A0A2K5NN36_CERAT Loading...

Ceramide synthase 3

AlphaFold DB , UniProt , Accession A0A2K5NN36, Species CERAT (Cercocebus atys, Sooty mangabey), Gene CERS3, Length 385 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
1M67.8Low84.2Confident204 Ų204117.3 Ų117.3100%1.00553%0.526SS*.  0-57.10-157.5177.5-8600111.9W3 F5M1-W3 PolarHBondContact O-N 3.48Å; M1-F5 WeakPolarHBondContact O-CB 3.24Å; M1-F5 PolarHBondContact O-N 3.46Å
2F77.8Confident84.7Confident167 Ų167113.6 Ų113.673%0.73251%0.51SS*.Hα-helixtrans-61-43.9178.5-175.7-100.7000114.1F5 K6F2-F5 PolarHBondContact O-N 3.36Å; F2-K6 PolarHBondContact O-N 3.24Å
3W75.6Confident85Confident171 Ų171117.4 Ų117.465%0.64852%0.518SS*.Hα-helixtrans-64.8-47.5179.9-162.681000112.2M1 F5 K6 E7M1-W3 PolarHBondContact O-N 3.48Å; W3-F5 VanDerWaalsContact C-N 3.31Å; W3-F5 PolarHBondContact O-N 3.3Å; W3-K6 WeakPolarHBondContact O-CB 3.28Å; W3-K6 PolarHBondContact O-N 3.48Å; W3-K6 VanDerWaalsContact O-N 3.11Å; W3-E7 HydrophobicContact CD2-CG 4.46Å; W3-E7 HydrophobicContact CE3-CG 4.34Å; W3-E7 VanDerWaalsContact CH2-CD 3.49Å; W3-E7 WeakPolarHBondContact CH2-OE1 3.38Å; W3-E7 WeakPolarHBondContact CZ2-OE1 3.47Å; W3-E7 HydrophobicContact CZ3-CG 4.41Å; W3-E7 WeakPolarHBondContact CZ3-OE1 3.38Å; W3-E7 WeakPolarHBondContact CZ3-OE2 3.25Å; W3-E7 PolarHBondContact O-N 3Å
4T84.2Confident85.3Confident89 Ų89111.9 Ų111.955%0.54649%0.494SS..Hα-helixtrans-58.6-39.4174.4-38.70000112.6W8T4-W8 WeakPolarHBondContact O-CB 3.36Å; T4-W8 PolarHBondContact O-N 3.21Å
5F85.1Confident85.7Confident116 Ų116104.9 Ų104.951%0.50946%0.463SS..Hα-helixtrans-67.3-41.9174.9177.4-97.6000111.9M1 F2 W3 W8 F9M1-F5 WeakPolarHBondContact O-CB 3.24Å; M1-F5 PolarHBondContact O-N 3.46Å; F2-F5 PolarHBondContact O-N 3.36Å; W3-F5 VanDerWaalsContact C-N 3.31Å; W3-F5 PolarHBondContact O-N 3.3Å; F5-W8 HydrophobicContact CD2-CE3 4.07Å; F5-W8 HydrophobicContact CD2-CZ3 4.37Å; F5-W8 AromaticContact CE2-CE3 3.96Å; F5-W8 HydrophobicContact CE2-CE3 3.96Å; F5-W8 AromaticContact CE2-CZ3 3.82Å; F5-W8 HydrophobicContact CE2-CZ3 3.82Å; F5-W8 PolarHBondContact O-N 3.16Å; F5-F9 HydrophobicContact CE1-CB 4.44Å; F5-F9 HydrophobicContact CZ-CD2 4.34Å; F5-F9 VanDerWaalsContact O-CB 3.24Å; F5-F9 WeakPolarHBondContact O-CB 3.42Å; F5-F9 PolarHBondContact O-N 3.01Å
6K86.3Confident86Confident114 Ų11498.5 Ų98.550%0.49644%0.435SS..Hα-helixtrans-59.4-47.9176.6-178-175.5175.2-173.60111.1F2 W3 F9 W10F2-K6 PolarHBondContact O-N 3.24Å; W3-K6 WeakPolarHBondContact O-CB 3.28Å; W3-K6 PolarHBondContact O-N 3.48Å; W3-K6 VanDerWaalsContact O-N 3.11Å; K6-F9 PolarHBondContact O-N 3.4Å; K6-W10 PolarHBondContact O-N 2.98Å
7E87.7Confident86.1Confident98 Ų9893.1 Ų93.146%0.45841%0.412SS..Hα-helixtrans-62.4-44.7177.7-68.1-173136.900112.1W3 F9 W10 L11W3-E7 HydrophobicContact CD2-CG 4.46Å; W3-E7 HydrophobicContact CE3-CG 4.34Å; W3-E7 VanDerWaalsContact CH2-CD 3.49Å; W3-E7 WeakPolarHBondContact CH2-OE1 3.38Å; W3-E7 WeakPolarHBondContact CZ2-OE1 3.47Å; W3-E7 HydrophobicContact CZ3-CG 4.41Å; W3-E7 WeakPolarHBondContact CZ3-OE1 3.38Å; W3-E7 WeakPolarHBondContact CZ3-OE2 3.25Å; W3-E7 PolarHBondContact O-N 3Å; E7-F9 VanDerWaalsContact C-N 3.35Å; E7-F9 PolarHBondContact O-N 3.49Å; E7-W10 PolarHBondContact O-N 3.46Å; E7-L11 PolarHBondContact O-N 3.39Å
8W91Very high86Confident132 Ų13293.6 Ų93.650%0.543%0.425SS..Hα-helixtrans-61.8-41.8176.4174.684.5000112.5T4 F5 L11 F14T4-W8 WeakPolarHBondContact O-CB 3.36Å; T4-W8 PolarHBondContact O-N 3.21Å; F5-W8 HydrophobicContact CD2-CE3 4.07Å; F5-W8 HydrophobicContact CD2-CZ3 4.37Å; F5-W8 AromaticContact CE2-CE3 3.96Å; F5-W8 HydrophobicContact CE2-CE3 3.96Å; F5-W8 AromaticContact CE2-CZ3 3.82Å; F5-W8 HydrophobicContact CE2-CZ3 3.82Å; F5-W8 PolarHBondContact O-N 3.16Å; W8-L11 HydrophobicContact CG-CD1 4.46Å; W8-L11 WeakPolarHBondContact O-CB 3.37Å; W8-L11 WeakPolarHBondContact O-CD1 3.41Å; W8-L11 WeakPolarHBondContact O-CG 3.2Å; W8-L11 PolarHBondContact O-N 3.13Å; W8-F14 HydrophobicContact CD2-CE2 4.42Å; W8-F14 AromaticContact CE2-CE2 3.97Å; W8-F14 HydrophobicContact CZ2-CE2 4.15Å; W8-F14 HydrophobicContact CZ2-CZ 4.21Å; W8-F14 WeakPolarHBondContact O-CE2 3.43Å
9F88.8Confident85.9Confident66 Ų6695.1 Ų95.129%0.28944%0.443SS..Hα-helixtrans-66.4-39.1-179.7-178.2-96.4000111.8F5 K6 E7 L11 W15F5-F9 HydrophobicContact CE1-CB 4.44Å; F5-F9 HydrophobicContact CZ-CD2 4.34Å; F5-F9 VanDerWaalsContact O-CB 3.24Å; F5-F9 WeakPolarHBondContact O-CB 3.42Å; F5-F9 PolarHBondContact O-N 3.01Å; K6-F9 PolarHBondContact O-N 3.4Å; E7-F9 VanDerWaalsContact C-N 3.35Å; E7-F9 PolarHBondContact O-N 3.49Å; F9-L11 VanDerWaalsContact C-N 3.31Å; F9-L11 PolarHBondContact O-N 3.02Å; F9-W15 HydrophobicContact CD1-CZ2 4.22Å; F9-W15 HydrophobicContact CE1-CH2 4.25Å; F9-W15 AromaticContact CE1-CZ2 3.45Å; F9-W15 HydrophobicContact CE1-CZ2 3.45Å; F9-W15 VanDerWaalsContact CE1-CZ2 3.45Å; F9-W15 HydrophobicContact CE2-CZ2 4.19Å; F9-W15 HydrophobicContact CZ-CH2 4.08Å; F9-W15 AromaticContact CZ-CZ2 3.45Å; F9-W15 HydrophobicContact CZ-CZ2 3.45Å; F9-W15 VanDerWaalsContact CZ-CZ2 3.45Å; F9-W15 PolarHBondContact O-NE1 3.2Å
10W90.7Very high86Confident67 Ų6791.6 Ų91.625%0.25443%0.427SS..THydrogen-bonded Turntrans-8914.9-179.2-70.8109.7000114.4K6 E7 E12 W15 W22 P36 C224K6-W10 PolarHBondContact O-N 2.98Å; E7-W10 PolarHBondContact O-N 3.46Å; W10-E12 PolarHBondContact O-N 3.29Å; W10-W15 HydrophobicContact CZ3-CD2 4.18Å; W10-W15 HydrophobicContact CZ3-CZ2 4.34Å; W10-W22 HydrophobicContact CE3-CH2 4.18Å; W10-W22 AromaticContact CE3-CZ2 3.72Å; W10-W22 HydrophobicContact CE3-CZ2 3.72Å; W10-W22 HydrophobicContact CZ3-CH2 4.05Å; W10-W22 HydrophobicContact CZ3-CZ2 4.05Å; W10-W22 PolarHBondContact O-NE1 3.07Å; W10-P36 HydrophobicContact CE3-CG 4.47Å; W10-P36 HydrophobicContact CH2-CB 3.49Å; W10-P36 VanDerWaalsContact CH2-CB 3.49Å; W10-P36 HydrophobicContact CH2-CG 3.18Å; W10-P36 HydrophobicContact CZ2-CB 3.68Å; W10-P36 HydrophobicContact CZ2-CG 3.75Å; W10-P36 HydrophobicContact CZ3-CB 4.39Å; W10-P36 HydrophobicContact CZ3-CG 3.6Å; W10-C224 HydrophobicContact CH2-CB 4.06Å; W10-C224 HydrophobicContact CZ3-CB 4.26Å
11L91.1Very high86.2Confident66 Ų6692.8 Ų92.835%0.34643%0.431SS..  trans-56.8130.4173.2-73.1172.4000111E7 W8 F9 R13 F14E7-L11 PolarHBondContact O-N 3.39Å; W8-L11 HydrophobicContact CG-CD1 4.46Å; W8-L11 WeakPolarHBondContact O-CB 3.37Å; W8-L11 WeakPolarHBondContact O-CD1 3.41Å; W8-L11 WeakPolarHBondContact O-CG 3.2Å; W8-L11 PolarHBondContact O-N 3.13Å; F9-L11 VanDerWaalsContact C-N 3.31Å; F9-L11 PolarHBondContact O-N 3.02Å; L11-R13 VanDerWaalsContact C-N 3.26Å; L11-R13 HydrophobicContact CB-CG 4.23Å; L11-R13 PolarHBondContact O-N 3.48Å; L11-F14 HydrophobicContact CB-CD2 3.89Å; L11-F14 HydrophobicContact CB-CE2 4.24Å; L11-F14 HydrophobicContact CD1-CD2 4.48Å; L11-F14 HydrophobicContact CD1-CE2 3.99Å; L11-F14 PolarHBondContact O-N 2.82Å
12E90.4Very high87.3Confident73 Ų7386.1 Ų86.134%0.34139%0.394SS..Hα-helixtrans-52.9-42.6-175.2-66.5172.216000112.4W10 F14 W15 L16 K21 W22W10-E12 PolarHBondContact O-N 3.29Å; E12-F14 PolarHBondContact O-N 3.17Å; E12-W15 PolarHBondContact O-N 3.16Å; E12-L16 PolarHBondContact O-N 2.99Å; E12-K21 WeakPolarHBondContact OE1-CA 3.29Å; E12-K21 VanDerWaalsContact OE1-CB 3.27Å; E12-K21 WeakPolarHBondContact OE1-CB 3.43Å; E12-K21 WeakPolarHBondContact OE1-CG 3.48Å; E12-W22 HydrophobicContact CG-CG 4.38Å; E12-W22 PolarHBondContact OE1-N 3.33Å
13R88.3Confident87.8Confident163 Ų16381.5 Ų81.562%0.61538%0.383SS*.Hα-helixtrans-55.2-2317871.4177.3-179.4-172.1-4.2115L11L11-R13 VanDerWaalsContact C-N 3.26Å; L11-R13 HydrophobicContact CB-CG 4.23Å; L11-R13 PolarHBondContact O-N 3.48Å
14F90.1Very high88.3Confident41 Ų4175.8 Ų75.818%0.1837%0.365CS..Hα-helixtrans-86.3-25-179.8-67.7-39.6000112.6W8 L11 E12 F299 S300W8-F14 HydrophobicContact CD2-CE2 4.42Å; W8-F14 AromaticContact CE2-CE2 3.97Å; W8-F14 HydrophobicContact CZ2-CE2 4.15Å; W8-F14 HydrophobicContact CZ2-CZ 4.21Å; W8-F14 WeakPolarHBondContact O-CE2 3.43Å; L11-F14 HydrophobicContact CB-CD2 3.89Å; L11-F14 HydrophobicContact CB-CE2 4.24Å; L11-F14 HydrophobicContact CD1-CD2 4.48Å; L11-F14 HydrophobicContact CD1-CE2 3.99Å; L11-F14 PolarHBondContact O-N 2.82Å; E12-F14 PolarHBondContact O-N 3.17Å; F14-F299 HydrophobicContact CB-CB 4.36Å; F14-F299 HydrophobicContact CB-CD1 4.15Å; F14-F299 HydrophobicContact CD1-CB 3.94Å; F14-F299 HydrophobicContact CD1-CD1 4.45Å; F14-F299 HydrophobicContact CD1-CG 4.17Å; F14-S300 VanDerWaalsContact O-CB 3.25Å; F14-S300 WeakPolarHBondContact O-CB 2.96Å; F14-S300 PolarHBondContact O-N 2.99Å; F14-S300 PolarHBondContact O-OG 3.21Å
15W90.3Very high88.5Confident6 Ų672.2 Ų72.22%0.02334%0.343CS..Hα-helixtrans-118.8-28.2-168-66.693.2000114.3F9 W10 E12 W22 F221 C224 A225 F298 S300F9-W15 HydrophobicContact CD1-CZ2 4.22Å; F9-W15 HydrophobicContact CE1-CH2 4.25Å; F9-W15 AromaticContact CE1-CZ2 3.45Å; F9-W15 HydrophobicContact CE1-CZ2 3.45Å; F9-W15 VanDerWaalsContact CE1-CZ2 3.45Å; F9-W15 HydrophobicContact CE2-CZ2 4.19Å; F9-W15 HydrophobicContact CZ-CH2 4.08Å; F9-W15 AromaticContact CZ-CZ2 3.45Å; F9-W15 HydrophobicContact CZ-CZ2 3.45Å; F9-W15 VanDerWaalsContact CZ-CZ2 3.45Å; F9-W15 PolarHBondContact O-NE1 3.2Å; W10-W15 HydrophobicContact CZ3-CD2 4.18Å; W10-W15 HydrophobicContact CZ3-CZ2 4.34Å; E12-W15 PolarHBondContact O-N 3.16Å; W15-W22 HydrophobicContact CB-CH2 3.57Å; W15-W22 HydrophobicContact CB-CZ2 3.33Å; W15-W22 AromaticContact CD1-CZ2 3.89Å; W15-W22 HydrophobicContact CD2-CZ2 4.44Å; W15-W22 AromaticContact CG-CH2 3.98Å; W15-W22 HydrophobicContact CG-CH2 3.98Å; W15-W22 AromaticContact CG-CZ2 3.59Å; W15-W22 HydrophobicContact CG-CZ2 3.59Å; W15-F221 AromaticContact CH2-CD1 3.46Å; W15-F221 HydrophobicContact CH2-CD1 3.46Å; W15-F221 VanDerWaalsContact CH2-CD1 3.46Å; W15-F221 AromaticContact CH2-CE1 3.27Å; W15-F221 HydrophobicContact CH2-CE1 3.27Å; W15-F221 HydrophobicContact CH2-CG 4.17Å; W15-F221 AromaticContact CH2-CZ 3.86Å; W15-F221 HydrophobicContact CH2-CZ 3.86Å; W15-F221 HydrophobicContact CZ2-CD1 4.49Å; W15-F221 AromaticContact CZ2-CE1 3.95Å; W15-F221 HydrophobicContact CZ2-CE1 3.95Å; W15-F221 HydrophobicContact CZ2-CZ 4.44Å; W15-F221 AromaticContact CZ3-CD1 3.5Å; W15-F221 HydrophobicContact CZ3-CD1 3.5Å; W15-F221 AromaticContact CZ3-CE1 3.81Å; W15-F221 HydrophobicContact CZ3-CE1 3.81Å; W15-F221 HydrophobicContact CZ3-CG 4.21Å; W15-C224 HydrophobicContact CE3-CB 3.87Å; W15-C224 HydrophobicContact CH2-CB 4.03Å; W15-C224 HydrophobicContact CZ3-CB 3.39Å; W15-A225 HydrophobicContact CE3-CB 4.25Å; W15-F298 WeakPolarHBondContact O-CE2 3.45Å; W15-S300 WeakPolarHBondContact CA-OG 3.39Å; W15-S300 PolarHBondContact O-OG 3Å
16L90.4Very high88.7Confident3 Ų372.8 Ų72.82%0.01635%0.347CS..SBendtrans-122.7155.6-170.3-58.3175.9000111E12 I20 W22 L25E12-L16 PolarHBondContact O-N 2.99Å; L16-I20 HydrophobicContact CD1-CG2 4.37Å; L16-W22 HydrophobicContact CD1-CD2 3.72Å; L16-W22 HydrophobicContact CD1-CE3 3.89Å; L16-W22 HydrophobicContact CD1-CG 4.08Å; L16-W22 HydrophobicContact CD1-CZ2 4.44Å; L16-W22 HydrophobicContact CD1-CZ3 4.31Å; L16-W22 HydrophobicContact CD2-CE3 4.36Å; L16-W22 HydrophobicContact CD2-CH2 4.23Å; L16-W22 HydrophobicContact CD2-CZ3 4.02Å; L16-W22 HydrophobicContact CG-CD2 4.43Å; L16-W22 HydrophobicContact CG-CE3 4.41Å; L16-W22 HydrophobicContact CG-CH2 4.29Å; L16-W22 HydrophobicContact CG-CZ2 4.32Å; L16-W22 HydrophobicContact CG-CZ3 4.33Å; L16-L25 HydrophobicContact CD1-CD1 4.39Å; L16-L25 HydrophobicContact CD2-CD1 3.59Å
17P88.8Confident88.9Confident7 Ų770.7 Ų70.75%0.04534%0.341CS..  trans-57.9153.4168.2-22.333.7000112.1T19 I20 Y169 P170 L295 F298P17-T19 PolarHBondContact O-N 2.93Å; P17-I20 PolarHBondContact O-N 3.34Å; P17-I20 VanDerWaalsContact O-N 3.09Å; P17-Y169 HydrophobicContact CG-CE1 4.07Å; P17-P170 HydrophobicContact CG-CG 4.21Å; P17-L295 HydrophobicContact CB-CD2 4.29Å; P17-L295 HydrophobicContact CG-CD2 4.08Å; P17-F298 HydrophobicContact CB-CE1 4.46Å; P17-F298 HydrophobicContact CG-CE1 3.93Å; P17-F298 HydrophobicContact CG-CZ 4.2Å
18P83.5Confident88.9Confident101 Ų10169.9 Ų69.966%0.65634%0.337SS*.THydrogen-bonded Turntrans-56.4-21.5-171.5-27.234.6000116.3
19T84Confident88.6Confident123 Ų12370.8 Ų70.876%0.75535%0.352SS*.THydrogen-bonded Turntrans-98.7-3.1-174.753.10000114.2P17P17-T19 PolarHBondContact O-N 2.93Å
20I88.3Confident88.4Confident25 Ų2571.5 Ų71.513%0.12838%0.378CS..  trans-117.4139.6-171.7-56.9-64.3000110.9L16 P17 D24 P170L16-I20 HydrophobicContact CD1-CG2 4.37Å; P17-I20 PolarHBondContact O-N 3.34Å; P17-I20 VanDerWaalsContact O-N 3.09Å; I20-D24 HydrophobicContact CG2-CB 4.17Å; I20-P170 HydrophobicContact CB-CG 4.17Å; I20-P170 HydrophobicContact CG1-CG 3.81Å; I20-P170 HydrophobicContact CG2-CG 3.84Å
21K90.2Very high88.2Confident116 Ų11671.8 Ų71.850%0.50438%0.384SS..  trans-111161.4176.9-63.9-168.6177.9-179.50112.1E12 S23 D24E12-K21 WeakPolarHBondContact OE1-CA 3.29Å; E12-K21 VanDerWaalsContact OE1-CB 3.27Å; E12-K21 WeakPolarHBondContact OE1-CB 3.43Å; E12-K21 WeakPolarHBondContact OE1-CG 3.48Å; K21-S23 PolarHBondContact O-N 3.41Å; K21-D24 PolarHBondContact N-OD2 3.41Å; K21-D24 WeakPolarHBondContact O-CB 3.46Å; K21-D24 PolarHBondContact O-N 3.16Å
22W89.9Confident88.3Confident64 Ų6471.8 Ų71.824%0.24239%0.386CS..G310 helixtrans-60.3-31.8174.1-70.4118.3000112.8W10 E12 W15 L16 D24 L25W10-W22 HydrophobicContact CE3-CH2 4.18Å; W10-W22 AromaticContact CE3-CZ2 3.72Å; W10-W22 HydrophobicContact CE3-CZ2 3.72Å; W10-W22 HydrophobicContact CZ3-CH2 4.05Å; W10-W22 HydrophobicContact CZ3-CZ2 4.05Å; W10-W22 PolarHBondContact O-NE1 3.07Å; E12-W22 HydrophobicContact CG-CG 4.38Å; E12-W22 PolarHBondContact OE1-N 3.33Å; W15-W22 HydrophobicContact CB-CH2 3.57Å; W15-W22 HydrophobicContact CB-CZ2 3.33Å; W15-W22 AromaticContact CD1-CZ2 3.89Å; W15-W22 HydrophobicContact CD2-CZ2 4.44Å; W15-W22 AromaticContact CG-CH2 3.98Å; W15-W22 HydrophobicContact CG-CH2 3.98Å; W15-W22 AromaticContact CG-CZ2 3.59Å; W15-W22 HydrophobicContact CG-CZ2 3.59Å; L16-W22 HydrophobicContact CD1-CD2 3.72Å; L16-W22 HydrophobicContact CD1-CE3 3.89Å; L16-W22 HydrophobicContact CD1-CG 4.08Å; L16-W22 HydrophobicContact CD1-CZ2 4.44Å; L16-W22 HydrophobicContact CD1-CZ3 4.31Å; L16-W22 HydrophobicContact CD2-CE3 4.36Å; L16-W22 HydrophobicContact CD2-CH2 4.23Å; L16-W22 HydrophobicContact CD2-CZ3 4.02Å; L16-W22 HydrophobicContact CG-CD2 4.43Å; L16-W22 HydrophobicContact CG-CE3 4.41Å; L16-W22 HydrophobicContact CG-CH2 4.29Å; L16-W22 HydrophobicContact CG-CZ2 4.32Å; L16-W22 HydrophobicContact CG-CZ3 4.33Å; W22-D24 PolarHBondContact O-N 3Å; W22-L25 HydrophobicContact CE3-CD1 4.22Å; W22-L25 HydrophobicContact CZ3-CD1 4.31Å; W22-L25 PolarHBondContact O-N 3.34Å
23S88.4Confident88.3Confident70 Ų7068.7 Ų68.749%0.4937%0.372SS..G310 helixtrans-62.1-25.9175.556.60000113.3K21 L25K21-S23 PolarHBondContact O-N 3.41Å; S23-L25 PolarHBondContact O-N 2.64Å
24D86.8Confident88.5Confident52 Ų5261.6 Ų61.628%0.27835%0.346SS..G310 helixtrans-75.9-10.3177-59.4-48.2000112.8I20 K21 W22I20-D24 HydrophobicContact CG2-CB 4.17Å; K21-D24 PolarHBondContact N-OD2 3.41Å; K21-D24 WeakPolarHBondContact O-CB 3.46Å; K21-D24 PolarHBondContact O-N 3.16Å; W22-D24 PolarHBondContact O-N 3Å
