3.93Å; M47-L68 HydrophobicContact SD-CD2 4.28Å; M47-L70 HydrophobicContact CE-CB 4.29Å; M47-V71 HydrophobicContact CE-CG2 3.88Å; M47-V71 HydrophobicContact SD-CG2 4.32Å; M47-F79 HydrophobicContact CB-CE2 3.82Å; M47-F79 HydrophobicContact CB-CZ 3.73Å; M47-F79 HydrophobicContact SD-CZ 4Å
48V95.2Very high91.5Very high18 Ų1843.3 Ų43.311%0.10924%0.235CC..Hα-helixtrans-59.9-48.1173.71720000110.2S44 E45 F50 F51 D52 F79 R82 L83S44-V48 WeakPolarHBondContact O-CG2 3.47Å; S44-V48 PolarHBondContact O-N 3.35Å; E45-V48 PolarHBondContact O-N 3.42Å; V48-F50 VanDerWaalsContact C-N 3.32Å; V48-F50 PolarHBondContact O-N 2.93Å; V48-F51 CarbonylContact O-C 3.59Å; V48-F51 WeakPolarHBondContact O-CB 3.41Å; V48-F51 PolarHBondContact O-N 2.73Å; V48-F51 VanDerWaalsContact O-N 3.08Å; V48-D52 PolarHBondContact O-N 2.86Å; V48-F79 HydrophobicContact CG2-CD2 3.96Å; V48-F79 HydrophobicContact CG2-CE2 3.8Å; V48-R82 HydrophobicContact CG1-CB 4.43Å; V48-R82 HydrophobicContact CG2-CB 3.74Å; V48-L83 HydrophobicContact CG2-CD2 4.05Å
49L93.3Very high91.3Very high75 Ų7540 Ų4039%0.39322%0.22SC..Hα-helixtrans-58-45176.1-71.6170.4000111.5E45 F51 D52 M53E45-L49 WeakPolarHBondContact O-CG 3.21Å; E45-L49 PolarHBondContact O-N 3.17Å; L49-F51 VanDerWaalsContact C-N 3.29Å; L49-F51 PolarHBondContact O-N 2.66Å; L49-D52 PolarHBondContact O-N 3.26Å; L49-M53 VanDerWaalsContact C-CE 3.47Å; L49-M53 HydrophobicContact CB-CE 4.24Å; L49-M53 WeakPolarHBondContact O-CE 3.39Å; L49-M53 PolarHBondContact O-N 3.07Å
50F94.6Very high91.4Very high0 Ų037.3 Ų37.30%019%0.192CC..Hα-helixtrans-58-44.6175.6-174.3-88.9000111.7R11 Q14 L15 L46 M47 V48 M53 F54 V60 D63 L64R11-F50 HydrophobicContact CG-CE2 4.22Å; R11-F50 HydrophobicContact CG-CZ 4.28Å; Q14-F50 HydrophobicContact CB-CD2 3.56Å; Q14-F50 HydrophobicContact CB-CE2 4.1Å; Q14-F50 HydrophobicContact CG-CD2 4.17Å; L15-F50 HydrophobicContact CD1-CE2 4.48Å; L15-F50 HydrophobicContact CD2-CD2 4.27Å; L15-F50 HydrophobicContact CD2-CE2 3.7Å; L15-F50 HydrophobicContact CD2-CZ 3.98Å; L15-F50 HydrophobicContact CG-CE2 3.83Å; L15-F50 HydrophobicContact CG-CZ 4.34Å; L46-F50 WeakPolarHBondContact O-CB 3.35Å; L46-F50 PolarHBondContact O-N 3.14Å; M47-F50 WeakPolarHBondContact O-CB 3.48Å; M47-F50 PolarHBondContact O-N 3.03Å; V48-F50 VanDerWaalsContact C-N 3.32Å; V48-F50 PolarHBondContact O-N 2.93Å; F50-M53 PolarHBondContact O-N 3.19Å; F50-F54 HydrophobicContact CD1-CB 4.33Å; F50-F54 HydrophobicContact CD1-CD2 4.35Å; F50-F54 AromaticContact CD2-CD2 3.74Å; F50-F54 HydrophobicContact CD2-CD2 3.74Å; F50-F54 HydrophobicContact CD2-CE2 4.21Å; F50-F54 HydrophobicContact CE1-CB 3.93Å; F50-F54 HydrophobicContact CE1-CD2 4.23Å; F50-F54 HydrophobicContact CE1-CG 4.43Å; F50-F54 AromaticContact CE2-CD2 3.58Å; F50-F54 HydrophobicContact CE2-CD2 3.58Å; F50-F54 HydrophobicContact CE2-CE2 4.05Å; F50-F54 HydrophobicContact CE2-CG 4.34Å; F50-F54 HydrophobicContact CG-CD2 4.14Å; F50-F54 HydrophobicContact CZ-CB 4.12Å; F50-F54 AromaticContact CZ-CD2 3.85Å; F50-F54 HydrophobicContact CZ-CD2 3.85Å; F50-F54 HydrophobicContact CZ-CG 4.17Å; F50-F54 WeakPolarHBondContact O-CD2 3.37Å; F50-F54 PolarHBondContact O-N 3.39Å; F50-V60 HydrophobicContact CD1-CG2 4.26Å; F50-V60 HydrophobicContact CE1-CG2 4.05Å; F50-D63 HydrophobicContact CE1-CB 3.91Å; F50-D63 HydrophobicContact CZ-CB 3.79Å; F50-L64 HydrophobicContact CB-CD2 4.14Å; F50-L64 HydrophobicContact CD1-CD1 4.09Å; F50-L64 HydrophobicContact CD1-CD2 3.55Å; F50-L64 HydrophobicContact CD1-CG 3.79Å; F50-L64 HydrophobicContact CE1-CD2 4.2Å; F50-L64 HydrophobicContact CE1-CG 4.16Å; F50-L64 HydrophobicContact CG-CD2 3.98Å
51F95.5Very high91.3Very high0 Ų036 Ų360%019%0.186CC..Hα-helixtrans-66.1-35.7179.2-169.7-100.1000112.4M47 V48 L49 M53 G55 V60 L64 L83 A87 R111 N114 L115 L118M47-F51 WeakPolarHBondContact O-CB 3.35Å; M47-F51 PolarHBondContact O-N 2.95Å; V48-F51 CarbonylContact O-C 3.59Å; V48-F51 WeakPolarHBondContact O-CB 3.41Å; V48-F51 PolarHBondContact O-N 2.73Å; V48-F51 VanDerWaalsContact O-N 3.08Å; L49-F51 VanDerWaalsContact C-N 3.29Å; L49-F51 PolarHBondContact O-N 2.66Å; F51-M53 VanDerWaalsContact C-N 3.28Å; F51-M53 PolarHBondContact O-N 2.85Å; F51-G55 WeakPolarHBondContact O-CA 3.47Å; F51-G55 PolarHBondContact O-N 3.47Å; F51-V60 HydrophobicContact CD2-CG2 3.84Å; F51-V60 HydrophobicContact CE2-CG2 4.35Å; F51-L64 HydrophobicContact CB-CD1 4.38Å; F51-L64 HydrophobicContact CD2-CD1 4.27Å; F51-L83 HydrophobicContact CB-CD2 3.65Å; F51-L83 HydrophobicContact CD1-CB 4.44Å; F51-L83 HydrophobicContact CD1-CD2 3.78Å; F51-L83 HydrophobicContact CD2-CD2 4.38Å; F51-L83 HydrophobicContact CE1-CB 4.48Å; F51-L83 HydrophobicContact CG-CD2 3.69Å; F51-A87 HydrophobicContact CE1-CB 4.33Å; F51-R111 HydrophobicContact CE1-CG 3.74Å; F51-R111 HydrophobicContact CZ-CG 3.66Å; F51-R111 WeakPolarHBondContact CZ-O 3.29Å; F51-N114 HydrophobicContact CE2-CB 4.35Å; F51-L115 HydrophobicContact CZ-CB 4.02Å; F51-L118 HydrophobicContact CD2-CD1 3.82Å; F51-L118 HydrophobicContact CE2-CD1 3.75Å
52D93.9Very high91Very high66 Ų6639.3 Ų39.335%0.35319%0.192SC..Hα-helixtrans-59.1-40.2173.5-72.9-32.8000112.4V48 L49 S86 R111V48-D52 PolarHBondContact O-N 2.86Å; L49-D52 PolarHBondContact O-N 3.26Å; D52-S86 WeakPolarHBondContact OD1-CB 3.27Å; D52-S86 PolarHBondContact OD1-OG 3.31Å; D52-R111 PolarHBondContact O-NH1 3.38Å; D52-R111 PolarHBondContact O-NH2 3.45Å
53M92.1Very high91Very high74 Ų7437.4 Ų37.437%0.36518%0.184SC..Hα-helixtrans-82.6-36.2-178.2-74.6174.2-79.800113.8Q14 L49 F50 F51Q14-M53 HydrophobicContact CG-CE 3.92Å; Q14-M53 HydrophobicContact CG-SD 4.47Å; L49-M53 VanDerWaalsContact C-CE 3.47Å; L49-M53 HydrophobicContact CB-CE 4.24Å; L49-M53 WeakPolarHBondContact O-CE 3.39Å; L49-M53 PolarHBondContact O-N 3.07Å; F50-M53 PolarHBondContact O-N 3.19Å; F51-M53 VanDerWaalsContact C-N 3.28Å; F51-M53 PolarHBondContact O-N 2.85Å
54F92.7Very high91Very high35 Ų3537.3 Ų37.315%0.15418%0.183CC..Hα-helixtrans-1275.1-168-57.6-72.5000114R11 Q14 F50 S56 R57R11-F54 HydrophobicContact CB-CE1 3.98Å; R11-F54 HydrophobicContact CB-CE2 4.29Å; R11-F54 HydrophobicContact CB-CZ 3.83Å; Q14-F54 HydrophobicContact CG-CE2 4.2Å; F50-F54 HydrophobicContact CD1-CB 4.33Å; F50-F54 HydrophobicContact CD1-CD2 4.35Å; F50-F54 AromaticContact CD2-CD2 3.74Å; F50-F54 HydrophobicContact CD2-CD2 3.74Å; F50-F54 HydrophobicContact CD2-CE2 4.21Å; F50-F54 HydrophobicContact CE1-CB 3.93Å; F50-F54 HydrophobicContact CE1-CD2 4.23Å; F50-F54 HydrophobicContact CE1-CG 4.43Å; F50-F54 AromaticContact CE2-CD2 3.58Å; F50-F54 HydrophobicContact CE2-CD2 3.58Å; F50-F54 HydrophobicContact CE2-CE2 4.05Å; F50-F54 HydrophobicContact CE2-CG 4.34Å; F50-F54 HydrophobicContact CG-CD2 4.14Å; F50-F54 HydrophobicContact CZ-CB 4.12Å; F50-F54 AromaticContact CZ-CD2 3.85Å; F50-F54 HydrophobicContact CZ-CD2 3.85Å; F50-F54 HydrophobicContact CZ-CG 4.17Å; F50-F54 WeakPolarHBondContact O-CD2 3.37Å; F50-F54 PolarHBondContact O-N 3.39Å; F54-S56 PolarHBondContact O-N 3.27Å; F54-S56 VanDerWaalsContact O-N 3.1Å; F54-R57 HydrophobicContact CB-CG 4.32Å; F54-R57 HydrophobicContact CD1-CG 4.36Å; F54-R57 VanDerWaalsContact O-CB 3.27Å; F54-R57 WeakPolarHBondContact O-CB 3.49Å; F54-R57 PolarHBondContact O-N 3.38Å
55G91.6Very high90.8Very high0 Ų037.5 Ų37.50%018%0.183CC..THydrogen-bonded Turntrans-58.6-27.3-175.700000114.1F51 R57 R111 N114F51-G55 WeakPolarHBondContact O-CA 3.47Å; F51-G55 PolarHBondContact O-N 3.47Å; G55-R57 VanDerWaalsContact C-N 3.31Å; G55-R57 PolarHBondContact O-N 2.83Å; G55-R111 WeakPolarHBondContact O-CA 3.48Å; G55-N114 PolarHBondContact O-ND2 2.93Å
56S90.2Very high90.6Very high11 Ų1136.7 Ų36.78%0.07719%0.186CC..THydrogen-bonded Turntrans-87.410.7174.853.80000114.3F54 E107 L110F54-S56 PolarHBondContact O-N 3.27Å; F54-S56 VanDerWaalsContact O-N 3.1Å; S56-E107 WeakPolarHBondContact CB-O 3.44Å; S56-E107 VanDerWaalsContact OG-CG 3.3Å; S56-E107 WeakPolarHBondContact OG-CG 3.44Å; S56-E107 PolarHBondContact OG-OE1 3.46Å; S56-L110 WeakPolarHBondContact O-CD2 3.32Å
57R87.8Confident90.5Very high149 Ų14937.3 Ų37.356%0.56219%0.188SC*.SBendtrans-104137.4178.9-56.8-60.8-175.6170.6-3.2110.4F54 G55 C59 V60 N114F54-R57 HydrophobicContact CB-CG 4.32Å; F54-R57 HydrophobicContact CD1-CG 4.36Å; F54-R57 VanDerWaalsContact O-CB 3.27Å; F54-R57 WeakPolarHBondContact O-CB 3.49Å; F54-R57 PolarHBondContact O-N 3.38Å; G55-R57 VanDerWaalsContact C-N 3.31Å; G55-R57 PolarHBondContact O-N 2.83Å; R57-C59 PolarHBondContact O-N 3.47Å; R57-V60 WeakPolarHBondContact O-CB 3.32Å; R57-V60 VanDerWaalsContact O-CG1 3.3Å; R57-V60 WeakPolarHBondContact O-CG1 3.19Å; R57-V60 PolarHBondContact O-N 3.03Å; R57-N114 PolarHBondContact O-ND2 3.35Å
58P79Confident90.4Very high94 Ų9437.5 Ų37.561%0.6119%0.189SC*.THydrogen-bonded Turntrans-56.6-24.2176.8-26.234.2000114.3V60 L110P58-V60 VanDerWaalsContact C-N 3.28Å; P58-V60 PolarHBondContact O-N 2.86Å; P58-L110 HydrophobicContact CG-CD2 4.43Å
59C84.1Confident90.1Very high26 Ų2640.1 Ų40.118%0.17621%0.207CC..THydrogen-bonded Turntrans-74.6-12.3179.764.80000114.8R57 L61 R62 D63R57-C59 PolarHBondContact O-N 3.47Å; C59-L61 VanDerWaalsContact C-N 3.29Å; C59-L61 PolarHBondContact O-N 2.7Å; C59-R62 PolarHBondContact O-N 3.19Å; C59-D63 WeakPolarHBondContact O-CB 3.4Å; C59-D63 PolarHBondContact O-N 3.29Å
60V90.2Very high90Very high0 Ų038.4 Ų38.40%020%0.197CC..Hα-helixtrans-59.3-39.4-171.770.50000112.6F50 F51 R57 P58 D63 L64 N114F50-V60 HydrophobicContact CD1-CG2 4.26Å; F50-V60 HydrophobicContact CE1-CG2 4.05Å; F51-V60 HydrophobicContact CD2-CG2 3.84Å; F51-V60 HydrophobicContact CE2-CG2 4.35Å; R57-V60 WeakPolarHBondContact O-CB 3.32Å; R57-V60 VanDerWaalsContact O-CG1 3.3Å; R57-V60 WeakPolarHBondContact O-CG1 3.19Å; R57-V60 PolarHBondContact O-N 3.03Å; P58-V60 VanDerWaalsContact C-N 3.28Å; P58-V60 PolarHBondContact O-N 2.86Å; V60-D63 PolarHBondContact O-N 3.48Å; V60-L64 HydrophobicContact CG2-CD1 3.75Å; V60-L64 HydrophobicContact CG2-CG 4.15Å; V60-L64 WeakPolarHBondContact O-CB 3.48Å; V60-L64 PolarHBondContact O-N 2.86Å; V60-N114 HydrophobicContact CG1-CB 3.58Å; V60-N114 VanDerWaalsContact CG1-CG 3.4Å; V60-N114 VanDerWaalsContact CG1-ND2 3.28Å; V60-N114 WeakPolarHBondContact CG1-ND2 3.39Å
61L87.2Confident89.8Confident17 Ų1738.5 Ų38.59%0.08920%0.198CC..Hα-helixtrans-63.5-54.3-179.5-61.9179.4000110.6C59 D63 L64 I65 N114 H117 L118 I258C59-L61 VanDerWaalsContact C-N 3.29Å; C59-L61 PolarHBondContact O-N 2.7Å; L61-D63 PolarHBondContact O-N 2.92Å; L61-D63 VanDerWaalsContact O-N 3.15Å; L61-L64 PolarHBondContact O-N 3.23Å; L61-I65 HydrophobicContact CB-CD1 4.19Å; L61-I65 WeakPolarHBondContact O-CB 3.42Å; L61-I65 WeakPolarHBondContact O-CD1 3.24Å; L61-I65 WeakPolarHBondContact O-CG1 3.47Å; L61-I65 PolarHBondContact O-N 3.37Å; L61-N114 HydrophobicContact CD2-CB 4.36Å; L61-N114 WeakPolarHBondContact CD2-O 3.25Å; L61-H117 HydrophobicContact CD1-CB 3.6Å; L61-H117 HydrophobicContact CD2-CB 3.54Å; L61-H117 HydrophobicContact CG-CB 4.23Å; L61-L118 HydrophobicContact CD2-CD2 3.88Å; L61-L118 HydrophobicContact CD2-CG 3.78Å; L61-I258 HydrophobicContact CD1-CD1 3.77Å
62R85.9Confident89.5Confident107 Ų10740.6 Ų40.640%0.40421%0.213SC..Hα-helixtrans-54.3-36.2176.4-179.1-171.264.3-148.5-1.5112.4C59 P66C59-R62 PolarHBondContact O-N 3.19Å; R62-P66 VanDerWaalsContact O-CD 3.22Å; R62-P66 WeakPolarHBondContact O-CD 3.31Å
63D90.5Very high89.2Confident11 Ų1142.7 Ų42.76%0.05922%0.22CC..Hα-helixtrans-80.9-35.8-174.1-69.1-7.2000112.9R11 L15 F50 C59 V60 L61 F67R11-D63 IonicContact CZ-OD1 3.9Å; R11-D63 IonicContact CZ-OD2 2.67Å; R11-D63 IonicContact NE-OD1 2.65Å; R11-D63 IonicContact NE-OD2 2.94Å; R11-D63 PolarHBondContact NE-OD2 3.15Å; R11-D63 IonicContact NH2-OD1 3.75Å; R11-D63 PolarHBondContact NH2-OD1 3.38Å; R11-D63 IonicContact NH2-OD2 3.67Å; R11-D63 PolarHBondContact NH2-OD2 3.44Å; L15-D63 HydrophobicContact CD1-CB 4.39Å; L15-D63 HydrophobicContact CD2-CB 3.94Å; F50-D63 HydrophobicContact CE1-CB 3.91Å; F50-D63 HydrophobicContact CZ-CB 3.79Å; C59-D63 WeakPolarHBondContact O-CB 3.4Å; C59-D63 PolarHBondContact O-N 3.29Å; V60-D63 PolarHBondContact O-N 3.48Å; L61-D63 PolarHBondContact O-N 2.92Å; L61-D63 VanDerWaalsContact O-N 3.15Å; D63-F67 WeakPolarHBondContact O-CD2 3.37Å; D63-F67 WeakPolarHBondContact O-CE2 3.26Å
64L92.4Very high89.1Confident1 Ų147 Ų471%0.00524%0.24CC..Hα-helixtrans-92-31.9-178.3-69.2-174.4000113.5L18 M47 F50 F51 V60 L61 P66 F67 L68 L118L18-L64 HydrophobicContact CD1-CD2 4.23Å; M47-L64 HydrophobicContact CB-CD2 4.15Å; M47-L64 HydrophobicContact CG-CD2 3.96Å; F50-L64 HydrophobicContact CB-CD2 4.14Å; F50-L64 HydrophobicContact CD1-CD1 4.09Å; F50-L64 HydrophobicContact CD1-CD2 3.55Å; F50-L64 HydrophobicContact CD1-CG 3.79Å; F50-L64 HydrophobicContact CE1-CD2 4.2Å; F50-L64 HydrophobicContact CE1-CG 4.16Å; F50-L64 HydrophobicContact CG-CD2 3.98Å; F51-L64 HydrophobicContact CB-CD1 4.38Å; F51-L64 HydrophobicContact CD2-CD1 4.27Å; V60-L64 HydrophobicContact CG2-CD1 3.75Å; V60-L64 HydrophobicContact CG2-CG 4.15Å; V60-L64 WeakPolarHBondContact O-CB 3.48Å; V60-L64 PolarHBondContact O-N 2.86Å; L61-L64 PolarHBondContact O-N 3.23Å; L64-P66 VanDerWaalsContact C-N 3.31Å; L64-F67 PolarHBondContact O-N 3.03Å; L64-L68 PolarHBondContact O-N 3.48Å; L64-L118 HydrophobicContact CB-CD2 4.06Å; L64-L118 HydrophobicContact CD1-CD1 4.01Å; L64-L118 HydrophobicContact CD1-CD2 4.45Å
65I89.4Confident89Confident12 Ų1248.9 Ų48.96%0.06225%0.249CC..THydrogen-bonded Turntrans-47.1-44.1-179.3-87.6171.4000113.9L61 F67 L68 A121 P257 R265L61-I65 HydrophobicContact CB-CD1 4.19Å; L61-I65 WeakPolarHBondContact O-CB 3.42Å; L61-I65 WeakPolarHBondContact O-CD1 3.24Å; L61-I65 WeakPolarHBondContact O-CG1 3.47Å; L61-I65 PolarHBondContact O-N 3.37Å; I65-F67 PolarHBondContact O-N 2.9Å; I65-L68 HydrophobicContact CG1-CD1 4.28Å; I65-L68 PolarHBondContact O-N 3.21Å; I65-A121 HydrophobicContact CG1-CB 4.38Å; I65-P257 HydrophobicContact CD1-CB 4.41Å; I65-R265 VanDerWaalsContact CG2-CZ 3.49Å; I65-R265 VanDerWaalsContact CG2-NH1 3.32Å
66P89Confident89Confident71 Ų7152 Ų5246%0.46126%0.261SS..THydrogen-bonded Turntrans-63.5-26.4179.3-24.936000113.8R62 L64 P69R62-P66 VanDerWaalsContact O-CD 3.22Å; R62-P66 WeakPolarHBondContact O-CD 3.31Å; L64-P66 VanDerWaalsContact C-N 3.31Å; P66-P69 WeakPolarHBondContact O-CD 3.45Å
67F91.8Very high89.1Confident16 Ų1657 Ų577%0.0729%0.287CS..THydrogen-bonded Turntrans-96.2-15-175.2-54.3-71.4000113.3L15 L18 N19 M47 D63 L64 I65 P69 L70L15-F67 HydrophobicContact CD2-CE2 4.07Å; L18-F67 HydrophobicContact CB-CD1 4.1Å; L18-F67 HydrophobicContact CB-CD2 4.26Å; L18-F67 HydrophobicContact CB-CE1 3.89Å; L18-F67 HydrophobicContact CB-CE2 4.05Å; L18-F67 HydrophobicContact CB-CG 4.28Å; L18-F67 HydrophobicContact CB-CZ 3.86Å; L18-F67 HydrophobicContact CD1-CD2 4.1Å; L18-F67 HydrophobicContact CD1-CE2 4.25Å; N19-F67 WeakPolarHBondContact OD1-CE1 3.41Å; N19-F67 VanDerWaalsContact OD1-CZ 3.26Å; N19-F67 WeakPolarHBondContact OD1-CZ 3.35Å; M47-F67 HydrophobicContact CE-CB 3.62Å; M47-F67 WeakPolarHBondContact CE-O 3.46Å; M47-F67 HydrophobicContact SD-CB 3.93Å; D63-F67 WeakPolarHBondContact O-CD2 3.37Å; D63-F67 WeakPolarHBondContact O-CE2 3.26Å; L64-F67 PolarHBondContact O-N 3.03Å; I65-F67 PolarHBondContact O-N 2.9Å; F67-P69 VanDerWaalsContact C-N 3.27Å; F67-P69 VanDerWaalsContact O-N 3.16Å; F67-L70 HydrophobicContact CB-CD1 4.23Å; F67-L70 HydrophobicContact CD1-CD1 4.12Å; F67-L70 WeakPolarHBondContact O-CB 3.34Å; F67-L70 WeakPolarHBondContact O-CG 3.24Å; F67-L70 PolarHBondContact O-N 3.48Å
68L91.4Very high89.4Confident4 Ų455.9 Ų55.92%0.02129%0.288CS..G310 helixtrans-51.1-35.9178.2-62-179.1000114.6M47 L64 I65 L70 V71 F79 L118 A121 L122M47-L68 HydrophobicContact SD-CD2 4.28Å; L64-L68 PolarHBondContact O-N 3.48Å; I65-L68 HydrophobicContact CG1-CD1 4.28Å; I65-L68 PolarHBondContact O-N 3.21Å; L68-L70 PolarHBondContact O-N 3.16Å; L68-L70 VanDerWaalsContact O-N 3.14Å; L68-V71 PolarHBondContact O-N 2.96Å; L68-F79 HydrophobicContact CD2-CE1 4.21Å; L68-L118 HydrophobicContact CD1-CD2 4.31Å; L68-L118 HydrophobicContact CD2-CD2 4.39Å; L68-A121 HydrophobicContact CD1-CB 3.56Å; L68-L122 HydrophobicContact CB-CD2 4.07Å; L68-L122 HydrophobicContact CD1-CD2 4.44Å; L68-L122 HydrophobicContact CD1-CG 4.3Å; L68-L122 HydrophobicContact CD2-CD2 4.03Å; L68-L122 HydrophobicContact CD2-CG 4.26Å; L68-L122 HydrophobicContact CG-CD2 4.39Å
69P90.2Very high90.2Very high74 Ų7451.5 Ų51.548%0.48126%0.259SS..G310 helixtrans-61.1-18.5175-24.536000114.8P66 F67 V71 V262P66-P69 WeakPolarHBondContact O-CD 3.45Å; F67-P69 VanDerWaalsContact C-N 3.27Å; F67-P69 VanDerWaalsContact O-N 3.16Å; P69-V71 PolarHBondContact O-N 3.42Å; P69-V262 HydrophobicContact CG-CG1 4.03Å
70L90.9Very high90.7Very high38 Ų3850.6 Ų50.620%0.19925%0.252CS..G310 helixtrans-74.5-12.6175.8-57.3174.8000112.9E26 P43 M47 F67 L68E26-L70 HydrophobicContact CG-CD2 4.18Å; P43-L70 HydrophobicContact CB-CB 3.86Å; P43-L70 HydrophobicContact CB-CD1 4.16Å; P43-L70 HydrophobicContact CG-CB 4.11Å; P43-L70 HydrophobicContact CG-CD1 4.4Å; M47-L70 HydrophobicContact CE-CB 4.29Å; F67-L70 HydrophobicContact CB-CD1 4.23Å; F67-L70 HydrophobicContact CD1-CD1 4.12Å; F67-L70 WeakPolarHBondContact O-CB 3.34Å; F67-L70 WeakPolarHBondContact O-CG 3.24Å; F67-L70 PolarHBondContact O-N 3.48Å; L68-L70 PolarHBondContact O-N 3.16Å; L68-L70 VanDerWaalsContact O-N 3.14Å
71V91.4Very high90.9Very high2 Ų254 Ų541%0.01227%0.269CS..SBendtrans-88.7117.3174.8-175.50000108.7M47 L68 P69 Q75 R76 F79M47-V71 HydrophobicContact CE-CG2 3.88Å; M47-V71 HydrophobicContact SD-CG2 4.32Å; L68-V71 PolarHBondContact O-N 2.96Å; P69-V71 PolarHBondContact O-N 3.42Å; V71-Q75 HydrophobicContact CG1-CB 4.19Å; V71-R76 HydrophobicContact CG1-CG 4.31Å; V71-F79 HydrophobicContact CG1-CB 4.08Å; V71-F79 HydrophobicContact CG1-CD1 4.14Å; V71-F79 HydrophobicContact CG1-CG 4.19Å; V71-F79 HydrophobicContact CG2-CD1 4.13Å; V71-F79 HydrophobicContact CG2-CE1 4.12Å; V71-F79 HydrophobicContact CG2-CG 4.42Å; V71-F79 HydrophobicContact CG2-CZ 4.42Å
72S87.7Confident91.3Very high45 Ų4556.2 Ų56.232%0.31528%0.276SS..  trans-64.8152.7179.588.80000111.2E74 Q75 R76S72-E74 WeakPolarHBondContact CB-OE2 3.46Å; S72-E74 PolarHBondContact O-N 3.46Å; S72-E74 PolarHBondContact OG-OE2 3.4Å; S72-Q75 PolarHBondContact O-N 2.98Å; S72-Q75 WeakPolarHBondContact OG-CG 3.21Å; S72-R76 WeakPolarHBondContact O-CG 3.29Å; S72-R76 PolarHBondContact O-N 3.06Å
73E88.5Confident91.8Very high109 Ų10951.1 Ų51.151%0.50926%0.256SS..G310 helixtrans-59.7-35.7-177.1-51.1-148.613200111.4Q75 R76 K263E73-Q75 PolarHBondContact O-N 3.35Å; E73-R76 PolarHBondContact O-N 3.35Å; E73-R76 IonicContact OE1-CZ 2.77Å; E73-R76 IonicContact OE1-NH1 3.44Å; E73-R76 PolarHBondContact OE1-NH1 2.9Å; E73-R76 IonicContact OE1-NH2 3.41Å; E73-R76 PolarHBondContact OE1-NH2 2.85Å; E73-K263 IonicContact OE1-NZ 3.52Å
74E89Confident92Very high165 Ų16553 Ų5377%0.77126%0.263SS*.G310 helixtrans-68.1-21.8178.8-49.981.5-176.400113.3S72S72-E74 WeakPolarHBondContact CB-OE2 3.46Å; S72-E74 PolarHBondContact O-N 3.46Å; S72-E74 PolarHBondContact OG-OE2 3.4Å
75Q90.5Very high92Very high75 Ų7557.8 Ų57.835%0.3529%0.285SS..G310 helixtrans-97.9-6.6-179.1-68.5-177.9-1000113.3V71 S72 E73 D77 Q78 F79V71-Q75 HydrophobicContact CG1-CB 4.19Å; S72-Q75 PolarHBondContact O-N 2.98Å; S72-Q75 WeakPolarHBondContact OG-CG 3.21Å; E73-Q75 PolarHBondContact O-N 3.35Å; Q75-D77 PolarHBondContact O-N 2.95Å; Q75-Q78 PolarHBondContact O-N 3.21Å; Q75-F79 WeakPolarHBondContact O-CB 3.44Å; Q75-F79 PolarHBondContact O-N 2.85Å
76R92.5Very high92Very high66 Ų6658 Ų5825%0.24929%0.287CS..Hα-helixtrans-60.1-46-172.5-74.6-176.7-176.1149.95.4112.7V71 S72 E73 Q78 F79 I80 L122V71-R76 HydrophobicContact CG1-CG 4.31Å; S72-R76 WeakPolarHBondContact O-CG 3.29Å; S72-R76 PolarHBondContact O-N 3.06Å; E73-R76 PolarHBondContact O-N 3.35Å; E73-R76 IonicContact OE1-CZ 2.77Å; E73-R76 IonicContact OE1-NH1 3.44Å; E73-R76 PolarHBondContact OE1-NH1 2.9Å; E73-R76 IonicContact OE1-NH2 3.41Å; E73-R76 PolarHBondContact OE1-NH2 2.85Å; R76-Q78 PolarHBondContact O-N 2.9Å; R76-F79 WeakPolarHBondContact O-CB 3.46Å; R76-F79 PolarHBondContact O-N 3.41Å; R76-F79 VanDerWaalsContact O-N 3.17Å; R76-I80 WeakPolarHBondContact O-CG1 3.42Å; R76-I80 PolarHBondContact O-N 3.36Å; R76-L122 HydrophobicContact CG-CD2 4.46Å
77D92.2Very high92.1Very high115 Ų11554.6 Ų54.662%0.61527%0.265SS*.Hα-helixtrans-63.2-45.4-178.8-67.9-21.7000111.7Q75 F79 I80 E81Q75-D77 PolarHBondContact O-N 2.95Å; D77-F79 VanDerWaalsContact C-N 3.28Å; D77-F79 PolarHBondContact O-N 3Å; D77-I80 PolarHBondContact O-N 3.17Å; D77-E81 WeakPolarHBondContact O-CB 3.48Å; D77-E81 PolarHBondContact O-N 3.2Å
78Q94.2Very high91.9Very high126 Ų12657 Ų5759%0.58928%0.284SS*.Hα-helixtrans-65.1-34176.1-169.6-174.22700111.9Q75 R76 R82Q75-Q78 PolarHBondContact O-N 3.21Å; R76-Q78 PolarHBondContact O-N 2.9Å; Q78-R82 WeakPolarHBondContact O-CG 3.4Å; Q78-R82 PolarHBondContact O-N 3.34Å; Q78-R82 PolarHBondContact O-NE 3.46Å