25L88.4Confident88.5Confident14 Ų1463.1 Ų63.17%0.07335%0.353CS..G310 helixtrans-11420.5-178.8-57.5177.8000111.6L16 W22 S23 Y33 P170 K171L16-L25 HydrophobicContact CD1-CD1 4.39Å; L16-L25 HydrophobicContact CD2-CD1 3.59Å; W22-L25 HydrophobicContact CE3-CD1 4.22Å; W22-L25 HydrophobicContact CZ3-CD1 4.31Å; W22-L25 PolarHBondContact O-N 3.34Å; S23-L25 PolarHBondContact O-N 2.64Å; L25-Y33 HydrophobicContact CD2-CD1 4.15Å; L25-Y33 HydrophobicContact CD2-CE1 4.31Å; L25-Y33 WeakPolarHBondContact O-CB 3.47Å; L25-P170 WeakPolarHBondContact CD2-O 3.46Å; L25-K171 HydrophobicContact CD2-CG 4.28Å
26E88.9Confident88.5Confident127 Ų12764.8 Ų64.859%0.59337%0.365SS*.SBendtrans-82.6152.3169.6-68.8-174.7175.200110.7H28 Y33E26-H28 PolarHBondContact O-N 3.09Å; E26-H28 PolarHBondContact O-ND1 3.47Å; E26-Y33 VanDerWaalsContact O-CD2 3.31Å; E26-Y33 WeakPolarHBondContact O-CD2 3.27Å
27D90.9Very high88.6Confident71 Ų7167.6 Ų67.638%0.3838%0.384SS..  trans-64.2124.1179.6-57.2-20000109.9L31 V32 Y33 K35D27-L31 VanDerWaalsContact CA-O 3.3Å; D27-L31 WeakPolarHBondContact CA-O 3.38Å; D27-V32 WeakPolarHBondContact OD1-CA 3.32Å; D27-Y33 PolarHBondContact OD1-N 3.4Å; D27-K35 IonicContact OD1-NZ 3.56Å; D27-K35 WeakPolarHBondContact OD2-CE 3.43Å; D27-K35 IonicContact OD2-NZ 3.22Å; D27-K35 PolarHBondContact OD2-NZ 2.85Å
28H87.3Confident88.7Confident80 Ų8069.1 Ų69.137%0.3739%0.391SS..BIsolated β-bridgetrans-148.6153.7178.660.4-79.7000109.9E26 G30 L31 Y33E26-H28 PolarHBondContact O-N 3.09Å; E26-H28 PolarHBondContact O-ND1 3.47Å; H28-G30 PolarHBondContact O-N 2.76Å; H28-L31 PolarHBondContact N-O 3.11Å; H28-L31 WeakPolarHBondContact O-CA 3.38Å; H28-L31 VanDerWaalsContact O-CB 3.31Å; H28-L31 WeakPolarHBondContact O-CB 3.23Å; H28-L31 PolarHBondContact O-N 2.88Å; H28-Y33 AromaticContact CE1-CE2 3.43Å; H28-Y33 VanDerWaalsContact CE1-CE2 3.43Å; H28-Y33 WeakPolarHBondContact CE1-CE2 3.38Å; H28-Y33 AromaticContact CE1-CZ 3.84Å; H28-Y33 AromaticContact ND1-CE2 3.65Å
29D84.4Confident89.2Confident152 Ų15265.4 Ų65.481%0.81337%0.366SS*.THydrogen-bonded Turntrans52.830.5174.8-56.4-32.6000115L31D29-L31 PolarHBondContact O-N 3.01Å
30G84.5Confident89.7Confident81 Ų8168.1 Ų68.184%0.83536%0.363SS*.THydrogen-bonded Turntrans76.40-176.500000114.7H28H28-G30 PolarHBondContact O-N 2.76Å
31L87.8Confident90Very high72 Ų7270.7 Ų70.738%0.37738%0.376SS..BIsolated β-bridgetrans-82.3128.1170.6-57.4178.2000109.6D27 H28 D29 Y33 P173D27-L31 VanDerWaalsContact CA-O 3.3Å; D27-L31 WeakPolarHBondContact CA-O 3.38Å; H28-L31 PolarHBondContact N-O 3.11Å; H28-L31 WeakPolarHBondContact O-CA 3.38Å; H28-L31 VanDerWaalsContact O-CB 3.31Å; H28-L31 WeakPolarHBondContact O-CB 3.23Å; H28-L31 PolarHBondContact O-N 2.88Å; D29-L31 PolarHBondContact O-N 3.01Å; L31-Y33 HydrophobicContact CB-CE2 3.87Å; L31-P173 HydrophobicContact CB-CB 4.39Å; L31-P173 HydrophobicContact CD2-CB 4.13Å; L31-P173 HydrophobicContact CD2-CG 4.42Å
32V92.1Very high90.2Very high66 Ų6665.3 Ų65.340%0.435%0.353SS..  trans-101.6135.6175.5-179.30000108.5D27 L174D27-V32 WeakPolarHBondContact OD1-CA 3.32Å; V32-L174 WeakPolarHBondContact O-CB 3.48Å; V32-L174 PolarHBondContact O-N 2.87Å
33Y91.6Very high90.5Very high8 Ų865 Ų653%0.03136%0.355CS..  trans-113.6162.6177.6-70.4-86.9000111.7L25 E26 D27 H28 L31 K35L25-Y33 HydrophobicContact CD2-CD1 4.15Å; L25-Y33 HydrophobicContact CD2-CE1 4.31Å; L25-Y33 WeakPolarHBondContact O-CB 3.47Å; E26-Y33 VanDerWaalsContact O-CD2 3.31Å; E26-Y33 WeakPolarHBondContact O-CD2 3.27Å; D27-Y33 PolarHBondContact OD1-N 3.4Å; H28-Y33 AromaticContact CE1-CE2 3.43Å; H28-Y33 VanDerWaalsContact CE1-CE2 3.43Å; H28-Y33 WeakPolarHBondContact CE1-CE2 3.38Å; H28-Y33 AromaticContact CE1-CZ 3.84Å; H28-Y33 AromaticContact ND1-CE2 3.65Å; L31-Y33 HydrophobicContact CB-CE2 3.87Å; Y33-K35 PolarHBondContact O-N 2.85Å
34V91.2Very high90.9Very high14 Ų1465 Ų659%0.08535%0.354CS..  trans-68.9132.7178-67.70000110.7L174 W223 N226 I228V34-L174 HydrophobicContact CG1-CB 4.18Å; V34-L174 HydrophobicContact CG1-CD1 3.97Å; V34-L174 HydrophobicContact CG1-CD2 4.16Å; V34-L174 HydrophobicContact CG1-CG 4.32Å; V34-W223 HydrophobicContact CB-CZ2 4.49Å; V34-W223 HydrophobicContact CG1-CD2 4.36Å; V34-W223 HydrophobicContact CG1-CH2 4.35Å; V34-W223 HydrophobicContact CG1-CZ2 4.15Å; V34-W223 WeakPolarHBondContact CG2-O 3.46Å; V34-N226 HydrophobicContact CG2-CB 3.57Å; V34-N226 WeakPolarHBondContact CG2-OD1 3.43Å; V34-I228 HydrophobicContact CG1-CD1 3.9Å; V34-I228 HydrophobicContact CG1-CG1 3.68Å
35K91.8Very high91.3Very high73 Ų7365.5 Ų65.532%0.31735%0.352SS..  trans-120.8138.3174.5-60.2176.5-171.2172.20109.1D27 Y33 S37 H38 W223D27-K35 IonicContact OD1-NZ 3.56Å; D27-K35 WeakPolarHBondContact OD2-CE 3.43Å; D27-K35 IonicContact OD2-NZ 3.22Å; D27-K35 PolarHBondContact OD2-NZ 2.85Å; Y33-K35 PolarHBondContact O-N 2.85Å; K35-S37 WeakPolarHBondContact CB-OG 3.49Å; K35-S37 PolarHBondContact O-N 2.94Å; K35-S37 VanDerWaalsContact O-N 3.14Å; K35-H38 PolarHBondContact N-ND1 3.35Å; K35-H38 VanDerWaalsContact O-CB 3.3Å; K35-H38 WeakPolarHBondContact O-CB 3.48Å; K35-H38 PolarHBondContact O-N 2.98Å; K35-W223 PolarHBondContact O-NE1 3.24Å
36P90.3Very high91.7Very high42 Ų4264.8 Ų64.827%0.27335%0.348SS..G310 helixtrans-56.8-29.1174.8-26.935.2000113.1W10 H38 L39W10-P36 HydrophobicContact CE3-CG 4.47Å; W10-P36 HydrophobicContact CH2-CB 3.49Å; W10-P36 VanDerWaalsContact CH2-CB 3.49Å; W10-P36 HydrophobicContact CH2-CG 3.18Å; W10-P36 HydrophobicContact CZ2-CB 3.68Å; W10-P36 HydrophobicContact CZ2-CG 3.75Å; W10-P36 HydrophobicContact CZ3-CB 4.39Å; W10-P36 HydrophobicContact CZ3-CG 3.6Å; P36-H38 PolarHBondContact O-N 3.25Å; P36-L39 WeakPolarHBondContact O-CB 3.47Å; P36-L39 PolarHBondContact O-N 3.09Å; P36-L39 VanDerWaalsContact O-N 3.13Å
37S90.9Very high92Very high61 Ų6164 Ų6443%0.42734%0.343SS..G310 helixtrans-61.4-25.9176.855.20000113.7K35 L39 Y40K35-S37 WeakPolarHBondContact CB-OG 3.49Å; K35-S37 PolarHBondContact O-N 2.94Å; K35-S37 VanDerWaalsContact O-N 3.14Å; S37-L39 PolarHBondContact O-N 3.02Å; S37-Y40 WeakPolarHBondContact O-CB 3.4Å; S37-Y40 WeakPolarHBondContact O-CD2 3.3Å; S37-Y40 PolarHBondContact O-N 3.45Å; S37-Y40 VanDerWaalsContact O-N 3.14Å
38H92.8Very high92.3Very high39 Ų3964.5 Ų64.518%0.18135%0.345CS..G310 helixtrans-61.5-30.9176.4-62.4164.5000111.8K35 P36 Y40 M41 Y179 I183 W223K35-H38 PolarHBondContact N-ND1 3.35Å; K35-H38 VanDerWaalsContact O-CB 3.3Å; K35-H38 WeakPolarHBondContact O-CB 3.48Å; K35-H38 PolarHBondContact O-N 2.98Å; P36-H38 PolarHBondContact O-N 3.25Å; H38-Y40 PolarHBondContact O-N 3.07Å; H38-M41 WeakPolarHBondContact O-CB 3.49Å; H38-M41 PolarHBondContact O-N 3.3Å; H38-M41 VanDerWaalsContact O-N 3.07Å; H38-Y179 HydrophobicContact CB-CE2 3.97Å; H38-I183 WeakPolarHBondContact O-CD1 3.31Å; H38-W223 HydrophobicContact CB-CZ2 3.65Å; H38-W223 AromaticContact CG-CZ2 3.99Å; H38-W223 AromaticContact ND1-CZ2 3.53Å
39L93.4Very high92.7Very high24 Ų2461.4 Ų61.413%0.12633%0.331CS..G310 helixtrans-64.9-23.2178.8-62.2-175.9000112.8P36 S37 M41 T42 M186 W223P36-L39 WeakPolarHBondContact O-CB 3.47Å; P36-L39 PolarHBondContact O-N 3.09Å; P36-L39 VanDerWaalsContact O-N 3.13Å; S37-L39 PolarHBondContact O-N 3.02Å; L39-M41 PolarHBondContact O-N 3.01Å; L39-T42 WeakPolarHBondContact O-CB 3.45Å; L39-T42 WeakPolarHBondContact O-CG2 3.48Å; L39-T42 PolarHBondContact O-N 3.39Å; L39-T42 PolarHBondContact O-OG1 3.36Å; L39-M186 HydrophobicContact CD2-CE 3.67Å; L39-M186 HydrophobicContact CD2-SD 3.82Å; L39-W223 HydrophobicContact CD1-CB 4.34Å; L39-W223 HydrophobicContact CD1-CG 4.39Å; L39-W223 HydrophobicContact CD2-CB 3.88Å; L39-W223 HydrophobicContact CD2-CD2 4.06Å; L39-W223 HydrophobicContact CD2-CG 3.55Å; L39-W223 HydrophobicContact CG-CB 4.45Å; L39-W223 HydrophobicContact CG-CG 4.05Å
40Y93.4Very high93.2Very high179 Ų17955.7 Ų55.770%0.70230%0.3SS*.G310 helixtrans-62.7-24174.7-61.6-43.2000112.7S37 H38 T42 P44S37-Y40 WeakPolarHBondContact O-CB 3.4Å; S37-Y40 WeakPolarHBondContact O-CD2 3.3Å; S37-Y40 PolarHBondContact O-N 3.45Å; S37-Y40 VanDerWaalsContact O-N 3.14Å; H38-Y40 PolarHBondContact O-N 3.07Å; Y40-T42 PolarHBondContact O-N 2.88Å; Y40-P44 WeakPolarHBondContact O-CD 3.46Å
41M94.3Very high93.8Very high80 Ų8056.8 Ų56.839%0.39429%0.286SS..G310 helixtrans-69.3-22175.9-62.3-60.8-77.800112.4H38 L39 I43 P44 Y45H38-M41 WeakPolarHBondContact O-CB 3.49Å; H38-M41 PolarHBondContact O-N 3.3Å; H38-M41 VanDerWaalsContact O-N 3.07Å; L39-M41 PolarHBondContact O-N 3.01Å; M41-I43 VanDerWaalsContact C-N 3.26Å; M41-I43 PolarHBondContact O-N 3.42Å; M41-P44 WeakPolarHBondContact O-CD 3.44Å; M41-P44 VanDerWaalsContact O-CG 3.23Å; M41-P44 WeakPolarHBondContact O-CG 3.42Å; M41-Y45 HydrophobicContact CB-CD2 4.17Å; M41-Y45 HydrophobicContact CB-CE2 4.16Å; M41-Y45 HydrophobicContact CE-CE2 4.06Å; M41-Y45 WeakPolarHBondContact O-CD2 3.47Å; M41-Y45 PolarHBondContact O-N 2.86Å
42T95.9Very high94.2Very high3 Ų356.9 Ų56.92%0.01829%0.286CS..Hα-helixtrans-66.3-29.4-178.265.10000112.9L39 Y40 A46 I183 M186 S187 W190L39-T42 WeakPolarHBondContact O-CB 3.45Å; L39-T42 WeakPolarHBondContact O-CG2 3.48Å; L39-T42 PolarHBondContact O-N 3.39Å; L39-T42 PolarHBondContact O-OG1 3.36Å; Y40-T42 PolarHBondContact O-N 2.88Å; T42-A46 VanDerWaalsContact O-CB 3.27Å; T42-A46 WeakPolarHBondContact O-CB 3.26Å; T42-A46 PolarHBondContact O-N 3.23Å; T42-I183 HydrophobicContact CG2-CD1 3.6Å; T42-I183 HydrophobicContact CG2-CG2 4.38Å; T42-M186 HydrophobicContact CG2-CB 3.96Å; T42-M186 HydrophobicContact CG2-CG 4.03Å; T42-M186 HydrophobicContact CG2-SD 3.72Å; T42-S187 WeakPolarHBondContact CA-OG 3.38Å; T42-S187 PolarHBondContact O-OG 3.02Å; T42-S187 VanDerWaalsContact O-OG 3.1Å; T42-W190 PolarHBondContact OG1-NE1 3.1Å
43I95.4Very high94.3Very high57 Ų5753.9 Ų53.929%0.29227%0.268SS..Hα-helixtrans-69.1-54.9178.6-55.9-60.4000112.5M41 Y45 A46 F47 W190 F194M41-I43 VanDerWaalsContact C-N 3.26Å; M41-I43 PolarHBondContact O-N 3.42Å; I43-Y45 VanDerWaalsContact C-N 3.29Å; I43-Y45 PolarHBondContact O-N 3.42Å; I43-A46 WeakPolarHBondContact O-CB 3.23Å; I43-A46 PolarHBondContact O-N 3.47Å; I43-A46 VanDerWaalsContact O-N 3.12Å; I43-F47 HydrophobicContact CG2-CD2 4.1Å; I43-F47 HydrophobicContact CG2-CE2 3.71Å; I43-F47 WeakPolarHBondContact O-CD2 3.32Å; I43-F47 PolarHBondContact O-N 3.46Å; I43-F47 VanDerWaalsContact O-N 3.13Å; I43-W190 HydrophobicContact CD1-CD2 3.71Å; I43-W190 HydrophobicContact CD1-CE3 4.1Å; I43-W190 HydrophobicContact CD1-CG 4.02Å; I43-W190 HydrophobicContact CD1-CZ2 4.15Å; I43-W190 HydrophobicContact CD1-CZ3 4.49Å; I43-F194 HydrophobicContact CD1-CZ 4.16Å
44P96.5Very high94.4Very high71 Ų7162.3 Ų62.346%0.46130%0.3SS..Hα-helixtrans-61.3-37.2176.222.4-31.7000112.2Y40 M41 A46 F47 L48Y40-P44 WeakPolarHBondContact O-CD 3.46Å; M41-P44 WeakPolarHBondContact O-CD 3.44Å; M41-P44 VanDerWaalsContact O-CG 3.23Å; M41-P44 WeakPolarHBondContact O-CG 3.42Å; P44-A46 VanDerWaalsContact C-N 3.34Å; P44-A46 PolarHBondContact O-N 3.3Å; P44-F47 PolarHBondContact O-N 3.16Å; P44-L48 PolarHBondContact O-N 3.12Å
45Y96.7Very high94.6Very high61 Ų6165.3 Ų65.324%0.23932%0.318CS..Hα-helixtrans-66.4-33.8173.9-78-61.8000112.7M41 I43 F47 L48 L49 W180 I183 S187M41-Y45 HydrophobicContact CB-CD2 4.17Å; M41-Y45 HydrophobicContact CB-CE2 4.16Å; M41-Y45 HydrophobicContact CE-CE2 4.06Å; M41-Y45 WeakPolarHBondContact O-CD2 3.47Å; M41-Y45 PolarHBondContact O-N 2.86Å; I43-Y45 VanDerWaalsContact C-N 3.29Å; I43-Y45 PolarHBondContact O-N 3.42Å; Y45-F47 PolarHBondContact O-N 2.88Å; Y45-L48 HydrophobicContact CD1-CD2 4.03Å; Y45-L48 HydrophobicContact CE1-CD2 4.31Å; Y45-L48 WeakPolarHBondContact O-CB 3.35Å; Y45-L48 PolarHBondContact O-N 3.44Å; Y45-L49 WeakPolarHBondContact O-CB 3.28Å; Y45-L49 WeakPolarHBondContact O-CG 3.47Å; Y45-L49 PolarHBondContact O-N 2.92Å; Y45-W180 HydrophobicContact CE1-CZ3 4.26Å; Y45-W180 HydrophobicContact CE2-CH2 4.41Å; Y45-W180 HydrophobicContact CE2-CZ3 4.05Å; Y45-W180 AromaticContact CZ-CH2 3.91Å; Y45-W180 AromaticContact CZ-CZ3 3.75Å; Y45-W180 WeakPolarHBondContact OH-CH2 3.32Å; Y45-I183 HydrophobicContact CD2-CG2 3.64Å; Y45-I183 HydrophobicContact CE2-CG2 4.12Å; Y45-I183 HydrophobicContact CG-CG2 4.43Å; Y45-S187 WeakPolarHBondContact CB-OG 3.41Å
46A96.2Very high94.9Very high0 Ų063.8 Ų63.80%031%0.311CS..Hα-helixtrans-62-42.4172.300000111.9T42 I43 P44 L49 L50 S187 W190 F194T42-A46 VanDerWaalsContact O-CB 3.27Å; T42-A46 WeakPolarHBondContact O-CB 3.26Å; T42-A46 PolarHBondContact O-N 3.23Å; I43-A46 WeakPolarHBondContact O-CB 3.23Å; I43-A46 PolarHBondContact O-N 3.47Å; I43-A46 VanDerWaalsContact O-N 3.12Å; P44-A46 VanDerWaalsContact C-N 3.34Å; P44-A46 PolarHBondContact O-N 3.3Å; A46-L49 PolarHBondContact O-N 3.29Å; A46-L50 WeakPolarHBondContact O-CG 3.33Å; A46-L50 PolarHBondContact O-N 2.99Å; A46-S187 WeakPolarHBondContact CA-O 3.49Å; A46-S187 WeakPolarHBondContact CB-O 3.32Å; A46-W190 HydrophobicContact CB-CB 3.57Å; A46-F194 HydrophobicContact CB-CD2 4.39Å; A46-F194 HydrophobicContact CB-CE2 4.02Å
47F95.9Very high95Very high111 Ų11162.9 Ų62.949%0.48730%0.303SS..Hα-helixtrans-65.7-39.6173.8-73.9-70.4000112.3I43 P44 Y45 L49 L50 I51 F194I43-F47 HydrophobicContact CG2-CD2 4.1Å; I43-F47 HydrophobicContact CG2-CE2 3.71Å; I43-F47 WeakPolarHBondContact O-CD2 3.32Å; I43-F47 PolarHBondContact O-N 3.46Å; I43-F47 VanDerWaalsContact O-N 3.13Å; P44-F47 PolarHBondContact O-N 3.16Å; Y45-F47 PolarHBondContact O-N 2.88Å; F47-L49 VanDerWaalsContact C-N 3.34Å; F47-L49 PolarHBondContact O-N 3.09Å; F47-L50 HydrophobicContact CD1-CD1 4.26Å; F47-L50 WeakPolarHBondContact O-CB 3.3Å; F47-L50 PolarHBondContact O-N 3.45Å; F47-I51 WeakPolarHBondContact O-CG1 3.41Å; F47-I51 PolarHBondContact O-N 3.41Å; F47-F194 HydrophobicContact CE1-CD2 4.44Å; F47-F194 HydrophobicContact CE2-CE2 4.1Å; F47-F194 HydrophobicContact CZ-CD2 4.35Å; F47-F194 HydrophobicContact CZ-CE2 4.06Å
48L96.6Very high95.1Very high80 Ų8066.8 Ų66.842%0.41931%0.313SS..Hα-helixtrans-60.1-45.2173.4-177.763.1000111.1P44 Y45 L50 I51 I52P44-L48 PolarHBondContact O-N 3.12Å; Y45-L48 HydrophobicContact CD1-CD2 4.03Å; Y45-L48 HydrophobicContact CE1-CD2 4.31Å; Y45-L48 WeakPolarHBondContact O-CB 3.35Å; Y45-L48 PolarHBondContact O-N 3.44Å; L48-L50 VanDerWaalsContact C-N 3.28Å; L48-L50 PolarHBondContact O-N 3.46Å; L48-I51 WeakPolarHBondContact O-CB 3.45Å; L48-I51 PolarHBondContact O-N 3.08Å; L48-I52 HydrophobicContact CD1-CD1 4.42Å; L48-I52 HydrophobicContact CD2-CD1 4.48Å; L48-I52 HydrophobicContact CG-CD1 3.93Å; L48-I52 HydrophobicContact CG-CG1 4.44Å; L48-I52 WeakPolarHBondContact O-CG1 3.33Å; L48-I52 PolarHBondContact O-N 3.21Å
49L96.2Very high95.3Very high16 Ų1671.6 Ų71.68%0.08433%0.333CS..Hα-helixtrans-60.8-35.6175.2-74.3172.4000112.1Y45 A46 F47 I51 I52 R53 W137 F141 F188Y45-L49 WeakPolarHBondContact O-CB 3.28Å; Y45-L49 WeakPolarHBondContact O-CG 3.47Å; Y45-L49 PolarHBondContact O-N 2.92Å; A46-L49 PolarHBondContact O-N 3.29Å; F47-L49 VanDerWaalsContact C-N 3.34Å; F47-L49 PolarHBondContact O-N 3.09Å; L49-I51 VanDerWaalsContact C-N 3.34Å; L49-I52 PolarHBondContact O-N 2.8Å; L49-R53 WeakPolarHBondContact O-CB 3.32Å; L49-R53 PolarHBondContact O-N 2.89Å; L49-W137 HydrophobicContact CD2-CH2 4.44Å; L49-W137 HydrophobicContact CD2-CZ2 4.37Å; L49-F141 HydrophobicContact CD1-CE2 4.37Å; L49-F141 HydrophobicContact CD2-CE2 4.36Å; L49-F188 HydrophobicContact CD1-CB 4.08Å
50L94.9Very high95.4Very high31 Ų3173.7 Ų73.716%0.16235%0.347CS..Hα-helixtrans-65.2-36.6173-70.7174.7000112.6A46 F47 L48 R54 F194A46-L50 WeakPolarHBondContact O-CG 3.33Å; A46-L50 PolarHBondContact O-N 2.99Å; F47-L50 HydrophobicContact CD1-CD1 4.26Å; F47-L50 WeakPolarHBondContact O-CB 3.3Å; F47-L50 PolarHBondContact O-N 3.45Å; L48-L50 VanDerWaalsContact C-N 3.28Å; L48-L50 PolarHBondContact O-N 3.46Å; L50-R54 WeakPolarHBondContact O-CG 3.45Å; L50-R54 PolarHBondContact O-N 3.26Å; L50-F194 HydrophobicContact CD1-CB 4.3Å; L50-F194 HydrophobicContact CD1-CD2 4.39Å
51I95.4Very high95.4Very high104 Ų10465.2 Ų65.253%0.53331%0.314SS..Hα-helixtrans-68.4-50.4174.9-64167000109.8F47 L48 L49 R53 R54 V55F47-I51 WeakPolarHBondContact O-CG1 3.41Å; F47-I51 PolarHBondContact O-N 3.41Å; L48-I51 WeakPolarHBondContact O-CB 3.45Å; L48-I51 PolarHBondContact O-N 3.08Å; L49-I51 VanDerWaalsContact C-N 3.34Å; I51-R53 PolarHBondContact O-N 3.35Å; I51-R54 PolarHBondContact O-N 3.12Å; I51-R54 VanDerWaalsContact O-N 3.1Å; I51-V55 WeakPolarHBondContact O-CG2 3.18Å; I51-V55 PolarHBondContact O-N 2.78Å; I51-V55 VanDerWaalsContact O-N 3.12Å
52I96.4Very high95.3Very high75 Ų7562.5 Ų62.539%0.38530%0.303SS..Hα-helixtrans-56.2-43.8177.3-66.2169.3000110L48 L49 R54 V55 F56 W137L48-I52 HydrophobicContact CD1-CD1 4.42Å; L48-I52 HydrophobicContact CD2-CD1 4.48Å; L48-I52 HydrophobicContact CG-CD1 3.93Å; L48-I52 HydrophobicContact CG-CG1 4.44Å; L48-I52 WeakPolarHBondContact O-CG1 3.33Å; L48-I52 PolarHBondContact O-N 3.21Å; L49-I52 PolarHBondContact O-N 2.8Å; I52-R54 PolarHBondContact O-N 3Å; I52-V55 WeakPolarHBondContact O-CB 3.41Å; I52-V55 PolarHBondContact O-N 2.86Å; I52-F56 WeakPolarHBondContact O-CB 3.37Å; I52-F56 PolarHBondContact O-N 2.67Å; I52-W137 HydrophobicContact CB-CH2 4.19Å; I52-W137 HydrophobicContact CG2-CH2 3.7Å; I52-W137 HydrophobicContact CG2-CZ3 3.86Å
53R95.3Very high95.2Very high2 Ų265.7 Ų65.71%0.00832%0.323CS..Hα-helixtrans-56.4-47.8175.8179.3173.1-175.5171.52.2112.4L49 I51 V55 F56 E57 W137 R195L49-R53 WeakPolarHBondContact O-CB 3.32Å; L49-R53 PolarHBondContact O-N 2.89Å; I51-R53 PolarHBondContact O-N 3.35Å; R53-V55 VanDerWaalsContact C-N 3.28Å; R53-V55 PolarHBondContact O-N 3.47Å; R53-F56 PolarHBondContact O-N 2.97Å; R53-E57 HydrophobicContact CG-CG 4.09Å; R53-E57 WeakPolarHBondContact CG-OE1 3.18Å; R53-E57 IonicContact CZ-OE1 2.67Å; R53-E57 IonicContact NE-OE1 2.9Å; R53-E57 PolarHBondContact NE-OE1 3.48Å; R53-E57 IonicContact NH2-OE1 3.94Å; R53-E57 PolarHBondContact NH2-OE1 2.86Å; R53-E57 WeakPolarHBondContact O-CB 3.3Å; R53-E57 VanDerWaalsContact O-CG 3.29Å; R53-E57 WeakPolarHBondContact O-CG 3.41Å; R53-E57 PolarHBondContact O-N 3.44Å; R53-W137 HydrophobicContact CB-CD2 3.81Å; R53-W137 HydrophobicContact CB-CE3 4.12Å; R53-W137 HydrophobicContact CB-CG 4.39Å; R53-W137 HydrophobicContact CB-CH2 4.07Å; R53-W137 HydrophobicContact CB-CZ2 3.76Å; R53-W137 HydrophobicContact CB-CZ3 4.25Å; R53-W137 VanDerWaalsContact CD-CD1 3.47Å; R53-W137 HydrophobicContact CG-CB 4.42Å; R53-W137 HydrophobicContact CG-CD2 3.64Å; R53-W137 HydrophobicContact CG-CE3 4.23Å; R53-W137 HydrophobicContact CG-CG 3.7Å; R53-W137 HydrophobicContact CG-CZ2 4.41Å; R53-R195 VanDerWaalsContact CD-NH2 3.25Å
54R93.2Very high95.1Very high186 Ų18665.6 Ų65.670%0.70232%0.323SS*.Hα-helixtrans-61.7-38.8179-74.9-178.1179.6168.61.9112L50 I51 I52 K58L50-R54 WeakPolarHBondContact O-CG 3.45Å; L50-R54 PolarHBondContact O-N 3.26Å; I51-R54 PolarHBondContact O-N 3.12Å; I51-R54 VanDerWaalsContact O-N 3.1Å; I52-R54 PolarHBondContact O-N 3Å; R54-K58 WeakPolarHBondContact O-CB 3.38Å; R54-K58 PolarHBondContact O-N 3.38Å
55V96.1Very high94.9Very high77 Ų7762.2 Ų62.247%0.46730%0.301SS..Hα-helixtrans-65.1-48.1174.8176.30000109.8I51 I52 R53 K58 F59I51-V55 WeakPolarHBondContact O-CG2 3.18Å; I51-V55 PolarHBondContact O-N 2.78Å; I51-V55 VanDerWaalsContact O-N 3.12Å; I52-V55 WeakPolarHBondContact O-CB 3.41Å; I52-V55 PolarHBondContact O-N 2.86Å; R53-V55 VanDerWaalsContact C-N 3.28Å; R53-V55 PolarHBondContact O-N 3.47Å; V55-K58 PolarHBondContact O-N 3.3Å; V55-F59 HydrophobicContact CB-CD2 4.48Å; V55-F59 HydrophobicContact CG1-CD2 3.66Å; V55-F59 HydrophobicContact CG1-CE2 4.11Å; V55-F59 WeakPolarHBondContact O-CB 3.35Å; V55-F59 VanDerWaalsContact O-CD2 3.25Å; V55-F59 WeakPolarHBondContact O-CD2 3.48Å; V55-F59 PolarHBondContact O-N 3.22Å
56F96.4Very high94.6Very high40 Ų4065.8 Ų65.818%0.17532%0.318CS..Hα-helixtrans-61-47178.6-177-87000112.7I52 R53 K58 F59 V60 A61 C136 W137 A140I52-F56 WeakPolarHBondContact O-CB 3.37Å; I52-F56 PolarHBondContact O-N 2.67Å; R53-F56 PolarHBondContact O-N 2.97Å; F56-K58 PolarHBondContact O-N 3.19Å; F56-F59 PolarHBondContact O-N 3.43Å; F56-V60 HydrophobicContact CD2-CB 3.92Å; F56-V60 HydrophobicContact CD2-CG1 4.3Å; F56-V60 HydrophobicContact CD2-CG2 3.93Å; F56-V60 HydrophobicContact CE1-CB 4.43Å; F56-V60 HydrophobicContact CE1-CG1 4.45Å; F56-V60 HydrophobicContact CE2-CB 3.83Å; F56-V60 HydrophobicContact CE2-CG1 3.7Å; F56-V60 HydrophobicContact CE2-CG2 4.1Å; F56-V60 HydrophobicContact CG-CB 4.27Å; F56-V60 HydrophobicContact CZ-CB 4.1Å; F56-V60 HydrophobicContact CZ-CG1 3.78Å; F56-V60 WeakPolarHBondContact O-CA 3.15Å; F56-V60 WeakPolarHBondContact O-CB 3.46Å; F56-V60 PolarHBondContact O-N 3.17Å; F56-A61 HydrophobicContact CD1-CB 4.32Å; F56-A61 HydrophobicContact CE1-CB 4.12Å; F56-A61 PolarHBondContact O-N 2.78Å; F56-C136 HydrophobicContact CE1-CB 4.47Å; F56-W137 HydrophobicContact CB-CE3 3.79Å; F56-W137 HydrophobicContact CB-CZ3 3.87Å; F56-W137 HydrophobicContact CD1-CB 4.28Å; F56-W137 AromaticContact CD1-CE3 3.71Å; F56-W137 HydrophobicContact CD1-CE3 3.71Å; F56-W137 HydrophobicContact CD2-CE3 4.38Å; F56-W137 HydrophobicContact CD2-CZ3 4.48Å; F56-W137 HydrophobicContact CE1-CB 4.42Å; F56-W137 HydrophobicContact CE1-CE3 4.39Å; F56-W137 AromaticContact CG-CE3 3.7Å; F56-W137 HydrophobicContact CG-CE3 3.7Å; F56-W137 HydrophobicContact CG-CZ3 4.06Å; F56-A140 HydrophobicContact CE1-CB 4.4Å; F56-A140 HydrophobicContact CE2-CB 3.98Å; F56-A140 HydrophobicContact CZ-CB 3.66Å
57E93.8Very high94.4Very high24 Ų2470 Ų7011%0.11235%0.348CS..Iπ-helixtrans-57.5-40.9178.2-73.9173.5167.600110.3R53 S62 Q133 R195R53-E57 HydrophobicContact CG-CG 4.09Å; R53-E57 WeakPolarHBondContact CG-OE1 3.18Å; R53-E57 IonicContact CZ-OE1 2.67Å; R53-E57 IonicContact NE-OE1 2.9Å; R53-E57 PolarHBondContact NE-OE1 3.48Å; R53-E57 IonicContact NH2-OE1 3.94Å; R53-E57 PolarHBondContact NH2-OE1 2.86Å; R53-E57 WeakPolarHBondContact O-CB 3.3Å; R53-E57 VanDerWaalsContact O-CG 3.29Å; R53-E57 WeakPolarHBondContact O-CG 3.41Å; R53-E57 PolarHBondContact O-N 3.44Å; E57-S62 WeakPolarHBondContact O-CB 3.39Å; E57-S62 PolarHBondContact O-N 3.14Å; E57-S62 PolarHBondContact O-OG 3.13Å; E57-Q133 HydrophobicContact CG-CB 4.25Å; E57-R195 IonicContact OE1-CZ 2.83Å; E57-R195 IonicContact OE1-NH1 2.83Å; E57-R195 PolarHBondContact OE1-NH1 3.32Å; E57-R195 IonicContact OE1-NH2 3.94Å; E57-R195 PolarHBondContact OE1-NH2 3.12Å; E57-R195 IonicContact OE2-NH1 3.69Å; E57-R195 IonicContact OE2-NH2 3.92Å; E57-R195 PolarHBondContact OE2-NH2 3.1Å
58K93.1Very high94Very high143 Ų14367 Ų6762%0.62233%0.334SS*.Iπ-helixtrans-74.5-48.2-179.6-174176.2-178.8179.80113.5R54 V55 F56R54-K58 WeakPolarHBondContact O-CB 3.38Å; R54-K58 PolarHBondContact O-N 3.38Å; V55-K58 PolarHBondContact O-N 3.3Å; F56-K58 PolarHBondContact O-N 3.19Å
59F95.7Very high93.5Very high139 Ų13965.8 Ų65.861%0.6134%0.342SS*.Iπ-helixtrans-96.7-21.4-168.4-68.9-72.6000114.4V55 F56 P63V55-F59 HydrophobicContact CB-CD2 4.48Å; V55-F59 HydrophobicContact CG1-CD2 3.66Å; V55-F59 HydrophobicContact CG1-CE2 4.11Å; V55-F59 WeakPolarHBondContact O-CB 3.35Å; V55-F59 VanDerWaalsContact O-CD2 3.25Å; V55-F59 WeakPolarHBondContact O-CD2 3.48Å; V55-F59 PolarHBondContact O-N 3.22Å; F56-F59 PolarHBondContact O-N 3.43Å; F59-P63 WeakPolarHBondContact O-CG 3.3Å
60V95.8Very high93.1Very high69 Ų6965.5 Ų65.542%0.41834%0.34SS..Iπ-helixtrans-115.6-57.1-177.8-176.10000110.5F56 S62 P63 L64F56-V60 HydrophobicContact CD2-CB 3.92Å; F56-V60 HydrophobicContact CD2-CG1 4.3Å; F56-V60 HydrophobicContact CD2-CG2 3.93Å; F56-V60 HydrophobicContact CE1-CB 4.43Å; F56-V60 HydrophobicContact CE1-CG1 4.45Å; F56-V60 HydrophobicContact CE2-CB 3.83Å; F56-V60 HydrophobicContact CE2-CG1 3.7Å; F56-V60 HydrophobicContact CE2-CG2 4.1Å; F56-V60 HydrophobicContact CG-CB 4.27Å; F56-V60 HydrophobicContact CZ-CB 4.1Å; F56-V60 HydrophobicContact CZ-CG1 3.78Å; F56-V60 WeakPolarHBondContact O-CA 3.15Å; F56-V60 WeakPolarHBondContact O-CB 3.46Å; F56-V60 PolarHBondContact O-N 3.17Å; V60-S62 PolarHBondContact O-N 3.23Å; V60-P63 WeakPolarHBondContact O-CD 3.49Å; V60-L64 WeakPolarHBondContact O-CB 3.29Å; V60-L64 PolarHBondContact O-N 2.77Å; V60-L64 VanDerWaalsContact O-N 3.08Å
61A93.9Very high92.3Very high0 Ų072.3 Ų72.30%037%0.369CS..Iπ-helixtrans-70.8-37.8-171.100000112.9F56 L64 A65 Q133 C136F56-A61 HydrophobicContact CD1-CB 4.32Å; F56-A61 HydrophobicContact CE1-CB 4.12Å; F56-A61 PolarHBondContact O-N 2.78Å; A61-L64 PolarHBondContact O-N 3.07Å; A61-A65 VanDerWaalsContact O-CB 3.3Å; A61-A65 WeakPolarHBondContact O-CB 3.23Å; A61-A65 PolarHBondContact O-N 3.42Å; A61-Q133 HydrophobicContact CB-CB 4.17Å; A61-Q133 HydrophobicContact CB-CG 3.96Å; A61-C136 HydrophobicContact CB-CB 4.11Å
62S92.3Very high91.2Very high24 Ų2473.7 Ų73.717%0.16837%0.373CS..Hα-helixtrans-67.4-47.9179.1-54.50000113.1E57 V60 L64 A65 K66 Q133E57-S62 WeakPolarHBondContact O-CB 3.39Å; E57-S62 PolarHBondContact O-N 3.14Å; E57-S62 PolarHBondContact O-OG 3.13Å; V60-S62 PolarHBondContact O-N 3.23Å; S62-L64 VanDerWaalsContact C-N 3.3Å; S62-L64 PolarHBondContact O-N 3.01Å; S62-A65 PolarHBondContact O-N 3.3Å; S62-K66 WeakPolarHBondContact O-CG 3.31Å; S62-K66 PolarHBondContact O-N 2.85Å; S62-K66 VanDerWaalsContact O-N 3.12Å; S62-Q133 PolarHBondContact OG-NE2 3.17Å
63P93Very high89.7Confident69 Ų6973.3 Ų73.345%0.44837%0.374SS..Hα-helixtrans-60.4-40.7172.6-25.836.8000112.4F59 V60 K66 S67F59-P63 WeakPolarHBondContact O-CG 3.3Å; V60-P63 WeakPolarHBondContact O-CD 3.49Å; P63-K66 PolarHBondContact O-N 3.47Å; P63-S67 PolarHBondContact O-N 3.45Å
64L93.6Very high88.3Confident55 Ų5578.3 Ų78.329%0.28840%0.404SS..Hα-helixtrans-62-47178.7-172.368.1000111.3V60 A61 S62 K66 S67 F68 F132 M250V60-L64 WeakPolarHBondContact O-CB 3.29Å; V60-L64 PolarHBondContact O-N 2.77Å; V60-L64 VanDerWaalsContact O-N 3.08Å; A61-L64 PolarHBondContact O-N 3.07Å; S62-L64 VanDerWaalsContact C-N 3.3Å; S62-L64 PolarHBondContact O-N 3.01Å; L64-K66 VanDerWaalsContact C-N 3.3Å; L64-K66 PolarHBondContact O-N 2.97Å; L64-S67 PolarHBondContact O-N 2.91Å; L64-S67 VanDerWaalsContact O-N 3.09Å; L64-S67 PolarHBondContact O-OG 3.49Å; L64-F68 HydrophobicContact CD1-CD2 4.15Å; L64-F68 HydrophobicContact CD1-CE2 3.55Å; L64-F68 HydrophobicContact CD1-CZ 4.36Å; L64-F68 HydrophobicContact CD2-CE2 4.1Å; L64-F68 HydrophobicContact CG-CD2 3.87Å; L64-F68 HydrophobicContact CG-CE2 3.55Å; L64-F68 WeakPolarHBondContact O-CD2 3.43Å; L64-F68 PolarHBondContact O-N 3.11Å; L64-F132 HydrophobicContact CB-CE1 4.44Å; L64-F132 HydrophobicContact CD2-CE1 4.26Å; L64-F132 HydrophobicContact CD2-CZ 4.11Å; L64-F132 HydrophobicContact CG-CE1 4.33Å; L64-F132 HydrophobicContact CG-CZ 4.18Å; L64-M250 HydrophobicContact CD2-CE 4.12Å
65A91.9Very high87.3Confident0 Ų072.7 Ų72.70%038%0.383CS..Hα-helixtrans-58-42.5176.400000112.3A61 S62 S67 F68 G69 I70 M129 F132A61-A65 VanDerWaalsContact O-CB 3.3Å; A61-A65 WeakPolarHBondContact O-CB 3.23Å; A61-A65 PolarHBondContact O-N 3.42Å; S62-A65 PolarHBondContact O-N 3.3Å; A65-S67 VanDerWaalsContact C-N 3.35Å; A65-F68 CarbonylContact O-C 3.57Å; A65-F68 PolarHBondContact O-N 3.2Å; A65-G69 PolarHBondContact O-N 3.15Å; A65-I70 HydrophobicContact CB-CB 4.35Å; A65-I70 HydrophobicContact CB-CD1 4.17Å; A65-I70 WeakPolarHBondContact O-CB 3.41Å; A65-I70 PolarHBondContact O-N 3.36Å; A65-M129 HydrophobicContact CB-CE 3.77Å; A65-M129 HydrophobicContact CB-SD 3.31Å; A65-M129 WeakPolarHBondContact CB-SD 3.46Å; A65-F132 HydrophobicContact CB-CD1 3.53Å; A65-F132 HydrophobicContact CB-CE1 3.72Å; A65-F132 HydrophobicContact CB-CG 4.23Å
66K91.4Very high86Confident136 Ų13677.9 Ų77.959%0.59140%0.399SS*.Hα-helixtrans-64.6-39.1175.6-70.4178.2-177.9-175.40111.9S62 P63 L64 F68 G69 M129S62-K66 WeakPolarHBondContact O-CG 3.31Å; S62-K66 PolarHBondContact O-N 2.85Å; S62-K66 VanDerWaalsContact O-N 3.12Å; P63-K66 PolarHBondContact O-N 3.47Å; L64-K66 VanDerWaalsContact C-N 3.3Å; L64-K66 PolarHBondContact O-N 2.97Å; K66-F68 VanDerWaalsContact C-N 3.25Å; K66-F68 PolarHBondContact O-N 3.39Å; K66-G69 PolarHBondContact O-N 3.15Å; K66-M129 HydrophobicContact CG-CE 4.34Å
67S91.4Very high85.1Confident90 Ų9077.1 Ų77.163%0.62940%0.398SS*.Hα-helixtrans-65.5-29.9176.276.50000112.7P63 L64 A65 G69P63-S67 PolarHBondContact O-N 3.45Å; L64-S67 PolarHBondContact O-N 2.91Å; L64-S67 VanDerWaalsContact O-N 3.09Å; L64-S67 PolarHBondContact O-OG 3.49Å; A65-S67 VanDerWaalsContact C-N 3.35Å; S67-G69 PolarHBondContact O-N 2.83Å
68F88.5Confident84.5Confident46 Ų4680.9 Ų80.920%0.20242%0.423CS..THydrogen-bonded Turntrans-80.75.7171.2-74.4-63.3000113.6L64 A65 K66 I70 F132 F251 A254 W256L64-F68 HydrophobicContact CD1-CD2 4.15Å; L64-F68 HydrophobicContact CD1-CE2 3.55Å; L64-F68 HydrophobicContact CD1-CZ 4.36Å; L64-F68 HydrophobicContact CD2-CE2 4.1Å; L64-F68 HydrophobicContact CG-CD2 3.87Å; L64-F68 HydrophobicContact CG-CE2 3.55Å; L64-F68 WeakPolarHBondContact O-CD2 3.43Å; L64-F68 PolarHBondContact O-N 3.11Å; A65-F68 CarbonylContact O-C 3.57Å; A65-F68 PolarHBondContact O-N 3.2Å; K66-F68 VanDerWaalsContact C-N 3.25Å; K66-F68 PolarHBondContact O-N 3.39Å; F68-I70 PolarHBondContact O-N 3.07Å; F68-F132 HydrophobicContact CD2-CE2 4.11Å; F68-F132 AromaticContact CD2-CZ 3.72Å; F68-F132 HydrophobicContact CD2-CZ 3.72Å; F68-F132 HydrophobicContact CE2-CZ 4.1Å; F68-F251 HydrophobicContact CE1-CE1 4.1Å; F68-F251 HydrophobicContact CZ-CE1 4.32Å; F68-A254 HydrophobicContact CB-CB 4.02Å; F68-A254 HydrophobicContact CD1-CB 4.44Å; F68-A254 HydrophobicContact CG-CB 4.33Å; F68-W256 AromaticContact CD1-CH2 3.75Å; F68-W256 HydrophobicContact CD1-CH2 3.75Å; F68-W256 AromaticContact CD1-CZ2 3.7Å; F68-W256 HydrophobicContact CD1-CZ2 3.7Å; F68-W256 HydrophobicContact CD1-CZ3 4.31Å; F68-W256 AromaticContact CE1-CH2 3.53Å; F68-W256 HydrophobicContact CE1-CH2 3.53Å; F68-W256 HydrophobicContact CE1-CZ2 4.01Å; F68-W256 AromaticContact CE1-CZ3 3.84Å; F68-W256 HydrophobicContact CE1-CZ3 3.84Å
69G85.9Confident83.9Confident56 Ų5680.6 Ų80.658%0.57744%0.436SS*.THydrogen-bonded Turntrans79.611.2176.400000115.1A65 K66 S67 K71A65-G69 PolarHBondContact O-N 3.15Å; K66-G69 PolarHBondContact O-N 3.15Å; S67-G69 PolarHBondContact O-N 2.83Å; G69-K71 PolarHBondContact O-N 3.37Å; G69-K71 VanDerWaalsContact O-N 3.13Å