79F95.4Very high91.8Very high1 Ų160.6 Ų60.60%0.00430%0.303CS..Hα-helixtrans-69-46.1175.8177.3-119.1000111.8S44 M47 V48 L68 V71 Q75 R76 D77 E81 R82 L83 L122S44-F79 WeakPolarHBondContact O-CE2 3.35Å; M47-F79 HydrophobicContact CB-CE2 3.82Å; M47-F79 HydrophobicContact CB-CZ 3.73Å; M47-F79 HydrophobicContact SD-CZ 4Å; V48-F79 HydrophobicContact CG2-CD2 3.96Å; V48-F79 HydrophobicContact CG2-CE2 3.8Å; L68-F79 HydrophobicContact CD2-CE1 4.21Å; V71-F79 HydrophobicContact CG1-CB 4.08Å; V71-F79 HydrophobicContact CG1-CD1 4.14Å; V71-F79 HydrophobicContact CG1-CG 4.19Å; V71-F79 HydrophobicContact CG2-CD1 4.13Å; V71-F79 HydrophobicContact CG2-CE1 4.12Å; V71-F79 HydrophobicContact CG2-CG 4.42Å; V71-F79 HydrophobicContact CG2-CZ 4.42Å; Q75-F79 WeakPolarHBondContact O-CB 3.44Å; Q75-F79 PolarHBondContact O-N 2.85Å; R76-F79 WeakPolarHBondContact O-CB 3.46Å; R76-F79 PolarHBondContact O-N 3.41Å; R76-F79 VanDerWaalsContact O-N 3.17Å; D77-F79 VanDerWaalsContact C-N 3.28Å; D77-F79 PolarHBondContact O-N 3Å; F79-E81 VanDerWaalsContact C-N 3.32Å; F79-E81 PolarHBondContact O-N 3.28Å; F79-R82 PolarHBondContact O-N 2.8Å; F79-L83 HydrophobicContact CD1-CD1 4.21Å; F79-L83 HydrophobicContact CE1-CD1 3.73Å; F79-L83 HydrophobicContact CE2-CD1 4.29Å; F79-L83 HydrophobicContact CE2-CD2 4.29Å; F79-L83 HydrophobicContact CE2-CG 4.25Å; F79-L83 HydrophobicContact CZ-CD1 3.77Å; F79-L83 HydrophobicContact CZ-CD2 4.3Å; F79-L83 HydrophobicContact CZ-CG 4.22Å; F79-L83 WeakPolarHBondContact O-CG 3.37Å; F79-L83 PolarHBondContact O-N 3.49Å; F79-L122 HydrophobicContact CD1-CD1 3.86Å; F79-L122 HydrophobicContact CE1-CD1 3.97Å
80I94.9Very high91.7Very high7 Ų758.5 Ų58.54%0.03629%0.288CS..Hα-helixtrans-59.6-44.2176-71169.3000110.4R76 D77 R82 L83 R84 L122 Y124R76-I80 WeakPolarHBondContact O-CG1 3.42Å; R76-I80 PolarHBondContact O-N 3.36Å; D77-I80 PolarHBondContact O-N 3.17Å; I80-R82 VanDerWaalsContact C-N 3.32Å; I80-R82 PolarHBondContact O-N 3.16Å; I80-L83 CarbonylContact O-C 3.34Å; I80-L83 PolarHBondContact O-N 3Å; I80-L83 VanDerWaalsContact O-N 3.14Å; I80-R84 WeakPolarHBondContact O-CB 3.5Å; I80-R84 PolarHBondContact O-N 3.08Å; I80-L122 HydrophobicContact CD1-CD1 4.11Å; I80-L122 HydrophobicContact CG1-CD1 3.78Å; I80-Y124 HydrophobicContact CD1-CD2 3.35Å; I80-Y124 HydrophobicContact CD1-CE2 4.08Å; I80-Y124 HydrophobicContact CD1-CG 3.73Å
81E94.9Very high91.7Very high73 Ų7358.4 Ų58.434%0.34129%0.29SS..Hα-helixtrans-62.3-39.1178.7-174.657.8-163.300112.4D77 F79 L83 R84 H85D77-E81 WeakPolarHBondContact O-CB 3.48Å; D77-E81 PolarHBondContact O-N 3.2Å; F79-E81 VanDerWaalsContact C-N 3.32Å; F79-E81 PolarHBondContact O-N 3.28Å; E81-L83 PolarHBondContact O-N 3.4Å; E81-R84 VanDerWaalsContact CD-NE 3.34Å; E81-R84 WeakPolarHBondContact O-CB 3.39Å; E81-R84 PolarHBondContact O-N 3.46Å; E81-R84 IonicContact OE1-CZ 2.83Å; E81-R84 IonicContact OE1-NE 3.32Å; E81-R84 PolarHBondContact OE1-NE 3.07Å; E81-R84 IonicContact OE1-NH2 3.39Å; E81-R84 PolarHBondContact OE1-NH2 2.83Å; E81-R84 IonicContact OE2-CZ 2.91Å; E81-R84 IonicContact OE2-NE 3.21Å; E81-R84 PolarHBondContact OE2-NE 3.08Å; E81-R84 IonicContact OE2-NH2 3.56Å; E81-H85 PolarHBondContact O-CD2 3.22Å; E81-H85 VanDerWaalsContact O-CD2 3.24Å; E81-H85 PolarHBondContact O-N 3.45Å; E81-H85 IonicContact OE1-CE1 3.32Å; E81-H85 PolarHBondContact OE1-CE1 3.35Å; E81-H85 IonicContact OE1-NE2 2.67Å; E81-H85 PolarHBondContact OE1-NE2 3.39Å
82R95.4Very high91.7Very high62 Ų6258.9 Ų58.923%0.23429%0.292CS..Hα-helixtrans-62.8-42.4173.4-74.2-177.8-71.9167.8-1.6112.1S44 V48 Q78 F79 I80 R84 H85 S86S44-R82 VanDerWaalsContact CB-NH2 3.31Å; S44-R82 PolarHBondContact OG-NH2 3.48Å; V48-R82 HydrophobicContact CG1-CB 4.43Å; V48-R82 HydrophobicContact CG2-CB 3.74Å; Q78-R82 WeakPolarHBondContact O-CG 3.4Å; Q78-R82 PolarHBondContact O-N 3.34Å; Q78-R82 PolarHBondContact O-NE 3.46Å; F79-R82 PolarHBondContact O-N 2.8Å; I80-R82 VanDerWaalsContact C-N 3.32Å; I80-R82 PolarHBondContact O-N 3.16Å; R82-R84 VanDerWaalsContact C-N 3.3Å; R82-R84 PolarHBondContact O-N 3.05Å; R82-H85 PolarHBondContact O-N 3.46Å; R82-S86 PolarHBondContact O-N 2.9Å; R82-S86 PolarHBondContact O-OG 3.36Å
83L95.7Very high91.6Very high0 Ų058.8 Ų58.80%029%0.291CS..Hα-helixtrans-66.4-33.1174.7-62174.5000112.2V48 F51 F79 I80 E81 S86 A87 L115 L118V48-L83 HydrophobicContact CG2-CD2 4.05Å; F51-L83 HydrophobicContact CB-CD2 3.65Å; F51-L83 HydrophobicContact CD1-CB 4.44Å; F51-L83 HydrophobicContact CD1-CD2 3.78Å; F51-L83 HydrophobicContact CD2-CD2 4.38Å; F51-L83 HydrophobicContact CE1-CB 4.48Å; F51-L83 HydrophobicContact CG-CD2 3.69Å; F79-L83 HydrophobicContact CD1-CD1 4.21Å; F79-L83 HydrophobicContact CE1-CD1 3.73Å; F79-L83 HydrophobicContact CE2-CD1 4.29Å; F79-L83 HydrophobicContact CE2-CD2 4.29Å; F79-L83 HydrophobicContact CE2-CG 4.25Å; F79-L83 HydrophobicContact CZ-CD1 3.77Å; F79-L83 HydrophobicContact CZ-CD2 4.3Å; F79-L83 HydrophobicContact CZ-CG 4.22Å; F79-L83 WeakPolarHBondContact O-CG 3.37Å; F79-L83 PolarHBondContact O-N 3.49Å; I80-L83 CarbonylContact O-C 3.34Å; I80-L83 PolarHBondContact O-N 3Å; I80-L83 VanDerWaalsContact O-N 3.14Å; E81-L83 PolarHBondContact O-N 3.4Å; L83-S86 WeakPolarHBondContact O-CB 3.48Å; L83-S86 PolarHBondContact O-N 3.19Å; L83-A87 PolarHBondContact O-N 3.34Å; L83-L115 HydrophobicContact CB-CD1 3.55Å; L83-L115 HydrophobicContact CD1-CD1 4.13Å; L83-L118 HydrophobicContact CD1-CD1 4.26Å
84R94.6Very high91.1Very high50 Ų5054.6 Ų54.619%0.18927%0.274CS..Hα-helixtrans-62.3-44.6175.9-162.9-175.770.176.914.8111.5I80 E81 R82 S86 A87 S88 D89 L90 L115I80-R84 WeakPolarHBondContact O-CB 3.5Å; I80-R84 PolarHBondContact O-N 3.08Å; E81-R84 VanDerWaalsContact CD-NE 3.34Å; E81-R84 WeakPolarHBondContact O-CB 3.39Å; E81-R84 PolarHBondContact O-N 3.46Å; E81-R84 IonicContact OE1-CZ 2.83Å; E81-R84 IonicContact OE1-NE 3.32Å; E81-R84 PolarHBondContact OE1-NE 3.07Å; E81-R84 IonicContact OE1-NH2 3.39Å; E81-R84 PolarHBondContact OE1-NH2 2.83Å; E81-R84 IonicContact OE2-CZ 2.91Å; E81-R84 IonicContact OE2-NE 3.21Å; E81-R84 PolarHBondContact OE2-NE 3.08Å; E81-R84 IonicContact OE2-NH2 3.56Å; R82-R84 VanDerWaalsContact C-N 3.3Å; R82-R84 PolarHBondContact O-N 3.05Å; R84-S86 VanDerWaalsContact C-N 3.3Å; R84-S86 PolarHBondContact O-N 2.84Å; R84-A87 CarbonylContact O-C 3.59Å; R84-A87 WeakPolarHBondContact O-CA 3.32Å; R84-A87 PolarHBondContact O-N 3.44Å; R84-S88 PolarHBondContact O-N 2.91Å; R84-D89 IonicContact CZ-OD1 3.38Å; R84-D89 VanDerWaalsContact NH1-C 3.33Å; R84-D89 PolarHBondContact NH1-O 3.43Å; R84-D89 IonicContact NH1-OD1 3.8Å; R84-D89 PolarHBondContact NH1-OD1 3.42Å; R84-D89 IonicContact NH2-OD1 2.73Å; R84-D89 PolarHBondContact NH2-OD1 3.35Å; R84-D89 PolarHBondContact O-N 3.34Å; R84-L90 WeakPolarHBondContact CG-O 3.3Å; R84-L115 HydrophobicContact CB-CD2 4.21Å; R84-L115 HydrophobicContact CG-CD2 4.37Å
85H93.3Very high90.5Very high102 Ų10248.6 Ų48.647%0.47225%0.252SS..Hα-helixtrans-58.7-41.8172.7-68.9-49.5000112E81 R82 A87 S88 D89E81-H85 PolarHBondContact O-CD2 3.22Å; E81-H85 VanDerWaalsContact O-CD2 3.24Å; E81-H85 PolarHBondContact O-N 3.45Å; E81-H85 IonicContact OE1-CE1 3.32Å; E81-H85 PolarHBondContact OE1-CE1 3.35Å; E81-H85 IonicContact OE1-NE2 2.67Å; E81-H85 PolarHBondContact OE1-NE2 3.39Å; R82-H85 PolarHBondContact O-N 3.46Å; H85-A87 PolarHBondContact O-N 3.24Å; H85-S88 PolarHBondContact O-N 2.85Å; H85-D89 IonicContact CE1-OD1 3.7Å; H85-D89 PolarHBondContact CE1-OD1 2.85Å; H85-D89 IonicContact CG-OD1 2.8Å; H85-D89 IonicContact ND1-OD1 3.81Å; H85-D89 PolarHBondContact ND1-OD1 3.11Å; H85-D89 IonicContact ND1-OD2 3.86Å
86S89.4Confident89.7Confident16 Ų1651 Ų5111%0.11226%0.262CS..Hα-helixtrans-63.3-23.2174.4-580000113.9D52 R82 L83 R84 R111D52-S86 WeakPolarHBondContact OD1-CB 3.27Å; D52-S86 PolarHBondContact OD1-OG 3.31Å; R82-S86 PolarHBondContact O-N 2.9Å; R82-S86 PolarHBondContact O-OG 3.36Å; L83-S86 WeakPolarHBondContact O-CB 3.48Å; L83-S86 PolarHBondContact O-N 3.19Å; R84-S86 VanDerWaalsContact C-N 3.3Å; R84-S86 PolarHBondContact O-N 2.84Å; S86-R111 WeakPolarHBondContact O-CD 3.44Å; S86-R111 PolarHBondContact O-NH1 3.2Å
87A89.9Confident88.4Confident0 Ų051.9 Ų51.90%029%0.292CS..THydrogen-bonded Turntrans-10130.7178.300000113.3F51 L83 R84 H85 D89 L90 R111 L115F51-A87 HydrophobicContact CE1-CB 4.33Å; L83-A87 PolarHBondContact O-N 3.34Å; R84-A87 CarbonylContact O-C 3.59Å; R84-A87 WeakPolarHBondContact O-CA 3.32Å; R84-A87 PolarHBondContact O-N 3.44Å; H85-A87 PolarHBondContact O-N 3.24Å; A87-D89 VanDerWaalsContact C-N 3.3Å; A87-D89 PolarHBondContact O-N 3Å; A87-L90 PolarHBondContact O-N 3.45Å; A87-R111 HydrophobicContact CB-CG 4.19Å; A87-L115 HydrophobicContact CB-CB 4.47Å; A87-L115 HydrophobicContact CB-CD2 3.75Å
88S89Confident87.3Confident67 Ų6752.4 Ų52.447%0.46929%0.291SS..THydrogen-bonded Turntrans63.131.5175.5-51.60000114.4R84 H85 L90R84-S88 PolarHBondContact O-N 2.91Å; H85-S88 PolarHBondContact O-N 2.85Å; S88-L90 PolarHBondContact O-N 2.7Å; S88-L90 VanDerWaalsContact O-N 3.08Å
89D88.7Confident86Confident79 Ų7952.8 Ų52.842%0.42230%0.297SS..THydrogen-bonded Turntrans59.221.3177.7-71.1-64.6000114.2R84 H85 A87R84-D89 IonicContact CZ-OD1 3.38Å; R84-D89 VanDerWaalsContact NH1-C 3.33Å; R84-D89 PolarHBondContact NH1-O 3.43Å; R84-D89 IonicContact NH1-OD1 3.8Å; R84-D89 PolarHBondContact NH1-OD1 3.42Å; R84-D89 IonicContact NH2-OD1 2.73Å; R84-D89 PolarHBondContact NH2-OD1 3.35Å; R84-D89 PolarHBondContact O-N 3.34Å; H85-D89 IonicContact CE1-OD1 3.7Å; H85-D89 PolarHBondContact CE1-OD1 2.85Å; H85-D89 IonicContact CG-OD1 2.8Å; H85-D89 IonicContact ND1-OD1 3.81Å; H85-D89 PolarHBondContact ND1-OD1 3.11Å; H85-D89 IonicContact ND1-OD2 3.86Å; A87-D89 VanDerWaalsContact C-N 3.3Å; A87-D89 PolarHBondContact O-N 3Å
90L89Confident84.9Confident30 Ų3054.7 Ų54.716%0.15731%0.307CS..  trans-66.4141.1174.4-71170.6000110.4R84 A87 S88 I108 H112R84-L90 WeakPolarHBondContact CG-O 3.3Å; A87-L90 PolarHBondContact O-N 3.45Å; S88-L90 PolarHBondContact O-N 2.7Å; S88-L90 VanDerWaalsContact O-N 3.08Å; L90-I108 HydrophobicContact CD1-CG2 3.85Å; L90-H112 HydrophobicContact CB-CB 4.47Å; L90-H112 WeakPolarHBondContact CB-CD2 3.49Å; L90-H112 HydrophobicContact CD1-CB 3.68Å
91P90.4Very high83.8Confident36 Ų3659.7 Ų59.723%0.23434%0.337CS..  trans-75.9136.8-172.629.9-34.8000112.1L100 H112P91-L100 HydrophobicContact CB-CD1 4.42Å; P91-L100 HydrophobicContact CG-CD1 3.37Å; P91-L100 HydrophobicContact CG-CD2 3.71Å; P91-L100 HydrophobicContact CG-CG 4.14Å; P91-H112 PolarHBondContact O-NE2 3.08Å; P91-H112 VanDerWaalsContact O-NE2 3.09Å
92V91Very high82.9Confident12 Ų1256.7 Ų56.77%0.07332%0.323CS..SBendtrans-85.2-11.9176.3-62.60000113.5L115 L116 Y124 Y125V92-L115 HydrophobicContact CG1-CD2 3.7Å; V92-L115 HydrophobicContact CG1-CG 3.88Å; V92-L116 HydrophobicContact CB-CD2 4.27Å; V92-L116 HydrophobicContact CG1-CD2 4.45Å; V92-Y124 HydrophobicContact CG2-CE1 3.73Å; V92-Y125 WeakPolarHBondContact O-CE1 3.48Å; V92-Y125 PolarHBondContact O-OH 2.87Å; V92-Y125 VanDerWaalsContact O-OH 3.04Å
93C86.5Confident82.1Confident43 Ų4356.4 Ų56.429%0.29133%0.329SS..SBendtrans-129.6148.1174.8-79.60000110.3A95C93-A95 PolarHBondContact O-N 3.36Å
94P77.4Confident81.3Confident21 Ų2162.7 Ų62.714%0.13637%0.367CS..  trans-65.4132.1174.625.8-33.2000110.3A135 L136 Q139P94-A135 HydrophobicContact CB-CB 4.06Å; P94-A135 HydrophobicContact CG-CB 3.61Å; P94-L136 VanDerWaalsContact CD-CD2 3.47Å; P94-L136 HydrophobicContact CG-CD2 4.43Å; P94-L136 HydrophobicContact CG-CG 4.18Å; P94-Q139 VanDerWaalsContact CA-OE1 3.22Å; P94-Q139 VanDerWaalsContact CB-OE1 3.27Å
95A75.5Confident80.9Confident39 Ų3963.7 Ų63.732%0.32238%0.376SS..  trans-84.6113.7160.600000107.9C93 G97 E98C93-A95 PolarHBondContact O-N 3.36Å; A95-G97 PolarHBondContact O-N 3.13Å; A95-E98 HydrophobicContact CB-CB 3.96Å; A95-E98 HydrophobicContact CB-CG 3.77Å; A95-E98 WeakPolarHBondContact CB-OE2 3.4Å; A95-E98 PolarHBondContact O-N 3.39Å
96F74Confident80.7Confident125 Ų12562.4 Ų62.455%0.54837%0.371SS..THydrogen-bonded Turntrans-55.9125-179.5-70.1-84.2000110.8H132 A135F96-H132 AromaticContact CE2-CD2 3.5Å; F96-H132 VanDerWaalsContact CE2-CD2 3.5Å; F96-H132 WeakPolarHBondContact CE2-CD2 3.32Å; F96-H132 AromaticContact CE2-CE1 3.89Å; F96-H132 AromaticContact CE2-NE2 3.41Å; F96-H132 WeakPolarHBondContact CE2-NE2 3.39Å; F96-H132 AromaticContact CZ-CD2 3.78Å; F96-H132 AromaticContact CZ-CG 3.85Å; F96-H132 AromaticContact CZ-NE2 3.95Å; F96-A135 HydrophobicContact CE1-CB 3.89Å; F96-A135 HydrophobicContact CZ-CB 4.32Å
97G65.8Low80.6Confident86 Ų8666.7 Ų66.789%0.88739%0.389SS*.THydrogen-bonded Turntrans88.9-4.4-17900000115.1A95A95-G97 PolarHBondContact O-N 3.13Å
98E69.5Low80.7Confident126 Ų12669 Ų6959%0.58940%0.401SS*.  trans-95.5125.1176.3-63.3-169171.700111.8A95 L100A95-E98 HydrophobicContact CB-CB 3.96Å; A95-E98 HydrophobicContact CB-CG 3.77Å; A95-E98 WeakPolarHBondContact CB-OE2 3.4Å; A95-E98 PolarHBondContact O-N 3.39Å; E98-L100 PolarHBondContact O-N 2.92Å; E98-L100 VanDerWaalsContact O-N 3.16Å
99N66.9Low80.8Confident133 Ų13365.8 Ų65.871%0.71138%0.378SS*.  trans-85.583.8170.5-86.7-42.9000109.6V101 K142N99-V101 PolarHBondContact O-N 3.05Å; N99-K142 PolarHBondContact OD1-NZ 3.33Å
100L72Confident80.9Confident41 Ų4162.8 Ų62.822%0.21536%0.362CS..  trans-66.2120.1172.3-71.3153000109.4P91 E98 Q139 H143P91-L100 HydrophobicContact CB-CD1 4.42Å; P91-L100 HydrophobicContact CG-CD1 3.37Å; P91-L100 HydrophobicContact CG-CD2 3.71Å; P91-L100 HydrophobicContact CG-CG 4.14Å; E98-L100 PolarHBondContact O-N 2.92Å; E98-L100 VanDerWaalsContact O-N 3.16Å; L100-Q139 VanDerWaalsContact CD1-NE2 3.34Å; L100-H143 PolarHBondContact O-CE1 3.43Å
101V72Confident81.1Confident112 Ų11263.1 Ų63.168%0.67936%0.361SS*.  trans-99.9116172179.20000106.5N99N99-V101 PolarHBondContact O-N 3.05Å
102I75.6Confident81.3Confident10 Ų1061.5 Ų61.55%0.05135%0.351CS..  trans-77145172.5-72.8-174.9000108.9A109 H143 Y166I102-A109 HydrophobicContact CG2-CB 4.01Å; I102-H143 HydrophobicContact CD1-CB 3.97Å; I102-H143 WeakPolarHBondContact CD1-CD2 3.26Å; I102-H143 VanDerWaalsContact CD1-CE1 3.45Å; I102-H143 WeakPolarHBondContact CD1-CE1 3.1Å; I102-H143 WeakPolarHBondContact CD1-ND1 3.29Å; I102-H143 WeakPolarHBondContact CD1-NE2 3.39Å; I102-H143 WeakPolarHBondContact CG1-CE1 3.48Å; I102-H143 WeakPolarHBondContact CG1-ND1 3.45Å; I102-Y166 HydrophobicContact CD1-CE1 3.99Å; I102-Y166 HydrophobicContact CD1-CE2 4.32Å; I102-Y166 VanDerWaalsContact CD1-OH 3.24Å; I102-Y166 WeakPolarHBondContact CD1-OH 3.16Å
103T78.7Confident81.4Confident57 Ų5761 Ų6135%0.3535%0.347SS..  trans-56.3146.2174.3179.40000111.6N105 I108T103-N105 HydrophobicContact CG2-CB 3.98Å; T103-N105 PolarHBondContact O-N 3.44Å; T103-N105 WeakPolarHBondContact OG1-CB 3.44Å; T103-N105 PolarHBondContact OG1-N 2.9Å; T103-I108 HydrophobicContact CG2-CB 3.59Å; T103-I108 HydrophobicContact CG2-CD1 4.1Å; T103-I108 HydrophobicContact CG2-CG1 4.41Å; T103-I108 HydrophobicContact CG2-CG2 3.55Å
104T78.5Confident81.8Confident131 Ų13159.1 Ų59.180%0.80433%0.334SS*.SBendtrans-71.1-3.2171.653.20000112.8Q106T104-Q106 PolarHBondContact O-N 3.37Å
105N87.1Confident82.6Confident71 Ų7158.1 Ų58.138%0.3833%0.328SS..  trans-73.5106.5175-173.3-37.8000110.9T103 E107 I108 A109T103-N105 HydrophobicContact CG2-CB 3.98Å; T103-N105 PolarHBondContact O-N 3.44Å; T103-N105 WeakPolarHBondContact OG1-CB 3.44Å; T103-N105 PolarHBondContact OG1-N 2.9Å; N105-E107 PolarHBondContact O-N 3.29Å; N105-E107 WeakPolarHBondContact OD1-CA 3.43Å; N105-E107 VanDerWaalsContact OD1-CB 3.27Å; N105-E107 WeakPolarHBondContact OD1-CB 3.45Å; N105-E107 PolarHBondContact OD1-N 3.18Å; N105-I108 HydrophobicContact CB-CB 4.36Å; N105-I108 HydrophobicContact CB-CD1 4.05Å; N105-I108 HydrophobicContact CB-CG1 4.25Å; N105-I108 PolarHBondContact O-N 3.01Å; N105-I108 PolarHBondContact OD1-N 2.92Å; N105-A109 WeakPolarHBondContact O-CB 3.43Å; N105-A109 PolarHBondContact O-N 2.92Å
106Q87.6Confident83.5Confident76 Ų7656.5 Ų56.536%0.35531%0.314SS..Hα-helixtrans-51.2-36.9177.2-68.9-72-9.500113.5T104 L110 M147T104-Q106 PolarHBondContact O-N 3.37Å; Q106-L110 VanDerWaalsContact O-CB 3.24Å; Q106-L110 WeakPolarHBondContact O-CB 3.41Å; Q106-L110 PolarHBondContact O-N 3.43Å; Q106-M147 HydrophobicContact CG-CE 4.08Å; Q106-M147 VanDerWaalsContact NE2-CE 3.33Å
107E88.8Confident84.4Confident106 Ų10650.7 Ų50.750%0.49529%0.289SS..Hα-helixtrans-68-46.1-178-165-177168.900111.7S56 N105 R111S56-E107 WeakPolarHBondContact CB-O 3.44Å; S56-E107 VanDerWaalsContact OG-CG 3.3Å; S56-E107 WeakPolarHBondContact OG-CG 3.44Å; S56-E107 PolarHBondContact OG-OE1 3.46Å; N105-E107 PolarHBondContact O-N 3.29Å; N105-E107 WeakPolarHBondContact OD1-CA 3.43Å; N105-E107 VanDerWaalsContact OD1-CB 3.27Å; N105-E107 WeakPolarHBondContact OD1-CB 3.45Å; N105-E107 PolarHBondContact OD1-N 3.18Å; E107-R111 VanDerWaalsContact O-CB 3.28Å; E107-R111 WeakPolarHBondContact O-CB 3.35Å; E107-R111 PolarHBondContact O-N 2.93Å; E107-R111 IonicContact OE1-NH2 3.21Å
108I90.8Very high85.6Confident48 Ų4846.7 Ų46.725%0.24625%0.247CC..Hα-helixtrans-67.8-43.5177.6-61.5174000109.5L90 T103 N105 R111 H112L90-I108 HydrophobicContact CD1-CG2 3.85Å; T103-I108 HydrophobicContact CG2-CB 3.59Å; T103-I108 HydrophobicContact CG2-CD1 4.1Å; T103-I108 HydrophobicContact CG2-CG1 4.41Å; T103-I108 HydrophobicContact CG2-CG2 3.55Å; N105-I108 HydrophobicContact CB-CB 4.36Å; N105-I108 HydrophobicContact CB-CD1 4.05Å; N105-I108 HydrophobicContact CB-CG1 4.25Å; N105-I108 PolarHBondContact O-N 3.01Å; N105-I108 PolarHBondContact OD1-N 2.92Å; I108-R111 PolarHBondContact O-N 3.36Å; I108-H112 WeakPolarHBondContact O-CB 3.47Å; I108-H112 PolarHBondContact O-N 3.47Å
109A91.3Very high86.8Confident0 Ų040.7 Ų40.70%022%0.219CC..Hα-helixtrans-60.6-46.4178.500000112I102 N105 H112 A113 M147 A162 Y166I102-A109 HydrophobicContact CG2-CB 4.01Å; N105-A109 WeakPolarHBondContact O-CB 3.43Å; N105-A109 PolarHBondContact O-N 2.92Å; A109-H112 PolarHBondContact O-N 3.05Å; A109-A113 PolarHBondContact O-N 3.04Å; A109-M147 HydrophobicContact CB-CE 3.55Å; A109-M147 HydrophobicContact CB-CG 4.34Å; A109-M147 HydrophobicContact CB-SD 3.83Å; A109-A162 HydrophobicContact CB-CB 4Å; A109-Y166 HydrophobicContact CB-CE2 4.23Å; A109-Y166 PolarHBondContact O-OH 3.15Å
110L91.4Very high87.9Confident15 Ų1535.1 Ų35.18%0.07919%0.19CC..Hα-helixtrans-68-38.4177.5-179.153.1000111.8S56 P58 Q106 H112 A113 N114 A161 A162S56-L110 WeakPolarHBondContact O-CD2 3.32Å; P58-L110 HydrophobicContact CG-CD2 4.43Å; Q106-L110 VanDerWaalsContact O-CB 3.24Å; Q106-L110 WeakPolarHBondContact O-CB 3.41Å; Q106-L110 PolarHBondContact O-N 3.43Å; L110-H112 VanDerWaalsContact C-N 3.33Å; L110-H112 PolarHBondContact O-N 2.94Å; L110-A113 PolarHBondContact O-N 3.24Å; L110-N114 WeakPolarHBondContact O-CB 3.39Å; L110-N114 VanDerWaalsContact O-CG 3.24Å; L110-N114 PolarHBondContact O-N 3.01Å; L110-N114 PolarHBondContact O-ND2 2.69Å; L110-A161 HydrophobicContact CD2-CB 3.99Å; L110-A162 HydrophobicContact CB-CB 4.12Å
111R93.6Very high88.7Confident38 Ų3833.2 Ų33.214%0.14318%0.181CC..Hα-helixtrans-59.8-45.2174.3-174.4176.8-64.4-153-8.8111.7F51 D52 G55 S86 A87 E107 I108 N114 L115F51-R111 HydrophobicContact CE1-CG 3.74Å; F51-R111 HydrophobicContact CZ-CG 3.66Å; F51-R111 WeakPolarHBondContact CZ-O 3.29Å; D52-R111 PolarHBondContact O-NH1 3.38Å; D52-R111 PolarHBondContact O-NH2 3.45Å; G55-R111 WeakPolarHBondContact O-CA 3.48Å; S86-R111 WeakPolarHBondContact O-CD 3.44Å; S86-R111 PolarHBondContact O-NH1 3.2Å; A87-R111 HydrophobicContact CB-CG 4.19Å; E107-R111 VanDerWaalsContact O-CB 3.28Å; E107-R111 WeakPolarHBondContact O-CB 3.35Å; E107-R111 PolarHBondContact O-N 2.93Å; E107-R111 IonicContact OE1-NH2 3.21Å; I108-R111 PolarHBondContact O-N 3.36Å; R111-N114 PolarHBondContact O-N 3.47Å; R111-L115 PolarHBondContact O-N 3.08Å
112H94.4Very high89.5Confident2 Ų228.3 Ų28.31%0.00915%0.15CC..Hα-helixtrans-65.1-45.3176176.6-114.4000112.3L90 P91 I108 A109 L110 N114 L115 L116 Y166L90-H112 HydrophobicContact CB-CB 4.47Å; L90-H112 WeakPolarHBondContact CB-CD2 3.49Å; L90-H112 HydrophobicContact CD1-CB 3.68Å; P91-H112 PolarHBondContact O-NE2 3.08Å; P91-H112 VanDerWaalsContact O-NE2 3.09Å; I108-H112 WeakPolarHBondContact O-CB 3.47Å; I108-H112 PolarHBondContact O-N 3.47Å; A109-H112 PolarHBondContact O-N 3.05Å; L110-H112 VanDerWaalsContact C-N 3.33Å; L110-H112 PolarHBondContact O-N 2.94Å; H112-N114 VanDerWaalsContact C-N 3.27Å; H112-N114 PolarHBondContact O-N 3.48Å; H112-L115 WeakPolarHBondContact O-CA 3.46Å; H112-L115 VanDerWaalsContact O-CB 3.32Å; H112-L115 WeakPolarHBondContact O-CB 3.41Å; H112-L115 PolarHBondContact O-N 2.98Å; H112-L116 WeakPolarHBondContact O-CG 3.32Å; H112-L116 PolarHBondContact O-N 2.8Å; H112-Y166 WeakPolarHBondContact CB-OH 3.28Å; H112-Y166 AromaticContact ND1-CE1 3.63Å; H112-Y166 AromaticContact ND1-CZ 3.67Å; H112-Y166 PolarHBondContact ND1-OH 3.28Å
113A93.1Very high90Very high0 Ų028.5 Ų28.50%015%0.154CC..Hα-helixtrans-57.7-42175.700000111.8A109 L110 L115 L116 H117 S165 Y166A109-A113 PolarHBondContact O-N 3.04Å; L110-A113 PolarHBondContact O-N 3.24Å; A113-L115 PolarHBondContact O-N 2.98Å; A113-L116 WeakPolarHBondContact O-CB 3.44Å; A113-L116 PolarHBondContact O-N 2.65Å; A113-H117 PolarHBondContact O-CD2 3.29Å; A113-H117 PolarHBondContact O-N 3.22Å; A113-H117 VanDerWaalsContact O-N 3.12Å; A113-S165 VanDerWaalsContact CB-OG 3.29Å; A113-S165 WeakPolarHBondContact CB-OG 3.31Å; A113-Y166 HydrophobicContact CB-CD1 4.09Å; A113-Y166 HydrophobicContact CB-CD2 4.3Å; A113-Y166 HydrophobicContact CB-CE1 3.86Å; A113-Y166 HydrophobicContact CB-CE2 4.06Å; A113-Y166 HydrophobicContact CB-CG 4.28Å
114N93.4Very high90.6Very high4 Ų429.9 Ų29.92%0.02115%0.154CC..Hα-helixtrans-64.7-36.7174.9-71.1-28.3000112.8F51 G55 R57 V60 L61 L110 R111 H112 H117 L118F51-N114 HydrophobicContact CE2-CB 4.35Å; G55-N114 PolarHBondContact O-ND2 2.93Å; R57-N114 PolarHBondContact O-ND2 3.35Å; V60-N114 HydrophobicContact CG1-CB 3.58Å; V60-N114 VanDerWaalsContact CG1-CG 3.4Å; V60-N114 VanDerWaalsContact CG1-ND2 3.28Å; V60-N114 WeakPolarHBondContact CG1-ND2 3.39Å; L61-N114 HydrophobicContact CD2-CB 4.36Å; L61-N114 WeakPolarHBondContact CD2-O 3.25Å; L110-N114 WeakPolarHBondContact O-CB 3.39Å; L110-N114 VanDerWaalsContact O-CG 3.24Å; L110-N114 PolarHBondContact O-N 3.01Å; L110-N114 PolarHBondContact O-ND2 2.69Å; R111-N114 PolarHBondContact O-N 3.47Å; H112-N114 VanDerWaalsContact C-N 3.27Å; H112-N114 PolarHBondContact O-N 3.48Å; N114-H117 PolarHBondContact O-N 2.78Å; N114-L118 WeakPolarHBondContact O-CG 3.3Å; N114-L118 PolarHBondContact O-N 3.33Å
115L94.8Very high91.1Very high0 Ų023.7 Ų23.70%012%0.116CC..Hα-helixtrans-59.6-46.8171.5172.658.8000111.3F51 L83 R84 A87 V92 R111 H112 A113 H117 L118 C119F51-L115 HydrophobicContact CZ-CB 4.02Å; L83-L115 HydrophobicContact CB-CD1 3.55Å; L83-L115 HydrophobicContact CD1-CD1 4.13Å; R84-L115 HydrophobicContact CB-CD2 4.21Å; R84-L115 HydrophobicContact CG-CD2 4.37Å; A87-L115 HydrophobicContact CB-CB 4.47Å; A87-L115 HydrophobicContact CB-CD2 3.75Å; V92-L115 HydrophobicContact CG1-CD2 3.7Å; V92-L115 HydrophobicContact CG1-CG 3.88Å; R111-L115 PolarHBondContact O-N 3.08Å; H112-L115 WeakPolarHBondContact O-CA 3.46Å; H112-L115 VanDerWaalsContact O-CB 3.32Å; H112-L115 WeakPolarHBondContact O-CB 3.41Å; H112-L115 PolarHBondContact O-N 2.98Å; A113-L115 PolarHBondContact O-N 2.98Å; L115-H117 VanDerWaalsContact C-N 3.29Å; L115-H117 PolarHBondContact O-N 3.24Å; L115-L118 WeakPolarHBondContact O-CB 3.08Å; L115-L118 PolarHBondContact O-N 2.96Å; L115-L118 VanDerWaalsContact O-N 3.08Å; L115-C119 PolarHBondContact O-N 3.3Å; L115-C119 PolarHBondContact O-SG 3.34Å; L115-C119 VanDerWaalsContact O-SG 3.35Å
116L94.2Very high91Very high6 Ų624.4 Ų24.43%0.03112%0.12CC..Hα-helixtrans-57.2-43.9178.2-61.3178.7000111.5V92 H112 A113 C119 S120 Y125 Y166 F169V92-L116 HydrophobicContact CB-CD2 4.27Å; V92-L116 HydrophobicContact CG1-CD2 4.45Å; H112-L116 WeakPolarHBondContact O-CG 3.32Å; H112-L116 PolarHBondContact O-N 2.8Å; A113-L116 WeakPolarHBondContact O-CB 3.44Å; A113-L116 PolarHBondContact O-N 2.65Å; L116-C119 WeakPolarHBondContact O-CB 3.5Å; L116-C119 PolarHBondContact O-N 3.4Å; L116-S120 PolarHBondContact O-N 3.17Å; L116-Y125 WeakPolarHBondContact CD2-OH 3.5Å; L116-Y125 WeakPolarHBondContact O-CE2 3.41Å; L116-Y166 HydrophobicContact CD1-CD1 4.19Å; L116-Y166 HydrophobicContact CD1-CE1 3.89Å; L116-F169 HydrophobicContact CB-CD1 4.27Å; L116-F169 HydrophobicContact CB-CD2 3.8Å; L116-F169 HydrophobicContact CB-CE1 4.17Å; L116-F169 HydrophobicContact CB-CE2 3.7Å; L116-F169 HydrophobicContact CB-CG 4.09Å; L116-F169 HydrophobicContact CB-CZ 3.89Å; L116-F169 HydrophobicContact CD1-CD1 4.03Å; L116-F169 HydrophobicContact CD1-CE1 4.12Å; L116-F169 HydrophobicContact CD1-CG 4.45Å; L116-F169 WeakPolarHBondContact O-CE2 3.27Å
117H92.7Very high90.8Very high3 Ų324.5 Ų24.51%0.01414%0.141CC..Hα-helixtrans-63.1-40.6175.1-76-65.3000112.9L61 A113 N114 L115 S120 A121 S165 F169 I258L61-H117 HydrophobicContact CD1-CB 3.6Å; L61-H117 HydrophobicContact CD2-CB 3.54Å; L61-H117 HydrophobicContact CG-CB 4.23Å; A113-H117 PolarHBondContact O-CD2 3.29Å; A113-H117 PolarHBondContact O-N 3.22Å; A113-H117 VanDerWaalsContact O-N 3.12Å; N114-H117 PolarHBondContact O-N 2.78Å; L115-H117 VanDerWaalsContact C-N 3.29Å; L115-H117 PolarHBondContact O-N 3.24Å; H117-S120 WeakPolarHBondContact O-CB 3.4Å; H117-S120 PolarHBondContact O-N 2.89Å; H117-A121 PolarHBondContact O-N 3.12Å; H117-S165 PolarHBondContact NE2-O 3.43Å; H117-F169 VanDerWaalsContact CE1-CA 3.41Å; H117-F169 WeakPolarHBondContact CE1-CA 3.44Å; H117-F169 PolarHBondContact CE1-N 2.93Å; H117-F169 AromaticContact ND1-CD2 3.87Å; H117-I258 WeakPolarHBondContact ND1-CG2 3.32Å
118L92.5Very high90.8Very high1 Ų121.3 Ų21.31%0.00513%0.127CC..Hα-helixtrans-64.3-41.5174.7-69.9171.9000111.8F51 L61 L64 L68 L83 N114 L115 S120 A121 L122F51-L118 HydrophobicContact CD2-CD1 3.82Å; F51-L118 HydrophobicContact CE2-CD1 3.75Å; L61-L118 HydrophobicContact CD2-CD2 3.88Å; L61-L118 HydrophobicContact CD2-CG 3.78Å; L64-L118 HydrophobicContact CB-CD2 4.06Å; L64-L118 HydrophobicContact CD1-CD1 4.01Å; L64-L118 HydrophobicContact CD1-CD2 4.45Å; L68-L118 HydrophobicContact CD1-CD2 4.31Å; L68-L118 HydrophobicContact CD2-CD2 4.39Å; L83-L118 HydrophobicContact CD1-CD1 4.26Å; N114-L118 WeakPolarHBondContact O-CG 3.3Å; N114-L118 PolarHBondContact O-N 3.33Å; L115-L118 WeakPolarHBondContact O-CB 3.08Å; L115-L118 PolarHBondContact O-N 2.96Å; L115-L118 VanDerWaalsContact O-N 3.08Å; L118-S120 VanDerWaalsContact C-N 3.28Å; L118-S120 PolarHBondContact O-N 3.45Å; L118-A121 PolarHBondContact O-N 2.95Å; L118-L122 WeakPolarHBondContact O-CB 3.36Å; L118-L122 WeakPolarHBondContact O-CG 3.27Å; L118-L122 PolarHBondContact O-N 3.34Å
119C92.9Very high90.8Very high1 Ų122.5 Ų22.51%0.00713%0.134CC..Hα-helixtrans-58.1-43.1172.8-69.20000111L115 L116 L122 G123 Y124 Y125L115-C119 PolarHBondContact O-N 3.3Å; L115-C119 PolarHBondContact O-SG 3.34Å; L115-C119 VanDerWaalsContact O-SG 3.35Å; L116-C119 WeakPolarHBondContact O-CB 3.5Å; L116-C119 PolarHBondContact O-N 3.4Å; C119-L122 PolarHBondContact O-N 3.17Å; C119-G123 PolarHBondContact O-N 3.31Å; C119-Y124 HydrophobicContact CB-CD1 4.19Å; C119-Y124 HydrophobicContact CB-CG 4.35Å; C119-Y124 WeakPolarHBondContact O-CB 3.4Å; C119-Y124 PolarHBondContact O-N 3.49Å; C119-Y125 HydrophobicContact CB-CE2 3.69Å
120S90.4Very high90.7Very high15 Ų1524.7 Ų24.711%0.10515%0.147CC..Hα-helixtrans-60.9-46.5174.6-160.50000111.8L116 H117 L118 L122 G123L116-S120 PolarHBondContact O-N 3.17Å; H117-S120 WeakPolarHBondContact O-CB 3.4Å; H117-S120 PolarHBondContact O-N 2.89Å; L118-S120 VanDerWaalsContact C-N 3.28Å; L118-S120 PolarHBondContact O-N 3.45Å; S120-L122 VanDerWaalsContact C-N 3.27Å; S120-L122 PolarHBondContact O-N 3.14Å; S120-G123 PolarHBondContact O-N 3.16Å
121A88.4Confident90.7Very high2 Ų229.3 Ų29.32%0.01717%0.168CC..Hα-helixtrans-66.5-26.1179.500000113.6I65 L68 H117 L118 G123I65-A121 HydrophobicContact CG1-CB 4.38Å; L68-A121 HydrophobicContact CD1-CB 3.56Å; H117-A121 PolarHBondContact O-N 3.12Å; L118-A121 PolarHBondContact O-N 2.95Å; A121-G123 VanDerWaalsContact C-N 3.26Å
122L89.5Confident90.6Very high9 Ų931 Ų315%0.04718%0.178CC..THydrogen-bonded Turntrans-79.9-5.1173.1-75167.3000113.4L68 R76 F79 I80 L118 C119 S120 Y124L68-L122 HydrophobicContact CB-CD2 4.07Å; L68-L122 HydrophobicContact CD1-CD2 4.44Å; L68-L122 HydrophobicContact CD1-CG 4.3Å; L68-L122 HydrophobicContact CD2-CD2 4.03Å; L68-L122 HydrophobicContact CD2-CG 4.26Å; L68-L122 HydrophobicContact CG-CD2 4.39Å; R76-L122 HydrophobicContact CG-CD2 4.46Å; F79-L122 HydrophobicContact CD1-CD1 3.86Å; F79-L122 HydrophobicContact CE1-CD1 3.97Å; I80-L122 HydrophobicContact CD1-CD1 4.11Å; I80-L122 HydrophobicContact CG1-CD1 3.78Å; L118-L122 WeakPolarHBondContact O-CB 3.36Å; L118-L122 WeakPolarHBondContact O-CG 3.27Å; L118-L122 PolarHBondContact O-N 3.34Å; C119-L122 PolarHBondContact O-N 3.17Å; S120-L122 VanDerWaalsContact C-N 3.27Å; S120-L122 PolarHBondContact O-N 3.14Å; L122-Y124 VanDerWaalsContact C-N 3.34Å
123G86.9Confident90.5Very high13 Ų1331.1 Ų31.113%0.13418%0.178CC..THydrogen-bonded Turntrans75.919.1-175.600000113.9C119 S120 A121 Y125 N126C119-G123 PolarHBondContact O-N 3.31Å; S120-G123 PolarHBondContact O-N 3.16Å; A121-G123 VanDerWaalsContact C-N 3.26Å; G123-Y125 PolarHBondContact O-N 3.43Å; G123-N126 VanDerWaalsContact CA-CG 3.47Å; G123-N126 WeakPolarHBondContact CA-ND2 3.27Å; G123-N126 WeakPolarHBondContact O-CB 3.42Å; G123-N126 PolarHBondContact O-N 2.83Å
124Y89.7Confident90.4Very high86 Ų8635.1 Ų35.134%0.33720%0.197SC..THydrogen-bonded Turntrans-61.5-31.9-178.6-175.9-106.6000112.9I80 V92 C119 L122 N126I80-Y124 HydrophobicContact CD1-CD2 3.35Å; I80-Y124 HydrophobicContact CD1-CE2 4.08Å; I80-Y124 HydrophobicContact CD1-CG 3.73Å; V92-Y124 HydrophobicContact CG2-CE1 3.73Å; C119-Y124 HydrophobicContact CB-CD1 4.19Å; C119-Y124 HydrophobicContact CB-CG 4.35Å; C119-Y124 WeakPolarHBondContact O-CB 3.4Å; C119-Y124 PolarHBondContact O-N 3.49Å; L122-Y124 VanDerWaalsContact C-N 3.34Å; Y124-N126 VanDerWaalsContact C-N 3.32Å
125Y90Very high90.4Very high2 Ų235.6 Ų35.61%0.00820%0.202CC..THydrogen-bonded Turntrans-916.5177.2-51.6-57.9000113.1V92 L116 C119 G123 G127 L128 R133 L136 F169V92-Y125 WeakPolarHBondContact O-CE1 3.48Å; V92-Y125 PolarHBondContact O-OH 2.87Å; V92-Y125 VanDerWaalsContact O-OH 3.04Å; L116-Y125 WeakPolarHBondContact CD2-OH 3.5Å; L116-Y125 WeakPolarHBondContact O-CE2 3.41Å; C119-Y125 HydrophobicContact CB-CE2 3.69Å; G123-Y125 PolarHBondContact O-N 3.43Å; Y125-G127 PolarHBondContact O-N 2.87Å; Y125-L128 HydrophobicContact CD1-CD1 3.72Å; Y125-L128 HydrophobicContact CG-CD1 4.23Å; Y125-L128 PolarHBondContact O-N 2.81Å; Y125-R133 PolarHBondContact O-NH2 3.48Å; Y125-L136 HydrophobicContact CD1-CD1 3.81Å; Y125-L136 HydrophobicContact CE1-CD1 4.01Å; Y125-L136 HydrophobicContact CE1-CD2 4.28Å; Y125-L136 HydrophobicContact CG-CD1 4.39Å; Y125-F169 HydrophobicContact CD2-CE2 4.29Å; Y125-F169 HydrophobicContact CD2-CZ 4.16Å; Y125-F169 AromaticContact CE2-CE2 3.63Å; Y125-F169 HydrophobicContact CE2-CE2 3.63Å; Y125-F169 AromaticContact CE2-CZ 3.49Å; Y125-F169 HydrophobicContact CE2-CZ 3.49Å; Y125-F169 VanDerWaalsContact CE2-CZ 3.49Å; Y125-F169 AromaticContact CZ-CZ 3.78Å
126N84.9Confident90.3Very high86 Ų8635.7 Ų35.746%0.4620%0.202SC..THydrogen-bonded Turntrans-67.4130.8175.8-67-2.8000108.7G123 Y124 L128 D261G123-N126 VanDerWaalsContact CA-CG 3.47Å; G123-N126 WeakPolarHBondContact CA-ND2 3.27Å; G123-N126 WeakPolarHBondContact O-CB 3.42Å; G123-N126 PolarHBondContact O-N 2.83Å; Y124-N126 VanDerWaalsContact C-N 3.32Å; N126-L128 VanDerWaalsContact C-N 3.3Å; N126-L128 PolarHBondContact O-N 3.18Å; N126-D261 PolarHBondContact ND2-OD2 3.44Å
127G83.8Confident90.2Very high78 Ų7835.5 Ų35.580%0.80420%0.201SC*.THydrogen-bonded Turntrans794-179.300000115.6Y125 N129Y125-G127 PolarHBondContact O-N 2.87Å; G127-N129 PolarHBondContact O-N 2.99Å
128L88.3Confident90.3Very high38 Ų3841.4 Ų41.420%0.19923%0.229CC..  trans-58.8135.3165.6-75.4-172.9000110.4Y125 N126 H132 L136Y125-L128 HydrophobicContact CD1-CD1 3.72Å; Y125-L128 HydrophobicContact CG-CD1 4.23Å; Y125-L128 PolarHBondContact O-N 2.81Å; N126-L128 VanDerWaalsContact C-N 3.3Å; N126-L128 PolarHBondContact O-N 3.18Å; L128-H132 HydrophobicContact CB-CB 4.48Å; L128-H132 HydrophobicContact CD1-CB 4.44Å; L128-H132 HydrophobicContact CD2-CB 4.1Å; L128-L136 HydrophobicContact CD1-CD1 3.38Å
129N89.8Confident90.3Very high74 Ų7442.7 Ų42.740%0.39624%0.235SC..  trans-69169.8172.474.212.1000111.4G127 E131 H132 R133G127-N129 PolarHBondContact O-N 2.99Å; N129-E131 VanDerWaalsContact C-N 3.3Å; N129-E131 PolarHBondContact ND2-OE2 3.45Å; N129-E131 PolarHBondContact O-N 2.94Å; N129-E131 PolarHBondContact OD1-N 3.45Å; N129-E131 PolarHBondContact OD1-OE2 3.22Å; N129-H132 VanDerWaalsContact CG-ND1 3.32Å; N129-H132 PolarHBondContact ND2-ND1 2.67Å; N129-H132 PolarHBondContact O-N 3.47Å; N129-H132 WeakPolarHBondContact OD1-CB 3.45Å; N129-H132 PolarHBondContact OD1-N 2.92Å; N129-H132 PolarHBondContact OD1-ND1 2.96Å; N129-R133 PolarHBondContact O-N 3.41Å; N129-R133 VanDerWaalsContact O-N 3.11Å
130V90.8Very high90.3Very high45 Ų4542.8 Ų42.827%0.27324%0.235SC..Hα-helixtrans-61-40.5-176.3176.10000111.2R133 Q134 L177V130-R133 PolarHBondContact O-N 3Å; V130-Q134 HydrophobicContact CG1-CG 4.28Å; V130-Q134 WeakPolarHBondContact O-CB 3.3Å; V130-Q134 VanDerWaalsContact O-CG 3.31Å; V130-Q134 WeakPolarHBondContact O-CG 3.46Å; V130-Q134 PolarHBondContact O-N 2.97Å; V130-L177 HydrophobicContact CB-CD2 4.46Å; V130-L177 HydrophobicContact CG1-CD2 4.09Å; V130-L177 HydrophobicContact CG2-CD2 4.34Å
131E90.8Very high90.4Very high113 Ų11343.8 Ų43.853%0.52824%0.239SC..Hα-helixtrans-64.6-45.5-177.4-60.877.5-168.700112.2N129 Q134 A135N129-E131 VanDerWaalsContact C-N 3.3Å; N129-E131 PolarHBondContact ND2-OE2 3.45Å; N129-E131 PolarHBondContact O-N 2.94Å; N129-E131 PolarHBondContact OD1-N 3.45Å; N129-E131 PolarHBondContact OD1-OE2 3.22Å; E131-Q134 PolarHBondContact O-N 3.38Å; E131-A135 PolarHBondContact O-N 2.9Å
132H91Very high90.5Very high74 Ų7446.7 Ų46.734%0.34325%0.252SS..Hα-helixtrans-67.3-38.2177.7-72.378.4000111.3F96 L128 N129 A135 L136F96-H132 AromaticContact CE2-CD2 3.5Å; F96-H132 VanDerWaalsContact CE2-CD2 3.5Å; F96-H132 WeakPolarHBondContact CE2-CD2 3.32Å; F96-H132 AromaticContact CE2-CE1 3.89Å; F96-H132 AromaticContact CE2-NE2 3.41Å; F96-H132 WeakPolarHBondContact CE2-NE2 3.39Å; F96-H132 AromaticContact CZ-CD2 3.78Å; F96-H132 AromaticContact CZ-CG 3.85Å; F96-H132 AromaticContact CZ-NE2 3.95Å; L128-H132 HydrophobicContact CB-CB 4.48Å; L128-H132 HydrophobicContact CD1-CB 4.44Å; L128-H132 HydrophobicContact CD2-CB 4.1Å; N129-H132 VanDerWaalsContact CG-ND1 3.32Å; N129-H132 PolarHBondContact ND2-ND1 2.67Å; N129-H132 PolarHBondContact O-N 3.47Å; N129-H132 WeakPolarHBondContact OD1-CB 3.45Å; N129-H132 PolarHBondContact OD1-N 2.92Å; N129-H132 PolarHBondContact OD1-ND1 2.96Å; H132-A135 PolarHBondContact O-N 3.18Å; H132-L136 PolarHBondContact O-N 3.24Å
133R92Very high90.6Very high4 Ų446.4 Ų46.42%0.01525%0.25CC..Hα-helixtrans-68.3-38.4177.4-166175-60.3-98.43.1111.8Y125 N129 V130 L136 I137 Q173 L177Y125-R133 PolarHBondContact O-NH2 3.48Å; N129-R133 PolarHBondContact O-N 3.41Å; N129-R133 VanDerWaalsContact O-N 3.11Å; V130-R133 PolarHBondContact O-N 3Å; R133-L136 WeakPolarHBondContact O-CB 3.44Å; R133-L136 PolarHBondContact O-N 3.27Å; R133-I137 HydrophobicContact CG-CD1 4.48Å; R133-I137 WeakPolarHBondContact O-CD1 3.46Å; R133-I137 VanDerWaalsContact O-CG1 3.32Å; R133-I137 WeakPolarHBondContact O-CG1 3.14Å; R133-I137 PolarHBondContact O-N 2.94Å; R133-Q173 WeakPolarHBondContact CD-O 3.47Å; R133-Q173 HydrophobicContact CG-CB 4.13Å; R133-L177 HydrophobicContact CB-CD2 4.12Å; R133-L177 HydrophobicContact CB-CG 4.5Å; R133-L177 HydrophobicContact CG-CD2 4.13Å; R133-L177 HydrophobicContact CG-CG 4.03Å
134Q92.4Very high90.8Very high83 Ų8346.8 Ų46.839%0.38825%0.248SC..Hα-helixtrans-61.9-44.3171.8-76.1177.30.500111.7V130 E131 L136 I137 E138 L177V130-Q134 HydrophobicContact CG1-CG 4.28Å; V130-Q134 WeakPolarHBondContact O-CB 3.3Å; V130-Q134 VanDerWaalsContact O-CG 3.31Å; V130-Q134 WeakPolarHBondContact O-CG 3.46Å; V130-Q134 PolarHBondContact O-N 2.97Å; E131-Q134 PolarHBondContact O-N 3.38Å; Q134-L136 VanDerWaalsContact C-N 3.31Å; Q134-L136 PolarHBondContact O-N 3.23Å; Q134-I137 WeakPolarHBondContact O-CB 3.28Å; Q134-I137 PolarHBondContact O-N 2.84Å; Q134-I137 VanDerWaalsContact O-N 3.13Å; Q134-E138 WeakPolarHBondContact O-CG 3.38Å; Q134-E138 PolarHBondContact O-N 3.06Å; Q134-L177 HydrophobicContact CG-CD1 4.08Å
135A92.4Very high90.8Very high15 Ų1546.3 Ų46.312%0.12426%0.257CS..Hα-helixtrans-60.5-39.3175.700000112.4P94 F96 E131 H132 E138 Q139P94-A135 HydrophobicContact CB-CB 4.06Å; P94-A135 HydrophobicContact CG-CB 3.61Å; F96-A135 HydrophobicContact CE1-CB 3.89Å; F96-A135 HydrophobicContact CZ-CB 4.32Å; E131-A135 PolarHBondContact O-N 2.9Å; H132-A135 PolarHBondContact O-N 3.18Å; A135-E138 PolarHBondContact O-N 2.91Å; A135-Q139 VanDerWaalsContact O-CB 3.3Å; A135-Q139 WeakPolarHBondContact O-CB 3.41Å; A135-Q139 PolarHBondContact O-N 3.41Å
136L92.5Very high90.7Very high2 Ų249.3 Ų49.31%0.0127%0.271CS..Hα-helixtrans-60.8-44.1173-83167000112.1P94 Y125 L128 H132 R133 Q134 S140 F169P94-L136 VanDerWaalsContact CD-CD2 3.47Å; P94-L136 HydrophobicContact CG-CD2 4.43Å; P94-L136 HydrophobicContact CG-CG 4.18Å; Y125-L136 HydrophobicContact CD1-CD1 3.81Å; Y125-L136 HydrophobicContact CE1-CD1 4.01Å; Y125-L136 HydrophobicContact CE1-CD2 4.28Å; Y125-L136 HydrophobicContact CG-CD1 4.39Å; L128-L136 HydrophobicContact CD1-CD1 3.38Å; H132-L136 PolarHBondContact O-N 3.24Å; R133-L136 WeakPolarHBondContact O-CB 3.44Å; R133-L136 PolarHBondContact O-N 3.27Å; Q134-L136 VanDerWaalsContact C-N 3.31Å; Q134-L136 PolarHBondContact O-N 3.23Å; L136-S140 VanDerWaalsContact O-CB 3.27Å; L136-S140 WeakPolarHBondContact O-CB 3.34Å; L136-S140 PolarHBondContact O-N 3.15Å; L136-S140 PolarHBondContact O-OG 3.21Å; L136-F169 HydrophobicContact CD2-CE1 4.3Å
137I93.4Very high90.8Very high2 Ų245.5 Ų45.51%0.0125%0.251CS..Hα-helixtrans-62-50.4177.8-68.1158000110R133 Q134 Q139 S140 L141 Q173 L174 L177R133-I137 HydrophobicContact CG-CD1 4.48Å; R133-I137 WeakPolarHBondContact O-CD1 3.46Å; R133-I137 VanDerWaalsContact O-CG1 3.32Å; R133-I137 WeakPolarHBondContact O-CG1 3.14Å; R133-I137 PolarHBondContact O-N 2.94Å; Q134-I137 WeakPolarHBondContact O-CB 3.28Å; Q134-I137 PolarHBondContact O-N 2.84Å; Q134-I137 VanDerWaalsContact O-N 3.13Å; I137-Q139 PolarHBondContact O-N 3.14Å; I137-S140 PolarHBondContact O-N 3.47Å; I137-L141 HydrophobicContact CG2-CD1 3.93Å; I137-L141 HydrophobicContact CG2-CG 4.38Å; I137-L141 WeakPolarHBondContact O-CG 3.42Å; I137-L141 PolarHBondContact O-N 2.97Å; I137-Q173 HydrophobicContact CD1-CB 4.01Å; I137-Q173 HydrophobicContact CG1-CB 3.51Å; I137-L174 HydrophobicContact CD1-CD2 3.79Å; I137-L174 HydrophobicContact CD1-CG 3.92Å; I137-L174 HydrophobicContact CG1-CG 4.29Å; I137-L174 HydrophobicContact CG2-CD1 4.49Å; I137-L174 HydrophobicContact CG2-CD2 4.28Å; I137-L174 HydrophobicContact CG2-CG 4.16Å; I137-L177 HydrophobicContact CD1-CD1 3.49Å; I137-L177 VanDerWaalsContact CD1-CD1 3.49Å; I137-L177 HydrophobicContact CD1-CG 4.31Å
138E93.2Very high90.8Very high127 Ų12744.4 Ų44.459%0.59323%0.225SC*.Hα-helixtrans-60.6-45.6-179.3-72177.1-178.500112.2Q134 A135 S140 L141 K142Q134-E138 WeakPolarHBondContact O-CG 3.38Å; Q134-E138 PolarHBondContact O-N 3.06Å; A135-E138 PolarHBondContact O-N 2.91Å; E138-S140 VanDerWaalsContact C-N 3.32Å; E138-S140 PolarHBondContact O-N 3.45Å; E138-L141 PolarHBondContact O-N 2.97Å; E138-K142 WeakPolarHBondContact O-CB 3.44Å; E138-K142 PolarHBondContact O-N 2.86Å
139Q92.3Very high90Very high28 Ų2843.7 Ų43.713%0.13122%0.222CC..Hα-helixtrans-60.8-43.4176.1-179.2179.63.400111.4P94 L100 A135 I137 K142 H143P94-Q139 VanDerWaalsContact CA-OE1 3.22Å; P94-Q139 VanDerWaalsContact CB-OE1 3.27Å; L100-Q139 VanDerWaalsContact CD1-NE2 3.34Å; A135-Q139 VanDerWaalsContact O-CB 3.3Å; A135-Q139 WeakPolarHBondContact O-CB 3.41Å; A135-Q139 PolarHBondContact O-N 3.41Å; I137-Q139 PolarHBondContact O-N 3.14Å; Q139-K142 WeakPolarHBondContact O-CB 3.39Å; Q139-K142 PolarHBondContact O-N 3.45Å; Q139-H143 WeakPolarHBondContact CG-NE2 3.41Å; Q139-H143 PolarHBondContact NE2-NE2 3.41Å; Q139-H143 VanDerWaalsContact NE2-NE2 3.12Å; Q139-H143 PolarHBondContact O-CD2 3.44Å; Q139-H143 VanDerWaalsContact O-CG 3.27Å; Q139-H143 PolarHBondContact O-N 2.84Å
140S92.8Very high89Confident3 Ų342.4 Ų42.42%0.02122%0.219CC..Hα-helixtrans-66.7-39.7-179.8-57.70000112L136 I137 E138 K142 H143 F144 F169L136-S140 VanDerWaalsContact O-CB 3.27Å; L136-S140 WeakPolarHBondContact O-CB 3.34Å; L136-S140 PolarHBondContact O-N 3.15Å; L136-S140 PolarHBondContact O-OG 3.21Å; I137-S140 PolarHBondContact O-N 3.47Å; E138-S140 VanDerWaalsContact C-N 3.32Å; E138-S140 PolarHBondContact O-N 3.45Å; S140-K142 VanDerWaalsContact C-N 3.33Å; S140-H143 PolarHBondContact O-N 3Å; S140-F144 WeakPolarHBondContact O-CB 3.37Å; S140-F144 PolarHBondContact O-N 3.15Å; S140-F169 VanDerWaalsContact OG-CD1 3.28Å; S140-F169 WeakPolarHBondContact OG-CD1 3.17Å
141L93.3Very high87.8Confident36 Ų3646.8 Ų46.819%0.18825%0.249CC..Hα-helixtrans-66.3-36173.7-68.8176.5000111.9I137 E138 F144 S145 L167 A170 L193I137-L141 HydrophobicContact CG2-CD1 3.93Å; I137-L141 HydrophobicContact CG2-CG 4.38Å; I137-L141 WeakPolarHBondContact O-CG 3.42Å; I137-L141 PolarHBondContact O-N 2.97Å; E138-L141 PolarHBondContact O-N 2.97Å; L141-F144 WeakPolarHBondContact O-CB 3.45Å; L141-F144 PolarHBondContact O-N 3.4Å; L141-S145 PolarHBondContact O-N 2.79Å; L141-L167 HydrophobicContact CD2-CD1 3.71Å; L141-A170 HydrophobicContact CD2-CB 3.98Å; L141-A170 HydrophobicContact CG-CB 4.14Å; L141-L193 HydrophobicContact CD1-CD1 4.43Å; L141-L193 HydrophobicContact CD2-CD1 4.07Å; L141-L193 HydrophobicContact CD2-CD2 3.92Å
142K91.5Very high86.1Confident63 Ų6350.3 Ų50.327%0.27427%0.265SS..Hα-helixtrans-62.2-45.9172-172.1-177.8179.2-168.10111N99 E138 Q139 S140 S145 Q146N99-K142 PolarHBondContact OD1-NZ 3.33Å; E138-K142 WeakPolarHBondContact O-CB 3.44Å; E138-K142 PolarHBondContact O-N 2.86Å; Q139-K142 WeakPolarHBondContact O-CB 3.39Å; Q139-K142 PolarHBondContact O-N 3.45Å; S140-K142 VanDerWaalsContact C-N 3.33Å; K142-S145 PolarHBondContact O-N 3.31Å; K142-S145 PolarHBondContact O-OG 2.96Å; K142-Q146 WeakPolarHBondContact O-CG 3.3Å; K142-Q146 PolarHBondContact O-N 2.84Å