70I86.7Confident83.5Confident10 Ų1075.7 Ų75.75%0.05142%0.416CS..  trans-72.9108.6178.5-55.3177.6000109A65 F68 R128 M129 F132 Y253A65-I70 HydrophobicContact CB-CB 4.35Å; A65-I70 HydrophobicContact CB-CD1 4.17Å; A65-I70 WeakPolarHBondContact O-CB 3.41Å; A65-I70 PolarHBondContact O-N 3.36Å; F68-I70 PolarHBondContact O-N 3.07Å; I70-R128 HydrophobicContact CG2-CG 4.3Å; I70-M129 HydrophobicContact CB-CE 4.29Å; I70-M129 HydrophobicContact CG2-CB 4.45Å; I70-M129 HydrophobicContact CG2-CE 4.1Å; I70-M129 VanDerWaalsContact O-CE 3.3Å; I70-M129 WeakPolarHBondContact O-CE 3.47Å; I70-F132 HydrophobicContact CD1-CB 3.89Å; I70-F132 HydrophobicContact CD1-CD1 4.35Å; I70-F132 HydrophobicContact CD1-CD2 3.41Å; I70-F132 VanDerWaalsContact CD1-CD2 3.41Å; I70-F132 HydrophobicContact CD1-CE2 3.99Å; I70-F132 HydrophobicContact CD1-CG 3.62Å; I70-Y253 WeakPolarHBondContact CD1-O 3.3Å
71K77.8Confident83.1Confident174 Ų17477.5 Ų77.576%0.75743%0.427SS*.  trans-75.9141.2175-66.4179.5-176.8171.90110.5G69 T73G69-K71 PolarHBondContact O-N 3.37Å; G69-K71 VanDerWaalsContact O-N 3.13Å; K71-T73 PolarHBondContact O-N 3.41Å; K71-T73 VanDerWaalsContact O-N 3.14Å
72E72.6Confident82.8Confident133 Ų13380.2 Ų80.262%0.62144%0.444SS*.  trans-8290172.8-167.3166.4-166.500108.8V74E72-V74 PolarHBondContact O-N 2.82Å
73T65.7Low82.7Confident66 Ų6679 Ų7941%0.40544%0.436SS..  trans-82.6109.4176.650.30000109.6K71 R75K71-T73 PolarHBondContact O-N 3.41Å; K71-T73 VanDerWaalsContact O-N 3.14Å; T73-R75 PolarHBondContact O-N 3.3Å
74V66.4Low82.5Confident107 Ų10777.5 Ų77.565%0.64842%0.422SS*.  trans-86101.9168.4-178.50000107.2E72 K76E72-V74 PolarHBondContact O-N 2.82Å; V74-K76 PolarHBondContact O-N 2.87Å; V74-K76 VanDerWaalsContact O-N 3.09Å
75R70.6Confident82.4Confident68 Ų6879.3 Ų79.326%0.25743%0.432SS..  trans-60111.2174.6-68.1175.7176174-6.4108.4T73 N122 Q123 E347T73-R75 PolarHBondContact O-N 3.3Å; R75-N122 WeakPolarHBondContact CD-O 3.45Å; R75-N122 PolarHBondContact NH1-O 3.13Å; R75-Q123 HydrophobicContact CB-CG 3.97Å; R75-Q123 WeakPolarHBondContact O-CG 3.49Å; R75-Q123 PolarHBondContact O-NE2 3.45Å; R75-E347 IonicContact CZ-OE2 3.81Å; R75-E347 IonicContact NH2-OE2 3.96Å; R75-E347 PolarHBondContact NH2-OE2 2.85Å
76K70.4Confident82.3Confident186 Ų18681.2 Ų81.281%0.80944%0.441SS*.PPolyproline II helixtrans-96.8122.6179.2-69.9-178.1-175.7175.30109.6V74V74-K76 PolarHBondContact O-N 2.87Å; V74-K76 VanDerWaalsContact O-N 3.09Å
77V77Confident82.1Confident24 Ų2475.1 Ų75.115%0.14541%0.414CS..PPolyproline II helixtrans-96138.5173.2168.80000108.8W116 S119 R120 Q123V77-W116 HydrophobicContact CG1-CD2 4.36Å; V77-W116 HydrophobicContact CG1-CG 4.37Å; V77-W116 HydrophobicContact CG1-CZ2 4.08Å; V77-S119 VanDerWaalsContact CG2-OG 3.26Å; V77-S119 WeakPolarHBondContact CG2-OG 3.18Å; V77-R120 HydrophobicContact CG2-CB 4.37Å; V77-Q123 HydrophobicContact CG2-CG 3.63Å; V77-Q123 VanDerWaalsContact CG2-NE2 3.28Å
78T79.8Confident81.9Confident104 Ų10477 Ų7764%0.63841%0.411SS*.PPolyproline II helixtrans-60125.6173.6400000110.2N80 W116T78-N80 PolarHBondContact O-N 3.47Å; T78-N80 VanDerWaalsContact O-N 3.17Å; T78-W116 PolarHBondContact O-NE1 3.18Å
79P82.6Confident82Confident137 Ų13782.1 Ų82.189%0.8944%0.435SS*.PPolyproline II helixtrans-64.3119.6-177.5-18.929.9000110.8
80N85.7Confident82.1Confident35 Ų3583.4 Ų83.419%0.18744%0.435CS..  trans-140.7113.1171.5-173.7-39.5000109.8T78 V82 L83 E84T78-N80 PolarHBondContact O-N 3.47Å; T78-N80 VanDerWaalsContact O-N 3.17Å; N80-V82 PolarHBondContact O-N 2.9Å; N80-V82 PolarHBondContact OD1-N 2.86Å; N80-L83 HydrophobicContact CB-CB 4.15Å; N80-L83 HydrophobicContact CB-CD1 4.02Å; N80-L83 HydrophobicContact CB-CG 4.13Å; N80-L83 PolarHBondContact OD1-N 3.32Å; N80-L83 VanDerWaalsContact OD1-N 3.16Å; N80-E84 VanDerWaalsContact O-CB 3.24Å; N80-E84 WeakPolarHBondContact O-CB 3.49Å; N80-E84 PolarHBondContact O-N 3.46Å
81T87.6Confident82.1Confident108 Ų10885.2 Ų85.266%0.66345%0.447SS*.Hα-helixtrans-68.1-33.7-175.353.20000112.8N85T81-N85 VanDerWaalsContact O-CB 3.28Å; T81-N85 WeakPolarHBondContact O-CB 3.46Å; T81-N85 PolarHBondContact O-N 2.92Å; T81-N85 PolarHBondContact O-ND2 2.85Å
82V88.4Confident82.3Confident56 Ų5684.1 Ų84.134%0.33944%0.438SS..Hα-helixtrans-70.4-46.8-180179.70000110.4N80 F86 L102 K105N80-V82 PolarHBondContact O-N 2.9Å; N80-V82 PolarHBondContact OD1-N 2.86Å; V82-F86 PolarHBondContact O-N 3.13Å; V82-F86 VanDerWaalsContact O-N 3.1Å; V82-L102 HydrophobicContact CG1-CD2 4.22Å; V82-K105 HydrophobicContact CG1-CB 4.47Å
83L88.8Confident83Confident0 Ų084.7 Ų84.70%044%0.441CS..Hα-helixtrans-67.9-39.7178.3-59.3179.9000111.7N80 F86 F87 L102 L108 V113 W116 F117N80-L83 HydrophobicContact CB-CB 4.15Å; N80-L83 HydrophobicContact CB-CD1 4.02Å; N80-L83 HydrophobicContact CB-CG 4.13Å; N80-L83 PolarHBondContact OD1-N 3.32Å; N80-L83 VanDerWaalsContact OD1-N 3.16Å; L83-F86 PolarHBondContact O-N 3.38Å; L83-F87 WeakPolarHBondContact O-CB 3.35Å; L83-F87 PolarHBondContact O-N 3.46Å; L83-L102 HydrophobicContact CD2-CB 3.9Å; L83-L102 HydrophobicContact CD2-CD1 4.19Å; L83-L102 HydrophobicContact CD2-CD2 4.25Å; L83-L102 HydrophobicContact CD2-CG 4.34Å; L83-L108 HydrophobicContact CD1-CD1 4.07Å; L83-V113 HydrophobicContact CD2-CG1 3.97Å; L83-V113 HydrophobicContact CD2-CG2 4.34Å; L83-W116 VanDerWaalsContact C-CH2 3.46Å; L83-W116 HydrophobicContact CB-CD2 3.68Å; L83-W116 HydrophobicContact CB-CE3 3.53Å; L83-W116 HydrophobicContact CB-CH2 3.76Å; L83-W116 HydrophobicContact CB-CZ2 3.85Å; L83-W116 HydrophobicContact CB-CZ3 3.58Å; L83-W116 HydrophobicContact CD1-CB 3.87Å; L83-W116 HydrophobicContact CD1-CD2 3.55Å; L83-W116 HydrophobicContact CD1-CE3 3.95Å; L83-W116 HydrophobicContact CD1-CG 3.47Å; L83-W116 VanDerWaalsContact CD1-CG 3.47Å; L83-W116 HydrophobicContact CG-CD2 4.26Å; L83-W116 HydrophobicContact CG-CE3 4.31Å; L83-F117 HydrophobicContact CD2-CE2 3.93Å
84E90.3Very high84Confident36 Ų3682.5 Ų82.517%0.16843%0.428CS..Hα-helixtrans-65.3-40.6176.7-172.468.9-166.300112.4N80 F87 K88 W116 R120N80-E84 VanDerWaalsContact O-CB 3.24Å; N80-E84 WeakPolarHBondContact O-CB 3.49Å; N80-E84 PolarHBondContact O-N 3.46Å; E84-F87 PolarHBondContact O-N 3.31Å; E84-K88 HydrophobicContact CG-CD 4.25Å; E84-K88 WeakPolarHBondContact O-CB 3.49Å; E84-K88 WeakPolarHBondContact O-CG 3.5Å; E84-K88 PolarHBondContact O-N 3.25Å; E84-K88 WeakPolarHBondContact OE1-CE 3.43Å; E84-K88 IonicContact OE1-NZ 2.94Å; E84-K88 PolarHBondContact OE1-NZ 3.01Å; E84-W116 HydrophobicContact CB-CH2 4.18Å; E84-W116 HydrophobicContact CB-CZ2 4.23Å; E84-W116 WeakPolarHBondContact OE2-CH2 3.28Å; E84-R120 IonicContact OE1-CZ 3.55Å; E84-R120 IonicContact OE1-NE 3.35Å; E84-R120 PolarHBondContact OE1-NE 3.23Å; E84-R120 IonicContact OE1-NH2 2.85Å; E84-R120 PolarHBondContact OE1-NH2 3.37Å; E84-R120 IonicContact OE2-CZ 3.78Å; E84-R120 IonicContact OE2-NE 2.85Å; E84-R120 PolarHBondContact OE2-NE 3.46Å; E84-R120 IonicContact OE2-NH2 3.82Å
85N89.9Confident85.1Confident94 Ų9484.1 Ų84.150%0.50343%0.43SS..Hα-helixtrans-64.3-43.5175.6-75-16.2000111.3T81 K88 H89T81-N85 VanDerWaalsContact O-CB 3.28Å; T81-N85 WeakPolarHBondContact O-CB 3.46Å; T81-N85 PolarHBondContact O-N 2.92Å; T81-N85 PolarHBondContact O-ND2 2.85Å; N85-K88 PolarHBondContact O-N 3.25Å; N85-H89 WeakPolarHBondContact O-CB 3.02Å; N85-H89 PolarHBondContact O-CD2 3.44Å; N85-H89 VanDerWaalsContact O-CD2 3.3Å; N85-H89 PolarHBondContact O-N 3.47Å
86F89.9Confident86Confident39 Ų3986 Ų8617%0.17144%0.442CS..Hα-helixtrans-63.9-42.6175.9-172.5-84.5000111.9V82 L83 K88 S90 T91 P94 D98 L102 F117V82-F86 PolarHBondContact O-N 3.13Å; V82-F86 VanDerWaalsContact O-N 3.1Å; L83-F86 PolarHBondContact O-N 3.38Å; F86-K88 VanDerWaalsContact C-N 3.34Å; F86-K88 PolarHBondContact O-N 3.37Å; F86-S90 WeakPolarHBondContact O-CA 3.49Å; F86-S90 WeakPolarHBondContact O-CB 3.21Å; F86-S90 PolarHBondContact O-N 3.33Å; F86-T91 HydrophobicContact CE1-CG2 3.49Å; F86-T91 VanDerWaalsContact CE1-CG2 3.49Å; F86-T91 HydrophobicContact CZ-CG2 3.86Å; F86-T91 PolarHBondContact O-N 2.9Å; F86-P94 HydrophobicContact CE1-CB 3.96Å; F86-D98 HydrophobicContact CE1-CB 4.49Å; F86-D98 HydrophobicContact CZ-CB 3.84Å; F86-L102 HydrophobicContact CB-CD1 4.39Å; F86-L102 HydrophobicContact CB-CD2 4.13Å; F86-L102 HydrophobicContact CD1-CD1 3.81Å; F86-L102 HydrophobicContact CD2-CD1 4.13Å; F86-L102 HydrophobicContact CD2-CD2 4.03Å; F86-L102 HydrophobicContact CD2-CG 4.49Å; F86-L102 HydrophobicContact CE1-CD1 4.03Å; F86-L102 HydrophobicContact CE2-CD1 4.35Å; F86-L102 HydrophobicContact CG-CD1 3.84Å; F86-L102 HydrophobicContact CG-CD2 4.1Å; F86-L102 HydrophobicContact CZ-CD1 4.3Å; F86-F117 AromaticContact CD1-CE1 3.95Å; F86-F117 HydrophobicContact CD1-CE1 3.95Å; F86-F117 AromaticContact CD1-CZ 3.57Å; F86-F117 HydrophobicContact CD1-CZ 3.57Å; F86-F117 HydrophobicContact CE1-CZ 4.21Å; F86-F117 HydrophobicContact CG-CZ 4.39Å
87F88.9Confident86.8Confident9 Ų982.3 Ų82.34%0.03944%0.435CS..Hα-helixtrans-60.5-41.7178.2-174.6-88.8000112.6L83 E84 R92 W116 F117 R120 R121 E124L83-F87 WeakPolarHBondContact O-CB 3.35Å; L83-F87 PolarHBondContact O-N 3.46Å; E84-F87 PolarHBondContact O-N 3.31Å; F87-R92 HydrophobicContact CD2-CB 4.46Å; F87-R92 HydrophobicContact CE1-CG 4.19Å; F87-R92 HydrophobicContact CE2-CB 3.87Å; F87-R92 HydrophobicContact CE2-CG 4.01Å; F87-R92 HydrophobicContact CZ-CB 4.13Å; F87-R92 HydrophobicContact CZ-CG 3.82Å; F87-W116 HydrophobicContact CB-CH2 4.25Å; F87-W116 HydrophobicContact CB-CZ3 4.13Å; F87-W116 HydrophobicContact CD2-CZ3 4.42Å; F87-F117 HydrophobicContact CB-CE1 4.08Å; F87-F117 AromaticContact CD2-CD1 3.74Å; F87-F117 HydrophobicContact CD2-CD1 3.74Å; F87-F117 AromaticContact CD2-CE1 3.88Å; F87-F117 HydrophobicContact CD2-CE1 3.88Å; F87-F117 HydrophobicContact CE2-CD1 4.48Å; F87-R120 HydrophobicContact CD1-CG 4.24Å; F87-R120 HydrophobicContact CD2-CG 4.12Å; F87-R120 HydrophobicContact CE1-CG 4.22Å; F87-R120 HydrophobicContact CE2-CG 4.09Å; F87-R120 HydrophobicContact CG-CG 4.2Å; F87-R120 HydrophobicContact CZ-CG 4.14Å; F87-R121 HydrophobicContact CE2-CG 3.76Å; F87-R121 HydrophobicContact CZ-CG 4.16Å; F87-E124 WeakPolarHBondContact CE1-OE1 3.47Å
88K87.2Confident87.4Confident128 Ų12883.8 Ų83.856%0.55744%0.442SS*.Hα-helixtrans-76.5-37.5-178.7-76.9176172.4152.90113.7E84 N85 F86E84-K88 HydrophobicContact CG-CD 4.25Å; E84-K88 WeakPolarHBondContact O-CB 3.49Å; E84-K88 WeakPolarHBondContact O-CG 3.5Å; E84-K88 PolarHBondContact O-N 3.25Å; E84-K88 WeakPolarHBondContact OE1-CE 3.43Å; E84-K88 IonicContact OE1-NZ 2.94Å; E84-K88 PolarHBondContact OE1-NZ 3.01Å; N85-K88 PolarHBondContact O-N 3.25Å; F86-K88 VanDerWaalsContact C-N 3.34Å; F86-K88 PolarHBondContact O-N 3.37Å
89H89.1Confident87.9Confident154 Ų15479.3 Ų79.371%0.71341%0.414SS*.Hα-helixtrans-109.1-14.4-167.8-64-69.5000114.9N85N85-H89 WeakPolarHBondContact O-CB 3.02Å; N85-H89 PolarHBondContact O-CD2 3.44Å; N85-H89 VanDerWaalsContact O-CD2 3.3Å; N85-H89 PolarHBondContact O-N 3.47Å
90S88.9Confident88.2Confident83 Ų8379.4 Ų79.458%0.5840%0.397SS*.THydrogen-bonded Turntrans-118.1-76.2-176.9-55.30000112.2F86F86-S90 WeakPolarHBondContact O-CA 3.49Å; F86-S90 WeakPolarHBondContact O-CB 3.21Å; F86-S90 PolarHBondContact O-N 3.33Å
91T85.4Confident88.4Confident49 Ų4979.1 Ų79.130%0.30140%0.403SS..  trans-154148.7-179.6178.30000111.7F86 Q93 P94F86-T91 HydrophobicContact CE1-CG2 3.49Å; F86-T91 VanDerWaalsContact CE1-CG2 3.49Å; F86-T91 HydrophobicContact CZ-CG2 3.86Å; F86-T91 PolarHBondContact O-N 2.9Å; T91-Q93 PolarHBondContact OG1-N 2.65Å; T91-Q93 VanDerWaalsContact OG1-N 3.13Å; T91-Q93 PolarHBondContact OG1-O 3.08Å; T91-Q93 VanDerWaalsContact OG1-O 3.13Å; T91-P94 HydrophobicContact CG2-CB 4.5Å
92R83.8Confident88.6Confident151 Ų15174.4 Ų74.457%0.5737%0.374SS*.SBendtrans-82.2-19.2174.1-60-179-179.6175.5-4.2112.8F87 R121F87-R92 HydrophobicContact CD2-CB 4.46Å; F87-R92 HydrophobicContact CE1-CG 4.19Å; F87-R92 HydrophobicContact CE2-CB 3.87Å; F87-R92 HydrophobicContact CE2-CG 4.01Å; F87-R92 HydrophobicContact CZ-CB 4.13Å; F87-R92 HydrophobicContact CZ-CG 3.82Å; R92-R121 WeakPolarHBondContact O-CD 3.36Å; R92-R121 PolarHBondContact O-NH1 3.49Å
93Q86.4Confident88.7Confident145 Ų14572 Ų7268%0.67836%0.36SS*.SBendtrans-126.286179.7-70.6-176.3-15.200107.7T91T91-Q93 PolarHBondContact OG1-N 2.65Å; T91-Q93 VanDerWaalsContact OG1-N 3.13Å; T91-Q93 PolarHBondContact OG1-O 3.08Å; T91-Q93 VanDerWaalsContact OG1-O 3.13Å
94P87Confident88.8Confident20 Ų2079.3 Ų79.313%0.1339%0.392CS..  trans-64.3145.3177.226.2-33.6000111F86 T91 D98 I99 F117F86-P94 HydrophobicContact CE1-CB 3.96Å; T91-P94 HydrophobicContact CG2-CB 4.5Å; P94-D98 HydrophobicContact CB-CB 3.83Å; P94-I99 HydrophobicContact CB-CG1 4.03Å; P94-I99 HydrophobicContact CG-CD1 4.41Å; P94-I99 HydrophobicContact CG-CG1 3.93Å; P94-F117 HydrophobicContact CG-CB 4.48Å; P94-F117 HydrophobicContact CG-CD1 3.87Å; P94-F117 HydrophobicContact CG-CD2 3.78Å; P94-F117 HydrophobicContact CG-CE1 4Å; P94-F117 HydrophobicContact CG-CE2 3.9Å; P94-F117 HydrophobicContact CG-CG 3.79Å; P94-F117 HydrophobicContact CG-CZ 4.04Å
95M88.9Confident88.8Confident140 Ų14085.3 Ų85.369%0.6942%0.417SS*.  trans-78.7166.4169.7-70.4-172.1147.200110.7T97 D98 I99M95-T97 PolarHBondContact O-N 3.01Å; M95-T97 VanDerWaalsContact O-N 3.15Å; M95-D98 PolarHBondContact N-OD2 3.5Å; M95-D98 WeakPolarHBondContact O-CB 3.46Å; M95-D98 PolarHBondContact O-N 3.4Å; M95-I99 WeakPolarHBondContact O-CG1 3.38Å; M95-I99 PolarHBondContact O-N 2.86Å
96Q89Confident88.7Confident108 Ų10882 Ų8251%0.50540%0.401SS..Hα-helixtrans-55.5-36.4-179.2-160.665.923.100113D98 I99 Y100 E110Q96-D98 VanDerWaalsContact C-N 3.32Å; Q96-D98 PolarHBondContact O-N 3.35Å; Q96-I99 PolarHBondContact O-N 3.01Å; Q96-Y100 PolarHBondContact O-N 3.35Å; Q96-Y100 VanDerWaalsContact O-N 3.08Å; Q96-E110 PolarHBondContact NE2-OE2 2.87Å
97T88.9Confident88.6Confident108 Ų10887.5 Ų87.566%0.66343%0.433SS*.Hα-helixtrans-62.9-38.1176.249.70000112.5M95 G101M95-T97 PolarHBondContact O-N 3.01Å; M95-T97 VanDerWaalsContact O-N 3.15Å; T97-G101 PolarHBondContact O-N 3.36Å
98D88.9Confident88.6Confident55 Ų5589.7 Ų89.729%0.29445%0.445SS..Hα-helixtrans-72.7-40.6178.3-56.1-38.5000110.8F86 P94 M95 Q96 Y100 G101 L102F86-D98 HydrophobicContact CE1-CB 4.49Å; F86-D98 HydrophobicContact CZ-CB 3.84Å; P94-D98 HydrophobicContact CB-CB 3.83Å; M95-D98 PolarHBondContact N-OD2 3.5Å; M95-D98 WeakPolarHBondContact O-CB 3.46Å; M95-D98 PolarHBondContact O-N 3.4Å; Q96-D98 VanDerWaalsContact C-N 3.32Å; Q96-D98 PolarHBondContact O-N 3.35Å; D98-Y100 PolarHBondContact O-N 3.25Å; D98-G101 PolarHBondContact O-N 3.06Å; D98-L102 WeakPolarHBondContact O-CB 3.47Å; D98-L102 VanDerWaalsContact O-CG 3.23Å; D98-L102 WeakPolarHBondContact O-CG 3.48Å; D98-L102 PolarHBondContact O-N 2.81Å
99I90Very high88.8Confident11 Ų1187.4 Ų87.46%0.05644%0.441CS..Hα-helixtrans-58.4-48.3177.5-67.4165.7000110.1P94 M95 Q96 G101 L102 A103 E110 V113 E114P94-I99 HydrophobicContact CB-CG1 4.03Å; P94-I99 HydrophobicContact CG-CD1 4.41Å; P94-I99 HydrophobicContact CG-CG1 3.93Å; M95-I99 WeakPolarHBondContact O-CG1 3.38Å; M95-I99 PolarHBondContact O-N 2.86Å; Q96-I99 PolarHBondContact O-N 3.01Å; I99-G101 PolarHBondContact O-N 2.83Å; I99-L102 PolarHBondContact O-N 3.5Å; I99-A103 VanDerWaalsContact O-CB 3.27Å; I99-A103 WeakPolarHBondContact O-CB 3.43Å; I99-A103 PolarHBondContact O-N 3Å; I99-E110 HydrophobicContact CG2-CB 3.86Å; I99-E110 HydrophobicContact CG2-CG 4.13Å; I99-V113 HydrophobicContact CG2-CB 4.3Å; I99-V113 HydrophobicContact CG2-CG1 4.22Å; I99-E114 HydrophobicContact CD1-CG 3.73Å; I99-E114 HydrophobicContact CG1-CG 4.43Å; I99-E114 HydrophobicContact CG2-CG 4.07Å