143H91.3Very high84.5Confident2 Ų252.1 Ų52.11%0.00927%0.274CS..Hα-helixtrans-64.6-39.1176.3-63.2-33.4000112.9L100 I102 Q139 S140 S145 Q146 M147 Y166L100-H143 PolarHBondContact O-CE1 3.43Å; I102-H143 HydrophobicContact CD1-CB 3.97Å; I102-H143 WeakPolarHBondContact CD1-CD2 3.26Å; I102-H143 VanDerWaalsContact CD1-CE1 3.45Å; I102-H143 WeakPolarHBondContact CD1-CE1 3.1Å; I102-H143 WeakPolarHBondContact CD1-ND1 3.29Å; I102-H143 WeakPolarHBondContact CD1-NE2 3.39Å; I102-H143 WeakPolarHBondContact CG1-CE1 3.48Å; I102-H143 WeakPolarHBondContact CG1-ND1 3.45Å; Q139-H143 WeakPolarHBondContact CG-NE2 3.41Å; Q139-H143 PolarHBondContact NE2-NE2 3.41Å; Q139-H143 VanDerWaalsContact NE2-NE2 3.12Å; Q139-H143 PolarHBondContact O-CD2 3.44Å; Q139-H143 VanDerWaalsContact O-CG 3.27Å; Q139-H143 PolarHBondContact O-N 2.84Å; S140-H143 PolarHBondContact O-N 3Å; H143-S145 VanDerWaalsContact C-N 3.35Å; H143-S145 PolarHBondContact O-N 3.49Å; H143-Q146 PolarHBondContact ND1-OE1 2.93Å; H143-Q146 VanDerWaalsContact ND1-OE1 3.15Å; H143-Q146 PolarHBondContact O-N 3.28Å; H143-M147 WeakPolarHBondContact O-CB 3.01Å; H143-M147 WeakPolarHBondContact O-CG 3.2Å; H143-M147 PolarHBondContact O-N 3.32Å; H143-Y166 HydrophobicContact CB-CD1 3.86Å; H143-Y166 HydrophobicContact CB-CD2 3.93Å; H143-Y166 HydrophobicContact CB-CE1 4.08Å; H143-Y166 HydrophobicContact CB-CE2 4.17Å; H143-Y166 HydrophobicContact CB-CG 3.81Å
144F91.3Very high82.7Confident22 Ų2261.3 Ų61.310%0.09632%0.317CS..Hα-helixtrans-54.6-50.6169.9164.9-110.1000111.3S140 L141 Q146 M147 Q148 S163 L167 D197S140-F144 WeakPolarHBondContact O-CB 3.37Å; S140-F144 PolarHBondContact O-N 3.15Å; L141-F144 WeakPolarHBondContact O-CB 3.45Å; L141-F144 PolarHBondContact O-N 3.4Å; F144-Q146 VanDerWaalsContact C-N 3.29Å; F144-Q146 PolarHBondContact O-N 3.49Å; F144-M147 PolarHBondContact O-N 2.9Å; F144-M147 VanDerWaalsContact O-N 3.17Å; F144-Q148 HydrophobicContact CD2-CG 4.35Å; F144-Q148 HydrophobicContact CE1-CG 4.33Å; F144-Q148 HydrophobicContact CE2-CG 4.1Å; F144-Q148 HydrophobicContact CZ-CG 4.11Å; F144-Q148 WeakPolarHBondContact O-CG 3.42Å; F144-Q148 PolarHBondContact O-N 3.44Å; F144-S163 WeakPolarHBondContact CD2-O 3.4Å; F144-L167 HydrophobicContact CB-CB 4.44Å; F144-L167 HydrophobicContact CD2-CB 3.64Å; F144-L167 HydrophobicContact CD2-CD2 4.14Å; F144-L167 HydrophobicContact CD2-CG 4.42Å; F144-L167 HydrophobicContact CE1-CD2 4.16Å; F144-L167 HydrophobicContact CE2-CB 3.91Å; F144-L167 HydrophobicContact CE2-CD2 3.56Å; F144-L167 HydrophobicContact CE2-CG 4.31Å; F144-L167 HydrophobicContact CG-CB 4.04Å; F144-L167 HydrophobicContact CZ-CD2 3.55Å; F144-D197 WeakPolarHBondContact CE2-OD1 3.35Å
145S89.3Confident80.9Confident75 Ų7561.1 Ų61.152%0.52432%0.315SS..Hα-helixtrans-63.7-31.3179.373.50000113.9L141 K142 H143L141-S145 PolarHBondContact O-N 2.79Å; K142-S145 PolarHBondContact O-N 3.31Å; K142-S145 PolarHBondContact O-OG 2.96Å; H143-S145 VanDerWaalsContact C-N 3.35Å; H143-S145 PolarHBondContact O-N 3.49Å
146Q87.6Confident79.2Confident66 Ų6667 Ų6731%0.30834%0.344SS..Hα-helixtrans-73.6-28.9176.3-71.9171.9-21.100113.3K142 H143 F144K142-Q146 WeakPolarHBondContact O-CG 3.3Å; K142-Q146 PolarHBondContact O-N 2.84Å; H143-Q146 PolarHBondContact ND1-OE1 2.93Å; H143-Q146 VanDerWaalsContact ND1-OE1 3.15Å; H143-Q146 PolarHBondContact O-N 3.28Å; F144-Q146 VanDerWaalsContact C-N 3.29Å; F144-Q146 PolarHBondContact O-N 3.49Å
147M87.5Confident77.1Confident6 Ų674.9 Ų74.93%0.0339%0.385CS..Hα-helixtrans-100.5-5.5-176.9-63.6-56.9-57.900113.1Q106 A109 H143 F144 A162 Y166Q106-M147 HydrophobicContact CG-CE 4.08Å; Q106-M147 VanDerWaalsContact NE2-CE 3.33Å; A109-M147 HydrophobicContact CB-CE 3.55Å; A109-M147 HydrophobicContact CB-CG 4.34Å; A109-M147 HydrophobicContact CB-SD 3.83Å; H143-M147 WeakPolarHBondContact O-CB 3.01Å; H143-M147 WeakPolarHBondContact O-CG 3.2Å; H143-M147 PolarHBondContact O-N 3.32Å; F144-M147 PolarHBondContact O-N 2.9Å; F144-M147 VanDerWaalsContact O-N 3.17Å; M147-A162 HydrophobicContact CE-CB 3.93Å; M147-Y166 HydrophobicContact CG-CD2 4.45Å; M147-Y166 HydrophobicContact CG-CE2 4.36Å
148Q82.6Confident75.3Confident55 Ų5577.1 Ų77.126%0.25741%0.409SS..SBendtrans-57.7126.3170.5-87.7-98.9-27.300108.6F144F144-Q148 HydrophobicContact CD2-CG 4.35Å; F144-Q148 HydrophobicContact CE1-CG 4.33Å; F144-Q148 HydrophobicContact CE2-CG 4.1Å; F144-Q148 HydrophobicContact CZ-CG 4.11Å; F144-Q148 WeakPolarHBondContact O-CG 3.42Å; F144-Q148 PolarHBondContact O-N 3.44Å
149P72.6Confident73.8Confident23 Ų2374.4 Ų74.415%0.14940%0.399CS..PPolyproline II helixtrans-70.2161.1179.829.5-33.8000111.3F155 H160P149-F155 HydrophobicContact CB-CD1 4.04Å; P149-F155 HydrophobicContact CB-CE1 3.18Å; P149-F155 HydrophobicContact CB-CZ 3.47Å; P149-F155 VanDerWaalsContact CB-CZ 3.47Å; P149-F155 HydrophobicContact CG-CD1 4.06Å; P149-F155 HydrophobicContact CG-CE1 3.44Å; P149-F155 VanDerWaalsContact CG-CE1 3.44Å; P149-F155 HydrophobicContact CG-CE2 4.06Å; P149-F155 HydrophobicContact CG-CZ 3.4Å; P149-F155 VanDerWaalsContact CG-CZ 3.4Å; P149-H160 WeakPolarHBondContact CG-CE1 3.18Å
150S69.1Low73Confident47 Ų4774.3 Ų74.333%0.32940%0.398SS..PPolyproline II helixtrans-69.3142.2-177.772.30000110.5Q152 E153 F155S150-Q152 PolarHBondContact O-N 3.1Å; S150-E153 PolarHBondContact N-OE2 3.13Å; S150-E153 PolarHBondContact O-N 3.32Å; S150-E153 WeakPolarHBondContact OG-CG 3.21Å; S150-E153 PolarHBondContact OG-OE2 3.32Å; S150-F155 VanDerWaalsContact O-CZ 3.32Å; S150-F155 WeakPolarHBondContact O-CZ 3.42Å
151P64.2Low72.4Confident137 Ų13775.7 Ų75.789%0.8941%0.41SS*.THydrogen-bonded Turntrans-59.6-3.2-177-24.432.6000116.2
152Q55.6Low72Confident186 Ų18674 Ų7487%0.86940%0.401SS*.THydrogen-bonded Turntrans-107.8-4-171.2-64.5176.7-6.400113.3S150S150-Q152 PolarHBondContact O-N 3.1Å
153E58.6Low71.9Confident113 Ų11371 Ų7153%0.52839%0.388SS..SBendtrans-94.6128.1-178.2-75.3165.2150.300110.3S150 F155S150-E153 PolarHBondContact N-OE2 3.13Å; S150-E153 PolarHBondContact O-N 3.32Å; S150-E153 WeakPolarHBondContact OG-CG 3.21Å; S150-E153 PolarHBondContact OG-OE2 3.32Å; E153-F155 HydrophobicContact CB-CD1 4.21Å; E153-F155 HydrophobicContact CB-CE1 3.44Å; E153-F155 VanDerWaalsContact CB-CE1 3.44Å; E153-F155 HydrophobicContact CB-CZ 3.96Å; E153-F155 WeakPolarHBondContact O-CD2 3.47Å; E153-F155 VanDerWaalsContact O-CE1 3.31Å; E153-F155 WeakPolarHBondContact O-CE1 3.49Å; E153-F155 WeakPolarHBondContact O-CE2 3.49Å; E153-F155 WeakPolarHBondContact O-CZ 3.28Å; E153-F155 PolarHBondContact O-N 2.75Å
154E52.3Low71.9Confident197 Ų19771.6 Ų71.692%0.92139%0.392SS*.  trans-74.6113.5169.5-73.5-176.3170.300108.6
155F56.7Low71.8Confident78 Ų7871.1 Ų71.134%0.34239%0.392SS..  trans-83.2138.4-169.6-56.9-58.1000113.6P149 S150 E153 D159 H160P149-F155 HydrophobicContact CB-CD1 4.04Å; P149-F155 HydrophobicContact CB-CE1 3.18Å; P149-F155 HydrophobicContact CB-CZ 3.47Å; P149-F155 VanDerWaalsContact CB-CZ 3.47Å; P149-F155 HydrophobicContact CG-CD1 4.06Å; P149-F155 HydrophobicContact CG-CE1 3.44Å; P149-F155 VanDerWaalsContact CG-CE1 3.44Å; P149-F155 HydrophobicContact CG-CE2 4.06Å; P149-F155 HydrophobicContact CG-CZ 3.4Å; P149-F155 VanDerWaalsContact CG-CZ 3.4Å; S150-F155 VanDerWaalsContact O-CZ 3.32Å; S150-F155 WeakPolarHBondContact O-CZ 3.42Å; E153-F155 HydrophobicContact CB-CD1 4.21Å; E153-F155 HydrophobicContact CB-CE1 3.44Å; E153-F155 VanDerWaalsContact CB-CE1 3.44Å; E153-F155 HydrophobicContact CB-CZ 3.96Å; E153-F155 WeakPolarHBondContact O-CD2 3.47Å; E153-F155 VanDerWaalsContact O-CE1 3.31Å; E153-F155 WeakPolarHBondContact O-CE1 3.49Å; E153-F155 WeakPolarHBondContact O-CE2 3.49Å; E153-F155 WeakPolarHBondContact O-CZ 3.28Å; E153-F155 PolarHBondContact O-N 2.75Å; F155-D159 HydrophobicContact CD1-CB 4.07Å; F155-H160 AromaticContact CD2-NE2 3.47Å; F155-H160 WeakPolarHBondContact CD2-NE2 3.4Å; F155-H160 AromaticContact CG-NE2 3.51Å
156L54.7Low72Confident140 Ų14067.6 Ų67.673%0.73337%0.367SS*.  trans-91.5146.9161.9-67172.3000108.8G158 D159L156-G158 PolarHBondContact O-N 3.26Å; L156-D159 PolarHBondContact N-OD2 2.99Å; L156-D159 VanDerWaalsContact N-OD2 3.15Å; L156-D159 PolarHBondContact O-N 3.07Å
157N50.1Low72.3Confident166 Ų16664.5 Ų64.589%0.88835%0.352SS*.THydrogen-bonded Turntrans-54.997.7176.9-64.4-18.8000110.3
158G55Low72.5Confident49 Ų4965 Ų6551%0.50536%0.355SS..THydrogen-bonded Turntrans148.5-26.3-17600000114.6L156 H160 A161L156-G158 PolarHBondContact O-N 3.26Å; G158-H160 PolarHBondContact O-N 2.83Å; G158-A161 VanDerWaalsContact O-CB 3.27Å; G158-A161 WeakPolarHBondContact O-CB 3.34Å; G158-A161 PolarHBondContact O-N 2.87Å
159D60.6Low73Confident71 Ų7162.4 Ų62.438%0.3834%0.343SS..THydrogen-bonded Turntrans-66.6-22.9-175-66-29.3000113.2F155 L156F155-D159 HydrophobicContact CD1-CB 4.07Å; L156-D159 PolarHBondContact N-OD2 2.99Å; L156-D159 VanDerWaalsContact N-OD2 3.15Å; L156-D159 PolarHBondContact O-N 3.07Å
160H75.9Confident74.1Confident26 Ų2661.3 Ų61.312%0.1234%0.336CS..THydrogen-bonded Turntrans-89.6-1.5176.9-59.3-83.2000114P149 F155 G158 A162 S163 S164P149-H160 WeakPolarHBondContact CG-CE1 3.18Å; F155-H160 AromaticContact CD2-NE2 3.47Å; F155-H160 WeakPolarHBondContact CD2-NE2 3.4Å; F155-H160 AromaticContact CG-NE2 3.51Å; G158-H160 PolarHBondContact O-N 2.83Å; H160-A162 VanDerWaalsContact C-N 3.32Å; H160-A162 PolarHBondContact O-N 3.48Å; H160-S163 PolarHBondContact O-N 3.15Å; H160-S163 PolarHBondContact O-OG 2.72Å; H160-S164 VanDerWaalsContact O-CB 3.31Å; H160-S164 WeakPolarHBondContact O-CB 3.46Å; H160-S164 PolarHBondContact O-N 2.99Å; H160-S164 PolarHBondContact O-OG 2.75Å; H160-S164 VanDerWaalsContact O-OG 3.11Å
161A80.6Confident75.2Confident32 Ų3259.1 Ų59.126%0.26432%0.321SS..Hα-helixtrans-60.3-39.7-168.600000113.1L110 G158 S165L110-A161 HydrophobicContact CD2-CB 3.99Å; G158-A161 VanDerWaalsContact O-CB 3.27Å; G158-A161 WeakPolarHBondContact O-CB 3.34Å; G158-A161 PolarHBondContact O-N 2.87Å; A161-S165 WeakPolarHBondContact O-CB 3.38Å; A161-S165 PolarHBondContact O-N 3.24Å; A161-S165 VanDerWaalsContact O-N 3.16Å
162A85.7Confident76.5Confident0 Ų052.8 Ų52.80%028%0.279CS..Hα-helixtrans-73.6-46.9178.400000112.2A109 L110 M147 H160 S165 Y166A109-A162 HydrophobicContact CB-CB 4Å; L110-A162 HydrophobicContact CB-CB 4.12Å; M147-A162 HydrophobicContact CE-CB 3.93Å; H160-A162 VanDerWaalsContact C-N 3.32Å; H160-A162 PolarHBondContact O-N 3.48Å; A162-S165 PolarHBondContact O-N 3.16Å; A162-Y166 WeakPolarHBondContact O-CD2 3.36Å; A162-Y166 PolarHBondContact O-N 3.49Å; A162-Y166 VanDerWaalsContact O-N 3.11Å
163S89.6Confident78.3Confident0 Ų043.9 Ų43.90%024%0.238CC..Hα-helixtrans-61.7-52.3179.652.90000110.9F144 H160 S165 Y166 L167F144-S163 WeakPolarHBondContact CD2-O 3.4Å; H160-S163 PolarHBondContact O-N 3.15Å; H160-S163 PolarHBondContact O-OG 2.72Å; S163-S165 PolarHBondContact O-N 3.45Å; S163-Y166 PolarHBondContact O-N 3.04Å; S163-Y166 VanDerWaalsContact O-N 3.1Å; S163-L167 PolarHBondContact O-N 3.19Å
164S89.6Confident79.9Confident14 Ų1438.6 Ų38.610%0.09821%0.213CC..Hα-helixtrans-59.7-32.8176.8-57.30000112H160 L167 L168 F207H160-S164 VanDerWaalsContact O-CB 3.31Å; H160-S164 WeakPolarHBondContact O-CB 3.46Å; H160-S164 PolarHBondContact O-N 2.99Å; H160-S164 PolarHBondContact O-OG 2.75Å; H160-S164 VanDerWaalsContact O-OG 3.11Å; S164-L167 PolarHBondContact O-N 2.94Å; S164-L168 VanDerWaalsContact O-CB 3.23Å; S164-L168 WeakPolarHBondContact O-CB 3.37Å; S164-L168 PolarHBondContact O-N 3.23Å; S164-F207 WeakPolarHBondContact O-CZ 3.21Å
165S90.3Very high81.7Confident13 Ų1330.1 Ų30.19%0.09117%0.173CC..Hα-helixtrans-67.2-40175.8-169.90000112.8A113 H117 A161 A162 S163 F169A113-S165 VanDerWaalsContact CB-OG 3.29Å; A113-S165 WeakPolarHBondContact CB-OG 3.31Å; H117-S165 PolarHBondContact NE2-O 3.43Å; A161-S165 WeakPolarHBondContact O-CB 3.38Å; A161-S165 PolarHBondContact O-N 3.24Å; A161-S165 VanDerWaalsContact O-N 3.16Å; A162-S165 PolarHBondContact O-N 3.16Å; S163-S165 PolarHBondContact O-N 3.45Å; S165-F169 PolarHBondContact O-N 3.24Å
166Y93.1Very high83.2Confident0 Ų027.8 Ų27.80%016%0.163CC..Hα-helixtrans-66.8-42.4172.7-76.2-64.7000112.5I102 A109 H112 A113 L116 H143 M147 A162 S163 L168 F169 A170I102-Y166 HydrophobicContact CD1-CE1 3.99Å; I102-Y166 HydrophobicContact CD1-CE2 4.32Å; I102-Y166 VanDerWaalsContact CD1-OH 3.24Å; I102-Y166 WeakPolarHBondContact CD1-OH 3.16Å; A109-Y166 HydrophobicContact CB-CE2 4.23Å; A109-Y166 PolarHBondContact O-OH 3.15Å; H112-Y166 WeakPolarHBondContact CB-OH 3.28Å; H112-Y166 AromaticContact ND1-CE1 3.63Å; H112-Y166 AromaticContact ND1-CZ 3.67Å; H112-Y166 PolarHBondContact ND1-OH 3.28Å; A113-Y166 HydrophobicContact CB-CD1 4.09Å; A113-Y166 HydrophobicContact CB-CD2 4.3Å; A113-Y166 HydrophobicContact CB-CE1 3.86Å; A113-Y166 HydrophobicContact CB-CE2 4.06Å; A113-Y166 HydrophobicContact CB-CG 4.28Å; L116-Y166 HydrophobicContact CD1-CD1 4.19Å; L116-Y166 HydrophobicContact CD1-CE1 3.89Å; H143-Y166 HydrophobicContact CB-CD1 3.86Å; H143-Y166 HydrophobicContact CB-CD2 3.93Å; H143-Y166 HydrophobicContact CB-CE1 4.08Å; H143-Y166 HydrophobicContact CB-CE2 4.17Å; H143-Y166 HydrophobicContact CB-CG 3.81Å; M147-Y166 HydrophobicContact CG-CD2 4.45Å; M147-Y166 HydrophobicContact CG-CE2 4.36Å; A162-Y166 WeakPolarHBondContact O-CD2 3.36Å; A162-Y166 PolarHBondContact O-N 3.49Å; A162-Y166 VanDerWaalsContact O-N 3.11Å; S163-Y166 PolarHBondContact O-N 3.04Å; S163-Y166 VanDerWaalsContact O-N 3.1Å; Y166-L168 VanDerWaalsContact C-N 3.33Å; Y166-F169 WeakPolarHBondContact O-CB 3.45Å; Y166-F169 PolarHBondContact O-N 3.12Å; Y166-A170 PolarHBondContact O-N 3.03Å
167L94.2Very high84.8Confident1 Ų121.1 Ų21.11%0.00513%0.128CC..Hα-helixtrans-63.6-42.4177.1-179.954.3000111.2L141 F144 S163 S164 F169 A170 C171 L193 D197 F207L141-L167 HydrophobicContact CD2-CD1 3.71Å; F144-L167 HydrophobicContact CB-CB 4.44Å; F144-L167 HydrophobicContact CD2-CB 3.64Å; F144-L167 HydrophobicContact CD2-CD2 4.14Å; F144-L167 HydrophobicContact CD2-CG 4.42Å; F144-L167 HydrophobicContact CE1-CD2 4.16Å; F144-L167 HydrophobicContact CE2-CB 3.91Å; F144-L167 HydrophobicContact CE2-CD2 3.56Å; F144-L167 HydrophobicContact CE2-CG 4.31Å; F144-L167 HydrophobicContact CG-CB 4.04Å; F144-L167 HydrophobicContact CZ-CD2 3.55Å; S163-L167 PolarHBondContact O-N 3.19Å; S164-L167 PolarHBondContact O-N 2.94Å; L167-F169 VanDerWaalsContact C-N 3.3Å; L167-F169 PolarHBondContact O-N 3.47Å; L167-A170 WeakPolarHBondContact O-CB 3.33Å; L167-A170 PolarHBondContact O-N 2.69Å; L167-C171 WeakPolarHBondContact O-CB 3.32Å; L167-C171 PolarHBondContact O-N 2.95Å; L167-C171 PolarHBondContact O-SG 3.02Å; L167-L193 HydrophobicContact CD1-CB 4.21Å; L167-L193 HydrophobicContact CD1-CD1 4.46Å; L167-L193 HydrophobicContact CD1-CD2 4.28Å; L167-D197 HydrophobicContact CD2-CB 3.53Å; L167-F207 HydrophobicContact CB-CE2 4.35Å; L167-F207 HydrophobicContact CB-CZ 4.16Å; L167-F207 HydrophobicContact CD2-CE2 3.58Å; L167-F207 HydrophobicContact CD2-CZ 4.24Å; L167-F207 HydrophobicContact CG-CE2 3.87Å; L167-F207 HydrophobicContact CG-CZ 4.08Å
168L92.4Very high86.7Confident17 Ų1714.7 Ų14.79%0.0899%0.092CC..Hα-helixtrans-57.7-45.1173.4-177.359.2000111.2S164 Y166 A170 C171 C172 V206 F207 L210 V255 I258S164-L168 VanDerWaalsContact O-CB 3.23Å; S164-L168 WeakPolarHBondContact O-CB 3.37Å; S164-L168 PolarHBondContact O-N 3.23Å; Y166-L168 VanDerWaalsContact C-N 3.33Å; L168-A170 PolarHBondContact O-N 3.32Å; L168-C171 WeakPolarHBondContact O-CB 3.48Å; L168-C171 PolarHBondContact O-N 3Å; L168-C172 PolarHBondContact O-N 3.34Å; L168-C172 PolarHBondContact O-SG 3.05Å; L168-V206 HydrophobicContact CD1-CG1 4.2Å; L168-V206 HydrophobicContact CD2-CG1 4.44Å; L168-F207 HydrophobicContact CB-CE1 3.87Å; L168-F207 HydrophobicContact CB-CZ 4.19Å; L168-F207 HydrophobicContact CD1-CE1 4.05Å; L168-F207 HydrophobicContact CG-CE1 4.42Å; L168-L210 HydrophobicContact CD1-CD1 3.45Å; L168-L210 VanDerWaalsContact CD1-CD1 3.45Å; L168-V255 HydrophobicContact CD2-CG1 3.66Å; L168-I258 HydrophobicContact CD2-CD1 4.15Å
169F92.7Very high88.1Confident0 Ų015.8 Ų15.80%09%0.089CC..Hα-helixtrans-61.3-45177.6-177.7-102000111.7L116 H117 Y125 L136 S140 S165 Y166 L167 C171 C172 Q173L116-F169 HydrophobicContact CB-CD1 4.27Å; L116-F169 HydrophobicContact CB-CD2 3.8Å; L116-F169 HydrophobicContact CB-CE1 4.17Å; L116-F169 HydrophobicContact CB-CE2 3.7Å; L116-F169 HydrophobicContact CB-CG 4.09Å; L116-F169 HydrophobicContact CB-CZ 3.89Å; L116-F169 HydrophobicContact CD1-CD1 4.03Å; L116-F169 HydrophobicContact CD1-CE1 4.12Å; L116-F169 HydrophobicContact CD1-CG 4.45Å; L116-F169 WeakPolarHBondContact O-CE2 3.27Å; H117-F169 VanDerWaalsContact CE1-CA 3.41Å; H117-F169 WeakPolarHBondContact CE1-CA 3.44Å; H117-F169 PolarHBondContact CE1-N 2.93Å; H117-F169 AromaticContact ND1-CD2 3.87Å; Y125-F169 HydrophobicContact CD2-CE2 4.29Å; Y125-F169 HydrophobicContact CD2-CZ 4.16Å; Y125-F169 AromaticContact CE2-CE2 3.63Å; Y125-F169 HydrophobicContact CE2-CE2 3.63Å; Y125-F169 AromaticContact CE2-CZ 3.49Å; Y125-F169 HydrophobicContact CE2-CZ 3.49Å; Y125-F169 VanDerWaalsContact CE2-CZ 3.49Å; Y125-F169 AromaticContact CZ-CZ 3.78Å; L136-F169 HydrophobicContact CD2-CE1 4.3Å; S140-F169 VanDerWaalsContact OG-CD1 3.28Å; S140-F169 WeakPolarHBondContact OG-CD1 3.17Å; S165-F169 PolarHBondContact O-N 3.24Å; Y166-F169 WeakPolarHBondContact O-CB 3.45Å; Y166-F169 PolarHBondContact O-N 3.12Å; L167-F169 VanDerWaalsContact C-N 3.3Å; L167-F169 PolarHBondContact O-N 3.47Å; F169-C171 VanDerWaalsContact C-N 3.31Å; F169-C171 PolarHBondContact O-N 3.28Å; F169-C172 WeakPolarHBondContact O-CB 3.17Å; F169-C172 PolarHBondContact O-N 3.34Å; F169-Q173 HydrophobicContact CD1-CG 4.42Å; F169-Q173 HydrophobicContact CE1-CG 3.99Å; F169-Q173 HydrophobicContact CZ-CG 4.05Å; F169-Q173 WeakPolarHBondContact O-CG 3.42Å; F169-Q173 PolarHBondContact O-N 3.3Å
170A94.4Very high89.2Confident0 Ų016.5 Ų16.50%09%0.09CC..Hα-helixtrans-58.7-42.9174.400000111.8L141 Y166 L167 L168 C172 Q173 L174L141-A170 HydrophobicContact CD2-CB 3.98Å; L141-A170 HydrophobicContact CG-CB 4.14Å; Y166-A170 PolarHBondContact O-N 3.03Å; L167-A170 WeakPolarHBondContact O-CB 3.33Å; L167-A170 PolarHBondContact O-N 2.69Å; L168-A170 PolarHBondContact O-N 3.32Å; A170-C172 VanDerWaalsContact C-N 3.34Å; A170-C172 PolarHBondContact O-N 2.95Å; A170-Q173 PolarHBondContact O-N 3.22Å; A170-L174 PolarHBondContact O-N 2.86Å
171C93.8Very high89.6Confident2 Ų219.5 Ų19.51%0.01411%0.107CC..Hα-helixtrans-60.1-42175.8-71.30000111.9L167 L168 F169 Q173 L174 W175 L190L167-C171 WeakPolarHBondContact O-CB 3.32Å; L167-C171 PolarHBondContact O-N 2.95Å; L167-C171 PolarHBondContact O-SG 3.02Å; L168-C171 WeakPolarHBondContact O-CB 3.48Å; L168-C171 PolarHBondContact O-N 3Å; F169-C171 VanDerWaalsContact C-N 3.31Å; F169-C171 PolarHBondContact O-N 3.28Å; C171-Q173 VanDerWaalsContact C-N 3.33Å; C171-Q173 PolarHBondContact O-N 2.91Å; C171-L174 PolarHBondContact O-N 3.19Å; C171-W175 WeakPolarHBondContact O-CB 3.44Å; C171-W175 PolarHBondContact O-N 2.98Å; C171-L190 HydrophobicContact CB-CD1 3.36Å; C171-L190 VanDerWaalsContact SG-CD1 3.5Å
172C91.1Very high89.8Confident3 Ų325.2 Ų25.22%0.0213%0.128CC..Hα-helixtrans-63.1-38.8175-61.10000112L168 F169 A170 W175 Q176 I258 L259L168-C172 PolarHBondContact O-N 3.34Å; L168-C172 PolarHBondContact O-SG 3.05Å; F169-C172 WeakPolarHBondContact O-CB 3.17Å; F169-C172 PolarHBondContact O-N 3.34Å; A170-C172 VanDerWaalsContact C-N 3.34Å; A170-C172 PolarHBondContact O-N 2.95Å; C172-W175 WeakPolarHBondContact O-CB 3.33Å; C172-W175 PolarHBondContact O-N 3.43Å; C172-Q176 VanDerWaalsContact O-CG 3.29Å; C172-Q176 WeakPolarHBondContact O-CG 3.47Å; C172-Q176 PolarHBondContact O-N 3.33Å; C172-I258 HydrophobicContact CB-CG2 4.39Å; C172-I258 WeakPolarHBondContact SG-CG2 3.45Å; C172-L259 HydrophobicContact CB-CD2 3.91Å; C172-L259 VanDerWaalsContact SG-CD2 3.56Å
173Q92Very high89.9Confident0 Ų028 Ų280%014%0.143CC..Hα-helixtrans-71.4-35.8176.8-60-44.8-44.200112.9R133 I137 F169 A170 C171 W175 Q176 L177R133-Q173 WeakPolarHBondContact CD-O 3.47Å; R133-Q173 HydrophobicContact CG-CB 4.13Å; I137-Q173 HydrophobicContact CD1-CB 4.01Å; I137-Q173 HydrophobicContact CG1-CB 3.51Å; F169-Q173 HydrophobicContact CD1-CG 4.42Å; F169-Q173 HydrophobicContact CE1-CG 3.99Å; F169-Q173 HydrophobicContact CZ-CG 4.05Å; F169-Q173 WeakPolarHBondContact O-CG 3.42Å; F169-Q173 PolarHBondContact O-N 3.3Å; A170-Q173 PolarHBondContact O-N 3.22Å; C171-Q173 VanDerWaalsContact C-N 3.33Å; C171-Q173 PolarHBondContact O-N 2.91Å; Q173-W175 VanDerWaalsContact C-N 3.35Å; Q173-Q176 PolarHBondContact O-N 2.91Å; Q173-L177 PolarHBondContact O-N 2.92Å
174L92.4Very high89.9Confident1 Ų134 Ų341%0.00517%0.171CC..Hα-helixtrans-62.6-42.6171.4-77.7168.7000111.8I137 A170 C171 Q176 L177 F178 Q186 K189 L193I137-L174 HydrophobicContact CD1-CD2 3.79Å; I137-L174 HydrophobicContact CD1-CG 3.92Å; I137-L174 HydrophobicContact CG1-CG 4.29Å; I137-L174 HydrophobicContact CG2-CD1 4.49Å; I137-L174 HydrophobicContact CG2-CD2 4.28Å; I137-L174 HydrophobicContact CG2-CG 4.16Å; A170-L174 PolarHBondContact O-N 2.86Å; C171-L174 PolarHBondContact O-N 3.19Å; L174-Q176 VanDerWaalsContact C-N 3.29Å; L174-Q176 PolarHBondContact O-N 3.24Å; L174-L177 PolarHBondContact O-N 3.12Å; L174-F178 PolarHBondContact O-N 3.12Å; L174-Q186 VanDerWaalsContact CD2-OE1 3.23Å; L174-K189 HydrophobicContact CD1-CD 4.35Å; L174-K189 HydrophobicContact CD1-CG 4.15Å; L174-K189 HydrophobicContact CD2-CD 3.88Å; L174-K189 HydrophobicContact CD2-CG 4.39Å; L174-L193 HydrophobicContact CD1-CD1 3.53Å