100Y89.8Confident88.8Confident138 Ų13883.5 Ų83.554%0.54142%0.423SS..Hα-helixtrans-58.9-46.5176.5179-96000112.2Q96 D98 L102 A103 K104 E110Q96-Y100 PolarHBondContact O-N 3.35Å; Q96-Y100 VanDerWaalsContact O-N 3.08Å; D98-Y100 PolarHBondContact O-N 3.25Å; Y100-L102 VanDerWaalsContact C-N 3.35Å; Y100-L102 PolarHBondContact O-N 3.4Å; Y100-A103 PolarHBondContact O-N 3.47Å; Y100-K104 PolarHBondContact O-N 3.5Å; Y100-K104 VanDerWaalsContact O-N 3.12Å; Y100-E110 WeakPolarHBondContact CD2-OE1 3.33Å
101G89.7Confident88.7Confident30 Ų3088.7 Ų88.731%0.30943%0.43SS..Hα-helixtrans-63.4-38.8178.800000113.2T97 D98 I99 K105T97-G101 PolarHBondContact O-N 3.36Å; D98-G101 PolarHBondContact O-N 3.06Å; I99-G101 PolarHBondContact O-N 2.83Å; G101-K105 WeakPolarHBondContact O-CG 3.21Å; G101-K105 PolarHBondContact O-N 3.22Å; G101-K105 VanDerWaalsContact O-N 3.16Å
102L90.7Very high88.9Confident8 Ų890.9 Ų90.94%0.04244%0.437CS..Hα-helixtrans-73.1-39.1178-70.7170.2000112.2V82 L83 F86 D98 I99 Y100 K104 K105 C106 V113 F117V82-L102 HydrophobicContact CG1-CD2 4.22Å; L83-L102 HydrophobicContact CD2-CB 3.9Å; L83-L102 HydrophobicContact CD2-CD1 4.19Å; L83-L102 HydrophobicContact CD2-CD2 4.25Å; L83-L102 HydrophobicContact CD2-CG 4.34Å; F86-L102 HydrophobicContact CB-CD1 4.39Å; F86-L102 HydrophobicContact CB-CD2 4.13Å; F86-L102 HydrophobicContact CD1-CD1 3.81Å; F86-L102 HydrophobicContact CD2-CD1 4.13Å; F86-L102 HydrophobicContact CD2-CD2 4.03Å; F86-L102 HydrophobicContact CD2-CG 4.49Å; F86-L102 HydrophobicContact CE1-CD1 4.03Å; F86-L102 HydrophobicContact CE2-CD1 4.35Å; F86-L102 HydrophobicContact CG-CD1 3.84Å; F86-L102 HydrophobicContact CG-CD2 4.1Å; F86-L102 HydrophobicContact CZ-CD1 4.3Å; D98-L102 WeakPolarHBondContact O-CB 3.47Å; D98-L102 VanDerWaalsContact O-CG 3.23Å; D98-L102 WeakPolarHBondContact O-CG 3.48Å; D98-L102 PolarHBondContact O-N 2.81Å; I99-L102 PolarHBondContact O-N 3.5Å; Y100-L102 VanDerWaalsContact C-N 3.35Å; Y100-L102 PolarHBondContact O-N 3.4Å; L102-K104 VanDerWaalsContact C-N 3.33Å; L102-K104 PolarHBondContact O-N 3.42Å; L102-K105 PolarHBondContact O-N 2.98Å; L102-C106 WeakPolarHBondContact O-CB 3.32Å; L102-C106 PolarHBondContact O-N 2.78Å; L102-C106 PolarHBondContact O-SG 2.94Å; L102-V113 HydrophobicContact CB-CG1 4.11Å; L102-F117 HydrophobicContact CD1-CE2 3.64Å; L102-F117 HydrophobicContact CD1-CZ 3.73Å
103A91.4Very high89.1Confident7 Ų783.7 Ų83.76%0.05841%0.41CS..Hα-helixtrans-56.5-48.7174.300000110.6I99 Y100 K105 C106 N107 L108 E110 V113I99-A103 VanDerWaalsContact O-CB 3.27Å; I99-A103 WeakPolarHBondContact O-CB 3.43Å; I99-A103 PolarHBondContact O-N 3Å; Y100-A103 PolarHBondContact O-N 3.47Å; A103-K105 PolarHBondContact O-N 2.96Å; A103-C106 PolarHBondContact O-N 3.23Å; A103-N107 PolarHBondContact O-N 3.39Å; A103-L108 CarbonylContact C-O 3.47Å; A103-L108 WeakPolarHBondContact CA-O 3.43Å; A103-L108 VanDerWaalsContact CB-O 3.32Å; A103-L108 WeakPolarHBondContact CB-O 3.49Å; A103-L108 PolarHBondContact O-N 3.29Å; A103-E110 HydrophobicContact CB-CG 4.13Å; A103-V113 HydrophobicContact CB-CG2 4.02Å
104K91.2Very high89.2Confident153 Ų15380 Ų8067%0.66539%0.393SS*.Hα-helixtrans-63.3-39.7176.6-168.4175-176.9176.30113.2Y100 L102Y100-K104 PolarHBondContact O-N 3.5Å; Y100-K104 VanDerWaalsContact O-N 3.12Å; L102-K104 VanDerWaalsContact C-N 3.33Å; L102-K104 PolarHBondContact O-N 3.42Å
105K90.1Very high89.3Confident161 Ų16186.7 Ų86.770%0.742%0.415SS*.Hα-helixtrans-69.9-32.8178.5-78.1178.7-179.6179.30113.3V82 G101 L102 A103V82-K105 HydrophobicContact CG1-CB 4.47Å; G101-K105 WeakPolarHBondContact O-CG 3.21Å; G101-K105 PolarHBondContact O-N 3.22Å; G101-K105 VanDerWaalsContact O-N 3.16Å; L102-K105 PolarHBondContact O-N 2.98Å; A103-K105 PolarHBondContact O-N 2.96Å
106C86.9Confident89.3Confident25 Ų2580.6 Ų80.617%0.16939%0.385CS..Hα-helixtrans-95.7-1.9-175.7-58.50000113.4L102 A103 L108L102-C106 WeakPolarHBondContact O-CB 3.32Å; L102-C106 PolarHBondContact O-N 2.78Å; L102-C106 PolarHBondContact O-SG 2.94Å; A103-C106 PolarHBondContact O-N 3.23Å; C106-L108 HydrophobicContact CB-CB 4.23Å; C106-L108 HydrophobicContact CB-CD1 3.73Å; C106-L108 HydrophobicContact CB-CG 3.8Å; C106-L108 PolarHBondContact O-N 2.94Å
107N89.2Confident89.3Confident154 Ų15475.5 Ų75.582%0.82436%0.361SS*.THydrogen-bonded Turntrans5140.8-167.3-64.4-35000112.3A103A103-N107 PolarHBondContact O-N 3.39Å
108L88.9Confident89.1Confident56 Ų5675.9 Ų75.929%0.29335%0.35SS..  trans-113.6161.5177.8-67.4175.3000110L83 A103 C106 Q112 V113L83-L108 HydrophobicContact CD1-CD1 4.07Å; A103-L108 CarbonylContact C-O 3.47Å; A103-L108 WeakPolarHBondContact CA-O 3.43Å; A103-L108 VanDerWaalsContact CB-O 3.32Å; A103-L108 WeakPolarHBondContact CB-O 3.49Å; A103-L108 PolarHBondContact O-N 3.29Å; C106-L108 HydrophobicContact CB-CB 4.23Å; C106-L108 HydrophobicContact CB-CD1 3.73Å; C106-L108 HydrophobicContact CB-CG 3.8Å; C106-L108 PolarHBondContact O-N 2.94Å; L108-Q112 HydrophobicContact CB-CB 4.25Å; L108-V113 HydrophobicContact CB-CG2 4.03Å; L108-V113 HydrophobicContact CD1-CG2 4.35Å
109T90.4Very high88.9Confident79 Ų7975 Ų7549%0.48535%0.348SS..  trans-76.5155.1168.162.60000110.9R111 Q112 V113T109-R111 VanDerWaalsContact C-N 3.25Å; T109-R111 PolarHBondContact O-N 2.94Å; T109-Q112 WeakPolarHBondContact O-CB 3.35Å; T109-Q112 PolarHBondContact O-N 3.22Å; T109-Q112 WeakPolarHBondContact OG1-CB 3.48Å; T109-Q112 VanDerWaalsContact OG1-CD 3.31Å; T109-Q112 WeakPolarHBondContact OG1-CG 3.38Å; T109-Q112 PolarHBondContact OG1-N 3.37Å; T109-Q112 PolarHBondContact OG1-OE1 3.37Å; T109-V113 PolarHBondContact O-N 3.23Å; T109-V113 VanDerWaalsContact O-N 3.09Å
110E89.8Confident88.7Confident73 Ų7375.9 Ų75.934%0.34135%0.351SS..Hα-helixtrans-54.5-43.3175.4-68.1179.5-144.900111.7Q96 I99 Y100 A103 Q112 V113 E114Q96-E110 PolarHBondContact NE2-OE2 2.87Å; I99-E110 HydrophobicContact CG2-CB 3.86Å; I99-E110 HydrophobicContact CG2-CG 4.13Å; Y100-E110 WeakPolarHBondContact CD2-OE1 3.33Å; A103-E110 HydrophobicContact CB-CG 4.13Å; E110-Q112 VanDerWaalsContact C-N 3.34Å; E110-Q112 PolarHBondContact O-N 3.19Å; E110-V113 WeakPolarHBondContact O-CB 3.48Å; E110-V113 PolarHBondContact O-N 2.93Å; E110-V113 VanDerWaalsContact O-N 3.13Å; E110-E114 WeakPolarHBondContact O-CG 3.43Å; E110-E114 PolarHBondContact O-N 3.26Å
111R87Confident88.5Confident192 Ų19272.9 Ų72.973%0.72534%0.339SS*.Hα-helixtrans-60.3-39.3176-71.9-174177.9176.5-1.4113.1T109 V113 E114 R115T109-R111 VanDerWaalsContact C-N 3.25Å; T109-R111 PolarHBondContact O-N 2.94Å; R111-V113 VanDerWaalsContact C-N 3.34Å; R111-E114 PolarHBondContact O-N 3.19Å; R111-R115 WeakPolarHBondContact O-CB 3.38Å; R111-R115 VanDerWaalsContact O-CG 3.3Å; R111-R115 WeakPolarHBondContact O-CG 3.04Å; R111-R115 PolarHBondContact O-N 3.28Å
112Q88.2Confident88Confident95 Ų9572.8 Ų72.844%0.44433%0.331SS..Hα-helixtrans-66.8-37.8176.5-77.8168.1-3800111.5L108 T109 E110 W116L108-Q112 HydrophobicContact CB-CB 4.25Å; T109-Q112 WeakPolarHBondContact O-CB 3.35Å; T109-Q112 PolarHBondContact O-N 3.22Å; T109-Q112 WeakPolarHBondContact OG1-CB 3.48Å; T109-Q112 VanDerWaalsContact OG1-CD 3.31Å; T109-Q112 WeakPolarHBondContact OG1-CG 3.38Å; T109-Q112 PolarHBondContact OG1-N 3.37Å; T109-Q112 PolarHBondContact OG1-OE1 3.37Å; E110-Q112 VanDerWaalsContact C-N 3.34Å; E110-Q112 PolarHBondContact O-N 3.19Å; Q112-W116 VanDerWaalsContact O-CB 3.29Å; Q112-W116 WeakPolarHBondContact O-CB 3.44Å; Q112-W116 PolarHBondContact O-N 3.13Å
113V88.7Confident87.5Confident0 Ų075.9 Ų75.90%035%0.345CS..Hα-helixtrans-65.9-47.3174.3175.50000110.3L83 I99 L102 A103 L108 T109 E110 R111 R115 W116 F117L83-V113 HydrophobicContact CD2-CG1 3.97Å; L83-V113 HydrophobicContact CD2-CG2 4.34Å; I99-V113 HydrophobicContact CG2-CB 4.3Å; I99-V113 HydrophobicContact CG2-CG1 4.22Å; L102-V113 HydrophobicContact CB-CG1 4.11Å; A103-V113 HydrophobicContact CB-CG2 4.02Å; L108-V113 HydrophobicContact CB-CG2 4.03Å; L108-V113 HydrophobicContact CD1-CG2 4.35Å; T109-V113 PolarHBondContact O-N 3.23Å; T109-V113 VanDerWaalsContact O-N 3.09Å; E110-V113 WeakPolarHBondContact O-CB 3.48Å; E110-V113 PolarHBondContact O-N 2.93Å; E110-V113 VanDerWaalsContact O-N 3.13Å; R111-V113 VanDerWaalsContact C-N 3.34Å; V113-R115 PolarHBondContact O-N 3.49Å; V113-W116 WeakPolarHBondContact O-CB 3.36Å; V113-W116 PolarHBondContact O-N 3.49Å; V113-F117 HydrophobicContact CG1-CD2 3.71Å; V113-F117 HydrophobicContact CG1-CE2 3.67Å; V113-F117 VanDerWaalsContact O-CD2 3.28Å; V113-F117 WeakPolarHBondContact O-CD2 3.32Å; V113-F117 PolarHBondContact O-N 2.94Å
114E88.3Confident86.6Confident68 Ų6878.8 Ų78.832%0.31836%0.358SS..Hα-helixtrans-57.1-48.3175.2-75.1172-176.700112.5I99 E110 R111 W116 F117 R118I99-E114 HydrophobicContact CD1-CG 3.73Å; I99-E114 HydrophobicContact CG1-CG 4.43Å; I99-E114 HydrophobicContact CG2-CG 4.07Å; E110-E114 WeakPolarHBondContact O-CG 3.43Å; E110-E114 PolarHBondContact O-N 3.26Å; R111-E114 PolarHBondContact O-N 3.19Å; E114-W116 VanDerWaalsContact C-N 3.33Å; E114-W116 PolarHBondContact O-N 3Å; E114-F117 PolarHBondContact O-N 3.38Å; E114-R118 WeakPolarHBondContact O-CB 3.17Å; E114-R118 PolarHBondContact O-N 2.83Å
115R88.6Confident85.7Confident160 Ų16077.4 Ų77.460%0.60435%0.348SS*.Hα-helixtrans-59.4-43.1175.1-78.2-177.9178.1-176-2.5111.3R111 V113 R118 S119R111-R115 WeakPolarHBondContact O-CB 3.38Å; R111-R115 VanDerWaalsContact O-CG 3.3Å; R111-R115 WeakPolarHBondContact O-CG 3.04Å; R111-R115 PolarHBondContact O-N 3.28Å; V113-R115 PolarHBondContact O-N 3.49Å; R115-R118 PolarHBondContact O-N 3.3Å; R115-S119 VanDerWaalsContact O-CB 3.32Å; R115-S119 WeakPolarHBondContact O-CB 3.17Å; R115-S119 PolarHBondContact O-N 2.94Å
116W90.3Very high85Confident11 Ų1171.4 Ų71.44%0.04233%0.326CS..Hα-helixtrans-60.9-48.7176.8-173.496.9000111.6V77 T78 L83 E84 F87 Q112 V113 E114 R118 S119 R120V77-W116 HydrophobicContact CG1-CD2 4.36Å; V77-W116 HydrophobicContact CG1-CG 4.37Å; V77-W116 HydrophobicContact CG1-CZ2 4.08Å; T78-W116 PolarHBondContact O-NE1 3.18Å; L83-W116 VanDerWaalsContact C-CH2 3.46Å; L83-W116 HydrophobicContact CB-CD2 3.68Å; L83-W116 HydrophobicContact CB-CE3 3.53Å; L83-W116 HydrophobicContact CB-CH2 3.76Å; L83-W116 HydrophobicContact CB-CZ2 3.85Å; L83-W116 HydrophobicContact CB-CZ3 3.58Å; L83-W116 HydrophobicContact CD1-CB 3.87Å; L83-W116 HydrophobicContact CD1-CD2 3.55Å; L83-W116 HydrophobicContact CD1-CE3 3.95Å; L83-W116 HydrophobicContact CD1-CG 3.47Å; L83-W116 VanDerWaalsContact CD1-CG 3.47Å; L83-W116 HydrophobicContact CG-CD2 4.26Å; L83-W116 HydrophobicContact CG-CE3 4.31Å; E84-W116 HydrophobicContact CB-CH2 4.18Å; E84-W116 HydrophobicContact CB-CZ2 4.23Å; E84-W116 WeakPolarHBondContact OE2-CH2 3.28Å; F87-W116 HydrophobicContact CB-CH2 4.25Å; F87-W116 HydrophobicContact CB-CZ3 4.13Å; F87-W116 HydrophobicContact CD2-CZ3 4.42Å; Q112-W116 VanDerWaalsContact O-CB 3.29Å; Q112-W116 WeakPolarHBondContact O-CB 3.44Å; Q112-W116 PolarHBondContact O-N 3.13Å; V113-W116 WeakPolarHBondContact O-CB 3.36Å; V113-W116 PolarHBondContact O-N 3.49Å; E114-W116 VanDerWaalsContact C-N 3.33Å; E114-W116 PolarHBondContact O-N 3Å; W116-R118 VanDerWaalsContact C-N 3.31Å; W116-R118 PolarHBondContact O-N 2.88Å; W116-S119 PolarHBondContact O-N 3.11Å; W116-R120 HydrophobicContact CE3-CB 4.18Å; W116-R120 HydrophobicContact CH2-CB 4.01Å; W116-R120 HydrophobicContact CH2-CG 3.7Å; W116-R120 HydrophobicContact CZ2-CB 4.42Å; W116-R120 HydrophobicContact CZ2-CG 4.28Å; W116-R120 HydrophobicContact CZ3-CB 3.9Å; W116-R120 HydrophobicContact CZ3-CG 3.96Å; W116-R120 VanDerWaalsContact O-CB 3.23Å; W116-R120 WeakPolarHBondContact O-CB 3.27Å; W116-R120 PolarHBondContact O-N 2.86Å
117F88.8Confident84.7Confident2 Ų272.3 Ų72.31%0.00933%0.332CS..Hα-helixtrans-63.7-37.2177.5-86.6-82.9000111.9L83 F86 F87 P94 L102 V113 E114 R121L83-F117 HydrophobicContact CD2-CE2 3.93Å; F86-F117 AromaticContact CD1-CE1 3.95Å; F86-F117 HydrophobicContact CD1-CE1 3.95Å; F86-F117 AromaticContact CD1-CZ 3.57Å; F86-F117 HydrophobicContact CD1-CZ 3.57Å; F86-F117 HydrophobicContact CE1-CZ 4.21Å; F86-F117 HydrophobicContact CG-CZ 4.39Å; F87-F117 HydrophobicContact CB-CE1 4.08Å; F87-F117 AromaticContact CD2-CD1 3.74Å; F87-F117 HydrophobicContact CD2-CD1 3.74Å; F87-F117 AromaticContact CD2-CE1 3.88Å; F87-F117 HydrophobicContact CD2-CE1 3.88Å; F87-F117 HydrophobicContact CE2-CD1 4.48Å; P94-F117 HydrophobicContact CG-CB 4.48Å; P94-F117 HydrophobicContact CG-CD1 3.87Å; P94-F117 HydrophobicContact CG-CD2 3.78Å; P94-F117 HydrophobicContact CG-CE1 4Å; P94-F117 HydrophobicContact CG-CE2 3.9Å; P94-F117 HydrophobicContact CG-CG 3.79Å; P94-F117 HydrophobicContact CG-CZ 4.04Å; L102-F117 HydrophobicContact CD1-CE2 3.64Å; L102-F117 HydrophobicContact CD1-CZ 3.73Å; V113-F117 HydrophobicContact CG1-CD2 3.71Å; V113-F117 HydrophobicContact CG1-CE2 3.67Å; V113-F117 VanDerWaalsContact O-CD2 3.28Å; V113-F117 WeakPolarHBondContact O-CD2 3.32Å; V113-F117 PolarHBondContact O-N 2.94Å; E114-F117 PolarHBondContact O-N 3.38Å; F117-R121 WeakPolarHBondContact O-CG 3.07Å; F117-R121 PolarHBondContact O-N 3.41Å
118R84.8Confident84.5Confident115 Ų11569.1 Ų69.143%0.43431%0.308SS..Hα-helixtrans-63-54.2174.3-170.6-171.8-62.8-167.6-0.5111E114 R115 W116 R120 R121 N122 E350E114-R118 WeakPolarHBondContact O-CB 3.17Å; E114-R118 PolarHBondContact O-N 2.83Å; R115-R118 PolarHBondContact O-N 3.3Å; W116-R118 VanDerWaalsContact C-N 3.31Å; W116-R118 PolarHBondContact O-N 2.88Å; R118-R120 VanDerWaalsContact C-N 3.31Å; R118-R120 PolarHBondContact O-N 3.32Å; R118-R121 PolarHBondContact O-N 3.32Å; R118-N122 WeakPolarHBondContact O-CB 3.2Å; R118-N122 PolarHBondContact O-N 2.94Å; R118-E350 IonicContact NH1-OE1 3.3Å; R118-E350 PolarHBondContact NH1-OE1 2.82Å; R118-E350 IonicContact NH1-OE2 2.74Å
119S84.4Confident84.4Confident36 Ų3666.6 Ų66.625%0.25230%0.295SS..Hα-helixtrans-60-40.3179.3-171.80000111.7V77 R115 W116 R121 N122 Q123V77-S119 VanDerWaalsContact CG2-OG 3.26Å; V77-S119 WeakPolarHBondContact CG2-OG 3.18Å; R115-S119 VanDerWaalsContact O-CB 3.32Å; R115-S119 WeakPolarHBondContact O-CB 3.17Å; R115-S119 PolarHBondContact O-N 2.94Å; W116-S119 PolarHBondContact O-N 3.11Å; S119-R121 PolarHBondContact O-N 2.91Å; S119-N122 CarbonylContact O-C 3.53Å; S119-N122 PolarHBondContact O-N 3.39Å; S119-N122 VanDerWaalsContact O-N 3.15Å; S119-Q123 PolarHBondContact O-N 3.01Å
120R86.3Confident84.2Confident31 Ų3166.9 Ų66.912%0.11729%0.29CS..Hα-helixtrans-66.5-36.4177-173.959.8-179.579.92.9113.9V77 E84 F87 W116 R118 E124V77-R120 HydrophobicContact CG2-CB 4.37Å; E84-R120 IonicContact OE1-CZ 3.55Å; E84-R120 IonicContact OE1-NE 3.35Å; E84-R120 PolarHBondContact OE1-NE 3.23Å; E84-R120 IonicContact OE1-NH2 2.85Å; E84-R120 PolarHBondContact OE1-NH2 3.37Å; E84-R120 IonicContact OE2-CZ 3.78Å; E84-R120 IonicContact OE2-NE 2.85Å; E84-R120 PolarHBondContact OE2-NE 3.46Å; E84-R120 IonicContact OE2-NH2 3.82Å; F87-R120 HydrophobicContact CD1-CG 4.24Å; F87-R120 HydrophobicContact CD2-CG 4.12Å; F87-R120 HydrophobicContact CE1-CG 4.22Å; F87-R120 HydrophobicContact CE2-CG 4.09Å; F87-R120 HydrophobicContact CG-CG 4.2Å; F87-R120 HydrophobicContact CZ-CG 4.14Å; W116-R120 HydrophobicContact CE3-CB 4.18Å; W116-R120 HydrophobicContact CH2-CB 4.01Å; W116-R120 HydrophobicContact CH2-CG 3.7Å; W116-R120 HydrophobicContact CZ2-CB 4.42Å; W116-R120 HydrophobicContact CZ2-CG 4.28Å; W116-R120 HydrophobicContact CZ3-CB 3.9Å; W116-R120 HydrophobicContact CZ3-CG 3.96Å; W116-R120 VanDerWaalsContact O-CB 3.23Å; W116-R120 WeakPolarHBondContact O-CB 3.27Å; W116-R120 PolarHBondContact O-N 2.86Å; R118-R120 VanDerWaalsContact C-N 3.31Å; R118-R120 PolarHBondContact O-N 3.32Å; R120-E124 IonicContact CZ-OE1 3.72Å; R120-E124 VanDerWaalsContact NH1-CG 3.3Å; R120-E124 IonicContact NH1-OE1 3.23Å; R120-E124 PolarHBondContact NH1-OE1 2.83Å; R120-E124 IonicContact NH2-OE1 3.74Å