175W90Very high90.1Very high20 Ų2039.2 Ų39.28%0.07619%0.194CC..Hα-helixtrans-57.7-44.3173.8-179.5-90.6000111.6C171 C172 Q173 L177 F178 V179 L187 L190 V214 L217 L259 W271C171-W175 WeakPolarHBondContact O-CB 3.44Å; C171-W175 PolarHBondContact O-N 2.98Å; C172-W175 WeakPolarHBondContact O-CB 3.33Å; C172-W175 PolarHBondContact O-N 3.43Å; Q173-W175 VanDerWaalsContact C-N 3.35Å; W175-L177 PolarHBondContact O-N 3.38Å; W175-F178 WeakPolarHBondContact O-CB 3.5Å; W175-F178 PolarHBondContact O-N 3.02Å; W175-F178 VanDerWaalsContact O-N 3.16Å; W175-V179 WeakPolarHBondContact O-CG2 3.48Å; W175-V179 PolarHBondContact O-N 2.97Å; W175-L187 HydrophobicContact CE3-CD2 4.4Å; W175-L187 HydrophobicContact CZ3-CD2 4.21Å; W175-L190 HydrophobicContact CE3-CD2 3.91Å; W175-V214 HydrophobicContact CZ3-CG2 4.5Å; W175-L217 HydrophobicContact CH2-CD1 3.4Å; W175-L217 VanDerWaalsContact CH2-CD1 3.4Å; W175-L217 HydrophobicContact CZ2-CD1 4.49Å; W175-L217 HydrophobicContact CZ3-CD1 3.62Å; W175-L259 HydrophobicContact CB-CD2 3.9Å; W175-L259 HydrophobicContact CD2-CD1 4.39Å; W175-L259 HydrophobicContact CG-CD2 3.9Å; W175-W271 AromaticContact CH2-CH2 3.43Å; W175-W271 HydrophobicContact CH2-CH2 3.43Å; W175-W271 VanDerWaalsContact CH2-CH2 3.43Å; W175-W271 AromaticContact CH2-CZ2 3.85Å; W175-W271 HydrophobicContact CH2-CZ2 3.85Å; W175-W271 HydrophobicContact CH2-CZ3 4.08Å; W175-W271 HydrophobicContact CZ2-CH2 4.04Å; W175-W271 HydrophobicContact CZ2-CZ2 4.37Å; W175-W271 HydrophobicContact CZ2-CZ3 4.33Å; W175-W271 HydrophobicContact CZ3-CH2 4.41Å
176Q88.4Confident90.1Very high28 Ų2840 Ų4013%0.13120%0.196CC..Hα-helixtrans-64.5-38.3177.3-70.5-69.5-32.200112.5C172 Q173 L174 F178 V179 Q180 L259C172-Q176 VanDerWaalsContact O-CG 3.29Å; C172-Q176 WeakPolarHBondContact O-CG 3.47Å; C172-Q176 PolarHBondContact O-N 3.33Å; Q173-Q176 PolarHBondContact O-N 2.91Å; L174-Q176 VanDerWaalsContact C-N 3.29Å; L174-Q176 PolarHBondContact O-N 3.24Å; Q176-F178 VanDerWaalsContact C-N 3.32Å; Q176-F178 PolarHBondContact O-N 2.96Å; Q176-V179 PolarHBondContact O-N 3.11Å; Q176-Q180 WeakPolarHBondContact O-CB 3.47Å; Q176-Q180 VanDerWaalsContact O-CG 3.24Å; Q176-Q180 WeakPolarHBondContact O-CG 3.37Å; Q176-Q180 PolarHBondContact O-N 3.1Å; Q176-L259 PolarHBondContact NE2-O 3.38Å
177L89.3Confident90Very high1 Ų140.2 Ų40.21%0.00520%0.197CC..Hα-helixtrans-62.2-39.3171.3-75.9179.1000112.5V130 R133 Q134 I137 Q173 L174 W175 Q180 N181 Q186V130-L177 HydrophobicContact CB-CD2 4.46Å; V130-L177 HydrophobicContact CG1-CD2 4.09Å; V130-L177 HydrophobicContact CG2-CD2 4.34Å; R133-L177 HydrophobicContact CB-CD2 4.12Å; R133-L177 HydrophobicContact CB-CG 4.5Å; R133-L177 HydrophobicContact CG-CD2 4.13Å; R133-L177 HydrophobicContact CG-CG 4.03Å; Q134-L177 HydrophobicContact CG-CD1 4.08Å; I137-L177 HydrophobicContact CD1-CD1 3.49Å; I137-L177 VanDerWaalsContact CD1-CD1 3.49Å; I137-L177 HydrophobicContact CD1-CG 4.31Å; Q173-L177 PolarHBondContact O-N 2.92Å; L174-L177 PolarHBondContact O-N 3.12Å; W175-L177 PolarHBondContact O-N 3.38Å; L177-Q180 PolarHBondContact O-N 3.23Å; L177-N181 PolarHBondContact O-N 3.25Å; L177-N181 VanDerWaalsContact O-N 3.09Å; L177-N181 PolarHBondContact O-ND2 2.86Å; L177-N181 VanDerWaalsContact O-ND2 3.15Å; L177-Q186 HydrophobicContact CB-CG 4.1Å
178F89.4Confident90Very high30 Ų3044.2 Ų44.213%0.13222%0.218CC..Hα-helixtrans-62.4-49.1174.7167.7-108.8000111.1L174 W175 Q176 Q180 N181 E182 Q186 L187 L217L174-F178 PolarHBondContact O-N 3.12Å; W175-F178 WeakPolarHBondContact O-CB 3.5Å; W175-F178 PolarHBondContact O-N 3.02Å; W175-F178 VanDerWaalsContact O-N 3.16Å; Q176-F178 VanDerWaalsContact C-N 3.32Å; Q176-F178 PolarHBondContact O-N 2.96Å; F178-Q180 PolarHBondContact O-N 3.45Å; F178-N181 PolarHBondContact O-N 3.16Å; F178-E182 WeakPolarHBondContact O-CA 3.34Å; F178-E182 PolarHBondContact O-N 2.97Å; F178-Q186 HydrophobicContact CB-CB 4.03Å; F178-L187 HydrophobicContact CB-CD2 4.34Å; F178-L187 HydrophobicContact CB-CG 4.48Å; F178-L187 HydrophobicContact CD1-CD1 4.42Å; F178-L187 HydrophobicContact CD1-CD2 3.69Å; F178-L187 HydrophobicContact CD1-CG 4.09Å; F178-L187 HydrophobicContact CD2-CD1 3.85Å; F178-L187 HydrophobicContact CD2-CD2 4.07Å; F178-L187 HydrophobicContact CD2-CG 3.53Å; F178-L187 HydrophobicContact CE1-CD1 4.05Å; F178-L187 HydrophobicContact CE1-CD2 3.99Å; F178-L187 HydrophobicContact CE1-CG 4.23Å; F178-L187 HydrophobicContact CE2-CD1 3.42Å; F178-L187 VanDerWaalsContact CE2-CD1 3.42Å; F178-L187 HydrophobicContact CE2-CD2 4.34Å; F178-L187 HydrophobicContact CE2-CG 3.7Å; F178-L187 HydrophobicContact CG-CD1 4.32Å; F178-L187 HydrophobicContact CG-CD2 3.73Å; F178-L187 HydrophobicContact CG-CG 3.74Å; F178-L187 HydrophobicContact CZ-CD1 3.54Å; F178-L187 HydrophobicContact CZ-CD2 4.31Å; F178-L187 HydrophobicContact CZ-CG 4.05Å; F178-L217 HydrophobicContact CE1-CD1 3.87Å; F178-L217 HydrophobicContact CZ-CD1 4.39Å
179V85Confident90.1Very high73 Ų7347.6 Ų47.644%0.44223%0.232SC..Hα-helixtrans-60.1-35.2178.9172.50000111.8W175 Q176W175-V179 WeakPolarHBondContact O-CG2 3.48Å; W175-V179 PolarHBondContact O-N 2.97Å; Q176-V179 PolarHBondContact O-N 3.11Å
180Q83Confident90.2Very high85 Ų8547.9 Ų47.940%0.39723%0.234SC..Hα-helixtrans-75.8-35.7-179.2-73.4177-13.100114.1Q176 L177 F178Q176-Q180 WeakPolarHBondContact O-CB 3.47Å; Q176-Q180 VanDerWaalsContact O-CG 3.24Å; Q176-Q180 WeakPolarHBondContact O-CG 3.37Å; Q176-Q180 PolarHBondContact O-N 3.1Å; L177-Q180 PolarHBondContact O-N 3.23Å; F178-Q180 PolarHBondContact O-N 3.45Å
181N85.9Confident90.2Very high90 Ų9048.3 Ų48.348%0.48124%0.237SC..Hα-helixtrans-119.5-7-168.5-57.7-55.5000114.2L177 F178 D183L177-N181 PolarHBondContact O-N 3.25Å; L177-N181 VanDerWaalsContact O-N 3.09Å; L177-N181 PolarHBondContact O-ND2 2.86Å; L177-N181 VanDerWaalsContact O-ND2 3.15Å; F178-N181 PolarHBondContact O-N 3.16Å; N181-D183 HydrophobicContact CB-CB 4.29Å; N181-D183 PolarHBondContact O-N 3.11Å
182E84.7Confident90.3Very high151 Ų15151 Ų5171%0.70626%0.259SS*.  trans51.724.2-171-60.5-175.3172.700113.8F178 Q184F178-E182 WeakPolarHBondContact O-CA 3.34Å; F178-E182 PolarHBondContact O-N 2.97Å; E182-Q184 PolarHBondContact O-N 3.22Å; E182-Q184 VanDerWaalsContact O-N 3.16Å
183D87.6Confident90.5Very high58 Ų5851.9 Ų51.931%0.3126%0.264SS..  trans-76.7105.7-177.7175.319.6000110.8N181 Q185 Q186N181-D183 HydrophobicContact CB-CB 4.29Å; N181-D183 PolarHBondContact O-N 3.11Å; D183-Q185 PolarHBondContact O-N 3.1Å; D183-Q185 VanDerWaalsContact O-N 3.11Å; D183-Q185 VanDerWaalsContact OD1-CB 3.29Å; D183-Q185 WeakPolarHBondContact OD1-CB 3.39Å; D183-Q185 WeakPolarHBondContact OD1-CG 3.21Å; D183-Q185 PolarHBondContact OD1-N 2.62Å; D183-Q186 HydrophobicContact CB-CG 4.08Å; D183-Q186 WeakPolarHBondContact O-CB 3.47Å; D183-Q186 PolarHBondContact O-N 3.4Å; D183-Q186 PolarHBondContact OD2-NE2 2.97Å
184Q89.6Confident90.6Very high127 Ų12751.9 Ų51.959%0.59326%0.264SS*.Hα-helixtrans-58.6-22.4178.3-66.7-172.2-30.500113.5E182 Q186 L187 L188E182-Q184 PolarHBondContact O-N 3.22Å; E182-Q184 VanDerWaalsContact O-N 3.16Å; Q184-Q186 PolarHBondContact O-N 2.87Å; Q184-L187 PolarHBondContact O-N 3.08Å; Q184-L188 PolarHBondContact O-N 2.79Å
185Q93Very high90.6Very high124 Ų12454.2 Ų54.258%0.57928%0.276SS*.Hα-helixtrans-62.6-31.7174.4-62.6-62.3-35.400111.8D183 L188 K189D183-Q185 PolarHBondContact O-N 3.1Å; D183-Q185 VanDerWaalsContact O-N 3.11Å; D183-Q185 VanDerWaalsContact OD1-CB 3.29Å; D183-Q185 WeakPolarHBondContact OD1-CB 3.39Å; D183-Q185 WeakPolarHBondContact OD1-CG 3.21Å; D183-Q185 PolarHBondContact OD1-N 2.62Å; Q185-L188 PolarHBondContact O-N 3Å; Q185-K189 WeakPolarHBondContact O-CB 3.23Å; Q185-K189 PolarHBondContact O-N 3.33Å
186Q91Very high90.6Very high30 Ų3057.8 Ų57.814%0.1429%0.294CS..Hα-helixtrans-67.6-39175.5-53.5-51.9-39.900111.5L174 L177 F178 D183 Q184 K189 L190L174-Q186 VanDerWaalsContact CD2-OE1 3.23Å; L177-Q186 HydrophobicContact CB-CG 4.1Å; F178-Q186 HydrophobicContact CB-CB 4.03Å; D183-Q186 HydrophobicContact CB-CG 4.08Å; D183-Q186 WeakPolarHBondContact O-CB 3.47Å; D183-Q186 PolarHBondContact O-N 3.4Å; D183-Q186 PolarHBondContact OD2-NE2 2.97Å; Q184-Q186 PolarHBondContact O-N 2.87Å; Q186-K189 PolarHBondContact O-N 3.43Å; Q186-L190 VanDerWaalsContact O-CB 3.26Å; Q186-L190 WeakPolarHBondContact O-CB 3.47Å; Q186-L190 PolarHBondContact O-N 2.81Å
187L90.6Very high90.6Very high3 Ų356.6 Ų56.62%0.01629%0.288CS..Hα-helixtrans-65.9-41.5174.2-71.4-178.8000112.1W175 F178 Q184 L190 A191 V214 L217 L218W175-L187 HydrophobicContact CE3-CD2 4.4Å; W175-L187 HydrophobicContact CZ3-CD2 4.21Å; F178-L187 HydrophobicContact CB-CD2 4.34Å; F178-L187 HydrophobicContact CB-CG 4.48Å; F178-L187 HydrophobicContact CD1-CD1 4.42Å; F178-L187 HydrophobicContact CD1-CD2 3.69Å; F178-L187 HydrophobicContact CD1-CG 4.09Å; F178-L187 HydrophobicContact CD2-CD1 3.85Å; F178-L187 HydrophobicContact CD2-CD2 4.07Å; F178-L187 HydrophobicContact CD2-CG 3.53Å; F178-L187 HydrophobicContact CE1-CD1 4.05Å; F178-L187 HydrophobicContact CE1-CD2 3.99Å; F178-L187 HydrophobicContact CE1-CG 4.23Å; F178-L187 HydrophobicContact CE2-CD1 3.42Å; F178-L187 VanDerWaalsContact CE2-CD1 3.42Å; F178-L187 HydrophobicContact CE2-CD2 4.34Å; F178-L187 HydrophobicContact CE2-CG 3.7Å; F178-L187 HydrophobicContact CG-CD1 4.32Å; F178-L187 HydrophobicContact CG-CD2 3.73Å; F178-L187 HydrophobicContact CG-CG 3.74Å; F178-L187 HydrophobicContact CZ-CD1 3.54Å; F178-L187 HydrophobicContact CZ-CD2 4.31Å; F178-L187 HydrophobicContact CZ-CG 4.05Å; Q184-L187 PolarHBondContact O-N 3.08Å; L187-L190 PolarHBondContact O-N 2.85Å; L187-A191 WeakPolarHBondContact O-CB 3.42Å; L187-A191 PolarHBondContact O-N 3.28Å; L187-V214 HydrophobicContact CB-CG1 4.3Å; L187-V214 HydrophobicContact CD2-CG1 4.39Å; L187-V214 WeakPolarHBondContact O-CG1 3.31Å; L187-L217 HydrophobicContact CD1-CB 3.89Å; L187-L217 HydrophobicContact CD1-CD1 4.25Å; L187-L217 HydrophobicContact CD2-CD1 4.06Å; L187-L218 HydrophobicContact CB-CD2 3.83Å; L187-L218 HydrophobicContact CB-CG 4.25Å; L187-L218 HydrophobicContact CD1-CD2 4.24Å
188L94.4Very high90.6Very high85 Ų8557 Ų5745%0.44529%0.29SS..Hα-helixtrans-63.2-43.4176.2-69.9172.2000111.5Q184 Q185 A191 A192 L218Q184-L188 PolarHBondContact O-N 2.79Å; Q185-L188 PolarHBondContact O-N 3Å; L188-A191 PolarHBondContact O-N 3.25Å; L188-A192 PolarHBondContact O-N 2.95Å; L188-L218 HydrophobicContact CD2-CD1 4.03Å; L188-L218 HydrophobicContact CD2-CD2 3.93Å; L188-L218 HydrophobicContact CG-CD2 4.2Å
189K94.9Very high90.5Very high89 Ų8961.7 Ų61.739%0.38731%0.313SS..Hα-helixtrans-62.5-43.3175.1-175.9172.8177.6-179.40111.7L174 Q185 Q186 A192 L193L174-K189 HydrophobicContact CD1-CD 4.35Å; L174-K189 HydrophobicContact CD1-CG 4.15Å; L174-K189 HydrophobicContact CD2-CD 3.88Å; L174-K189 HydrophobicContact CD2-CG 4.39Å; Q185-K189 WeakPolarHBondContact O-CB 3.23Å; Q185-K189 PolarHBondContact O-N 3.33Å; Q186-K189 PolarHBondContact O-N 3.43Å; K189-A192 PolarHBondContact O-N 3.36Å; K189-L193 HydrophobicContact CG-CD1 4.21Å; K189-L193 WeakPolarHBondContact O-CG 3.42Å; K189-L193 PolarHBondContact O-N 3.01Å
190L94.3Very high90.3Very high6 Ų665.1 Ų65.13%0.03132%0.319CS..Hα-helixtrans-61.1-45.3175.6178.861.7000111.6C171 W175 Q186 L187 L193 L194 V214C171-L190 HydrophobicContact CB-CD1 3.36Å; C171-L190 VanDerWaalsContact SG-CD1 3.5Å; W175-L190 HydrophobicContact CE3-CD2 3.91Å; Q186-L190 VanDerWaalsContact O-CB 3.26Å; Q186-L190 WeakPolarHBondContact O-CB 3.47Å; Q186-L190 PolarHBondContact O-N 2.81Å; L187-L190 PolarHBondContact O-N 2.85Å; L190-L193 PolarHBondContact O-N 2.84Å; L190-L194 HydrophobicContact CD1-CD1 3.94Å; L190-L194 HydrophobicContact CD1-CG 4.21Å; L190-L194 HydrophobicContact CG-CD1 3.99Å; L190-L194 WeakPolarHBondContact O-CB 3.29Å; L190-L194 VanDerWaalsContact O-CG 3.28Å; L190-L194 WeakPolarHBondContact O-CG 3.26Å; L190-L194 PolarHBondContact O-N 3.02Å; L190-L194 VanDerWaalsContact O-N 3.08Å; L190-V214 HydrophobicContact CD2-CG2 3.41Å; L190-V214 VanDerWaalsContact CD2-CG2 3.41Å; L190-V214 HydrophobicContact CG-CG2 3.8Å
191A94.6Very high90.2Very high8 Ų862.8 Ų62.87%0.06631%0.309CS..Hα-helixtrans-59.4-47.4176.100000111.7L187 L188 L193 L194 D195 L211 V214 Y215 L218L187-A191 WeakPolarHBondContact O-CB 3.42Å; L187-A191 PolarHBondContact O-N 3.28Å; L188-A191 PolarHBondContact O-N 3.25Å; A191-L193 PolarHBondContact O-N 3.17Å; A191-L194 PolarHBondContact O-N 3.34Å; A191-D195 VanDerWaalsContact O-CB 3.29Å; A191-D195 WeakPolarHBondContact O-CB 3.47Å; A191-D195 PolarHBondContact O-N 3.4Å; A191-L211 HydrophobicContact CB-CD1 4.1Å; A191-V214 HydrophobicContact CB-CG1 3.77Å; A191-Y215 HydrophobicContact CB-CE1 4.17Å; A191-L218 HydrophobicContact CB-CD1 4.18Å
192A95.5Very high90.1Very high58 Ų5865.6 Ų65.648%0.47932%0.317SS..Hα-helixtrans-61-44.3-179.600000112.4L188 K189 D195 E196L188-A192 PolarHBondContact O-N 2.95Å; K189-A192 PolarHBondContact O-N 3.36Å; A192-D195 PolarHBondContact O-N 3.09Å; A192-E196 VanDerWaalsContact O-CB 3.31Å; A192-E196 WeakPolarHBondContact O-CB 3.46Å; A192-E196 PolarHBondContact O-N 3.34Å
193L94.8Very high89.9Confident23 Ų2362.2 Ų62.212%0.1231%0.31CS..Hα-helixtrans-64.8-42.2178.7-75.3171.9000112.8L141 L167 L174 K189 L190 A191 D197L141-L193 HydrophobicContact CD1-CD1 4.43Å; L141-L193 HydrophobicContact CD2-CD1 4.07Å; L141-L193 HydrophobicContact CD2-CD2 3.92Å; L167-L193 HydrophobicContact CD1-CB 4.21Å; L167-L193 HydrophobicContact CD1-CD1 4.46Å; L167-L193 HydrophobicContact CD1-CD2 4.28Å; L174-L193 HydrophobicContact CD1-CD1 3.53Å; K189-L193 HydrophobicContact CG-CD1 4.21Å; K189-L193 WeakPolarHBondContact O-CG 3.42Å; K189-L193 PolarHBondContact O-N 3.01Å; L190-L193 PolarHBondContact O-N 2.84Å; A191-L193 PolarHBondContact O-N 3.17Å; L193-D197 PolarHBondContact O-N 3.31Å
194L93.7Very high89.7Confident0 Ų060.4 Ų60.40%030%0.301CS..Hα-helixtrans-68.7-41.7177.9-70170.8000111.6L190 A191 L198 F207 L210 L211 V214L190-L194 HydrophobicContact CD1-CD1 3.94Å; L190-L194 HydrophobicContact CD1-CG 4.21Å; L190-L194 HydrophobicContact CG-CD1 3.99Å; L190-L194 WeakPolarHBondContact O-CB 3.29Å; L190-L194 VanDerWaalsContact O-CG 3.28Å; L190-L194 WeakPolarHBondContact O-CG 3.26Å; L190-L194 PolarHBondContact O-N 3.02Å; L190-L194 VanDerWaalsContact O-N 3.08Å; A191-L194 PolarHBondContact O-N 3.34Å; L194-L198 WeakPolarHBondContact O-CB 3.48Å; L194-L198 WeakPolarHBondContact O-CD1 3.21Å; L194-L198 VanDerWaalsContact O-CG 3.25Å; L194-L198 WeakPolarHBondContact O-CG 3.35Å; L194-L198 PolarHBondContact O-N 3.43Å; L194-F207 HydrophobicContact CD2-CB 3.99Å; L194-F207 HydrophobicContact CD2-CD1 4.32Å; L194-F207 HydrophobicContact CD2-CD2 3.74Å; L194-F207 HydrophobicContact CD2-CE2 4.28Å; L194-F207 HydrophobicContact CD2-CG 3.75Å; L194-L210 HydrophobicContact CD1-CB 3.77Å; L194-L210 HydrophobicContact CD2-CB 4.3Å; L194-L210 HydrophobicContact CD2-CD1 4.41Å; L194-L211 HydrophobicContact CB-CB 4.24Å; L194-L211 HydrophobicContact CB-CD1 4.11Å; L194-L211 HydrophobicContact CD1-CB 4.25Å; L194-L211 HydrophobicContact CD1-CD1 4.49Å; L194-V214 HydrophobicContact CD1-CG2 4.43Å
195D92.5Very high89.4Confident49 Ų4957.4 Ų57.426%0.26229%0.291SS..Hα-helixtrans-63.1-45.5177.1-168.384.4000111.2A191 A192 D197 L198 Q199 L211A191-D195 VanDerWaalsContact O-CB 3.29Å; A191-D195 WeakPolarHBondContact O-CB 3.47Å; A191-D195 PolarHBondContact O-N 3.4Å; A192-D195 PolarHBondContact O-N 3.09Å; D195-D197 PolarHBondContact O-N 3.08Å; D195-L198 PolarHBondContact O-N 3.17Å; D195-Q199 WeakPolarHBondContact O-CG 3.32Å; D195-Q199 PolarHBondContact O-N 3.48Å; D195-Q199 VanDerWaalsContact O-N 3.08Å; D195-Q199 PolarHBondContact OD2-NE2 2.84Å; D195-L211 HydrophobicContact CB-CD2 4.33Å
196E90.9Very high88.9Confident96 Ų9653 Ų5345%0.44927%0.272SS..Hα-helixtrans-57.5-49.5177-176177.8179.500111.7A192 L198 Q199 Y200A192-E196 VanDerWaalsContact O-CB 3.31Å; A192-E196 WeakPolarHBondContact O-CB 3.46Å; A192-E196 PolarHBondContact O-N 3.34Å; E196-L198 PolarHBondContact O-N 3.35Å; E196-Q199 WeakPolarHBondContact O-CB 3.21Å; E196-Q199 PolarHBondContact O-N 2.87Å; E196-Q199 VanDerWaalsContact O-N 3.15Å; E196-Y200 HydrophobicContact CG-CE2 4.15Å; E196-Y200 WeakPolarHBondContact O-CD2 3.45Å
197D88.6Confident88.8Confident2 Ų251.7 Ų51.71%0.01127%0.266CS..Hα-helixtrans-66.4-36.4179.3-166.176.4000112.4F144 L167 L193 D195 Q199 Y200 D201 F207F144-D197 WeakPolarHBondContact CE2-OD1 3.35Å; L167-D197 HydrophobicContact CD2-CB 3.53Å; L193-D197 PolarHBondContact O-N 3.31Å; D195-D197 PolarHBondContact O-N 3.08Å; D197-Q199 PolarHBondContact O-N 3.33Å; D197-Y200 WeakPolarHBondContact O-CA 3.19Å; D197-Y200 WeakPolarHBondContact O-CB 3.33Å; D197-Y200 PolarHBondContact O-N 2.99Å; D197-D201 PolarHBondContact O-N 3.23Å; D197-F207 HydrophobicContact CB-CD2 3.84Å; D197-F207 HydrophobicContact CB-CE2 3.78Å; D197-F207 WeakPolarHBondContact OD2-CD2 3.47Å; D197-F207 WeakPolarHBondContact OD2-CE2 3.5Å
198L88.6Confident88.7Confident10 Ų1052.7 Ų52.75%0.05227%0.27CS..Hα-helixtrans-66.6-20.4174.9-75.9168000113.2L194 D195 E196 Y200 K202 N204 F207 R208 L211L194-L198 WeakPolarHBondContact O-CB 3.48Å; L194-L198 WeakPolarHBondContact O-CD1 3.21Å; L194-L198 VanDerWaalsContact O-CG 3.25Å; L194-L198 WeakPolarHBondContact O-CG 3.35Å; L194-L198 PolarHBondContact O-N 3.43Å; D195-L198 PolarHBondContact O-N 3.17Å; E196-L198 PolarHBondContact O-N 3.35Å; L198-Y200 VanDerWaalsContact C-N 3.28Å; L198-K202 WeakPolarHBondContact O-CA 3.24Å; L198-K202 WeakPolarHBondContact O-CG 3.47Å; L198-K202 PolarHBondContact O-N 3.36Å; L198-N204 HydrophobicContact CD2-CB 4.23Å; L198-N204 WeakPolarHBondContact CD2-O 3.44Å; L198-F207 HydrophobicContact CD1-CB 4.34Å; L198-F207 HydrophobicContact CD2-CB 4.01Å; L198-F207 HydrophobicContact CG-CB 4.05Å; L198-R208 HydrophobicContact CD1-CB 4.33Å; L198-R208 HydrophobicContact CD2-CB 4.2Å; L198-L211 HydrophobicContact CD1-CB 4.32Å; L198-L211 HydrophobicContact CD1-CD2 3.6Å
199Q86.3Confident88.2Confident128 Ų12849.2 Ų49.260%0.59825%0.251SS*.Hα-helixtrans-69.1-30.5170.4-67.3174.928.500111.6D195 E196 D197D195-Q199 WeakPolarHBondContact O-CG 3.32Å; D195-Q199 PolarHBondContact O-N 3.48Å; D195-Q199 VanDerWaalsContact O-N 3.08Å; D195-Q199 PolarHBondContact OD2-NE2 2.84Å; E196-Q199 WeakPolarHBondContact O-CB 3.21Å; E196-Q199 PolarHBondContact O-N 2.87Å; E196-Q199 VanDerWaalsContact O-N 3.15Å; D197-Q199 PolarHBondContact O-N 3.33Å
200Y82Confident87.9Confident146 Ų14645.7 Ų45.757%0.57324%0.237SC*.Hα-helixtrans-85.3-52.9175.6-64-78000112.3E196 D197 L198E196-Y200 HydrophobicContact CG-CE2 4.15Å; E196-Y200 WeakPolarHBondContact O-CD2 3.45Å; D197-Y200 WeakPolarHBondContact O-CA 3.19Å; D197-Y200 WeakPolarHBondContact O-CB 3.33Å; D197-Y200 PolarHBondContact O-N 2.99Å; L198-Y200 VanDerWaalsContact C-N 3.28Å
201D81.1Confident87.7Confident35 Ų3545.4 Ų45.419%0.18724%0.235CC..  trans-114.683.4177.1-176.15.4000111.5D197 S203 N204D197-D201 PolarHBondContact O-N 3.23Å; D201-S203 PolarHBondContact O-N 2.93Å; D201-S203 VanDerWaalsContact O-N 3.08Å; D201-S203 WeakPolarHBondContact OD1-CA 3.5Å; D201-S203 WeakPolarHBondContact OD1-CB 3.32Å; D201-S203 PolarHBondContact OD1-N 3.31Å; D201-S203 PolarHBondContact OD1-OG 2.75Å; D201-N204 HydrophobicContact CB-CB 4.4Å; D201-N204 WeakPolarHBondContact O-CB 3.48Å; D201-N204 PolarHBondContact O-N 3.03Å; D201-N204 PolarHBondContact OD1-N 3.39Å
202K83.2Confident87.2Confident149 Ų14945.1 Ų45.165%0.64823%0.233SC*.THydrogen-bonded Turntrans-62-17.1176.8-66.8176.6-177.2177.50113.3L198 R208L198-K202 WeakPolarHBondContact O-CA 3.24Å; L198-K202 WeakPolarHBondContact O-CG 3.47Å; L198-K202 PolarHBondContact O-N 3.36Å; K202-R208 PolarHBondContact O-NH2 3.29Å
203S80.7Confident86.7Confident81 Ų8142.5 Ų42.557%0.56621%0.21SC*.THydrogen-bonded Turntrans-87.6-7.7-177.176.30000113.5D201 T205D201-S203 PolarHBondContact O-N 2.93Å; D201-S203 VanDerWaalsContact O-N 3.08Å; D201-S203 WeakPolarHBondContact OD1-CA 3.5Å; D201-S203 WeakPolarHBondContact OD1-CB 3.32Å; D201-S203 PolarHBondContact OD1-N 3.31Å; D201-S203 PolarHBondContact OD1-OG 2.75Å; S203-T205 PolarHBondContact O-N 3.25Å
204N83Confident86.3Confident20 Ų2041.5 Ų41.511%0.10721%0.205CC..  trans-69.988.3-179.8-170.5-20.9000112L198 D201 V206 F207 R208L198-N204 HydrophobicContact CD2-CB 4.23Å; L198-N204 WeakPolarHBondContact CD2-O 3.44Å; D201-N204 HydrophobicContact CB-CB 4.4Å; D201-N204 WeakPolarHBondContact O-CB 3.48Å; D201-N204 PolarHBondContact O-N 3.03Å; D201-N204 PolarHBondContact OD1-N 3.39Å; N204-V206 VanDerWaalsContact C-N 3.26Å; N204-V206 PolarHBondContact O-N 3.36Å; N204-V206 WeakPolarHBondContact OD1-CB 3.29Å; N204-V206 PolarHBondContact OD1-N 2.77Å; N204-F207 HydrophobicContact CB-CB 4.3Å; N204-F207 VanDerWaalsContact ND2-CD1 3.26Å; N204-F207 WeakPolarHBondContact ND2-CD1 3.32Å; N204-F207 VanDerWaalsContact ND2-CG 3.29Å; N204-F207 WeakPolarHBondContact ND2-CG 3.4Å; N204-F207 PolarHBondContact O-N 3.24Å; N204-F207 WeakPolarHBondContact OD1-CD1 3.16Å; N204-F207 PolarHBondContact OD1-N 2.97Å; N204-F207 VanDerWaalsContact OD1-N 3.1Å; N204-R208 PolarHBondContact O-N 3.47Å; N204-R208 VanDerWaalsContact O-N 3.13Å