121R85.4Confident84.1Confident75 Ų7565.7 Ų65.728%0.28328%0.284SS..Hα-helixtrans-67.9-39.9169.6-72.2-172.9-58.6-96.4-0.3111.3F87 R92 F117 R118 S119 Q123 E124F87-R121 HydrophobicContact CE2-CG 3.76Å; F87-R121 HydrophobicContact CZ-CG 4.16Å; R92-R121 WeakPolarHBondContact O-CD 3.36Å; R92-R121 PolarHBondContact O-NH1 3.49Å; F117-R121 WeakPolarHBondContact O-CG 3.07Å; F117-R121 PolarHBondContact O-N 3.41Å; R118-R121 PolarHBondContact O-N 3.32Å; S119-R121 PolarHBondContact O-N 2.91Å; R121-Q123 VanDerWaalsContact C-N 3.28Å; R121-Q123 PolarHBondContact O-N 3.06Å; R121-E124 PolarHBondContact O-N 2.94Å; R121-E124 VanDerWaalsContact O-N 3.15Å
122N79.7Confident84.3Confident28 Ų2856.6 Ų56.615%0.1525%0.249CC..Hα-helixtrans-69.3-24.5179.3-74.2-2.8000113R75 R118 S119 E124 R125R75-N122 WeakPolarHBondContact CD-O 3.45Å; R75-N122 PolarHBondContact NH1-O 3.13Å; R118-N122 WeakPolarHBondContact O-CB 3.2Å; R118-N122 PolarHBondContact O-N 2.94Å; S119-N122 CarbonylContact O-C 3.53Å; S119-N122 PolarHBondContact O-N 3.39Å; S119-N122 VanDerWaalsContact O-N 3.15Å; N122-E124 VanDerWaalsContact C-N 3.35Å; N122-R125 WeakPolarHBondContact O-CB 3.37Å; N122-R125 PolarHBondContact O-N 3.13Å
123Q79Confident84.5Confident73 Ų7353.7 Ų53.734%0.34124%0.236SC..Hα-helixtrans-66.4-30.8168.8-84.5-170.4-22.800113.8R75 V77 S119 R121 R125R75-Q123 HydrophobicContact CB-CG 3.97Å; R75-Q123 WeakPolarHBondContact O-CG 3.49Å; R75-Q123 PolarHBondContact O-NE2 3.45Å; V77-Q123 HydrophobicContact CG2-CG 3.63Å; V77-Q123 VanDerWaalsContact CG2-NE2 3.28Å; S119-Q123 PolarHBondContact O-N 3.01Å; R121-Q123 VanDerWaalsContact C-N 3.28Å; R121-Q123 PolarHBondContact O-N 3.06Å; Q123-R125 VanDerWaalsContact C-N 3.27Å
124E73.8Confident84.6Confident68 Ų6854.5 Ų54.532%0.31824%0.239SC..Hα-helixtrans-78.9-15.3177.7-61.7-172.8166.200112F87 R120 R121 N122 V200F87-E124 WeakPolarHBondContact CE1-OE1 3.47Å; R120-E124 IonicContact CZ-OE1 3.72Å; R120-E124 VanDerWaalsContact NH1-CG 3.3Å; R120-E124 IonicContact NH1-OE1 3.23Å; R120-E124 PolarHBondContact NH1-OE1 2.83Å; R120-E124 IonicContact NH2-OE1 3.74Å; R121-E124 PolarHBondContact O-N 2.94Å; R121-E124 VanDerWaalsContact O-N 3.15Å; N122-E124 VanDerWaalsContact C-N 3.35Å; E124-V200 WeakPolarHBondContact O-CG2 3.46Å
125R72.4Confident84.8Confident124 Ų12451.4 Ų51.447%0.46823%0.226SC..SBendtrans-70.2141.1176-68.4-178173.1-173-3.2110N122 Q123 S127 E347N122-R125 WeakPolarHBondContact O-CB 3.37Å; N122-R125 PolarHBondContact O-N 3.13Å; Q123-R125 VanDerWaalsContact C-N 3.27Å; R125-S127 PolarHBondContact O-N 3.15Å; R125-E347 IonicContact NH1-OE1 3.49Å; R125-E347 PolarHBondContact NH1-OE1 2.76Å
126P73.8Confident85.1Confident35 Ų3544 Ų4423%0.22720%0.198CC..PPolyproline II helixtrans-61.3134.4175.926.1-33.2000109.9K130 K131P126-K130 HydrophobicContact CB-CB 4.42Å; P126-K130 HydrophobicContact CB-CD 4.12Å; P126-K130 HydrophobicContact CB-CG 4.47Å; P126-K131 HydrophobicContact CB-CG 4.32Å; P126-K131 HydrophobicContact CG-CG 4.17Å
127S82.1Confident85.4Confident43 Ų4344.1 Ų44.130%0.30120%0.199SC..PPolyproline II helixtrans-60.2153.7176.4650000111.1R125 M129 K130 K131R125-S127 PolarHBondContact O-N 3.15Å; S127-M129 PolarHBondContact O-N 3.02Å; S127-K130 WeakPolarHBondContact O-CA 3.05Å; S127-K130 WeakPolarHBondContact O-CB 3.34Å; S127-K130 PolarHBondContact O-N 3.44Å; S127-K130 PolarHBondContact OG-N 3.35Å; S127-K131 PolarHBondContact O-N 2.98Å
128R83.3Confident85.7Confident87 Ų8745.7 Ų45.733%0.32821%0.205SC..Hα-helixtrans-52.7-39.6174.4-173.1171.5167.7166.10.8111.8I70 K131 F132 Y253 G255 E348I70-R128 HydrophobicContact CG2-CG 4.3Å; R128-K131 PolarHBondContact O-N 3.42Å; R128-F132 PolarHBondContact O-N 3.17Å; R128-Y253 PolarHBondContact NE-O 3.41Å; R128-Y253 PolarHBondContact NH2-O 3.38Å; R128-G255 VanDerWaalsContact NH2-N 3.11Å; R128-E348 IonicContact CZ-OE1 2.77Å; R128-E348 IonicContact NH1-OE1 2.91Å; R128-E348 PolarHBondContact NH1-OE1 3.28Å
129M86.9Confident86.2Confident4 Ų442.7 Ų42.72%0.0220%0.195CC..Hα-helixtrans-55.9-50.5171.1178.962.87000112.3A65 K66 I70 S127 F132 Q133A65-M129 HydrophobicContact CB-CE 3.77Å; A65-M129 HydrophobicContact CB-SD 3.31Å; A65-M129 WeakPolarHBondContact CB-SD 3.46Å; K66-M129 HydrophobicContact CG-CE 4.34Å; I70-M129 HydrophobicContact CB-CE 4.29Å; I70-M129 HydrophobicContact CG2-CB 4.45Å; I70-M129 HydrophobicContact CG2-CE 4.1Å; I70-M129 VanDerWaalsContact O-CE 3.3Å; I70-M129 WeakPolarHBondContact O-CE 3.47Å; S127-M129 PolarHBondContact O-N 3.02Å; M129-F132 PolarHBondContact O-N 2.97Å; M129-Q133 VanDerWaalsContact O-CG 3.31Å; M129-Q133 WeakPolarHBondContact O-CG 3.19Å; M129-Q133 PolarHBondContact O-N 2.68Å; M129-Q133 HydrophobicContact SD-CG 4.48Å
130K87.1Confident86.8Confident85 Ų8542.1 Ų42.137%0.3719%0.192SC..Hα-helixtrans-63.8-43.9179.1-172.8175.1177.4-174.20111.3P126 S127 F132 Q133 E134P126-K130 HydrophobicContact CB-CB 4.42Å; P126-K130 HydrophobicContact CB-CD 4.12Å; P126-K130 HydrophobicContact CB-CG 4.47Å; S127-K130 WeakPolarHBondContact O-CA 3.05Å; S127-K130 WeakPolarHBondContact O-CB 3.34Å; S127-K130 PolarHBondContact O-N 3.44Å; S127-K130 PolarHBondContact OG-N 3.35Å; K130-F132 VanDerWaalsContact C-N 3.31Å; K130-F132 PolarHBondContact O-N 3.24Å; K130-Q133 PolarHBondContact O-N 2.88Å; K130-E134 VanDerWaalsContact CE-OE1 3.3Å; K130-E134 WeakPolarHBondContact CE-OE1 3.31Å; K130-E134 VanDerWaalsContact O-CG 3.3Å; K130-E134 WeakPolarHBondContact O-CG 3.41Å; K130-E134 PolarHBondContact O-N 2.95Å
131K87.2Confident87.3Confident48 Ų4841.6 Ų41.621%0.20919%0.191CC..Hα-helixtrans-58-43.1175.7-64.1179.6-176174.50111.5P126 S127 R128 E134 A135 Y253P126-K131 HydrophobicContact CB-CG 4.32Å; P126-K131 HydrophobicContact CG-CG 4.17Å; S127-K131 PolarHBondContact O-N 2.98Å; R128-K131 PolarHBondContact O-N 3.42Å; K131-E134 PolarHBondContact O-N 3.17Å; K131-A135 WeakPolarHBondContact O-CB 3.25Å; K131-A135 PolarHBondContact O-N 2.93Å; K131-Y253 HydrophobicContact CB-CD1 4.43Å; K131-Y253 HydrophobicContact CB-CD2 4.03Å; K131-Y253 HydrophobicContact CB-CE1 4.08Å; K131-Y253 HydrophobicContact CB-CE2 3.6Å; K131-Y253 HydrophobicContact CB-CG 4.42Å; K131-Y253 HydrophobicContact CD-CE1 3.85Å
132F90.9Very high87.8Confident1 Ų138.8 Ų38.80%0.00418%0.18CC..Hα-helixtrans-63-45.9175.2-179.4-83.6000112.4L64 A65 F68 I70 R128 M129 K130 E134 A135 C136 M250 Y253L64-F132 HydrophobicContact CB-CE1 4.44Å; L64-F132 HydrophobicContact CD2-CE1 4.26Å; L64-F132 HydrophobicContact CD2-CZ 4.11Å; L64-F132 HydrophobicContact CG-CE1 4.33Å; L64-F132 HydrophobicContact CG-CZ 4.18Å; A65-F132 HydrophobicContact CB-CD1 3.53Å; A65-F132 HydrophobicContact CB-CE1 3.72Å; A65-F132 HydrophobicContact CB-CG 4.23Å; F68-F132 HydrophobicContact CD2-CE2 4.11Å; F68-F132 AromaticContact CD2-CZ 3.72Å; F68-F132 HydrophobicContact CD2-CZ 3.72Å; F68-F132 HydrophobicContact CE2-CZ 4.1Å; I70-F132 HydrophobicContact CD1-CB 3.89Å; I70-F132 HydrophobicContact CD1-CD1 4.35Å; I70-F132 HydrophobicContact CD1-CD2 3.41Å; I70-F132 VanDerWaalsContact CD1-CD2 3.41Å; I70-F132 HydrophobicContact CD1-CE2 3.99Å; I70-F132 HydrophobicContact CD1-CG 3.62Å; R128-F132 PolarHBondContact O-N 3.17Å; M129-F132 PolarHBondContact O-N 2.97Å; K130-F132 VanDerWaalsContact C-N 3.31Å; K130-F132 PolarHBondContact O-N 3.24Å; F132-E134 VanDerWaalsContact C-N 3.3Å; F132-E134 PolarHBondContact O-N 3.14Å; F132-A135 PolarHBondContact O-N 2.67Å; F132-C136 HydrophobicContact CD1-CB 4.42Å; F132-C136 HydrophobicContact CE1-CB 4.2Å; F132-C136 WeakPolarHBondContact O-CB 3.48Å; F132-C136 PolarHBondContact O-N 3.27Å; F132-M250 HydrophobicContact CD2-CB 4.14Å; F132-M250 HydrophobicContact CD2-CG 4.41Å; F132-M250 WeakPolarHBondContact CD2-O 3.07Å; F132-M250 HydrophobicContact CE1-CE 4.48Å; F132-M250 HydrophobicContact CE2-CB 3.79Å; F132-M250 HydrophobicContact CE2-CE 4.15Å; F132-M250 HydrophobicContact CE2-CG 4.2Å; F132-M250 WeakPolarHBondContact CE2-O 3.31Å; F132-M250 HydrophobicContact CZ-CE 3.8Å; F132-Y253 HydrophobicContact CB-CD2 4.2Å
133Q92Very high88.7Confident33 Ų3340.8 Ų40.815%0.15419%0.191CC..Hα-helixtrans-59.2-42.2177.6-71.9167.7-15.900111.9E57 A61 S62 M129 K130 C136 W137E57-Q133 HydrophobicContact CG-CB 4.25Å; A61-Q133 HydrophobicContact CB-CB 4.17Å; A61-Q133 HydrophobicContact CB-CG 3.96Å; S62-Q133 PolarHBondContact OG-NE2 3.17Å; M129-Q133 VanDerWaalsContact O-CG 3.31Å; M129-Q133 WeakPolarHBondContact O-CG 3.19Å; M129-Q133 PolarHBondContact O-N 2.68Å; M129-Q133 HydrophobicContact SD-CG 4.48Å; K130-Q133 PolarHBondContact O-N 2.88Å; Q133-C136 PolarHBondContact O-N 3.36Å; Q133-W137 PolarHBondContact O-N 2.93Å
134E91Very high89.5Confident17 Ų1742.1 Ų42.18%0.07920%0.203CC..Hα-helixtrans-65.7-44177.5-66.5-177.4172.200112.2K130 K131 F132 W137 R138 R195K130-E134 VanDerWaalsContact CE-OE1 3.3Å; K130-E134 WeakPolarHBondContact CE-OE1 3.31Å; K130-E134 VanDerWaalsContact O-CG 3.3Å; K130-E134 WeakPolarHBondContact O-CG 3.41Å; K130-E134 PolarHBondContact O-N 2.95Å; K131-E134 PolarHBondContact O-N 3.17Å; F132-E134 VanDerWaalsContact C-N 3.3Å; F132-E134 PolarHBondContact O-N 3.14Å; E134-W137 PolarHBondContact O-N 3.14Å; E134-R138 WeakPolarHBondContact O-CG 3.23Å; E134-R138 PolarHBondContact O-N 3.49Å; E134-R138 VanDerWaalsContact O-N 3.14Å; E134-R195 IonicContact OE1-NH1 2.96Å
135A92.6Very high90.6Very high4 Ų439 Ų393%0.03319%0.189CC..Hα-helixtrans-64.4-42.3175.800000111.7K131 F132 W137 R138 F139 E246 K249 M250 Y253K131-A135 WeakPolarHBondContact O-CB 3.25Å; K131-A135 PolarHBondContact O-N 2.93Å; F132-A135 PolarHBondContact O-N 2.67Å; A135-W137 PolarHBondContact O-N 3.47Å; A135-R138 PolarHBondContact O-N 2.82Å; A135-F139 WeakPolarHBondContact O-CB 3Å; A135-F139 PolarHBondContact O-N 3.3Å; A135-E246 WeakPolarHBondContact CA-OE2 3.33Å; A135-K249 HydrophobicContact CB-CB 4.12Å; A135-M250 HydrophobicContact CB-CG 3.84Å; A135-Y253 HydrophobicContact CB-CE2 4.27Å
136C95.7Very high91.7Very high4 Ų433.6 Ų33.63%0.02717%0.17CC..Hα-helixtrans-62.8-41.4178-174.60000112.5F56 A61 F132 Q133 A140 M250F56-C136 HydrophobicContact CE1-CB 4.47Å; A61-C136 HydrophobicContact CB-CB 4.11Å; F132-C136 HydrophobicContact CD1-CB 4.42Å; F132-C136 HydrophobicContact CE1-CB 4.2Å; F132-C136 WeakPolarHBondContact O-CB 3.48Å; F132-C136 PolarHBondContact O-N 3.27Å; Q133-C136 PolarHBondContact O-N 3.36Å; C136-A140 WeakPolarHBondContact O-CB 3.49Å; C136-A140 PolarHBondContact O-N 3Å; C136-M250 VanDerWaalsContact CA-SD 3.58Å; C136-M250 HydrophobicContact CB-CE 3.93Å; C136-M250 HydrophobicContact CB-CG 4.43Å; C136-M250 HydrophobicContact CB-SD 4.03Å
137W95.8Very high92.7Very high13 Ų1336.2 Ų36.25%0.04919%0.185CC..Hα-helixtrans-61.6-47173.7169.2-105000112.1L49 I52 R53 F56 Q133 E134 A135 A140 F141 F188L49-W137 HydrophobicContact CD2-CH2 4.44Å; L49-W137 HydrophobicContact CD2-CZ2 4.37Å; I52-W137 HydrophobicContact CB-CH2 4.19Å; I52-W137 HydrophobicContact CG2-CH2 3.7Å; I52-W137 HydrophobicContact CG2-CZ3 3.86Å; R53-W137 HydrophobicContact CB-CD2 3.81Å; R53-W137 HydrophobicContact CB-CE3 4.12Å; R53-W137 HydrophobicContact CB-CG 4.39Å; R53-W137 HydrophobicContact CB-CH2 4.07Å; R53-W137 HydrophobicContact CB-CZ2 3.76Å; R53-W137 HydrophobicContact CB-CZ3 4.25Å; R53-W137 VanDerWaalsContact CD-CD1 3.47Å; R53-W137 HydrophobicContact CG-CB 4.42Å; R53-W137 HydrophobicContact CG-CD2 3.64Å; R53-W137 HydrophobicContact CG-CE3 4.23Å; R53-W137 HydrophobicContact CG-CG 3.7Å; R53-W137 HydrophobicContact CG-CZ2 4.41Å; F56-W137 HydrophobicContact CB-CE3 3.79Å; F56-W137 HydrophobicContact CB-CZ3 3.87Å; F56-W137 HydrophobicContact CD1-CB 4.28Å; F56-W137 AromaticContact CD1-CE3 3.71Å; F56-W137 HydrophobicContact CD1-CE3 3.71Å; F56-W137 HydrophobicContact CD2-CE3 4.38Å; F56-W137 HydrophobicContact CD2-CZ3 4.48Å; F56-W137 HydrophobicContact CE1-CB 4.42Å; F56-W137 HydrophobicContact CE1-CE3 4.39Å; F56-W137 AromaticContact CG-CE3 3.7Å; F56-W137 HydrophobicContact CG-CE3 3.7Å; F56-W137 HydrophobicContact CG-CZ3 4.06Å; Q133-W137 PolarHBondContact O-N 2.93Å; E134-W137 PolarHBondContact O-N 3.14Å; A135-W137 PolarHBondContact O-N 3.47Å; W137-A140 PolarHBondContact O-N 2.93Å; W137-F141 PolarHBondContact O-N 3.39Å; W137-F188 AromaticContact NE1-CE2 3.6Å
138R94.9Very high93.4Very high36 Ų3635.3 Ų35.314%0.13618%0.18CC..Hα-helixtrans-63.7-45179-70.2174.7174.1-171.2-3.6111.3E134 A135 A140 F141 Y142 F188 E246E134-R138 WeakPolarHBondContact O-CG 3.23Å; E134-R138 PolarHBondContact O-N 3.49Å; E134-R138 VanDerWaalsContact O-N 3.14Å; A135-R138 PolarHBondContact O-N 2.82Å; R138-A140 PolarHBondContact O-N 3.24Å; R138-F141 PolarHBondContact O-N 3.04Å; R138-Y142 HydrophobicContact CB-CD2 4.19Å; R138-Y142 HydrophobicContact CB-CE2 4.08Å; R138-Y142 WeakPolarHBondContact O-CB 3.47Å; R138-Y142 WeakPolarHBondContact O-CD2 3.49Å; R138-Y142 PolarHBondContact O-N 3.1Å; R138-F188 HydrophobicContact CG-CZ 4.22Å; R138-E246 HydrophobicContact CB-CB 4.48Å; R138-E246 HydrophobicContact CB-CG 3.78Å; R138-E246 IonicContact NH1-OE1 3.24Å
139F96.4Very high94Very high52 Ų5231.1 Ų31.123%0.22816%0.164CC..Hα-helixtrans-54.3-50.4173.7168.6-102.1000111.8A135 F141 Y142 L143 I243 E246 S247 M250A135-F139 WeakPolarHBondContact O-CB 3Å; A135-F139 PolarHBondContact O-N 3.3Å; F139-F141 VanDerWaalsContact C-N 3.34Å; F139-F141 PolarHBondContact O-N 3.38Å; F139-Y142 PolarHBondContact O-N 2.56Å; F139-L143 HydrophobicContact CE1-CD2 4.21Å; F139-L143 HydrophobicContact CZ-CD2 4.04Å; F139-L143 VanDerWaalsContact O-CB 3.23Å; F139-L143 WeakPolarHBondContact O-CB 3.1Å; F139-L143 PolarHBondContact O-N 2.87Å; F139-I243 HydrophobicContact CD2-CG2 3.98Å; F139-I243 WeakPolarHBondContact CD2-O 3.23Å; F139-I243 HydrophobicContact CE2-CG2 3.59Å; F139-E246 HydrophobicContact CB-CB 3.92Å; F139-S247 WeakPolarHBondContact CD2-OG 3.29Å; F139-S247 WeakPolarHBondContact CE2-OG 3.03Å; F139-M250 HydrophobicContact CB-SD 3.81Å; F139-M250 HydrophobicContact CD1-SD 4.11Å; F139-M250 HydrophobicContact CG-SD 3.98Å
140A97.1Very high94.4Very high23 Ų2334.5 Ų34.519%0.1918%0.184CC..Hα-helixtrans-61.6-42.3-179.600000112F56 C136 W137 R138 V144F56-A140 HydrophobicContact CE1-CB 4.4Å; F56-A140 HydrophobicContact CE2-CB 3.98Å; F56-A140 HydrophobicContact CZ-CB 3.66Å; C136-A140 WeakPolarHBondContact O-CB 3.49Å; C136-A140 PolarHBondContact O-N 3Å; W137-A140 PolarHBondContact O-N 2.93Å; R138-A140 PolarHBondContact O-N 3.24Å; A140-V144 VanDerWaalsContact O-CG2 3.31Å; A140-V144 WeakPolarHBondContact O-CG2 3.43Å; A140-V144 PolarHBondContact O-N 2.65Å; A140-V144 VanDerWaalsContact O-N 3.13Å