205T83.1Confident86Confident63 Ų6342.8 Ų42.839%0.38721%0.21SC..Hα-helixtrans-62.9-31.7-178.854.70000112.8S203 R208 I209 L231S203-T205 PolarHBondContact O-N 3.25Å; T205-R208 PolarHBondContact O-N 2.93Å; T205-I209 WeakPolarHBondContact O-CB 3.33Å; T205-I209 WeakPolarHBondContact O-CD1 3.16Å; T205-I209 WeakPolarHBondContact O-CG1 3.46Å; T205-I209 PolarHBondContact O-N 3.21Å; T205-L231 HydrophobicContact CG2-CD2 4.49Å
206V82.7Confident85.5Confident32 Ų3240.9 Ų40.919%0.19420%0.201CC..Hα-helixtrans-61.9-50.1177.7175.70000110.3L168 N204 R208 I209 L210 V255L168-V206 HydrophobicContact CD1-CG1 4.2Å; L168-V206 HydrophobicContact CD2-CG1 4.44Å; N204-V206 VanDerWaalsContact C-N 3.26Å; N204-V206 PolarHBondContact O-N 3.36Å; N204-V206 WeakPolarHBondContact OD1-CB 3.29Å; N204-V206 PolarHBondContact OD1-N 2.77Å; V206-R208 VanDerWaalsContact C-N 3.31Å; V206-R208 PolarHBondContact O-N 2.8Å; V206-I209 PolarHBondContact O-N 2.69Å; V206-L210 HydrophobicContact CG1-CD1 4.25Å; V206-L210 WeakPolarHBondContact O-CG 3.45Å; V206-L210 PolarHBondContact O-N 3.01Å; V206-V255 HydrophobicContact CG1-CB 3.87Å; V206-V255 HydrophobicContact CG1-CG1 3.59Å; V206-V255 HydrophobicContact CG1-CG2 4.14Å; V206-V255 HydrophobicContact CG2-CB 4.27Å; V206-V255 HydrophobicContact CG2-CG1 4.46Å; V206-V255 HydrophobicContact CG2-CG2 3.59Å
207F88.4Confident85.1Confident3 Ų337.8 Ų37.81%0.01319%0.188CC..Hα-helixtrans-67.6-38.7-177.8-80.332.4000110.5S164 L167 L168 L194 D197 L198 N204 I209 L210 L211S164-F207 WeakPolarHBondContact O-CZ 3.21Å; L167-F207 HydrophobicContact CB-CE2 4.35Å; L167-F207 HydrophobicContact CB-CZ 4.16Å; L167-F207 HydrophobicContact CD2-CE2 3.58Å; L167-F207 HydrophobicContact CD2-CZ 4.24Å; L167-F207 HydrophobicContact CG-CE2 3.87Å; L167-F207 HydrophobicContact CG-CZ 4.08Å; L168-F207 HydrophobicContact CB-CE1 3.87Å; L168-F207 HydrophobicContact CB-CZ 4.19Å; L168-F207 HydrophobicContact CD1-CE1 4.05Å; L168-F207 HydrophobicContact CG-CE1 4.42Å; L194-F207 HydrophobicContact CD2-CB 3.99Å; L194-F207 HydrophobicContact CD2-CD1 4.32Å; L194-F207 HydrophobicContact CD2-CD2 3.74Å; L194-F207 HydrophobicContact CD2-CE2 4.28Å; L194-F207 HydrophobicContact CD2-CG 3.75Å; D197-F207 HydrophobicContact CB-CD2 3.84Å; D197-F207 HydrophobicContact CB-CE2 3.78Å; D197-F207 WeakPolarHBondContact OD2-CD2 3.47Å; D197-F207 WeakPolarHBondContact OD2-CE2 3.5Å; L198-F207 HydrophobicContact CD1-CB 4.34Å; L198-F207 HydrophobicContact CD2-CB 4.01Å; L198-F207 HydrophobicContact CG-CB 4.05Å; N204-F207 HydrophobicContact CB-CB 4.3Å; N204-F207 VanDerWaalsContact ND2-CD1 3.26Å; N204-F207 WeakPolarHBondContact ND2-CD1 3.32Å; N204-F207 VanDerWaalsContact ND2-CG 3.29Å; N204-F207 WeakPolarHBondContact ND2-CG 3.4Å; N204-F207 PolarHBondContact O-N 3.24Å; N204-F207 WeakPolarHBondContact OD1-CD1 3.16Å; N204-F207 PolarHBondContact OD1-N 2.97Å; N204-F207 VanDerWaalsContact OD1-N 3.1Å; F207-I209 PolarHBondContact O-N 3.07Å; F207-L210 PolarHBondContact O-N 3.21Å; F207-L211 WeakPolarHBondContact O-CB 3.42Å; F207-L211 PolarHBondContact O-N 3.36Å
208R88.8Confident84.9Confident23 Ų2340.1 Ų40.19%0.08720%0.2CC..Hα-helixtrans-61.3-44174.6-164.5176.1-62.2-87.311.1112.2L198 K202 N204 T205 V206 L211 I212 E227 L231L198-R208 HydrophobicContact CD1-CB 4.33Å; L198-R208 HydrophobicContact CD2-CB 4.2Å; K202-R208 PolarHBondContact O-NH2 3.29Å; N204-R208 PolarHBondContact O-N 3.47Å; N204-R208 VanDerWaalsContact O-N 3.13Å; T205-R208 PolarHBondContact O-N 2.93Å; V206-R208 VanDerWaalsContact C-N 3.31Å; V206-R208 PolarHBondContact O-N 2.8Å; R208-L211 PolarHBondContact O-N 3.44Å; R208-I212 HydrophobicContact CG-CD1 4.47Å; R208-I212 VanDerWaalsContact O-CG1 3.3Å; R208-I212 WeakPolarHBondContact O-CG1 3.36Å; R208-I212 PolarHBondContact O-N 3.06Å; R208-E227 WeakPolarHBondContact CD-O 3.47Å; R208-E227 HydrophobicContact CG-CB 4.32Å; R208-E227 WeakPolarHBondContact CG-OE2 3.11Å; R208-E227 IonicContact CZ-OE2 2.91Å; R208-E227 IonicContact NH1-OE2 2.71Å; R208-E227 PolarHBondContact NH1-OE2 3.2Å; R208-L231 HydrophobicContact CB-CD2 3.96Å; R208-L231 HydrophobicContact CG-CD2 3.89Å; R208-L231 HydrophobicContact CG-CG 3.92Å
209I85.1Confident84.6Confident12 Ų1241.3 Ų41.36%0.06221%0.214CC..Hα-helixtrans-62-43.2174.8-72.8162.8000111.2T205 V206 F207 L211 K213 L231 F253T205-I209 WeakPolarHBondContact O-CB 3.33Å; T205-I209 WeakPolarHBondContact O-CD1 3.16Å; T205-I209 WeakPolarHBondContact O-CG1 3.46Å; T205-I209 PolarHBondContact O-N 3.21Å; V206-I209 PolarHBondContact O-N 2.69Å; F207-I209 PolarHBondContact O-N 3.07Å; I209-L211 VanDerWaalsContact C-N 3.35Å; I209-K213 WeakPolarHBondContact O-CG 3.21Å; I209-K213 PolarHBondContact O-N 2.9Å; I209-L231 HydrophobicContact CG1-CD1 4.34Å; I209-L231 HydrophobicContact CG1-CD2 4.08Å; I209-F253 HydrophobicContact CB-CE1 4.5Å; I209-F253 HydrophobicContact CD1-CD1 4.14Å; I209-F253 HydrophobicContact CD1-CE1 3.66Å; I209-F253 HydrophobicContact CD1-CZ 4.02Å; I209-F253 HydrophobicContact CG1-CE1 4.04Å; I209-F253 HydrophobicContact CG1-CZ 4.49Å; I209-F253 HydrophobicContact CG2-CD1 4.05Å; I209-F253 HydrophobicContact CG2-CE1 3.63Å
210L87.1Confident84.4Confident16 Ų1636.9 Ų36.98%0.08420%0.198CC..Hα-helixtrans-64.1-40.8176-71.8173.4000111.7L168 L194 V206 F207 K213 V214 L259L168-L210 HydrophobicContact CD1-CD1 3.45Å; L168-L210 VanDerWaalsContact CD1-CD1 3.45Å; L194-L210 HydrophobicContact CD1-CB 3.77Å; L194-L210 HydrophobicContact CD2-CB 4.3Å; L194-L210 HydrophobicContact CD2-CD1 4.41Å; V206-L210 HydrophobicContact CG1-CD1 4.25Å; V206-L210 WeakPolarHBondContact O-CG 3.45Å; V206-L210 PolarHBondContact O-N 3.01Å; F207-L210 PolarHBondContact O-N 3.21Å; L210-K213 HydrophobicContact CD2-CD 4.5Å; L210-K213 VanDerWaalsContact O-CB 3.32Å; L210-K213 WeakPolarHBondContact O-CB 3.27Å; L210-K213 PolarHBondContact O-N 3.23Å; L210-V214 WeakPolarHBondContact O-CG2 3.17Å; L210-V214 PolarHBondContact O-N 2.89Å; L210-L259 HydrophobicContact CD2-CD1 3.54Å; L210-L259 HydrophobicContact CD2-CG 4.38Å
211L90.5Very high84.1Confident0 Ų032.2 Ų32.20%019%0.185CC..Hα-helixtrans-66.1-41.4179.5-174.456.8000111.7A191 L194 D195 L198 F207 R208 I209 K213 V214 Y215 E227A191-L211 HydrophobicContact CB-CD1 4.1Å; L194-L211 HydrophobicContact CB-CB 4.24Å; L194-L211 HydrophobicContact CB-CD1 4.11Å; L194-L211 HydrophobicContact CD1-CB 4.25Å; L194-L211 HydrophobicContact CD1-CD1 4.49Å; D195-L211 HydrophobicContact CB-CD2 4.33Å; L198-L211 HydrophobicContact CD1-CB 4.32Å; L198-L211 HydrophobicContact CD1-CD2 3.6Å; F207-L211 WeakPolarHBondContact O-CB 3.42Å; F207-L211 PolarHBondContact O-N 3.36Å; R208-L211 PolarHBondContact O-N 3.44Å; I209-L211 VanDerWaalsContact C-N 3.35Å; L211-K213 VanDerWaalsContact C-N 3.27Å; L211-K213 PolarHBondContact O-N 3.48Å; L211-V214 PolarHBondContact O-N 3.29Å; L211-V214 VanDerWaalsContact O-N 3.17Å; L211-Y215 HydrophobicContact CD1-CD1 4.41Å; L211-Y215 HydrophobicContact CD1-CD2 4.09Å; L211-Y215 HydrophobicContact CD1-CE1 3.93Å; L211-Y215 HydrophobicContact CD1-CE2 3.58Å; L211-Y215 HydrophobicContact CD1-CG 4.48Å; L211-Y215 VanDerWaalsContact CD1-CZ 3.48Å; L211-Y215 HydrophobicContact CD2-CE2 3.69Å; L211-Y215 HydrophobicContact CG-CD2 3.81Å; L211-Y215 HydrophobicContact CG-CE2 3.35Å; L211-Y215 PolarHBondContact O-N 3.15Å; L211-E227 HydrophobicContact CD2-CG 3.9Å; L211-E227 HydrophobicContact CG-CG 4.21Å
212I85.3Confident84Confident2 Ų235.1 Ų35.11%0.0121%0.207CC..Hα-helixtrans-55.3-44.1172-73.3163.8000111R208 Y215 A216 L224 E227 F228 L231R208-I212 HydrophobicContact CG-CD1 4.47Å; R208-I212 VanDerWaalsContact O-CG1 3.3Å; R208-I212 WeakPolarHBondContact O-CG1 3.36Å; R208-I212 PolarHBondContact O-N 3.06Å; I212-Y215 PolarHBondContact O-N 3.14Å; I212-A216 WeakPolarHBondContact O-CB 3.19Å; I212-A216 PolarHBondContact O-N 3.28Å; I212-L224 HydrophobicContact CG2-CG 4.28Å; I212-E227 HydrophobicContact CD1-CB 4.18Å; I212-E227 HydrophobicContact CG1-CB 3.58Å; I212-F228 HydrophobicContact CD1-CB 4.28Å; I212-L231 HydrophobicContact CD1-CD1 3.33Å; I212-L231 HydrophobicContact CD1-CG 4.03Å
213K83.4Confident84.2Confident2 Ų230.4 Ų30.41%0.00919%0.192CC..Hα-helixtrans-62.9-43.8177.3-76.3170.1164-163.10112.4I209 L210 L211 A216 L217 V256 W271 N272 V275I209-K213 WeakPolarHBondContact O-CG 3.21Å; I209-K213 PolarHBondContact O-N 2.9Å; L210-K213 HydrophobicContact CD2-CD 4.5Å; L210-K213 VanDerWaalsContact O-CB 3.32Å; L210-K213 WeakPolarHBondContact O-CB 3.27Å; L210-K213 PolarHBondContact O-N 3.23Å; L211-K213 VanDerWaalsContact C-N 3.27Å; L211-K213 PolarHBondContact O-N 3.48Å; K213-A216 WeakPolarHBondContact O-CB 3.47Å; K213-A216 PolarHBondContact O-N 3.38Å; K213-L217 PolarHBondContact O-N 2.63Å; K213-L217 VanDerWaalsContact O-N 3.14Å; K213-V256 VanDerWaalsContact NZ-CG2 3.32Å; K213-W271 HydrophobicContact CB-CH2 3.93Å; K213-W271 HydrophobicContact CB-CZ3 4.26Å; K213-W271 HydrophobicContact CD-CH2 4.3Å; K213-W271 HydrophobicContact CD-CZ3 3.8Å; K213-W271 HydrophobicContact CG-CH2 4.04Å; K213-W271 HydrophobicContact CG-CZ3 3.91Å; K213-N272 WeakPolarHBondContact CE-OD1 3.11Å; K213-N272 PolarHBondContact NZ-OD1 2.9Å; K213-V275 HydrophobicContact CG-CG1 4.27Å
214V88.3Confident84.2Confident2 Ų226.6 Ų26.61%0.01217%0.166CC..Hα-helixtrans-66.6-43.2178.5176.60000110.9W175 L187 L190 A191 L194 L210 L211 A216 L217 L218W175-V214 HydrophobicContact CZ3-CG2 4.5Å; L187-V214 HydrophobicContact CB-CG1 4.3Å; L187-V214 HydrophobicContact CD2-CG1 4.39Å; L187-V214 WeakPolarHBondContact O-CG1 3.31Å; L190-V214 HydrophobicContact CD2-CG2 3.41Å; L190-V214 VanDerWaalsContact CD2-CG2 3.41Å; L190-V214 HydrophobicContact CG-CG2 3.8Å; A191-V214 HydrophobicContact CB-CG1 3.77Å; L194-V214 HydrophobicContact CD1-CG2 4.43Å; L210-V214 WeakPolarHBondContact O-CG2 3.17Å; L210-V214 PolarHBondContact O-N 2.89Å; L211-V214 PolarHBondContact O-N 3.29Å; L211-V214 VanDerWaalsContact O-N 3.17Å; V214-A216 VanDerWaalsContact C-N 3.31Å; V214-A216 PolarHBondContact O-N 3.3Å; V214-L217 PolarHBondContact O-N 3.34Å; V214-L218 HydrophobicContact CG1-CD1 3.8Å; V214-L218 HydrophobicContact CG1-CG 4.27Å; V214-L218 WeakPolarHBondContact O-CB 3.31Å; V214-L218 WeakPolarHBondContact O-CG 3.43Å; V214-L218 PolarHBondContact O-N 2.71Å
215Y87Confident83.9Confident28 Ų2826.6 Ų26.611%0.1117%0.167CC..Hα-helixtrans-64.5-33.3175.4-70.8-33.4000113.3A191 L211 I212 L218 G219 S220 C223 E227A191-Y215 HydrophobicContact CB-CE1 4.17Å; L211-Y215 HydrophobicContact CD1-CD1 4.41Å; L211-Y215 HydrophobicContact CD1-CD2 4.09Å; L211-Y215 HydrophobicContact CD1-CE1 3.93Å; L211-Y215 HydrophobicContact CD1-CE2 3.58Å; L211-Y215 HydrophobicContact CD1-CG 4.48Å; L211-Y215 VanDerWaalsContact CD1-CZ 3.48Å; L211-Y215 HydrophobicContact CD2-CE2 3.69Å; L211-Y215 HydrophobicContact CG-CD2 3.81Å; L211-Y215 HydrophobicContact CG-CE2 3.35Å; L211-Y215 PolarHBondContact O-N 3.15Å; I212-Y215 PolarHBondContact O-N 3.14Å; Y215-L218 HydrophobicContact CD1-CD1 4.37Å; Y215-G219 PolarHBondContact O-N 2.91Å; Y215-G219 VanDerWaalsContact O-N 3.13Å; Y215-S220 PolarHBondContact O-N 3.44Å; Y215-C223 HydrophobicContact CD1-CB 3.87Å; Y215-C223 HydrophobicContact CD2-CB 3.52Å; Y215-C223 HydrophobicContact CE1-CB 3.92Å; Y215-C223 HydrophobicContact CE2-CB 3.55Å; Y215-C223 HydrophobicContact CG-CB 3.69Å; Y215-E227 HydrophobicContact CD2-CG 4.05Å; Y215-E227 HydrophobicContact CE2-CG 3.74Å
216A80.5Confident84Confident8 Ų826.1 Ų26.17%0.06617%0.169CC..Hα-helixtrans-61.7-45.6171.800000111.4I212 K213 V214 G219 L224 V275 L278I212-A216 WeakPolarHBondContact O-CB 3.19Å; I212-A216 PolarHBondContact O-N 3.28Å; K213-A216 WeakPolarHBondContact O-CB 3.47Å; K213-A216 PolarHBondContact O-N 3.38Å; V214-A216 VanDerWaalsContact C-N 3.31Å; V214-A216 PolarHBondContact O-N 3.3Å; A216-G219 PolarHBondContact O-N 2.77Å; A216-L224 HydrophobicContact CB-CD1 3.72Å; A216-V275 HydrophobicContact CB-CG1 3.8Å; A216-L278 HydrophobicContact CB-CD2 4.3Å
217L82.5Confident84.1Confident32 Ų3225.9 Ų25.917%0.16817%0.166CC..Hα-helixtrans-67.9-38.2177.9-74.9179.3000113.3W175 F178 L187 K213 V214 G219 W271 F305W175-L217 HydrophobicContact CH2-CD1 3.4Å; W175-L217 VanDerWaalsContact CH2-CD1 3.4Å; W175-L217 HydrophobicContact CZ2-CD1 4.49Å; W175-L217 HydrophobicContact CZ3-CD1 3.62Å; F178-L217 HydrophobicContact CE1-CD1 3.87Å; F178-L217 HydrophobicContact CZ-CD1 4.39Å; L187-L217 HydrophobicContact CD1-CB 3.89Å; L187-L217 HydrophobicContact CD1-CD1 4.25Å; L187-L217 HydrophobicContact CD2-CD1 4.06Å; K213-L217 PolarHBondContact O-N 2.63Å; K213-L217 VanDerWaalsContact O-N 3.14Å; V214-L217 PolarHBondContact O-N 3.34Å; L217-G219 PolarHBondContact O-N 3.41Å; L217-W271 HydrophobicContact CD1-CH2 4.3Å; L217-W271 HydrophobicContact CD1-CZ2 3.89Å; L217-W271 HydrophobicContact CD2-CZ2 3.88Å; L217-W271 HydrophobicContact CG-CH2 4.49Å; L217-W271 HydrophobicContact CG-CZ2 3.88Å; L217-F305 HydrophobicContact CD2-CE1 4Å
218L86Confident83.8Confident50 Ų5027.1 Ų27.126%0.26217%0.171SC..THydrogen-bonded Turntrans-71.4-9.3175-69.6172.5000112.9L187 L188 A191 V214 Y215L187-L218 HydrophobicContact CB-CD2 3.83Å; L187-L218 HydrophobicContact CB-CG 4.25Å; L187-L218 HydrophobicContact CD1-CD2 4.24Å; L188-L218 HydrophobicContact CD2-CD1 4.03Å; L188-L218 HydrophobicContact CD2-CD2 3.93Å; L188-L218 HydrophobicContact CG-CD2 4.2Å; A191-L218 HydrophobicContact CB-CD1 4.18Å; V214-L218 HydrophobicContact CG1-CD1 3.8Å; V214-L218 HydrophobicContact CG1-CG 4.27Å; V214-L218 WeakPolarHBondContact O-CB 3.31Å; V214-L218 WeakPolarHBondContact O-CG 3.43Å; V214-L218 PolarHBondContact O-N 2.71Å; Y215-L218 HydrophobicContact CD1-CD1 4.37Å
219G81.1Confident83.3Confident35 Ų3530.7 Ų30.736%0.36119%0.192SC..THydrogen-bonded Turntrans67.435.4-176.900000113.1Y215 A216 L217 P221Y215-G219 PolarHBondContact O-N 2.91Å; Y215-G219 VanDerWaalsContact O-N 3.13Å; A216-G219 PolarHBondContact O-N 2.77Å; L217-G219 PolarHBondContact O-N 3.41Å; G219-P221 VanDerWaalsContact C-CD 3.49Å; G219-P221 WeakPolarHBondContact O-CD 3.45Å
220S83.1Confident83.3Confident36 Ų3632.3 Ų32.325%0.25221%0.207SC..  trans-103.982.7179.5-170.10000111.7Y215 C222 C223 L224Y215-S220 PolarHBondContact O-N 3.44Å; S220-C222 VanDerWaalsContact C-N 3.31Å; S220-C222 PolarHBondContact O-N 3.19Å; S220-C223 PolarHBondContact O-N 2.67Å; S220-C223 WeakPolarHBondContact OG-CB 3.44Å; S220-C223 PolarHBondContact OG-SG 3.5Å; S220-L224 WeakPolarHBondContact O-CB 3.14Å; S220-L224 PolarHBondContact O-N 2.83Å
221P75Confident82.7Confident48 Ų4833.2 Ų33.231%0.31221%0.212SC..Hα-helixtrans-64.5-34-174.127-37.3000113.1G219 T225 T282G219-P221 VanDerWaalsContact C-CD 3.49Å; G219-P221 WeakPolarHBondContact O-CD 3.45Å; P221-T225 WeakPolarHBondContact O-CB 3.1Å; P221-T225 PolarHBondContact O-N 3.39Å; P221-T225 PolarHBondContact O-OG1 3.38Å; P221-T282 HydrophobicContact CB-CG2 3.31Å
222C79.3Confident81.4Confident96 Ų9638.1 Ų38.165%0.64924%0.238SC*.Hα-helixtrans-66.8-47.7179.9-620000111.5S220 T225 A226S220-C222 VanDerWaalsContact C-N 3.31Å; S220-C222 PolarHBondContact O-N 3.19Å; C222-T225 PolarHBondContact O-N 2.73Å; C222-A226 PolarHBondContact O-N 2.85Å
223C86.1Confident80Confident49 Ų4939.5 Ų39.533%0.33125%0.25SC..Hα-helixtrans-65.7-43.9178.1-61.30000111.1Y215 S220 T225 A226 E227Y215-C223 HydrophobicContact CD1-CB 3.87Å; Y215-C223 HydrophobicContact CD2-CB 3.52Å; Y215-C223 HydrophobicContact CE1-CB 3.92Å; Y215-C223 HydrophobicContact CE2-CB 3.55Å; Y215-C223 HydrophobicContact CG-CB 3.69Å; S220-C223 PolarHBondContact O-N 2.67Å; S220-C223 WeakPolarHBondContact OG-CB 3.44Å; S220-C223 PolarHBondContact OG-SG 3.5Å; C223-T225 VanDerWaalsContact C-N 3.33Å; C223-T225 PolarHBondContact O-N 3.08Å; C223-A226 PolarHBondContact O-N 2.8Å; C223-E227 PolarHBondContact O-N 3.24Å; C223-E227 VanDerWaalsContact O-N 3.08Å
224L82.4Confident78.2Confident2 Ų245.8 Ų45.81%0.0128%0.277CS..Hα-helixtrans-55.5-48.1174.3177.9156.9000111.9I212 A216 S220 A226 E227 F228 A279 I283I212-L224 HydrophobicContact CG2-CG 4.28Å; A216-L224 HydrophobicContact CB-CD1 3.72Å; S220-L224 WeakPolarHBondContact O-CB 3.14Å; S220-L224 PolarHBondContact O-N 2.83Å; L224-A226 VanDerWaalsContact C-N 3.34Å; L224-A226 PolarHBondContact O-N 3.2Å; L224-E227 PolarHBondContact O-N 3.05Å; L224-F228 WeakPolarHBondContact O-CB 3.22Å; L224-F228 PolarHBondContact O-N 3.44Å; L224-A279 HydrophobicContact CD1-CB 4.12Å; L224-A279 HydrophobicContact CD2-CB 3.78Å; L224-A279 HydrophobicContact CG-CB 4.38Å; L224-I283 HydrophobicContact CD2-CD1 4.22Å; L224-I283 HydrophobicContact CD2-CG1 4.26Å
225T76.1Confident75.8Confident20 Ų2056 Ų5612%0.12332%0.317CS..Hα-helixtrans-64.6-39.8-178.2-59.40000111.4P221 C222 C223 F228 N229 I283P221-T225 WeakPolarHBondContact O-CB 3.1Å; P221-T225 PolarHBondContact O-N 3.39Å; P221-T225 PolarHBondContact O-OG1 3.38Å; C222-T225 PolarHBondContact O-N 2.73Å; C223-T225 VanDerWaalsContact C-N 3.33Å; C223-T225 PolarHBondContact O-N 3.08Å; T225-F228 PolarHBondContact O-N 3.41Å; T225-N229 WeakPolarHBondContact O-CB 3.08Å; T225-N229 PolarHBondContact O-N 3.47Å; T225-N229 PolarHBondContact O-ND2 3Å; T225-I283 HydrophobicContact CG2-CG1 4.07Å
226A85.7Confident73.8Confident52 Ų5258.4 Ų58.443%0.4333%0.331SS..Hα-helixtrans-60.3-48.3176.300000111.5C222 C223 L224 N229 A230C222-A226 PolarHBondContact O-N 2.85Å; C223-A226 PolarHBondContact O-N 2.8Å; L224-A226 VanDerWaalsContact C-N 3.34Å; L224-A226 PolarHBondContact O-N 3.2Å; A226-N229 PolarHBondContact O-N 3Å; A226-A230 WeakPolarHBondContact O-CB 3.35Å; A226-A230 PolarHBondContact O-N 3.17Å; A226-A230 VanDerWaalsContact O-N 3.14Å
227E85.1Confident72.1Confident28 Ų2861 Ų6113%0.13134%0.343CS..Hα-helixtrans-67.9-39.4179.4-67-49.5124.500112.9R208 L211 I212 Y215 C223 L224 N229 A230 L231R208-E227 WeakPolarHBondContact CD-O 3.47Å; R208-E227 HydrophobicContact CG-CB 4.32Å; R208-E227 WeakPolarHBondContact CG-OE2 3.11Å; R208-E227 IonicContact CZ-OE2 2.91Å; R208-E227 IonicContact NH1-OE2 2.71Å; R208-E227 PolarHBondContact NH1-OE2 3.2Å; L211-E227 HydrophobicContact CD2-CG 3.9Å; L211-E227 HydrophobicContact CG-CG 4.21Å; I212-E227 HydrophobicContact CD1-CB 4.18Å; I212-E227 HydrophobicContact CG1-CB 3.58Å; Y215-E227 HydrophobicContact CD2-CG 4.05Å; Y215-E227 HydrophobicContact CE2-CG 3.74Å; C223-E227 PolarHBondContact O-N 3.24Å; C223-E227 VanDerWaalsContact O-N 3.08Å; L224-E227 PolarHBondContact O-N 3.05Å; E227-N229 PolarHBondContact O-N 3.46Å; E227-A230 PolarHBondContact O-N 3.2Å; E227-A230 VanDerWaalsContact O-N 3.17Å; E227-L231 PolarHBondContact O-N 3.36Å; E227-L231 VanDerWaalsContact O-N 3.16Å
228F80.9Confident70Confident28 Ų2866.2 Ų66.212%0.12337%0.37CS..Hα-helixtrans-62-44.2176.2-174.8-88.3000111.8I212 L224 T225 A230 L231 L237 I283I212-F228 HydrophobicContact CD1-CB 4.28Å; L224-F228 WeakPolarHBondContact O-CB 3.22Å; L224-F228 PolarHBondContact O-N 3.44Å; T225-F228 PolarHBondContact O-N 3.41Å; F228-A230 PolarHBondContact O-N 2.9Å; F228-L231 WeakPolarHBondContact O-CB 3.43Å; F228-L231 PolarHBondContact O-N 3.19Å; F228-L237 HydrophobicContact CE2-CD1 3.91Å; F228-L237 HydrophobicContact CZ-CD1 3.53Å; F228-I283 HydrophobicContact CB-CD1 3.83Å; F228-I283 HydrophobicContact CD1-CD1 3.33Å; F228-I283 HydrophobicContact CD2-CD1 4.11Å; F228-I283 HydrophobicContact CE1-CD1 3.82Å; F228-I283 HydrophobicContact CG-CD1 3.48Å; F228-I283 VanDerWaalsContact CG-CD1 3.48Å; F228-I283 HydrophobicContact CZ-CD1 4.37Å
229N79.3Confident67.6Low98 Ų9870.2 Ų70.252%0.52439%0.392SS..Hα-helixtrans-64.3-28.7176.5-72.9-25.2000112.5T225 A226 E227T225-N229 WeakPolarHBondContact O-CB 3.08Å; T225-N229 PolarHBondContact O-N 3.47Å; T225-N229 PolarHBondContact O-ND2 3Å; A226-N229 PolarHBondContact O-N 3Å; E227-N229 PolarHBondContact O-N 3.46Å
230A83.7Confident65.3Low47 Ų4776.2 Ų76.239%0.38842%0.415SS..Hα-helixtrans-83.6-10.8-18000000114.3A226 E227 F228 D232A226-A230 WeakPolarHBondContact O-CB 3.35Å; A226-A230 PolarHBondContact O-N 3.17Å; A226-A230 VanDerWaalsContact O-N 3.14Å; E227-A230 PolarHBondContact O-N 3.2Å; E227-A230 VanDerWaalsContact O-N 3.17Å; F228-A230 PolarHBondContact O-N 2.9Å; A230-D232 PolarHBondContact O-N 3.33Å; A230-D232 VanDerWaalsContact O-N 3.07Å
231L75.4Confident63.1Low35 Ų3580.5 Ų80.518%0.18344%0.435CS..THydrogen-bonded Turntrans-63.4-8.6172-85.6170.4000113.7T205 R208 I209 I212 E227 F228 A233T205-L231 HydrophobicContact CG2-CD2 4.49Å; R208-L231 HydrophobicContact CB-CD2 3.96Å; R208-L231 HydrophobicContact CG-CD2 3.89Å; R208-L231 HydrophobicContact CG-CG 3.92Å; I209-L231 HydrophobicContact CG1-CD1 4.34Å; I209-L231 HydrophobicContact CG1-CD2 4.08Å; I212-L231 HydrophobicContact CD1-CD1 3.33Å; I212-L231 HydrophobicContact CD1-CG 4.03Å; E227-L231 PolarHBondContact O-N 3.36Å; E227-L231 VanDerWaalsContact O-N 3.16Å; F228-L231 WeakPolarHBondContact O-CB 3.43Å; F228-L231 PolarHBondContact O-N 3.19Å; L231-A233 HydrophobicContact CB-CB 4.28Å; L231-A233 PolarHBondContact O-N 3.14Å