141F96.6Very high94.8Very high20 Ų2033.5 Ų33.59%0.08819%0.192CC..Hα-helixtrans-63.8-52.9176.3-176.6-89.3000111.7L49 W137 R138 F139 L143 V144 I145 F188L49-F141 HydrophobicContact CD1-CE2 4.37Å; L49-F141 HydrophobicContact CD2-CE2 4.36Å; W137-F141 PolarHBondContact O-N 3.39Å; R138-F141 PolarHBondContact O-N 3.04Å; F139-F141 VanDerWaalsContact C-N 3.34Å; F139-F141 PolarHBondContact O-N 3.38Å; F141-L143 VanDerWaalsContact C-N 3.27Å; F141-L143 PolarHBondContact O-N 3.3Å; F141-V144 PolarHBondContact O-N 3.4Å; F141-V144 VanDerWaalsContact O-N 3.15Å; F141-I145 HydrophobicContact CD1-CB 4.48Å; F141-I145 HydrophobicContact CD1-CG2 4.22Å; F141-I145 HydrophobicContact CE1-CB 4.01Å; F141-I145 HydrophobicContact CE1-CG1 4.14Å; F141-I145 HydrophobicContact CE1-CG2 3.91Å; F141-I145 HydrophobicContact CZ-CB 4.27Å; F141-I145 HydrophobicContact CZ-CG1 4.1Å; F141-I145 WeakPolarHBondContact O-CB 3.22Å; F141-I145 PolarHBondContact O-N 3.46Å; F141-F188 HydrophobicContact CB-CD2 4.14Å; F141-F188 HydrophobicContact CB-CE2 3.68Å; F141-F188 HydrophobicContact CB-CZ 4.08Å; F141-F188 HydrophobicContact CD1-CB 4.14Å; F141-F188 AromaticContact CD1-CD1 3.53Å; F141-F188 HydrophobicContact CD1-CD1 3.53Å; F141-F188 AromaticContact CD1-CD2 3.53Å; F141-F188 HydrophobicContact CD1-CD2 3.53Å; F141-F188 AromaticContact CD1-CE1 3.63Å; F141-F188 HydrophobicContact CD1-CE1 3.63Å; F141-F188 AromaticContact CD1-CE2 3.62Å; F141-F188 HydrophobicContact CD1-CE2 3.62Å; F141-F188 AromaticContact CD1-CG 3.47Å; F141-F188 HydrophobicContact CD1-CG 3.47Å; F141-F188 VanDerWaalsContact CD1-CG 3.47Å; F141-F188 AromaticContact CD1-CZ 3.67Å; F141-F188 HydrophobicContact CD1-CZ 3.67Å; F141-F188 HydrophobicContact CD2-CB 4.31Å; F141-F188 AromaticContact CD2-CD2 3.58Å; F141-F188 HydrophobicContact CD2-CD2 3.58Å; F141-F188 HydrophobicContact CD2-CE2 4.03Å; F141-F188 HydrophobicContact CD2-CG 4.05Å; F141-F188 HydrophobicContact CE1-CB 3.47Å; F141-F188 VanDerWaalsContact CE1-CB 3.47Å; F141-F188 AromaticContact CE1-CD1 3.41Å; F141-F188 HydrophobicContact CE1-CD1 3.41Å; F141-F188 VanDerWaalsContact CE1-CD1 3.41Å; F141-F188 AromaticContact CE1-CD2 3.8Å; F141-F188 HydrophobicContact CE1-CD2 3.8Å; F141-F188 HydrophobicContact CE1-CE1 4Å; F141-F188 HydrophobicContact CE1-CE2 4.33Å; F141-F188 AromaticContact CE1-CG 3.29Å; F141-F188 HydrophobicContact CE1-CG 3.29Å; F141-F188 HydrophobicContact CE1-CZ 4.42Å; F141-F188 HydrophobicContact CE2-CB 3.66Å; F141-F188 AromaticContact CE2-CD2 3.83Å; F141-F188 HydrophobicContact CE2-CD2 3.83Å; F141-F188 AromaticContact CE2-CG 3.88Å; F141-F188 HydrophobicContact CE2-CG 3.88Å; F141-F188 HydrophobicContact CG-CD1 4.31Å; F141-F188 AromaticContact CG-CD2 3.43Å; F141-F188 HydrophobicContact CG-CD2 3.43Å; F141-F188 VanDerWaalsContact CG-CD2 3.43Å; F141-F188 HydrophobicContact CG-CE1 4.34Å; F141-F188 AromaticContact CG-CE2 3.46Å; F141-F188 HydrophobicContact CG-CE2 3.46Å; F141-F188 VanDerWaalsContact CG-CE2 3.46Å; F141-F188 AromaticContact CG-CG 3.86Å; F141-F188 HydrophobicContact CG-CG 3.86Å; F141-F188 AromaticContact CG-CZ 3.94Å; F141-F188 HydrophobicContact CG-CZ 3.94Å; F141-F188 HydrophobicContact CZ-CB 3.21Å; F141-F188 HydrophobicContact CZ-CD1 4.11Å; F141-F188 AromaticContact CZ-CD2 3.96Å; F141-F188 HydrophobicContact CZ-CD2 3.96Å; F141-F188 AromaticContact CZ-CG 3.53Å; F141-F188 HydrophobicContact CZ-CG 3.53Å
142Y96.3Very high95.2Very high16 Ų1634.2 Ų34.26%0.06320%0.195CC..Hα-helixtrans-61.4-36.3-178.9-73.2-54.4000112.5R138 F139 I145 T146 F188 D242 E246R138-Y142 HydrophobicContact CB-CD2 4.19Å; R138-Y142 HydrophobicContact CB-CE2 4.08Å; R138-Y142 WeakPolarHBondContact O-CB 3.47Å; R138-Y142 WeakPolarHBondContact O-CD2 3.49Å; R138-Y142 PolarHBondContact O-N 3.1Å; F139-Y142 PolarHBondContact O-N 2.56Å; Y142-I145 HydrophobicContact CD1-CG2 4.42Å; Y142-T146 WeakPolarHBondContact O-CB 3.09Å; Y142-T146 PolarHBondContact O-N 2.91Å; Y142-T146 PolarHBondContact O-OG1 3.42Å; Y142-F188 AromaticContact CE1-CE1 3.97Å; Y142-F188 HydrophobicContact CE1-CE1 3.97Å; Y142-F188 HydrophobicContact CE2-CE1 4.26Å; Y142-F188 HydrophobicContact CE2-CZ 4.43Å; Y142-F188 AromaticContact CZ-CE1 3.71Å; Y142-D242 HydrophobicContact CD1-CB 4.25Å; Y142-D242 HydrophobicContact CD2-CB 3.87Å; Y142-D242 HydrophobicContact CE1-CB 4.3Å; Y142-D242 HydrophobicContact CE2-CB 3.93Å; Y142-D242 HydrophobicContact CG-CB 4.05Å; Y142-E246 HydrophobicContact CD2-CG 4.19Å; Y142-E246 HydrophobicContact CE2-CG 4.33Å
143L96.9Very high95.3Very high71 Ų7134.2 Ų34.237%0.37220%0.196SC..Hα-helixtrans-61.9-50.9174.3-178.965.1000111.2F139 F141 V147 I243F139-L143 HydrophobicContact CE1-CD2 4.21Å; F139-L143 HydrophobicContact CZ-CD2 4.04Å; F139-L143 VanDerWaalsContact O-CB 3.23Å; F139-L143 WeakPolarHBondContact O-CB 3.1Å; F139-L143 PolarHBondContact O-N 2.87Å; F141-L143 VanDerWaalsContact C-N 3.27Å; F141-L143 PolarHBondContact O-N 3.3Å; L143-V147 WeakPolarHBondContact O-CB 3.34Å; L143-V147 VanDerWaalsContact O-CG2 3.25Å; L143-V147 WeakPolarHBondContact O-CG2 3.34Å; L143-V147 PolarHBondContact O-N 3.12Å; L143-V147 VanDerWaalsContact O-N 3.08Å; L143-I243 HydrophobicContact CD1-CD1 4.3Å; L143-I243 HydrophobicContact CD1-CG2 4.44Å
144V96.6Very high95.5Very high100 Ų10040.3 Ų40.361%0.60622%0.218SC*.Hα-helixtrans-63.2-46.2-179.5170.10000111A140 F141 V147 A148A140-V144 VanDerWaalsContact O-CG2 3.31Å; A140-V144 WeakPolarHBondContact O-CG2 3.43Å; A140-V144 PolarHBondContact O-N 2.65Å; A140-V144 VanDerWaalsContact O-N 3.13Å; F141-V144 PolarHBondContact O-N 3.4Å; F141-V144 VanDerWaalsContact O-N 3.15Å; V144-V147 PolarHBondContact O-N 3.04Å; V144-A148 WeakPolarHBondContact O-CB 3.4Å; V144-A148 PolarHBondContact O-N 2.96Å
145I95.9Very high95.6Very high4 Ų444.6 Ų44.62%0.02124%0.241CC..Hα-helixtrans-72.9-33.5-173.9-150.743.5000112F141 Y142 A148 G149 Y181 L184 E185 D239F141-I145 HydrophobicContact CD1-CB 4.48Å; F141-I145 HydrophobicContact CD1-CG2 4.22Å; F141-I145 HydrophobicContact CE1-CB 4.01Å; F141-I145 HydrophobicContact CE1-CG1 4.14Å; F141-I145 HydrophobicContact CE1-CG2 3.91Å; F141-I145 HydrophobicContact CZ-CB 4.27Å; F141-I145 HydrophobicContact CZ-CG1 4.1Å; F141-I145 WeakPolarHBondContact O-CB 3.22Å; F141-I145 PolarHBondContact O-N 3.46Å; Y142-I145 HydrophobicContact CD1-CG2 4.42Å; I145-A148 PolarHBondContact O-N 3.2Å; I145-G149 PolarHBondContact O-N 3.11Å; I145-Y181 HydrophobicContact CD1-CD2 3.76Å; I145-Y181 HydrophobicContact CD1-CE2 4.08Å; I145-Y181 HydrophobicContact CG1-CD2 4.1Å; I145-Y181 HydrophobicContact CG1-CE2 3.93Å; I145-L184 HydrophobicContact CD1-CB 4.11Å; I145-L184 HydrophobicContact CD1-CD1 4.44Å; I145-E185 WeakPolarHBondContact CG1-OE2 3.28Å; I145-E185 WeakPolarHBondContact CG2-OE2 3.5Å; I145-D239 HydrophobicContact CG2-CB 4.46Å
146T95.8Very high95.7Very high9 Ų945.9 Ų45.96%0.05525%0.246CC..Hα-helixtrans-67.7-44.9173-61.70000111.2Y142 A148 G149 V150 D239 V240 I243Y142-T146 WeakPolarHBondContact O-CB 3.09Å; Y142-T146 PolarHBondContact O-N 2.91Å; Y142-T146 PolarHBondContact O-OG1 3.42Å; T146-A148 VanDerWaalsContact C-N 3.32Å; T146-A148 PolarHBondContact O-N 2.92Å; T146-G149 PolarHBondContact O-N 3.18Å; T146-V150 WeakPolarHBondContact O-CG2 3.43Å; T146-V150 PolarHBondContact O-N 3.37Å; T146-D239 WeakPolarHBondContact OG1-CB 3.46Å; T146-V240 HydrophobicContact CG2-CG2 3.55Å; T146-I243 HydrophobicContact CG2-CD1 3.89Å
147V96.5Very high95.7Very high91 Ų9148.8 Ų48.855%0.55227%0.265SS*.Hα-helixtrans-61.7-43.4176.2170.80000110.5L143 V144 V150 A151L143-V147 WeakPolarHBondContact O-CB 3.34Å; L143-V147 VanDerWaalsContact O-CG2 3.25Å; L143-V147 WeakPolarHBondContact O-CG2 3.34Å; L143-V147 PolarHBondContact O-N 3.12Å; L143-V147 VanDerWaalsContact O-N 3.08Å; V144-V147 PolarHBondContact O-N 3.04Å; V147-V150 PolarHBondContact O-N 3.43Å; V147-A151 WeakPolarHBondContact O-CB 3.45Å; V147-A151 PolarHBondContact O-N 3.14Å
148A95.7Very high95.6Very high23 Ų2348.7 Ų48.719%0.1927%0.265CS..Hα-helixtrans-62.4-43.4174.300000111.8V144 I145 T146 V150 A151 F152V144-A148 WeakPolarHBondContact O-CB 3.4Å; V144-A148 PolarHBondContact O-N 2.96Å; I145-A148 PolarHBondContact O-N 3.2Å; T146-A148 VanDerWaalsContact C-N 3.32Å; T146-A148 PolarHBondContact O-N 2.92Å; A148-V150 PolarHBondContact O-N 3.48Å; A148-A151 PolarHBondContact O-N 3.2Å; A148-F152 HydrophobicContact CB-CD2 4.36Å; A148-F152 HydrophobicContact CB-CE2 4Å; A148-F152 HydrophobicContact CB-CZ 4.34Å; A148-F152 VanDerWaalsContact O-CB 3.29Å; A148-F152 WeakPolarHBondContact O-CB 3.32Å; A148-F152 WeakPolarHBondContact O-CD2 3.3Å; A148-F152 WeakPolarHBondContact O-CG 3.49Å; A148-F152 PolarHBondContact O-N 3.38Å
149G95.1Very high95.5Very high0 Ų050 Ų500%027%0.274CS..Hα-helixtrans-59.5-46.3177.200000112.3I145 T146 F152 L153I145-G149 PolarHBondContact O-N 3.11Å; T146-G149 PolarHBondContact O-N 3.18Å; G149-F152 PolarHBondContact O-N 3.17Å; G149-L153 WeakPolarHBondContact O-CB 3.41Å; G149-L153 WeakPolarHBondContact O-CG 3.22Å; G149-L153 PolarHBondContact O-N 2.98Å
150V95.6Very high95.4Very high74 Ų7454.8 Ų54.845%0.44829%0.292SS..Hα-helixtrans-59.5-49.8173.7173.50000110T146 V147 A148 F152 L153 Y154 I236T146-V150 WeakPolarHBondContact O-CG2 3.43Å; T146-V150 PolarHBondContact O-N 3.37Å; V147-V150 PolarHBondContact O-N 3.43Å; A148-V150 PolarHBondContact O-N 3.48Å; V150-F152 VanDerWaalsContact C-N 3.33Å; V150-F152 PolarHBondContact O-N 3.48Å; V150-L153 PolarHBondContact O-N 3.29Å; V150-Y154 VanDerWaalsContact O-CB 3.29Å; V150-Y154 WeakPolarHBondContact O-CB 3.4Å; V150-Y154 PolarHBondContact O-N 2.9Å; V150-I236 HydrophobicContact CB-CD1 4.49Å; V150-I236 HydrophobicContact CG2-CD1 3.84Å
151A96.1Very high95.2Very high64 Ų6457.7 Ų57.753%0.52930%0.304SS..Hα-helixtrans-62.1-38.2-179.100000113.1V147 A148V147-A151 WeakPolarHBondContact O-CB 3.45Å; V147-A151 PolarHBondContact O-N 3.14Å; A148-A151 PolarHBondContact O-N 3.2Å
152F94.8Very high95Very high64 Ų6458.5 Ų58.528%0.28131%0.309SS..Hα-helixtrans-78.1-21.9-178.3-67.1-19.2000114.2A148 G149 V150 S177 Y181A148-F152 HydrophobicContact CB-CD2 4.36Å; A148-F152 HydrophobicContact CB-CE2 4Å; A148-F152 HydrophobicContact CB-CZ 4.34Å; A148-F152 VanDerWaalsContact O-CB 3.29Å; A148-F152 WeakPolarHBondContact O-CB 3.32Å; A148-F152 WeakPolarHBondContact O-CD2 3.3Å; A148-F152 WeakPolarHBondContact O-CG 3.49Å; A148-F152 PolarHBondContact O-N 3.38Å; G149-F152 PolarHBondContact O-N 3.17Å; V150-F152 VanDerWaalsContact C-N 3.33Å; V150-F152 PolarHBondContact O-N 3.48Å; F152-S177 WeakPolarHBondContact CD2-O 3.49Å; F152-Y181 HydrophobicContact CD2-CG 4.46Å
153L95Very high94.7Very high1 Ų162.7 Ų62.71%0.00533%0.325CS..Hα-helixtrans-103.1-16.4-179.9-66.6176.5000113.6G149 V150 D155 K156 L159 Y181 T232 I236G149-L153 WeakPolarHBondContact O-CB 3.41Å; G149-L153 WeakPolarHBondContact O-CG 3.22Å; G149-L153 PolarHBondContact O-N 2.98Å; V150-L153 PolarHBondContact O-N 3.29Å; L153-D155 VanDerWaalsContact C-N 3.27Å; L153-D155 PolarHBondContact O-N 3.14Å; L153-K156 HydrophobicContact CD2-CG 4.46Å; L153-K156 WeakPolarHBondContact O-CB 3.47Å; L153-K156 PolarHBondContact O-N 2.9Å; L153-L159 HydrophobicContact CB-CD1 4.43Å; L153-L159 HydrophobicContact CB-CD2 4.14Å; L153-L159 WeakPolarHBondContact O-CD2 3.3Å; L153-Y181 HydrophobicContact CD1-CE1 4.41Å; L153-T232 HydrophobicContact CD2-CG2 4.49Å; L153-I236 HydrophobicContact CD1-CB 4.26Å; L153-I236 HydrophobicContact CD1-CD1 4.06Å; L153-I236 HydrophobicContact CD1-CG2 3.9Å
154Y94.8Very high94.6Very high161 Ų16161.9 Ų61.963%0.63132%0.319SS*.THydrogen-bonded Turntrans-55.3-39.1-173.9-177.7-100.1000113.8V150 K156 Y160V150-Y154 VanDerWaalsContact O-CB 3.29Å; V150-Y154 WeakPolarHBondContact O-CB 3.4Å; V150-Y154 PolarHBondContact O-N 2.9Å; Y154-K156 VanDerWaalsContact C-N 3.32Å; Y154-Y160 WeakPolarHBondContact O-CE2 3.35Å; Y154-Y160 PolarHBondContact O-OH 3.36Å; Y154-Y160 VanDerWaalsContact O-OH 3.05Å
155D93.9Very high94.5Very high106 Ų10657.2 Ų57.257%0.56729%0.291SS*.THydrogen-bonded Turntrans-90.17.2-178.971.3-37.3000113.3L153L153-D155 VanDerWaalsContact C-N 3.27Å; L153-D155 PolarHBondContact O-N 3.14Å
156K94.9Very high94.3Very high31 Ų3158.7 Ų58.714%0.13530%0.296CS..  trans-100.1130.2-170.4-54-52-179.5-148.30112.2L153 Y154 W158 L159 L175L153-K156 HydrophobicContact CD2-CG 4.46Å; L153-K156 WeakPolarHBondContact O-CB 3.47Å; L153-K156 PolarHBondContact O-N 2.9Å; Y154-K156 VanDerWaalsContact C-N 3.32Å; K156-W158 VanDerWaalsContact C-N 3.3Å; K156-W158 HydrophobicContact CB-CD2 3.87Å; K156-W158 VanDerWaalsContact CB-CE2 3.46Å; K156-W158 HydrophobicContact CB-CE3 4.16Å; K156-W158 HydrophobicContact CB-CH2 3.76Å; K156-W158 HydrophobicContact CB-CZ2 3.39Å; K156-W158 HydrophobicContact CB-CZ3 4.12Å; K156-W158 HydrophobicContact CD-CH2 3.55Å; K156-W158 HydrophobicContact CD-CZ2 3.76Å; K156-W158 HydrophobicContact CD-CZ3 4.28Å; K156-W158 HydrophobicContact CG-CH2 3.71Å; K156-W158 HydrophobicContact CG-CZ2 3.36Å; K156-W158 HydrophobicContact CG-CZ3 4.5Å; K156-W158 PolarHBondContact O-N 3.41Å; K156-L159 WeakPolarHBondContact O-CB 3.39Å; K156-L159 PolarHBondContact O-N 3.08Å; K156-L159 VanDerWaalsContact O-N 3.15Å; K156-L175 HydrophobicContact CD-CD1 4.17Å
157P95.1Very high94.1Very high66 Ų6662.2 Ų62.243%0.42932%0.315SS..G310 helixtrans-65.9-33.3-173.826.5-34.8000112.6L159 Y160 D161 E164P157-L159 PolarHBondContact O-N 3.5Å; P157-L159 VanDerWaalsContact O-N 3.15Å; P157-Y160 PolarHBondContact O-N 2.91Å; P157-D161 PolarHBondContact O-N 3.48Å; P157-E164 HydrophobicContact CB-CB 4.39Å; P157-E164 HydrophobicContact CB-CG 4.19Å
158W93.9Very high93.8Very high11 Ų1160 Ų604%0.04231%0.311CS..G310 helixtrans-69-9.217962.880.5000114.8K156 Y160 D161 E164 V165 L175 R229K156-W158 VanDerWaalsContact C-N 3.3Å; K156-W158 HydrophobicContact CB-CD2 3.87Å; K156-W158 VanDerWaalsContact CB-CE2 3.46Å; K156-W158 HydrophobicContact CB-CE3 4.16Å; K156-W158 HydrophobicContact CB-CH2 3.76Å; K156-W158 HydrophobicContact CB-CZ2 3.39Å; K156-W158 HydrophobicContact CB-CZ3 4.12Å; K156-W158 HydrophobicContact CD-CH2 3.55Å; K156-W158 HydrophobicContact CD-CZ2 3.76Å; K156-W158 HydrophobicContact CD-CZ3 4.28Å; K156-W158 HydrophobicContact CG-CH2 3.71Å; K156-W158 HydrophobicContact CG-CZ2 3.36Å; K156-W158 HydrophobicContact CG-CZ3 4.5Å; K156-W158 PolarHBondContact O-N 3.41Å; W158-Y160 VanDerWaalsContact C-N 3.33Å; W158-D161 WeakPolarHBondContact CA-O 3.48Å; W158-E164 HydrophobicContact CB-CB 4Å; W158-V165 HydrophobicContact CB-CG2 3.82Å; W158-L175 HydrophobicContact CH2-CD1 3.75Å; W158-L175 HydrophobicContact CZ2-CD1 4.43Å; W158-R229 HydrophobicContact CD2-CB 4.26Å; W158-R229 HydrophobicContact CD2-CG 3.84Å; W158-R229 HydrophobicContact CE3-CG 4.11Å; W158-R229 HydrophobicContact CG-CB 4.12Å; W158-R229 HydrophobicContact CG-CG 4.22Å; W158-R229 HydrophobicContact CZ2-CG 4.34Å; W158-R229 HydrophobicContact CZ3-CG 4.45Å
159L93.5Very high93.5Very high62 Ų6260 Ų6033%0.32531%0.306SS..G310 helixtrans-72.5-31.6169.3-176.363.7000111.4L153 K156 P157 L233L153-L159 HydrophobicContact CB-CD1 4.43Å; L153-L159 HydrophobicContact CB-CD2 4.14Å; L153-L159 WeakPolarHBondContact O-CD2 3.3Å; K156-L159 WeakPolarHBondContact O-CB 3.39Å; K156-L159 PolarHBondContact O-N 3.08Å; K156-L159 VanDerWaalsContact O-N 3.15Å; P157-L159 PolarHBondContact O-N 3.5Å; P157-L159 VanDerWaalsContact O-N 3.15Å; L159-L233 HydrophobicContact CD1-CD2 3.84Å