232D62.7Low61.4Low103 Ų10387.3 Ų87.355%0.55146%0.46SS*.THydrogen-bonded Turntrans45.232.2-169.5-146.627.9000112.5A230 K234A230-D232 PolarHBondContact O-N 3.33Å; A230-D232 VanDerWaalsContact O-N 3.07Å; D232-K234 PolarHBondContact O-N 3.37Å; D232-K234 WeakPolarHBondContact OD1-CD 3.43Å; D232-K234 VanDerWaalsContact OD1-CE 3.28Å; D232-K234 WeakPolarHBondContact OD1-CE 3.33Å; D232-K234 WeakPolarHBondContact OD1-CG 3.49Å; D232-K234 IonicContact OD1-NZ 2.65Å; D232-K234 PolarHBondContact OD1-NZ 3.39Å
233A56.3Low59.3Low30 Ų3092.3 Ų92.325%0.24847%0.474CS..  trans-7022.7170.700000112.1L231 Y235 I236 L237L231-A233 HydrophobicContact CB-CB 4.28Å; L231-A233 PolarHBondContact O-N 3.14Å; A233-Y235 PolarHBondContact O-N 3.06Å; A233-Y235 VanDerWaalsContact O-N 3.15Å; A233-I236 PolarHBondContact O-N 3.23Å; A233-L237 HydrophobicContact CB-CD1 4.02Å
234K44.7Very low56.6Low135 Ų13592.6 Ų92.659%0.58749%0.486SS*.THydrogen-bonded Turntrans-55.7119.8167.7-60.3-172.7-170.4121.90105.3D232D232-K234 PolarHBondContact O-N 3.37Å; D232-K234 WeakPolarHBondContact OD1-CD 3.43Å; D232-K234 VanDerWaalsContact OD1-CE 3.28Å; D232-K234 WeakPolarHBondContact OD1-CE 3.33Å; D232-K234 WeakPolarHBondContact OD1-CG 3.49Å; D232-K234 IonicContact OD1-NZ 2.65Å; D232-K234 PolarHBondContact OD1-NZ 3.39Å
235Y39.1Very low54Low217 Ų21793.8 Ų93.885%0.85150%0.496SS*.THydrogen-bonded Turntrans94.38.3174.8-45-70.2000120.2A233A233-Y235 PolarHBondContact O-N 3.06Å; A233-Y235 VanDerWaalsContact O-N 3.15Å
236I45.7Very low51.9Low77 Ų7797.8 Ų97.840%0.39551%0.514SS..THydrogen-bonded Turntrans-119.3-18.8172.4-59.2179.2000114.5A233 M247 V248A233-I236 PolarHBondContact O-N 3.23Å; I236-M247 VanDerWaalsContact CG2-C 3.49Å; I236-V248 HydrophobicContact CB-CG2 4.24Å; I236-V248 HydrophobicContact CG2-CB 4.48Å; I236-V248 HydrophobicContact CG2-CG2 3.72Å
237L44.3Very low49.2Very low63 Ų63102 Ų10233%0.3353%0.526SS..SBendtrans-110.25.6-168.5-68.3168.2000115.9F228 A233 V248F228-L237 HydrophobicContact CE2-CD1 3.91Å; F228-L237 HydrophobicContact CZ-CD1 3.53Å; A233-L237 HydrophobicContact CB-CD1 4.02Å; L237-V248 HydrophobicContact CD1-CG2 4.34Å; L237-V248 HydrophobicContact CD2-CG2 4.04Å; L237-V248 HydrophobicContact CG-CG2 4.15Å
238I39.1Very low46.9Very low141 Ų141102.5 Ų102.572%0.72353%0.531SS*.  trans-1238.5-171.2-47.8177.1000113
239D34.2Very low44.5Very low135 Ų135103.6 Ų103.672%0.72254%0.539SS*.SBendtrans-84123.9171-80-22000110.5D241D239-D241 PolarHBondContact O-N 3.44Å
240D34.2Very low42.4Very low160 Ų160108.2 Ų108.286%0.85655%0.549SS*.SBendtrans-63.426-162.7-76.1-48.7000117.7
241D36.7Very low40Very low126 Ų126113.9 Ų113.967%0.67456%0.56SS**  trans-11997.4171.8-75.5-38.6000110.2D239 E243 G244 A245D239-D241 PolarHBondContact O-N 3.44Å; D241-E243 PolarHBondContact O-N 3.22Å; D241-G244 PolarHBondContact O-N 2.83Å; D241-A245 PolarHBondContact O-N 3.49Å
242F39.2Very low38Very low192 Ų192116.6 Ų116.684%0.84258%0.575SS**THydrogen-bonded Turntrans-55-5.6-179.1-110.5-97.5000115.4
243E34.5Very low36.8Very low201 Ų201113.5 Ų113.594%0.93956%0.557SS**THydrogen-bonded Turntrans-111.3-13.8174.5-75.2-173.7145.200114.3D241D241-E243 PolarHBondContact O-N 3.22Å
244G29.6Very low35.9Very low55 Ų55113.6 Ų113.657%0.56756%0.555SS**THydrogen-bonded Turntrans-107.5-23-17200000116D241D241-G244 PolarHBondContact O-N 2.83Å
245A28.4Very low35.7Very low27 Ų27108.9 Ų108.922%0.22354%0.538CS..  trans-94.37.6-167.100000115.8D241 M247D241-A245 PolarHBondContact O-N 3.49Å; A245-M247 PolarHBondContact O-N 3.07Å
246M31Very low35.9Very low103 Ų10398.8 Ų98.851%0.50750%0.499SS..  trans-81.353.2177-139.4-167.5140.900111.7R273M246-R273 HydrophobicContact CE-CG 4.39Å; M246-R273 HydrophobicContact SD-CG 4.38Å
247M30Very low35.7Very low140 Ų14096.5 Ų96.569%0.6949%0.489SS*.  trans-117.633.9177.6-72.8-75.4-73.300111.2I236 A245 D249I236-M247 VanDerWaalsContact CG2-C 3.49Å; A245-M247 PolarHBondContact O-N 3.07Å; M247-D249 PolarHBondContact O-N 3.48Å
248V35.3Very low35.9Very low39 Ų3993.8 Ų93.824%0.23648%0.475CS..SBendtrans-64.5120147.7178.80000103.6I236 L237 R250 F253I236-V248 HydrophobicContact CB-CG2 4.24Å; I236-V248 HydrophobicContact CG2-CB 4.48Å; I236-V248 HydrophobicContact CG2-CG2 3.72Å; L237-V248 HydrophobicContact CD1-CG2 4.34Å; L237-V248 HydrophobicContact CD2-CG2 4.04Å; L237-V248 HydrophobicContact CG-CG2 4.15Å; V248-R250 PolarHBondContact O-N 2.9Å; V248-F253 HydrophobicContact CB-CE2 3.79Å; V248-F253 HydrophobicContact CG1-CD2 4.23Å; V248-F253 HydrophobicContact CG1-CE2 3.44Å; V248-F253 VanDerWaalsContact CG1-CE2 3.44Å; V248-F253 HydrophobicContact CG1-CZ 4.2Å
249D32.3Very low36.3Very low52 Ų5287.4 Ų87.428%0.27844%0.442SS..  trans-41.6110.1-164.9-162-21.4000109.7M247 R251 D252M247-D249 PolarHBondContact O-N 3.48Å; D249-R251 PolarHBondContact O-N 2.98Å; D249-R251 WeakPolarHBondContact OD1-CB 3.35Å; D249-R251 WeakPolarHBondContact OD1-CD 3.32Å; D249-R251 WeakPolarHBondContact OD1-CG 3.48Å; D249-R251 IonicContact OD1-CZ 3.67Å; D249-R251 PolarHBondContact OD1-N 3.41Å; D249-R251 IonicContact OD1-NE 3.78Å; D249-R251 PolarHBondContact OD1-NE 3.31Å; D249-R251 IonicContact OD1-NH2 3.19Å; D249-R251 IonicContact OD2-CZ 2.72Å; D249-R251 IonicContact OD2-NE 3.36Å; D249-R251 PolarHBondContact OD2-NE 2.98Å; D249-R251 IonicContact OD2-NH2 3Å; D249-R251 PolarHBondContact OD2-NH2 2.87Å; D249-D252 PolarHBondContact O-N 2.95Å
250R34.3Very low36.7Very low194 Ų19481.1 Ų81.173%0.73241%0.409SS*.THydrogen-bonded Turntrans-50.5-19.6176.1-82.1-176.8172.6175.8-2.1110.5V248V248-R250 PolarHBondContact O-N 2.9Å
251R33.8Very low37.5Very low167 Ų16775 Ų7563%0.6338%0.376SS*.THydrogen-bonded Turntrans-75.5-25.6176.3-55.8173.9-77.3-168.42.1114.1D249 S254D249-R251 PolarHBondContact O-N 2.98Å; D249-R251 WeakPolarHBondContact OD1-CB 3.35Å; D249-R251 WeakPolarHBondContact OD1-CD 3.32Å; D249-R251 WeakPolarHBondContact OD1-CG 3.48Å; D249-R251 IonicContact OD1-CZ 3.67Å; D249-R251 PolarHBondContact OD1-N 3.41Å; D249-R251 IonicContact OD1-NE 3.78Å; D249-R251 PolarHBondContact OD1-NE 3.31Å; D249-R251 IonicContact OD1-NH2 3.19Å; D249-R251 IonicContact OD2-CZ 2.72Å; D249-R251 IonicContact OD2-NE 3.36Å; D249-R251 PolarHBondContact OD2-NE 2.98Å; D249-R251 IonicContact OD2-NH2 3Å; D249-R251 PolarHBondContact OD2-NH2 2.87Å; R251-S254 WeakPolarHBondContact O-CB 3.45Å; R251-S254 PolarHBondContact O-N 3.19Å; R251-S254 PolarHBondContact O-OG 2.81Å
252D33.5Very low38.1Very low92 Ų9271.4 Ų71.449%0.49236%0.358SS..THydrogen-bonded Turntrans-82.6-27.2174-74.4-17.5000112.1D249 S254D249-D252 PolarHBondContact O-N 2.95Å; D252-S254 PolarHBondContact O-N 3.21Å
253F36.3Very low38.7Very low38 Ų3869.1 Ų69.117%0.16735%0.348CS..G310 helixtrans-74.7-1.4167.8-72.3-76.3000113.8I209 V248 V255 V256 P257 F276I209-F253 HydrophobicContact CB-CE1 4.5Å; I209-F253 HydrophobicContact CD1-CD1 4.14Å; I209-F253 HydrophobicContact CD1-CE1 3.66Å; I209-F253 HydrophobicContact CD1-CZ 4.02Å; I209-F253 HydrophobicContact CG1-CE1 4.04Å; I209-F253 HydrophobicContact CG1-CZ 4.49Å; I209-F253 HydrophobicContact CG2-CD1 4.05Å; I209-F253 HydrophobicContact CG2-CE1 3.63Å; V248-F253 HydrophobicContact CB-CE2 3.79Å; V248-F253 HydrophobicContact CG1-CD2 4.23Å; V248-F253 HydrophobicContact CG1-CE2 3.44Å; V248-F253 VanDerWaalsContact CG1-CE2 3.44Å; V248-F253 HydrophobicContact CG1-CZ 4.2Å; F253-V255 PolarHBondContact O-N 3.43Å; F253-V256 HydrophobicContact CD1-CG2 4.21Å; F253-V256 VanDerWaalsContact O-CB 3.3Å; F253-V256 WeakPolarHBondContact O-CB 3.28Å; F253-V256 WeakPolarHBondContact O-CG2 3.44Å; F253-V256 PolarHBondContact O-N 3.2Å; F253-P257 WeakPolarHBondContact O-CD 3.24Å; F253-F276 HydrophobicContact CD1-CE2 4.43Å; F253-F276 AromaticContact CE1-CE2 3.47Å; F253-F276 HydrophobicContact CE1-CE2 3.47Å; F253-F276 VanDerWaalsContact CE1-CE2 3.47Å; F253-F276 AromaticContact CE1-CZ 3.42Å; F253-F276 HydrophobicContact CE1-CZ 3.42Å; F253-F276 VanDerWaalsContact CE1-CZ 3.42Å; F253-F276 HydrophobicContact CZ-CE1 4.29Å; F253-F276 AromaticContact CZ-CE2 3.7Å; F253-F276 HydrophobicContact CZ-CE2 3.7Å; F253-F276 AromaticContact CZ-CZ 3.4Å; F253-F276 HydrophobicContact CZ-CZ 3.4Å; F253-F276 VanDerWaalsContact CZ-CZ 3.4Å
254S37.9Very low39.5Very low32 Ų3262.7 Ų62.722%0.22432%0.318CS..G310 helixtrans-64.8-3.8177.271.30000114.5R251 D252 P257R251-S254 WeakPolarHBondContact O-CB 3.45Å; R251-S254 PolarHBondContact O-N 3.19Å; R251-S254 PolarHBondContact O-OG 2.81Å; D252-S254 PolarHBondContact O-N 3.21Å; S254-P257 VanDerWaalsContact C-CD 3.41Å; S254-P257 WeakPolarHBondContact O-CD 3.38Å; S254-P257 VanDerWaalsContact O-CG 3.32Å; S254-P257 WeakPolarHBondContact O-CG 3.4Å
255V40.6Very low40.5Very low36 Ų3662.3 Ų62.322%0.21830%0.3CS..G310 helixtrans-83.5-19.9170.6-153.80000112.3L168 V206 F253 I258L168-V255 HydrophobicContact CD2-CG1 3.66Å; V206-V255 HydrophobicContact CG1-CB 3.87Å; V206-V255 HydrophobicContact CG1-CG1 3.59Å; V206-V255 HydrophobicContact CG1-CG2 4.14Å; V206-V255 HydrophobicContact CG2-CB 4.27Å; V206-V255 HydrophobicContact CG2-CG1 4.46Å; V206-V255 HydrophobicContact CG2-CG2 3.59Å; F253-V255 PolarHBondContact O-N 3.43Å; V255-I258 HydrophobicContact CG1-CD1 3.54Å; V255-I258 HydrophobicContact CG1-CG1 4.34Å; V255-I258 VanDerWaalsContact O-CB 3.26Å; V255-I258 WeakPolarHBondContact O-CB 3.28Å; V255-I258 VanDerWaalsContact O-CG1 3.29Å; V255-I258 WeakPolarHBondContact O-CG1 3.1Å; V255-I258 PolarHBondContact O-N 3.49Å; V255-I258 VanDerWaalsContact O-N 3.1Å
256V43.5Very low41.7Very low5 Ų565 Ų653%0.0332%0.317CS..G310 helixtrans-65.3-33.3173.7-177.60000113.7K213 F253 I258 L259 I268 N272K213-V256 VanDerWaalsContact NZ-CG2 3.32Å; F253-V256 HydrophobicContact CD1-CG2 4.21Å; F253-V256 VanDerWaalsContact O-CB 3.3Å; F253-V256 WeakPolarHBondContact O-CB 3.28Å; F253-V256 WeakPolarHBondContact O-CG2 3.44Å; F253-V256 PolarHBondContact O-N 3.2Å; V256-I258 PolarHBondContact O-N 3.15Å; V256-L259 PolarHBondContact O-N 2.9Å; V256-I268 HydrophobicContact CG1-CG2 3.31Å; V256-N272 WeakPolarHBondContact CG1-ND2 3.39Å
257P41.5Very low42.7Very low28 Ų2865.2 Ų65.218%0.18231%0.312CS..G310 helixtrans-50.1-14.7164.7-32.731.3000116.6I65 F253 S254 A260I65-P257 HydrophobicContact CD1-CB 4.41Å; F253-P257 WeakPolarHBondContact O-CD 3.24Å; S254-P257 VanDerWaalsContact C-CD 3.41Å; S254-P257 WeakPolarHBondContact O-CD 3.38Å; S254-P257 VanDerWaalsContact O-CG 3.32Å; S254-P257 WeakPolarHBondContact O-CG 3.4Å; P257-A260 VanDerWaalsContact O-O 3.05Å
258I48.8Very low43.6Very low7 Ų759.6 Ų59.64%0.03628%0.284CS..G310 helixtrans-78.7-25.8175.7-55-179.1000111.3L61 H117 L168 C172 V255 V256 A260L61-I258 HydrophobicContact CD1-CD1 3.77Å; H117-I258 WeakPolarHBondContact ND1-CG2 3.32Å; L168-I258 HydrophobicContact CD2-CD1 4.15Å; C172-I258 HydrophobicContact CB-CG2 4.39Å; C172-I258 WeakPolarHBondContact SG-CG2 3.45Å; V255-I258 HydrophobicContact CG1-CD1 3.54Å; V255-I258 HydrophobicContact CG1-CG1 4.34Å; V255-I258 VanDerWaalsContact O-CB 3.26Å; V255-I258 WeakPolarHBondContact O-CB 3.28Å; V255-I258 VanDerWaalsContact O-CG1 3.29Å; V255-I258 WeakPolarHBondContact O-CG1 3.1Å; V255-I258 PolarHBondContact O-N 3.49Å; V255-I258 VanDerWaalsContact O-N 3.1Å; V256-I258 PolarHBondContact O-N 3.15Å; I258-A260 VanDerWaalsContact C-N 3.29Å; I258-A260 PolarHBondContact O-N 3.28Å
259L46.6Very low44.4Very low7 Ų761.6 Ų61.64%0.03729%0.294CS..SBendtrans-79.6-9.5179.2-66.6179.9000114.2C172 W175 Q176 L210 V256 I268C172-L259 HydrophobicContact CB-CD2 3.91Å; C172-L259 VanDerWaalsContact SG-CD2 3.56Å; W175-L259 HydrophobicContact CB-CD2 3.9Å; W175-L259 HydrophobicContact CD2-CD1 4.39Å; W175-L259 HydrophobicContact CG-CD2 3.9Å; Q176-L259 PolarHBondContact NE2-O 3.38Å; L210-L259 HydrophobicContact CD2-CD1 3.54Å; L210-L259 HydrophobicContact CD2-CG 4.38Å; V256-L259 PolarHBondContact O-N 2.9Å; L259-I268 HydrophobicContact CB-CD1 4.13Å
260A42.7Very low45.6Very low3 Ų363.7 Ų63.73%0.02530%0.302CS..SBendtrans-127.8140.3-177.500000111.3P257 I258 E264 R265 I268P257-A260 VanDerWaalsContact O-O 3.05Å; I258-A260 VanDerWaalsContact C-N 3.29Å; I258-A260 PolarHBondContact O-N 3.28Å; A260-E264 HydrophobicContact CB-CB 3.52Å; A260-R265 HydrophobicContact CB-CG 4.45Å; A260-I268 HydrophobicContact CB-CB 4.42Å; A260-I268 HydrophobicContact CB-CD1 3.18Å; A260-I268 HydrophobicContact CB-CG1 3.67Å
261D50.3Low46.6Very low32 Ų3255.7 Ų55.717%0.17127%0.272CS..  trans-47.4147.8153.5-174.8-32.3000109N126 K263 E264 R265N126-D261 PolarHBondContact ND2-OD2 3.44Å; D261-K263 PolarHBondContact O-N 2.86Å; D261-K263 PolarHBondContact OD1-N 3.17Å; D261-E264 HydrophobicContact CB-CG 4.39Å; D261-E264 PolarHBondContact O-N 3.06Å; D261-R265 PolarHBondContact O-N 3.02Å
262V50.2Low47.6Very low49 Ų4948.3 Ų48.330%0.29725%0.245SC..G310 helixtrans-42.5-37.3169.2175.60000111.6P69 E264P69-V262 HydrophobicContact CG-CG1 4.03Å; V262-E264 VanDerWaalsContact C-N 3.32Å; V262-E264 PolarHBondContact O-N 2.8Å
263K51.2Low48.8Very low145 Ų14549.2 Ų49.263%0.6324%0.241SC*.G310 helixtrans-68.5-24.2178.7-66178.3-177.4170.70114.4E73 D261E73-K263 IonicContact OE1-NZ 3.52Å; D261-K263 PolarHBondContact O-N 2.86Å; D261-K263 PolarHBondContact OD1-N 3.17Å
264E51.4Low49.9Very low65 Ų6549 Ų4930%0.30424%0.242SC..G310 helixtrans-96.6-7.3-177-69.9-174.8159.700113.7A260 D261 V262 S266 R267 I268A260-E264 HydrophobicContact CB-CB 3.52Å; D261-E264 HydrophobicContact CB-CG 4.39Å; D261-E264 PolarHBondContact O-N 3.06Å; V262-E264 VanDerWaalsContact C-N 3.32Å; V262-E264 PolarHBondContact O-N 2.8Å; E264-S266 VanDerWaalsContact C-N 3.32Å; E264-S266 PolarHBondContact O-N 3.05Å; E264-R267 WeakPolarHBondContact O-CB 3.16Å; E264-R267 PolarHBondContact O-N 2.67Å; E264-I268 PolarHBondContact O-N 2.94Å
265R51.9Low50.8Low48 Ų4847.5 Ų47.518%0.18123%0.231CC..Hα-helixtrans-56.1-41.9-175-71.6-176.5-178.4166.48.1114I65 A260 D261 R267 I268 D269I65-R265 VanDerWaalsContact CG2-CZ 3.49Å; I65-R265 VanDerWaalsContact CG2-NH1 3.32Å; A260-R265 HydrophobicContact CB-CG 4.45Å; D261-R265 PolarHBondContact O-N 3.02Å; R265-R267 VanDerWaalsContact C-N 3.29Å; R265-R267 PolarHBondContact O-N 3.49Å; R265-I268 PolarHBondContact O-N 3.06Å; R265-D269 WeakPolarHBondContact O-CB 3.22Å; R265-D269 PolarHBondContact O-N 3.31Å
266S52.2Low51.6Low83 Ų8347.4 Ų47.458%0.5823%0.228SC*.Hα-helixtrans-62.9-37.5177.855.70000112.3E264 E270E264-S266 VanDerWaalsContact C-N 3.32Å; E264-S266 PolarHBondContact O-N 3.05Å; S266-E270 PolarHBondContact O-N 2.65Å
267R51.6Low52.5Low107 Ų10753.6 Ų53.640%0.40425%0.251SS..Hα-helixtrans-71.3-42.2178.4-56.4-179.470.4178.63.6110.9E264 R265 D269 E270 W271 M312E264-R267 WeakPolarHBondContact O-CB 3.16Å; E264-R267 PolarHBondContact O-N 2.67Å; R265-R267 VanDerWaalsContact C-N 3.29Å; R265-R267 PolarHBondContact O-N 3.49Å; R267-D269 VanDerWaalsContact C-N 3.35Å; R267-E270 PolarHBondContact O-N 2.85Å; R267-W271 WeakPolarHBondContact O-CB 3.3Å; R267-W271 PolarHBondContact O-N 3.19Å; R267-M312 VanDerWaalsContact NH2-C 3.35Å; R267-M312 VanDerWaalsContact NH2-CA 3.26Å; R267-M312 VanDerWaalsContact NH2-CB 3.31Å; R267-M312 PolarHBondContact NH2-O 3.07Å
268I49.5Very low53.2Low22 Ų2252.7 Ų52.711%0.11325%0.245CC..Hα-helixtrans-65.3-38.6175.5-66-150.6000111.3V256 L259 A260 E264 R265 E270 W271 N272V256-I268 HydrophobicContact CG1-CG2 3.31Å; L259-I268 HydrophobicContact CB-CD1 4.13Å; A260-I268 HydrophobicContact CB-CB 4.42Å; A260-I268 HydrophobicContact CB-CD1 3.18Å; A260-I268 HydrophobicContact CB-CG1 3.67Å; E264-I268 PolarHBondContact O-N 2.94Å; R265-I268 PolarHBondContact O-N 3.06Å; I268-E270 VanDerWaalsContact C-N 3.32Å; I268-E270 PolarHBondContact O-N 2.79Å; I268-W271 PolarHBondContact O-N 3.24Å; I268-N272 WeakPolarHBondContact O-CB 3.39Å; I268-N272 PolarHBondContact O-N 3.27Å; I268-N272 PolarHBondContact O-ND2 3.43Å; I268-N272 VanDerWaalsContact O-ND2 3.12Å; I268-N272 PolarHBondContact O-OD1 3.46Å
269D52.2Low53.6Low82 Ų8252.4 Ų52.444%0.43924%0.243SC..Hα-helixtrans-62.2-39.5176-77.7-19.5000112.4R265 R267 R273R265-D269 WeakPolarHBondContact O-CB 3.22Å; R265-D269 PolarHBondContact O-N 3.31Å; R267-D269 VanDerWaalsContact C-N 3.35Å; D269-R273 WeakPolarHBondContact O-CG 3.32Å; D269-R273 PolarHBondContact O-N 3.4Å; D269-R273 PolarHBondContact O-NH1 3.14Å
270E56.8Low54.2Low96 Ų9654.7 Ų54.745%0.44926%0.257SS..Hα-helixtrans-66.8-45173.8-172.5171.8-170.600112.2S266 R267 I268 N272 R273 N274S266-E270 PolarHBondContact O-N 2.65Å; R267-E270 PolarHBondContact O-N 2.85Å; I268-E270 VanDerWaalsContact C-N 3.32Å; I268-E270 PolarHBondContact O-N 2.79Å; E270-N272 VanDerWaalsContact C-N 3.35Å; E270-N272 PolarHBondContact O-N 3.23Å; E270-R273 VanDerWaalsContact CA-NH2 3.35Å; E270-R273 WeakPolarHBondContact O-CB 3.43Å; E270-R273 PolarHBondContact O-N 3.4Å; E270-N274 PolarHBondContact O-N 3.44Å; E270-N274 PolarHBondContact O-ND2 2.89Å
271W55.7Low55.1Low25 Ų2557.8 Ų57.810%0.09528%0.278CS..Hα-helixtrans-60.7-43.4176.2-174.884.3000112W175 K213 L217 R267 I268 R273 N274 V275 F305W175-W271 AromaticContact CH2-CH2 3.43Å; W175-W271 HydrophobicContact CH2-CH2 3.43Å; W175-W271 VanDerWaalsContact CH2-CH2 3.43Å; W175-W271 AromaticContact CH2-CZ2 3.85Å; W175-W271 HydrophobicContact CH2-CZ2 3.85Å; W175-W271 HydrophobicContact CH2-CZ3 4.08Å; W175-W271 HydrophobicContact CZ2-CH2 4.04Å; W175-W271 HydrophobicContact CZ2-CZ2 4.37Å; W175-W271 HydrophobicContact CZ2-CZ3 4.33Å; W175-W271 HydrophobicContact CZ3-CH2 4.41Å; K213-W271 HydrophobicContact CB-CH2 3.93Å; K213-W271 HydrophobicContact CB-CZ3 4.26Å; K213-W271 HydrophobicContact CD-CH2 4.3Å; K213-W271 HydrophobicContact CD-CZ3 3.8Å; K213-W271 HydrophobicContact CG-CH2 4.04Å; K213-W271 HydrophobicContact CG-CZ3 3.91Å; L217-W271 HydrophobicContact CD1-CH2 4.3Å; L217-W271 HydrophobicContact CD1-CZ2 3.89Å; L217-W271 HydrophobicContact CD2-CZ2 3.88Å; L217-W271 HydrophobicContact CG-CH2 4.49Å; L217-W271 HydrophobicContact CG-CZ2 3.88Å; R267-W271 WeakPolarHBondContact O-CB 3.3Å; R267-W271 PolarHBondContact O-N 3.19Å; I268-W271 PolarHBondContact O-N 3.24Å; W271-R273 VanDerWaalsContact C-N 3.34Å; W271-R273 PolarHBondContact O-N 3.27Å; W271-N274 PolarHBondContact O-N 2.94Å; W271-N274 VanDerWaalsContact O-N 3.08Å; W271-V275 HydrophobicContact CD2-CG2 3.76Å; W271-V275 VanDerWaalsContact CE2-CG2 3.5Å; W271-V275 HydrophobicContact CE3-CG2 4.02Å; W271-V275 HydrophobicContact CG-CG2 4.42Å; W271-V275 HydrophobicContact CH2-CG2 3.8Å; W271-V275 HydrophobicContact CZ2-CG2 3.52Å; W271-V275 HydrophobicContact CZ3-CG2 4.05Å; W271-V275 WeakPolarHBondContact O-CG2 3.16Å; W271-V275 PolarHBondContact O-N 3.48Å; W271-F305 AromaticContact CD1-CZ 3.99Å; W271-F305 AromaticContact NE1-CE1 3.92Å; W271-F305 AromaticContact NE1-CZ 3.4Å
272N54.7Low55.3Low12 Ų1256.5 Ų56.56%0.06427%0.271CS..Hα-helixtrans-56-47.9174.3-69-29.4000111.2K213 V256 I268 E270 N274 V275 F276K213-N272 WeakPolarHBondContact CE-OD1 3.11Å; K213-N272 PolarHBondContact NZ-OD1 2.9Å; V256-N272 WeakPolarHBondContact CG1-ND2 3.39Å; I268-N272 WeakPolarHBondContact O-CB 3.39Å; I268-N272 PolarHBondContact O-N 3.27Å; I268-N272 PolarHBondContact O-ND2 3.43Å; I268-N272 VanDerWaalsContact O-ND2 3.12Å; I268-N272 PolarHBondContact O-OD1 3.46Å; E270-N272 VanDerWaalsContact C-N 3.35Å; E270-N272 PolarHBondContact O-N 3.23Å; N272-N274 VanDerWaalsContact C-N 3.26Å; N272-N274 PolarHBondContact O-N 3.29Å; N272-V275 PolarHBondContact O-N 3.38Å; N272-F276 VanDerWaalsContact O-CD2 3.27Å; N272-F276 WeakPolarHBondContact O-CD2 3.46Å; N272-F276 PolarHBondContact O-N 2.54Å
273R58.6Low55.6Low111 Ų11155.3 Ų55.342%0.41926%0.263SS..Hα-helixtrans-58.1-40.8177.2-73.1-173.6-63.9-91.66.3111.4M246 D269 E270 W271 R277M246-R273 HydrophobicContact CE-CG 4.39Å; M246-R273 HydrophobicContact SD-CG 4.38Å; D269-R273 WeakPolarHBondContact O-CG 3.32Å; D269-R273 PolarHBondContact O-N 3.4Å; D269-R273 PolarHBondContact O-NH1 3.14Å; E270-R273 VanDerWaalsContact CA-NH2 3.35Å; E270-R273 WeakPolarHBondContact O-CB 3.43Å; E270-R273 PolarHBondContact O-N 3.4Å; W271-R273 VanDerWaalsContact C-N 3.34Å; W271-R273 PolarHBondContact O-N 3.27Å; R273-R277 WeakPolarHBondContact O-CB 3.36Å; R273-R277 VanDerWaalsContact O-CG 3.32Å; R273-R277 WeakPolarHBondContact O-CG 3.26Å; R273-R277 PolarHBondContact O-N 3.09Å
274N60Low55.9Low33 Ų3351.9 Ų51.918%0.17626%0.257CS..Hα-helixtrans-72.9-39.9-179.6-69.4-25.1000112.9E270 W271 N272 R277 L278 F305E270-N274 PolarHBondContact O-N 3.44Å; E270-N274 PolarHBondContact O-ND2 2.89Å; W271-N274 PolarHBondContact O-N 2.94Å; W271-N274 VanDerWaalsContact O-N 3.08Å; N272-N274 VanDerWaalsContact C-N 3.26Å; N272-N274 PolarHBondContact O-N 3.29Å; N274-R277 WeakPolarHBondContact O-CB 3.32Å; N274-R277 PolarHBondContact O-N 2.99Å; N274-L278 WeakPolarHBondContact O-CB 3.06Å; N274-L278 PolarHBondContact O-N 2.99Å; N274-F305 HydrophobicContact CB-CE2 4.27Å
275V56.4Low56.1Low2 Ų249.8 Ų49.81%0.01225%0.251CS..Hα-helixtrans-65.3-41.4175.3172.50000111.3K213 A216 W271 N272 L278 A279 F305K213-V275 HydrophobicContact CG-CG1 4.27Å; A216-V275 HydrophobicContact CB-CG1 3.8Å; W271-V275 HydrophobicContact CD2-CG2 3.76Å; W271-V275 VanDerWaalsContact CE2-CG2 3.5Å; W271-V275 HydrophobicContact CE3-CG2 4.02Å; W271-V275 HydrophobicContact CG-CG2 4.42Å; W271-V275 HydrophobicContact CH2-CG2 3.8Å; W271-V275 HydrophobicContact CZ2-CG2 3.52Å; W271-V275 HydrophobicContact CZ3-CG2 4.05Å; W271-V275 WeakPolarHBondContact O-CG2 3.16Å; W271-V275 PolarHBondContact O-N 3.48Å; N272-V275 PolarHBondContact O-N 3.38Å; V275-L278 CarbonylContact O-C 3.5Å; V275-L278 WeakPolarHBondContact O-CB 3.13Å; V275-L278 PolarHBondContact O-N 2.9Å; V275-L278 VanDerWaalsContact O-N 3.16Å; V275-A279 WeakPolarHBondContact O-CB 3.36Å; V275-A279 PolarHBondContact O-N 3.43Å; V275-F305 HydrophobicContact CG2-CE2 4.01Å; V275-F305 HydrophobicContact CG2-CZ 3.79Å
276F58.1Low56.2Low33 Ų3351 Ų5115%0.14526%0.263CS..Hα-helixtrans-65.4-39.8174.9-87.6-73.3000112F253 N272 L278 A279 V280F253-F276 HydrophobicContact CD1-CE2 4.43Å; F253-F276 AromaticContact CE1-CE2 3.47Å; F253-F276 HydrophobicContact CE1-CE2 3.47Å; F253-F276 VanDerWaalsContact CE1-CE2 3.47Å; F253-F276 AromaticContact CE1-CZ 3.42Å; F253-F276 HydrophobicContact CE1-CZ 3.42Å; F253-F276 VanDerWaalsContact CE1-CZ 3.42Å; F253-F276 HydrophobicContact CZ-CE1 4.29Å; F253-F276 AromaticContact CZ-CE2 3.7Å; F253-F276 HydrophobicContact CZ-CE2 3.7Å; F253-F276 AromaticContact CZ-CZ 3.4Å; F253-F276 HydrophobicContact CZ-CZ 3.4Å; F253-F276 VanDerWaalsContact CZ-CZ 3.4Å; N272-F276 VanDerWaalsContact O-CD2 3.27Å; N272-F276 WeakPolarHBondContact O-CD2 3.46Å; N272-F276 PolarHBondContact O-N 2.54Å; F276-L278 VanDerWaalsContact C-N 3.3Å; F276-L278 PolarHBondContact O-N 3.44Å; F276-A279 PolarHBondContact O-N 2.87Å; F276-V280 WeakPolarHBondContact O-CB 3.35Å; F276-V280 VanDerWaalsContact O-CG2 3.3Å; F276-V280 WeakPolarHBondContact O-CG2 3.31Å; F276-V280 PolarHBondContact O-N 3.28Å
277R61.9Low56.3Low136 Ų13651.5 Ų51.551%0.51327%0.267SS..Hα-helixtrans-59-43.6169.9-77.5175.2176.6177.9-2.4111.3R273 N274 V280 C281R273-R277 WeakPolarHBondContact O-CB 3.36Å; R273-R277 VanDerWaalsContact O-CG 3.32Å; R273-R277 WeakPolarHBondContact O-CG 3.26Å; R273-R277 PolarHBondContact O-N 3.09Å; N274-R277 WeakPolarHBondContact O-CB 3.32Å; N274-R277 PolarHBondContact O-N 2.99Å; R277-V280 PolarHBondContact O-N 3.08Å; R277-C281 VanDerWaalsContact O-CB 3.27Å; R277-C281 WeakPolarHBondContact O-CB 3.02Å; R277-C281 PolarHBondContact O-N 3.34Å; R277-C281 PolarHBondContact O-SG 3.03Å
278L57.2Low56.1Low9 Ų948.2 Ų48.25%0.04726%0.263CS..Hα-helixtrans-61.6-45.7177.5-164.6139.1000111.4A216 N274 V275 F276 T282 F301 F305A216-L278 HydrophobicContact CB-CD2 4.3Å; N274-L278 WeakPolarHBondContact O-CB 3.06Å; N274-L278 PolarHBondContact O-N 2.99Å; V275-L278 CarbonylContact O-C 3.5Å; V275-L278 WeakPolarHBondContact O-CB 3.13Å; V275-L278 PolarHBondContact O-N 2.9Å; V275-L278 VanDerWaalsContact O-N 3.16Å; F276-L278 VanDerWaalsContact C-N 3.3Å; F276-L278 PolarHBondContact O-N 3.44Å; L278-T282 WeakPolarHBondContact O-CB 3.3Å; L278-T282 PolarHBondContact O-N 3.42Å; L278-T282 PolarHBondContact O-OG1 3.1Å; L278-F301 HydrophobicContact CB-CD1 4.38Å; L278-F301 HydrophobicContact CB-CE1 3.85Å; L278-F301 HydrophobicContact CD1-CD1 3.7Å; L278-F301 HydrophobicContact CD1-CE1 3.8Å; L278-F301 HydrophobicContact CG-CD1 3.99Å; L278-F301 HydrophobicContact CG-CE1 3.97Å; L278-F305 HydrophobicContact CD1-CB 4.43Å; L278-F305 HydrophobicContact CD1-CD2 3.81Å; L278-F305 HydrophobicContact CD1-CE2 4.29Å; L278-F305 HydrophobicContact CD1-CG 4.18Å
279A56.4Low56Low0 Ų053.2 Ų53.20%030%0.297CS..Hα-helixtrans-59.7-52.1176.700000111.4L224 V275 F276 T282 I283L224-A279 HydrophobicContact CD1-CB 4.12Å; L224-A279 HydrophobicContact CD2-CB 3.78Å; L224-A279 HydrophobicContact CG-CB 4.38Å; V275-A279 WeakPolarHBondContact O-CB 3.36Å; V275-A279 PolarHBondContact O-N 3.43Å; F276-A279 PolarHBondContact O-N 2.87Å; A279-T282 PolarHBondContact O-N 2.88Å; A279-I283 WeakPolarHBondContact O-CB 3.5Å; A279-I283 WeakPolarHBondContact O-CD1 3.35Å; A279-I283 WeakPolarHBondContact O-CG1 3.35Å; A279-I283 PolarHBondContact O-N 2.73Å
280V59.5Low55.5Low55 Ų5555.7 Ų55.733%0.33332%0.315SS..Hα-helixtrans-61.4-48179.1173.10000110.9F276 R277 T282 I283 S284F276-V280 WeakPolarHBondContact O-CB 3.35Å; F276-V280 VanDerWaalsContact O-CG2 3.3Å; F276-V280 WeakPolarHBondContact O-CG2 3.31Å; F276-V280 PolarHBondContact O-N 3.28Å; R277-V280 PolarHBondContact O-N 3.08Å; V280-T282 VanDerWaalsContact C-N 3.31Å; V280-T282 PolarHBondContact O-N 3.41Å; V280-I283 PolarHBondContact O-N 3.34Å; V280-S284 WeakPolarHBondContact O-CB 3.47Å; V280-S284 PolarHBondContact O-N 2.91Å; V280-S284 PolarHBondContact O-OG 2.85Å
281C60.8Low54.8Low69 Ų6952.9 Ų52.947%0.46631%0.311SS..Hα-helixtrans-61.3-39.6177.5-72.10000112.3R277 S284 A285R277-C281 VanDerWaalsContact O-CB 3.27Å; R277-C281 WeakPolarHBondContact O-CB 3.02Å; R277-C281 PolarHBondContact O-N 3.34Å; R277-C281 PolarHBondContact O-SG 3.03Å; C281-S284 PolarHBondContact O-N 3.06Å; C281-A285 WeakPolarHBondContact O-CB 3.47Å; C281-A285 PolarHBondContact O-N 3.1Å
282T54.5Low54.2Low5 Ų559 Ų593%0.03135%0.345CS..Hα-helixtrans-65.1-46.3176.7-60.30000110.8P221 L278 A279 V280 S284 A285 V286 L298P221-T282 HydrophobicContact CB-CG2 3.31Å; L278-T282 WeakPolarHBondContact O-CB 3.3Å; L278-T282 PolarHBondContact O-N 3.42Å; L278-T282 PolarHBondContact O-OG1 3.1Å; A279-T282 PolarHBondContact O-N 2.88Å; V280-T282 VanDerWaalsContact C-N 3.31Å; V280-T282 PolarHBondContact O-N 3.41Å; T282-S284 PolarHBondContact O-N 3.36Å; T282-A285 PolarHBondContact O-N 3.27Å; T282-V286 HydrophobicContact CG2-CG2 4.26Å; T282-V286 WeakPolarHBondContact O-CB 3.27Å; T282-V286 WeakPolarHBondContact O-CG2 3.12Å; T282-V286 PolarHBondContact O-N 2.94Å; T282-L298 HydrophobicContact CG2-CD2 4.09Å; T282-L298 WeakPolarHBondContact OG1-CD2 3.27Å
283I57.8Low53.9Low24 Ų2465.2 Ų65.212%0.12337%0.373CS..Hα-helixtrans-61.5-44.7177.1-67.8163.6000110.4L224 T225 F228 A279 V280 A285 V286 S287L224-I283 HydrophobicContact CD2-CD1 4.22Å; L224-I283 HydrophobicContact CD2-CG1 4.26Å; T225-I283 HydrophobicContact CG2-CG1 4.07Å; F228-I283 HydrophobicContact CB-CD1 3.83Å; F228-I283 HydrophobicContact CD1-CD1 3.33Å; F228-I283 HydrophobicContact CD2-CD1 4.11Å; F228-I283 HydrophobicContact CE1-CD1 3.82Å; F228-I283 HydrophobicContact CG-CD1 3.48Å; F228-I283 VanDerWaalsContact CG-CD1 3.48Å; F228-I283 HydrophobicContact CZ-CD1 4.37Å; A279-I283 WeakPolarHBondContact O-CB 3.5Å; A279-I283 WeakPolarHBondContact O-CD1 3.35Å; A279-I283 WeakPolarHBondContact O-CG1 3.35Å; A279-I283 PolarHBondContact O-N 2.73Å; V280-I283 PolarHBondContact O-N 3.34Å; I283-A285 VanDerWaalsContact C-N 3.34Å; I283-A285 PolarHBondContact O-N 3.16Å; I283-V286 PolarHBondContact O-N 3.2Å; I283-S287 VanDerWaalsContact O-CB 3.24Å; I283-S287 WeakPolarHBondContact O-CB 3.44Å; I283-S287 PolarHBondContact O-N 2.96Å; I283-S287 PolarHBondContact O-OG 3.27Å
284S57.4Low53.3Low73 Ų7361 Ų6151%0.5136%0.361SS..Hα-helixtrans-63-38.8175.2-59.50000112.3V280 C281 T282 A288V280-S284 WeakPolarHBondContact O-CB 3.47Å; V280-S284 PolarHBondContact O-N 2.91Å; V280-S284 PolarHBondContact O-OG 2.85Å; C281-S284 PolarHBondContact O-N 3.06Å; T282-S284 PolarHBondContact O-N 3.36Å; S284-A288 WeakPolarHBondContact O-CB 3.4Å; S284-A288 PolarHBondContact O-N 3.13Å; S284-A288 VanDerWaalsContact O-N 3.15Å
285A55.2Low52.5Low20 Ų2062.3 Ų62.317%0.16538%0.376CS..Hα-helixtrans-71.6-37.3179.200000112.8C281 T282 I283 A288 L298C281-A285 WeakPolarHBondContact O-CB 3.47Å; C281-A285 PolarHBondContact O-N 3.1Å; T282-A285 PolarHBondContact O-N 3.27Å; I283-A285 VanDerWaalsContact C-N 3.34Å; I283-A285 PolarHBondContact O-N 3.16Å; A285-A288 PolarHBondContact O-N 2.95Å; A285-L298 HydrophobicContact CB-CD1 4.14Å; A285-L298 HydrophobicContact CB-CG 4.43Å
286V54Low52.1Low73 Ų7366.2 Ų66.244%0.44240%0.4SS..Hα-helixtrans-73.5-29.9176.11740000111.2T282 I283 A288T282-V286 HydrophobicContact CG2-CG2 4.26Å; T282-V286 WeakPolarHBondContact O-CB 3.27Å; T282-V286 WeakPolarHBondContact O-CG2 3.12Å; T282-V286 PolarHBondContact O-N 2.94Å; I283-V286 PolarHBondContact O-N 3.2Å; V286-A288 VanDerWaalsContact C-N 3.35Å
287S53Low51.7Low95 Ų9573.1 Ų73.166%0.66443%0.425SS*.Hα-helixtrans-81-13.7176.4-54.70000113.5I283I283-S287 VanDerWaalsContact O-CB 3.24Å; I283-S287 WeakPolarHBondContact O-CB 3.44Å; I283-S287 PolarHBondContact O-N 2.96Å; I283-S287 PolarHBondContact O-OG 3.27Å
288A47.8Very low51.1Low37 Ų3769 Ų6931%0.30641%0.413SS..SBendtrans-86.3147.1175.300000111S284 A285 V286 V290S284-A288 WeakPolarHBondContact O-CB 3.4Å; S284-A288 PolarHBondContact O-N 3.13Å; S284-A288 VanDerWaalsContact O-N 3.15Å; A285-A288 PolarHBondContact O-N 2.95Å; V286-A288 VanDerWaalsContact C-N 3.35Å; A288-V290 PolarHBondContact O-N 2.87Å
289P47Very low50.7Low128 Ų12877.4 Ų77.483%0.83144%0.444SS*.  trans-57.5118175.122.8-30.8000109.5G291P289-G291 PolarHBondContact O-N 2.85Å
290V42.7Very low50.4Low134 Ų13479.5 Ų79.581%0.81246%0.462SS*.  trans-60.9100-167.6-172.20000110.9A288A288-V290 PolarHBondContact O-N 2.87Å
291G42.1Very low50Low36 Ų3680.6 Ų80.637%0.37146%0.462SS..  trans-104.8156.9165.500000110.9P289 E293 S294P289-G291 PolarHBondContact O-N 2.85Å; G291-E293 PolarHBondContact O-N 3.24Å; G291-S294 PolarHBondContact O-N 3.44Å
292L44Very low49.7Very low154 Ų15480.9 Ų80.981%0.80646%0.456SS*.Hα-helixtrans-50.8-30.2178.5-14588.4000112.7S294 A295 V296L292-S294 PolarHBondContact O-N 3.08Å; L292-A295 PolarHBondContact O-N 3.05Å; L292-V296 VanDerWaalsContact O-CG2 3.32Å; L292-V296 WeakPolarHBondContact O-CG2 3.46Å; L292-V296 PolarHBondContact O-N 3.34Å
293E46.7Very low49.6Very low142 Ų14286.6 Ų86.666%0.66448%0.478SS*.Hα-helixtrans-61.4-37.5176.2-74.9-168144.400113.8G291 V296 R297G291-E293 PolarHBondContact O-N 3.24Å; E293-V296 PolarHBondContact O-N 3.5Å; E293-R297 WeakPolarHBondContact O-CB 3.45Å; E293-R297 VanDerWaalsContact O-CG 3.29Å; E293-R297 WeakPolarHBondContact O-CG 3.47Å; E293-R297 PolarHBondContact O-N 3.03Å
294S46.1Very low49.2Very low24 Ų2490.5 Ų90.517%0.16850%0.496CS..Hα-helixtrans-68.4-38.5-179.5-59.10000111.3G291 L292 R297 L298G291-S294 PolarHBondContact O-N 3.44Å; L292-S294 PolarHBondContact O-N 3.08Å; S294-R297 PolarHBondContact O-N 2.8Å; S294-L298 PolarHBondContact O-N 3.38Å
295A43.9Very low48.9Very low59 Ų5988.1 Ų88.149%0.48848%0.476SS..Hα-helixtrans-68.5-39.9174.800000111.9L292 L298 W299L292-A295 PolarHBondContact O-N 3.05Å; A295-L298 PolarHBondContact O-N 3.48Å; A295-W299 WeakPolarHBondContact O-CB 3.41Å; A295-W299 PolarHBondContact O-N 3.35Å
296V49Very low48.8Very low85 Ų8595.4 Ų95.452%0.51550%0.5SS..Hα-helixtrans-65.3-38.6174.3172.40000111.2L292 E293 W299 A300L292-V296 VanDerWaalsContact O-CG2 3.32Å; L292-V296 WeakPolarHBondContact O-CG2 3.46Å; L292-V296 PolarHBondContact O-N 3.34Å; E293-V296 PolarHBondContact O-N 3.5Å; V296-W299 PolarHBondContact O-N 3.08Å; V296-A300 WeakPolarHBondContact O-CB 3.38Å; V296-A300 PolarHBondContact O-N 2.96Å
297R47.8Very low48.7Very low178 Ų17897 Ų9767%0.67250%0.498SS*.Hα-helixtrans-64.9-45.1174.7-75.7177.7-174.5-166.74.7111.9E293 S294 W299 F301E293-R297 WeakPolarHBondContact O-CB 3.45Å; E293-R297 VanDerWaalsContact O-CG 3.29Å; E293-R297 WeakPolarHBondContact O-CG 3.47Å; E293-R297 PolarHBondContact O-N 3.03Å; S294-R297 PolarHBondContact O-N 2.8Å; R297-W299 PolarHBondContact O-N 3.33Å; R297-F301 WeakPolarHBondContact O-CB 3.36Å; R297-F301 PolarHBondContact O-N 2.98Å
298L49.8Very low48.6Very low50 Ų5094.9 Ų94.926%0.26248%0.481SS..Hα-helixtrans-60.3-43.6174.5-85.1159.9000111.9T282 A285 S294 A295 F301 H302T282-L298 HydrophobicContact CG2-CD2 4.09Å; T282-L298 WeakPolarHBondContact OG1-CD2 3.27Å; A285-L298 HydrophobicContact CB-CD1 4.14Å; A285-L298 HydrophobicContact CB-CG 4.43Å; S294-L298 PolarHBondContact O-N 3.38Å; A295-L298 PolarHBondContact O-N 3.48Å; L298-F301 PolarHBondContact O-N 2.83Å; L298-H302 WeakPolarHBondContact O-CB 3.28Å; L298-H302 PolarHBondContact O-CD2 2.84Å; L298-H302 PolarHBondContact O-N 3.45Å
299W48.5Very low48.9Very low185 Ų18596.4 Ų96.470%0.70148%0.481SS*.Hα-helixtrans-68.1-46.8178.4-174.280.2000112.7A295 V296 R297 F301 H302 Y303A295-W299 WeakPolarHBondContact O-CB 3.41Å; A295-W299 PolarHBondContact O-N 3.35Å; V296-W299 PolarHBondContact O-N 3.08Å; R297-W299 PolarHBondContact O-N 3.33Å; W299-F301 PolarHBondContact O-N 3.45Å; W299-H302 PolarHBondContact O-N 3Å; W299-Y303 WeakPolarHBondContact O-CB 3.16Å; W299-Y303 PolarHBondContact O-N 3.01Å
300A51Low49.1Very low44 Ų4496.1 Ų96.136%0.36447%0.469SS..Hα-helixtrans-62.1-34176.500000111.7V296 Q304V296-A300 WeakPolarHBondContact O-CB 3.38Å; V296-A300 PolarHBondContact O-N 2.96Å; A300-Q304 WeakPolarHBondContact O-CG 3.46Å; A300-Q304 PolarHBondContact O-N 3.27Å
301F51.1Low49.6Very low77 Ų7796.1 Ų96.134%0.33846%0.458SS..Hα-helixtrans-76.7-39.1177.7-158.1-97.7000112.3L278 R297 L298 W299 Y303 Q304 F305L278-F301 HydrophobicContact CB-CD1 4.38Å; L278-F301 HydrophobicContact CB-CE1 3.85Å; L278-F301 HydrophobicContact CD1-CD1 3.7Å; L278-F301 HydrophobicContact CD1-CE1 3.8Å; L278-F301 HydrophobicContact CG-CD1 3.99Å; L278-F301 HydrophobicContact CG-CE1 3.97Å; R297-F301 WeakPolarHBondContact O-CB 3.36Å; R297-F301 PolarHBondContact O-N 2.98Å; L298-F301 PolarHBondContact O-N 2.83Å; W299-F301 PolarHBondContact O-N 3.45Å; F301-Y303 VanDerWaalsContact C-N 3.27Å; F301-Y303 PolarHBondContact O-N 3.29Å; F301-Q304 PolarHBondContact O-N 3.32Å; F301-F305 WeakPolarHBondContact O-CB 3.46Å; F301-F305 PolarHBondContact O-N 3.04Å
302H54.9Low49.8Very low75 Ų7596.6 Ų96.635%0.34745%0.451SS..Hα-helixtrans-58.9-38.7168.3-94.9-66.4000112.2L298 W299 F305 R306L298-H302 WeakPolarHBondContact O-CB 3.28Å; L298-H302 PolarHBondContact O-CD2 2.84Å; L298-H302 PolarHBondContact O-N 3.45Å; W299-H302 PolarHBondContact O-N 3Å; H302-F305 PolarHBondContact O-N 3.35Å; H302-R306 PolarHBondContact O-N 3.29Å
303Y51.3Low50.3Low125 Ų12593.1 Ų93.149%0.4944%0.444SS..Hα-helixtrans-64.8-42.9175.4-176-95.7000112.2W299 F301 F305 R306 R307W299-Y303 WeakPolarHBondContact O-CB 3.16Å; W299-Y303 PolarHBondContact O-N 3.01Å; F301-Y303 VanDerWaalsContact C-N 3.27Å; F301-Y303 PolarHBondContact O-N 3.29Å; Y303-F305 VanDerWaalsContact C-N 3.35Å; Y303-R306 PolarHBondContact O-N 3.05Å; Y303-R307 HydrophobicContact CE1-CG 4.39Å; Y303-R307 PolarHBondContact O-N 3.11Å; Y303-R307 VanDerWaalsContact O-N 3.1Å
304Q50.5Low50.4Low106 Ų10690.1 Ų90.150%0.49543%0.433SS..Hα-helixtrans-65.7-37.3174.2-71.9-70.1-11.400112.2A300 F301 R307 V308A300-Q304 WeakPolarHBondContact O-CG 3.46Å; A300-Q304 PolarHBondContact O-N 3.27Å; F301-Q304 PolarHBondContact O-N 3.32Å; Q304-R307 PolarHBondContact O-N 3.12Å; Q304-V308 WeakPolarHBondContact O-CG2 3.32Å; Q304-V308 PolarHBondContact O-N 3.43Å
305F49.7Very low50.6Low24 Ų2494.7 Ų94.711%0.10546%0.462CS..Hα-helixtrans-61.6-45.1176.4-162-90.6000111.3L217 W271 N274 V275 L278 F301 H302 Y303 R307 V308 E309L217-F305 HydrophobicContact CD2-CE1 4Å; W271-F305 AromaticContact CD1-CZ 3.99Å; W271-F305 AromaticContact NE1-CE1 3.92Å; W271-F305 AromaticContact NE1-CZ 3.4Å; N274-F305 HydrophobicContact CB-CE2 4.27Å; V275-F305 HydrophobicContact CG2-CE2 4.01Å; V275-F305 HydrophobicContact CG2-CZ 3.79Å; L278-F305 HydrophobicContact CD1-CB 4.43Å; L278-F305 HydrophobicContact CD1-CD2 3.81Å; L278-F305 HydrophobicContact CD1-CE2 4.29Å; L278-F305 HydrophobicContact CD1-CG 4.18Å; F301-F305 WeakPolarHBondContact O-CB 3.46Å; F301-F305 PolarHBondContact O-N 3.04Å; H302-F305 PolarHBondContact O-N 3.35Å; Y303-F305 VanDerWaalsContact C-N 3.35Å; F305-R307 VanDerWaalsContact C-N 3.34Å; F305-R307 PolarHBondContact O-N 3.42Å; F305-V308 WeakPolarHBondContact O-CB 3.38Å; F305-V308 PolarHBondContact O-N 3.45Å; F305-V308 VanDerWaalsContact O-N 3.14Å; F305-E309 HydrophobicContact CD1-CG 4.34Å; F305-E309 HydrophobicContact CE1-CG 4.34Å; F305-E309 WeakPolarHBondContact CE1-OE1 3.42Å; F305-E309 PolarHBondContact O-N 3.35Å
306R54.8Low50.7Low172 Ų172100.2 Ų100.265%0.64948%0.478SS*.Hα-helixtrans-60.3-39.2171.9-79.3-156.5-168.9-166.73.3113.2H302 Y303 V308 E309 E310H302-R306 PolarHBondContact O-N 3.29Å; Y303-R306 PolarHBondContact O-N 3.05Å; R306-V308 VanDerWaalsContact C-N 3.29Å; R306-V308 PolarHBondContact O-N 2.63Å; R306-E309 CarbonylContact O-C 3.59Å; R306-E309 WeakPolarHBondContact O-CB 2.92Å; R306-E309 PolarHBondContact O-N 3.46Å; R306-E309 VanDerWaalsContact O-N 3.15Å; R306-E310 WeakPolarHBondContact O-CG 3.48Å; R306-E310 PolarHBondContact O-N 3.12Å
307R51.6Low50.3Low108 Ų10899.6 Ų99.641%0.40848%0.477SS..Hα-helixtrans-64.7-32.7175.4-82.1-168.4121.2-172-1.5113Y303 Q304 F305 K311Y303-R307 HydrophobicContact CE1-CG 4.39Å; Y303-R307 PolarHBondContact O-N 3.11Å; Y303-R307 VanDerWaalsContact O-N 3.1Å; Q304-R307 PolarHBondContact O-N 3.12Å; F305-R307 VanDerWaalsContact C-N 3.34Å; F305-R307 PolarHBondContact O-N 3.42Å; R307-K311 WeakPolarHBondContact O-CG 3.45Å; R307-K311 PolarHBondContact O-N 3.19Å; R307-K311 VanDerWaalsContact O-N 3.09Å
308V51Low49.9Very low50 Ų5096.3 Ų96.330%0.30348%0.479SS..Hα-helixtrans-68.6-40.3172.8173.60000110Q304 F305 R306 K311 M312Q304-V308 WeakPolarHBondContact O-CG2 3.32Å; Q304-V308 PolarHBondContact O-N 3.43Å; F305-V308 WeakPolarHBondContact O-CB 3.38Å; F305-V308 PolarHBondContact O-N 3.45Å; F305-V308 VanDerWaalsContact O-N 3.14Å; R306-V308 VanDerWaalsContact C-N 3.29Å; R306-V308 PolarHBondContact O-N 2.63Å; V308-K311 PolarHBondContact O-N 3Å; V308-M312 HydrophobicContact CG1-CE 3.55Å; V308-M312 HydrophobicContact CG1-SD 4.14Å; V308-M312 WeakPolarHBondContact O-CB 3.44Å; V308-M312 WeakPolarHBondContact O-CG 3.43Å; V308-M312 PolarHBondContact O-N 3.07Å
309E52.7Low49.5Very low68 Ų6897.6 Ų97.632%0.31850%0.497SS..Hα-helixtrans-62.6-43.3173.1-69.7176.715100112.4F305 R306 K311 M312 A313F305-E309 HydrophobicContact CD1-CG 4.34Å; F305-E309 HydrophobicContact CE1-CG 4.34Å; F305-E309 WeakPolarHBondContact CE1-OE1 3.42Å; F305-E309 PolarHBondContact O-N 3.35Å; R306-E309 CarbonylContact O-C 3.59Å; R306-E309 WeakPolarHBondContact O-CB 2.92Å; R306-E309 PolarHBondContact O-N 3.46Å; R306-E309 VanDerWaalsContact O-N 3.15Å; E309-K311 VanDerWaalsContact C-N 3.33Å; E309-K311 PolarHBondContact O-N 3.15Å; E309-M312 CarbonylContact O-C 3.6Å; E309-M312 WeakPolarHBondContact O-CA 3.22Å; E309-M312 WeakPolarHBondContact O-CB 3.31Å; E309-M312 PolarHBondContact O-N 3.32Å; E309-A313 PolarHBondContact O-N 3.44Å
310E53Low48.9Very low122 Ų122100.4 Ų100.457%0.5752%0.518SS*.Hα-helixtrans-60.2-41.7175.1-73.8169.7178.400111.7R306 M312 A313 D314R306-E310 WeakPolarHBondContact O-CG 3.48Å; R306-E310 PolarHBondContact O-N 3.12Å; E310-M312 VanDerWaalsContact C-N 3.26Å; E310-M312 PolarHBondContact O-N 3.42Å; E310-A313 PolarHBondContact O-N 3.48Å; E310-D314 PolarHBondContact O-N 2.98Å
311K52.5Low48.8Very low135 Ų135103.2 Ų103.259%0.58753%0.525SS*.Hα-helixtrans-68.9-24172.6-77-174.6175.7-174.30113.3R307 V308 E309R307-K311 WeakPolarHBondContact O-CG 3.45Å; R307-K311 PolarHBondContact O-N 3.19Å; R307-K311 VanDerWaalsContact O-N 3.09Å; V308-K311 PolarHBondContact O-N 3Å; E309-K311 VanDerWaalsContact C-N 3.33Å; E309-K311 PolarHBondContact O-N 3.15Å
312M45.4Very low48.6Very low45 Ų45104.6 Ų104.622%0.22254%0.535CS..Hα-helixtrans-79.8-29.5174.7-75177.6178.500111.8R267 V308 E309 E310R267-M312 VanDerWaalsContact NH2-C 3.35Å; R267-M312 VanDerWaalsContact NH2-CA 3.26Å; R267-M312 VanDerWaalsContact NH2-CB 3.31Å; R267-M312 PolarHBondContact NH2-O 3.07Å; V308-M312 HydrophobicContact CG1-CE 3.55Å; V308-M312 HydrophobicContact CG1-SD 4.14Å; V308-M312 WeakPolarHBondContact O-CB 3.44Å; V308-M312 WeakPolarHBondContact O-CG 3.43Å; V308-M312 PolarHBondContact O-N 3.07Å; E309-M312 CarbonylContact O-C 3.6Å; E309-M312 WeakPolarHBondContact O-CA 3.22Å; E309-M312 WeakPolarHBondContact O-CB 3.31Å; E309-M312 PolarHBondContact O-N 3.32Å; E310-M312 VanDerWaalsContact C-N 3.26Å; E310-M312 PolarHBondContact O-N 3.42Å
313A54.2Low48.3Very low81 Ų81106.2 Ų106.267%0.66955%0.546SS*.Hα-helixtrans-76.2-30.3177.300000113.1E309 E310E309-A313 PolarHBondContact O-N 3.44Å; E310-A313 PolarHBondContact O-N 3.48Å
314D49.7Very low48.1Very low80 Ų80105.1 Ų105.143%0.42855%0.549SS..  trans-13498.6177.1-172.6-1.2000112.3E310 Q316 S317E310-D314 PolarHBondContact O-N 2.98Å; D314-Q316 PolarHBondContact O-N 2.8Å; D314-Q316 PolarHBondContact OD1-N 3.22Å; D314-S317 PolarHBondContact O-N 3.29Å; D314-S317 PolarHBondContact OD1-N 3.37Å
315P50.7Low48Very low119 Ų119105.1 Ų105.177%0.77355%0.552SS**THydrogen-bonded Turntrans-70.3-5.6178.127.5-31.9000113.9
316Q45.5Very low47.8Very low176 Ų176110.5 Ų110.582%0.82258%0.582SS**THydrogen-bonded Turntrans-107.61.1179.1-66-157.8-1900114.4D314 P318D314-Q316 PolarHBondContact O-N 2.8Å; D314-Q316 PolarHBondContact OD1-N 3.22Å; Q316-P318 VanDerWaalsContact O-CD 3.27Å; Q316-P318 WeakPolarHBondContact O-CD 3.44Å
317S40.3Very low47.4Very low71 Ų71106.1 Ų106.150%0.49758%0.577SS.*  trans-73.1115.6175.9173.20000111.5D314D314-S317 PolarHBondContact O-N 3.29Å; D314-S317 PolarHBondContact OD1-N 3.37Å
318P39Very low47Very low110 Ų110105.9 Ų105.971%0.71459%0.59SS**  trans-72.8129.2173.929.6-29.8000109.5Q316 E320Q316-P318 VanDerWaalsContact O-CD 3.27Å; Q316-P318 WeakPolarHBondContact O-CD 3.44Å; P318-E320 PolarHBondContact O-N 2.93Å; P318-E320 VanDerWaalsContact O-N 3.15Å
319A42.8Very low46.7Very low77 Ų77110.6 Ų110.664%0.63661%0.614SS**  trans-70.8106.7175.300000110.5
320E34.8Very low46.2Very low243 Ų243114.5 Ų114.5100%1.13664%0.641SS**  trans-80.40153.2-69.4-174166.500111.2P318P318-E320 PolarHBondContact O-N 2.93Å; P318-E320 VanDerWaalsContact O-N 3.15Å

Retrieved 320 of 320 residues in 364.8 ms (Link to these results)

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