160Y93.2Very high93.3Very high153 Ų15360.3 Ų60.360%0.631%0.308SS*.THydrogen-bonded Turntrans-102.8-33.5-174.5-56.1-73.9000112.6Y154 P157 W158Y154-Y160 WeakPolarHBondContact O-CE2 3.35Å; Y154-Y160 PolarHBondContact O-OH 3.36Å; Y154-Y160 VanDerWaalsContact O-OH 3.05Å; P157-Y160 PolarHBondContact O-N 2.91Å; W158-Y160 VanDerWaalsContact C-N 3.33Å
161D93.5Very high93Very high84 Ų8461.4 Ų61.445%0.44931%0.307SS..  trans-123.3112.3176.6-171.5-9.4000111P157 W158 W163 E164P157-D161 PolarHBondContact O-N 3.48Å; W158-D161 WeakPolarHBondContact CA-O 3.48Å; D161-W163 PolarHBondContact O-N 3.34Å; D161-W163 VanDerWaalsContact OD1-CB 3.23Å; D161-W163 WeakPolarHBondContact OD1-CB 3.37Å; D161-W163 PolarHBondContact OD1-N 3.15Å; D161-E164 HydrophobicContact CB-CG 4.28Å; D161-E164 WeakPolarHBondContact O-CB 3.41Å; D161-E164 PolarHBondContact O-N 2.88Å; D161-E164 VanDerWaalsContact O-N 3.13Å
162L92.6Very high92.9Very high37 Ų3758.7 Ų58.719%0.19428%0.283CS..G310 helixtrans-66.3-16.7-179.1-64.4174.7000113.2E164 V165 L233 W282 C286 L290L162-E164 VanDerWaalsContact C-N 3.3Å; L162-V165 HydrophobicContact CD2-CG2 4.39Å; L162-V165 VanDerWaalsContact O-CB 3.27Å; L162-V165 WeakPolarHBondContact O-CB 3.09Å; L162-V165 WeakPolarHBondContact O-CG2 3.29Å; L162-V165 PolarHBondContact O-N 2.88Å; L162-L233 HydrophobicContact CD2-CD1 3.91Å; L162-W282 HydrophobicContact CD1-CB 3.86Å; L162-W282 HydrophobicContact CD1-CG 4.32Å; L162-C286 HydrophobicContact CB-CB 4.23Å; L162-C286 HydrophobicContact CD1-CB 4.21Å; L162-C286 HydrophobicContact CD2-CB 4.33Å; L162-C286 HydrophobicContact CG-CB 4.5Å; L162-L290 HydrophobicContact CB-CD2 4.24Å; L162-L290 WeakPolarHBondContact O-CD2 3.44Å
163W90.3Very high92.8Very high105 Ų10557.8 Ų57.840%0.39828%0.284SS..G310 helixtrans-64.6-38.1173.3-163.5-104.4000112.2D161 V165 W166 N167 L290 Y294D161-W163 PolarHBondContact O-N 3.34Å; D161-W163 VanDerWaalsContact OD1-CB 3.23Å; D161-W163 WeakPolarHBondContact OD1-CB 3.37Å; D161-W163 PolarHBondContact OD1-N 3.15Å; W163-V165 PolarHBondContact O-N 3.4Å; W163-V165 VanDerWaalsContact O-N 3.13Å; W163-W166 PolarHBondContact O-N 2.87Å; W163-W166 VanDerWaalsContact O-N 3.13Å; W163-N167 PolarHBondContact O-N 3.11Å; W163-L290 HydrophobicContact CE3-CD2 3.86Å; W163-L290 HydrophobicContact CE3-CG 3.87Å; W163-L290 HydrophobicContact CZ3-CD2 4.48Å; W163-L290 HydrophobicContact CZ3-CG 3.98Å; W163-Y294 HydrophobicContact CH2-CD2 4.48Å; W163-Y294 AromaticContact CH2-CE2 3.25Å; W163-Y294 HydrophobicContact CH2-CE2 3.25Å; W163-Y294 AromaticContact CH2-CZ 3.6Å; W163-Y294 WeakPolarHBondContact CH2-OH 2.99Å; W163-Y294 HydrophobicContact CZ2-CD2 4.46Å; W163-Y294 AromaticContact CZ2-CE2 3.29Å; W163-Y294 HydrophobicContact CZ2-CE2 3.29Å; W163-Y294 AromaticContact CZ2-CZ 3.46Å; W163-Y294 VanDerWaalsContact CZ2-CZ 3.46Å; W163-Y294 WeakPolarHBondContact CZ2-OH 3.33Å; W163-Y294 HydrophobicContact CZ3-CE2 4.27Å
164E93.4Very high92.8Very high54 Ų5458.7 Ų58.725%0.25229%0.289SS..G310 helixtrans-67.5-13179.4-68.5-64.8154.800112.9P157 W158 D161 L162 W166 N167 R229P157-E164 HydrophobicContact CB-CB 4.39Å; P157-E164 HydrophobicContact CB-CG 4.19Å; W158-E164 HydrophobicContact CB-CB 4Å; D161-E164 HydrophobicContact CB-CG 4.28Å; D161-E164 WeakPolarHBondContact O-CB 3.41Å; D161-E164 PolarHBondContact O-N 2.88Å; D161-E164 VanDerWaalsContact O-N 3.13Å; L162-E164 VanDerWaalsContact C-N 3.3Å; E164-W166 VanDerWaalsContact C-N 3.27Å; E164-W166 PolarHBondContact O-N 3.13Å; E164-N167 PolarHBondContact OE1-ND2 3.33Å; E164-N167 WeakPolarHBondContact OE2-CB 3.32Å; E164-N167 PolarHBondContact OE2-ND2 3.32Å; E164-R229 PolarHBondContact O-NH1 3.02Å
165V94.4Very high92.7Very high2 Ų253.7 Ų53.71%0.01227%0.272CS..G310 helixtrans-60.7-40.2171.5175.30000110.9W158 L162 W163 Q172 R229 L233W158-V165 HydrophobicContact CB-CG2 3.82Å; L162-V165 HydrophobicContact CD2-CG2 4.39Å; L162-V165 VanDerWaalsContact O-CB 3.27Å; L162-V165 WeakPolarHBondContact O-CB 3.09Å; L162-V165 WeakPolarHBondContact O-CG2 3.29Å; L162-V165 PolarHBondContact O-N 2.88Å; W163-V165 PolarHBondContact O-N 3.4Å; W163-V165 VanDerWaalsContact O-N 3.13Å; V165-Q172 PolarHBondContact O-NE2 3.02Å; V165-R229 HydrophobicContact CG1-CB 4.17Å; V165-L233 HydrophobicContact CG2-CD1 3.69Å
166W93Very high92.7Very high34 Ų3454.6 Ų54.613%0.12928%0.277CS..THydrogen-bonded Turntrans-102.7-9.4-174.8-62.7103.5000113.5W163 E164 G168 Y169 Y227 C286 T287 P291W163-W166 PolarHBondContact O-N 2.87Å; W163-W166 VanDerWaalsContact O-N 3.13Å; E164-W166 VanDerWaalsContact C-N 3.27Å; E164-W166 PolarHBondContact O-N 3.13Å; W166-G168 PolarHBondContact O-N 3.41Å; W166-Y169 HydrophobicContact CE3-CD1 4.14Å; W166-Y169 HydrophobicContact CE3-CD2 4.09Å; W166-Y169 AromaticContact CE3-CG 3.8Å; W166-Y169 HydrophobicContact CE3-CG 3.8Å; W166-Y169 HydrophobicContact CZ3-CD1 4.2Å; W166-Y169 AromaticContact CZ3-CD2 3.98Å; W166-Y169 HydrophobicContact CZ3-CD2 3.98Å; W166-Y169 HydrophobicContact CZ3-CE1 4.35Å; W166-Y169 HydrophobicContact CZ3-CE2 4.15Å; W166-Y169 HydrophobicContact CZ3-CG 4.03Å; W166-Y169 VanDerWaalsContact O-CB 3.22Å; W166-Y169 WeakPolarHBondContact O-CB 3.39Å; W166-Y169 PolarHBondContact O-N 3.09Å; W166-Y227 AromaticContact CH2-CD1 3.64Å; W166-Y227 HydrophobicContact CH2-CD1 3.64Å; W166-Y227 AromaticContact CH2-CE1 3.68Å; W166-Y227 HydrophobicContact CH2-CE1 3.68Å; W166-Y227 AromaticContact CZ3-CD1 3.68Å; W166-Y227 HydrophobicContact CZ3-CD1 3.68Å; W166-Y227 AromaticContact CZ3-CE1 3.6Å; W166-Y227 HydrophobicContact CZ3-CE1 3.6Å; W166-C286 PolarHBondContact NE1-O 2.83Å; W166-T287 HydrophobicContact CZ2-CG2 4.32Å; W166-P291 HydrophobicContact CD2-CB 4.43Å; W166-P291 HydrophobicContact CD2-CG 3.52Å; W166-P291 HydrophobicContact CE3-CG 3.94Å; W166-P291 HydrophobicContact CG-CG 4.04Å; W166-P291 HydrophobicContact CH2-CG 3.82Å; W166-P291 HydrophobicContact CZ2-CG 3.4Å; W166-P291 VanDerWaalsContact CZ2-CG 3.4Å; W166-P291 HydrophobicContact CZ3-CG 4.06Å
167N91.8Very high92.7Very high83 Ų8354.4 Ų54.444%0.44428%0.279SS..THydrogen-bonded Turntrans-58.4123.5176.3-171.116.1000111.1W163 E164 Y169 Q172 R229W163-N167 PolarHBondContact O-N 3.11Å; E164-N167 PolarHBondContact OE1-ND2 3.33Å; E164-N167 WeakPolarHBondContact OE2-CB 3.32Å; E164-N167 PolarHBondContact OE2-ND2 3.32Å; N167-Y169 PolarHBondContact O-N 3.01Å; N167-Q172 PolarHBondContact O-NE2 3.45Å; N167-R229 PolarHBondContact O-NH1 3.46Å; N167-R229 VanDerWaalsContact O-NH1 3.12Å
168G88.7Confident92.7Very high45 Ų4551.5 Ų51.546%0.46426%0.26SS..THydrogen-bonded Turntrans71.77.1-176.300000115.5W166 K171W166-G168 PolarHBondContact O-N 3.41Å; G168-K171 CarbonylContact O-C 3.29Å; G168-K171 VanDerWaalsContact O-C 3.29Å; G168-K171 WeakPolarHBondContact O-CA 3.48Å; G168-K171 PolarHBondContact O-N 2.68Å
169Y90.6Very high92.8Very high22 Ų2252.7 Ų52.79%0.08626%0.264CS..THydrogen-bonded Turntrans-65.2138.4173.4179.4-86.1000110.6P17 W166 N167 A225 Y227 L295 F298P17-Y169 HydrophobicContact CG-CE1 4.07Å; W166-Y169 HydrophobicContact CE3-CD1 4.14Å; W166-Y169 HydrophobicContact CE3-CD2 4.09Å; W166-Y169 AromaticContact CE3-CG 3.8Å; W166-Y169 HydrophobicContact CE3-CG 3.8Å; W166-Y169 HydrophobicContact CZ3-CD1 4.2Å; W166-Y169 AromaticContact CZ3-CD2 3.98Å; W166-Y169 HydrophobicContact CZ3-CD2 3.98Å; W166-Y169 HydrophobicContact CZ3-CE1 4.35Å; W166-Y169 HydrophobicContact CZ3-CE2 4.15Å; W166-Y169 HydrophobicContact CZ3-CG 4.03Å; W166-Y169 VanDerWaalsContact O-CB 3.22Å; W166-Y169 WeakPolarHBondContact O-CB 3.39Å; W166-Y169 PolarHBondContact O-N 3.09Å; N167-Y169 PolarHBondContact O-N 3.01Å; Y169-A225 WeakPolarHBondContact CE2-O 3.31Å; Y169-A225 PolarHBondContact OH-O 2.96Å; Y169-A225 VanDerWaalsContact OH-O 3.07Å; Y169-Y227 HydrophobicContact CD2-CD1 4.23Å; Y169-Y227 HydrophobicContact CD2-CE1 4.39Å; Y169-Y227 HydrophobicContact CE1-CE1 4.18Å; Y169-Y227 AromaticContact CE2-CD1 3.4Å; Y169-Y227 HydrophobicContact CE2-CD1 3.4Å; Y169-Y227 VanDerWaalsContact CE2-CD1 3.4Å; Y169-Y227 AromaticContact CE2-CE1 3.38Å; Y169-Y227 HydrophobicContact CE2-CE1 3.38Å; Y169-Y227 AromaticContact CZ-CD1 3.84Å; Y169-Y227 AromaticContact CZ-CE1 3.26Å; Y169-Y227 WeakPolarHBondContact OH-CE1 3.45Å; Y169-Y227 PolarHBondContact OH-OH 2.91Å; Y169-L295 HydrophobicContact CD1-CD1 3.54Å; Y169-L295 HydrophobicContact CE1-CD1 3.88Å; Y169-F298 HydrophobicContact CE1-CZ 4.27Å
170P89.3Confident92.9Very high7 Ų754 Ų545%0.04527%0.265CS..THydrogen-bonded Turncis-89.30.92.935.3-37.3000115.2P17 I20 L25 Q172 N226P17-P170 HydrophobicContact CG-CG 4.21Å; I20-P170 HydrophobicContact CB-CG 4.17Å; I20-P170 HydrophobicContact CG1-CG 3.81Å; I20-P170 HydrophobicContact CG2-CG 3.84Å; L25-P170 WeakPolarHBondContact CD2-O 3.46Å; P170-Q172 PolarHBondContact O-N 3.09Å; P170-N226 PolarHBondContact O-ND2 3.29Å
171K90.6Very high93Very high98 Ų9846.8 Ų46.843%0.42624%0.237SC..  trans-82.646.4-176.4-59.2-170.4-178.2-1650112.8L25 G168L25-K171 HydrophobicContact CD2-CG 4.28Å; G168-K171 CarbonylContact O-C 3.29Å; G168-K171 VanDerWaalsContact O-C 3.29Å; G168-K171 WeakPolarHBondContact O-CA 3.48Å; G168-K171 PolarHBondContact O-N 2.68Å
172Q92.8Very high93.1Very high6 Ų642.9 Ų42.93%0.02822%0.216CC..PPolyproline II helixtrans-90.5123.3177.8-65.5176.6-15.200110V165 N167 P170 N226V165-Q172 PolarHBondContact O-NE2 3.02Å; N167-Q172 PolarHBondContact O-NE2 3.45Å; P170-Q172 PolarHBondContact O-N 3.09Å; Q172-N226 PolarHBondContact O-ND2 3.48Å
173P93.4Very high93.3Very high46 Ų4641.1 Ų41.130%0.29921%0.207SC..PPolyproline II helixtrans-71145.7177.629.4-34.3000110.9L31L31-P173 HydrophobicContact CB-CB 4.39Å; L31-P173 HydrophobicContact CD2-CB 4.13Å; L31-P173 HydrophobicContact CD2-CG 4.42Å
174L94.2Very high93.6Very high20 Ų2038.9 Ų38.911%0.10520%0.202CC..PPolyproline II helixtrans-78.2120.9177.2174.762.3000110.4V32 V34 Q178 Y179 W223V32-L174 WeakPolarHBondContact O-CB 3.48Å; V32-L174 PolarHBondContact O-N 2.87Å; V34-L174 HydrophobicContact CG1-CB 4.18Å; V34-L174 HydrophobicContact CG1-CD1 3.97Å; V34-L174 HydrophobicContact CG1-CD2 4.16Å; V34-L174 HydrophobicContact CG1-CG 4.32Å; L174-Q178 HydrophobicContact CD1-CB 4.49Å; L174-Y179 HydrophobicContact CD2-CD2 4.06Å; L174-W223 HydrophobicContact CD1-CH2 3.74Å; L174-W223 HydrophobicContact CD1-CZ3 4.12Å; L174-W223 HydrophobicContact CD2-CH2 3.88Å; L174-W223 HydrophobicContact CD2-CZ2 4.05Å; L174-W223 HydrophobicContact CG-CH2 4.48Å
175L94.1Very high93.7Very high56 Ų5636.3 Ų36.329%0.29319%0.19SC..PPolyproline II helixtrans-84.6142.8171.1-58178.3000111K156 W158 S177 Q178 Y179K156-L175 HydrophobicContact CD-CD1 4.17Å; W158-L175 HydrophobicContact CH2-CD1 3.75Å; W158-L175 HydrophobicContact CZ2-CD1 4.43Å; L175-S177 VanDerWaalsContact C-N 3.26Å; L175-S177 PolarHBondContact O-N 2.94Å; L175-Q178 HydrophobicContact CB-CB 4.43Å; L175-Q178 HydrophobicContact CB-CG 4.1Å; L175-Q178 PolarHBondContact O-N 3.31Å; L175-Q178 VanDerWaalsContact O-N 3.13Å; L175-Y179 PolarHBondContact O-N 3.34Å
176L93.9Very high93.7Very high125 Ų12536.3 Ų36.365%0.65419%0.19SC*.Hα-helixtrans-60.7-35.2179.9-174.661.6000112.7Y179 W180L176-Y179 WeakPolarHBondContact O-CB 3.44Å; L176-Y179 PolarHBondContact O-N 3.42Å; L176-W180 VanDerWaalsContact O-CD1 3.27Å; L176-W180 PolarHBondContact O-N 3.47Å; L176-W180 VanDerWaalsContact O-N 3.13Å
177S94.8Very high93.9Very high27 Ų2734.7 Ų34.719%0.18918%0.184CC..Hα-helixtrans-63.2-43.8175.654.90000112F152 L175 W180 Y181F152-S177 WeakPolarHBondContact CD2-O 3.49Å; L175-S177 VanDerWaalsContact C-N 3.26Å; L175-S177 PolarHBondContact O-N 2.94Å; S177-W180 PolarHBondContact O-N 2.94Å; S177-Y181 WeakPolarHBondContact O-CB 3.46Å; S177-Y181 PolarHBondContact O-N 3.1Å
178Q94.8Very high94.1Very high5 Ų530.8 Ų30.82%0.02316%0.163CC..Hα-helixtrans-67.9-37.2177.5-63.1173.7-43.800111.8L174 L175 Y181 Y182 I228 T232L174-Q178 HydrophobicContact CD1-CB 4.49Å; L175-Q178 HydrophobicContact CB-CB 4.43Å; L175-Q178 HydrophobicContact CB-CG 4.1Å; L175-Q178 PolarHBondContact O-N 3.31Å; L175-Q178 VanDerWaalsContact O-N 3.13Å; Q178-Y181 PolarHBondContact O-N 2.96Å; Q178-Y182 PolarHBondContact O-N 3.23Å; Q178-I228 HydrophobicContact CB-CG2 3.71Å; Q178-I228 HydrophobicContact CG-CG2 4.15Å; Q178-T232 HydrophobicContact CB-CG2 4.4Å; Q178-T232 HydrophobicContact CG-CG2 4.17Å
179Y95.7Very high94.3Very high35 Ų3529.4 Ų29.414%0.13714%0.144CC..Hα-helixtrans-55-55.5172.7173.8-87.6000110.7H38 L174 L175 L176 Y181 Y182 I183 W223H38-Y179 HydrophobicContact CB-CE2 3.97Å; L174-Y179 HydrophobicContact CD2-CD2 4.06Å; L175-Y179 PolarHBondContact O-N 3.34Å; L176-Y179 WeakPolarHBondContact O-CB 3.44Å; L176-Y179 PolarHBondContact O-N 3.42Å; Y179-Y181 VanDerWaalsContact C-N 3.31Å; Y179-Y181 PolarHBondContact O-N 2.74Å; Y179-Y182 PolarHBondContact O-N 3.07Å; Y179-I183 HydrophobicContact CD1-CG1 4.17Å; Y179-I183 HydrophobicContact CD2-CG1 4.24Å; Y179-I183 HydrophobicContact CE1-CG1 3.85Å; Y179-I183 HydrophobicContact CE2-CD1 4.32Å; Y179-I183 HydrophobicContact CE2-CG1 3.95Å; Y179-I183 HydrophobicContact CG-CG1 4.34Å; Y179-I183 WeakPolarHBondContact O-CB 3.42Å; Y179-I183 VanDerWaalsContact O-CG1 3.23Å; Y179-I183 WeakPolarHBondContact O-CG1 3.16Å; Y179-I183 PolarHBondContact O-N 3.33Å; Y179-W223 AromaticContact CD2-CH2 3.63Å; Y179-W223 HydrophobicContact CD2-CH2 3.63Å; Y179-W223 AromaticContact CD2-CZ2 3.94Å; Y179-W223 HydrophobicContact CD2-CZ2 3.94Å; Y179-W223 HydrophobicContact CE2-CH2 4.4Å; Y179-W223 HydrophobicContact CE2-CZ2 4.36Å; Y179-W223 HydrophobicContact CG-CH2 4.32Å
180W95.4Very high94.4Very high90 Ų9031.3 Ų31.334%0.34115%0.151SC..Hα-helixtrans-65.3-36.6-178.5-76.5113.1000112.6Y45 L176 S177 I183 L184Y45-W180 HydrophobicContact CE1-CZ3 4.26Å; Y45-W180 HydrophobicContact CE2-CH2 4.41Å; Y45-W180 HydrophobicContact CE2-CZ3 4.05Å; Y45-W180 AromaticContact CZ-CH2 3.91Å; Y45-W180 AromaticContact CZ-CZ3 3.75Å; Y45-W180 WeakPolarHBondContact OH-CH2 3.32Å; L176-W180 VanDerWaalsContact O-CD1 3.27Å; L176-W180 PolarHBondContact O-N 3.47Å; L176-W180 VanDerWaalsContact O-N 3.13Å; S177-W180 PolarHBondContact O-N 2.94Å; W180-I183 PolarHBondContact O-N 2.96Å; W180-L184 VanDerWaalsContact O-CB 3.28Å; W180-L184 WeakPolarHBondContact O-CB 3.33Å; W180-L184 WeakPolarHBondContact O-CG 3.42Å; W180-L184 PolarHBondContact O-N 3.34Å
181Y95.9Very high94.6Very high1 Ų131 Ų310%0.00415%0.149CC..Hα-helixtrans-59.3-51176.6-168.7-160.6000111.5I145 F152 L153 S177 Q178 Y179 E185 T232 M235 I236I145-Y181 HydrophobicContact CD1-CD2 3.76Å; I145-Y181 HydrophobicContact CD1-CE2 4.08Å; I145-Y181 HydrophobicContact CG1-CD2 4.1Å; I145-Y181 HydrophobicContact CG1-CE2 3.93Å; F152-Y181 HydrophobicContact CD2-CG 4.46Å; L153-Y181 HydrophobicContact CD1-CE1 4.41Å; S177-Y181 WeakPolarHBondContact O-CB 3.46Å; S177-Y181 PolarHBondContact O-N 3.1Å; Q178-Y181 PolarHBondContact O-N 2.96Å; Y179-Y181 VanDerWaalsContact C-N 3.31Å; Y179-Y181 PolarHBondContact O-N 2.74Å; Y181-E185 WeakPolarHBondContact O-CB 3.37Å; Y181-E185 PolarHBondContact O-N 2.94Å; Y181-E185 VanDerWaalsContact O-N 3.1Å; Y181-T232 HydrophobicContact CD1-CG2 3.85Å; Y181-T232 HydrophobicContact CE1-CG2 4.3Å; Y181-M235 HydrophobicContact CD1-CE 4.1Å; Y181-M235 HydrophobicContact CD2-CE 3.69Å; Y181-M235 HydrophobicContact CE1-CB 4.27Å; Y181-M235 HydrophobicContact CE1-CE 4.12Å; Y181-M235 HydrophobicContact CE2-CE 3.73Å; Y181-M235 HydrophobicContact CG-CE 3.89Å; Y181-I236 WeakPolarHBondContact OH-CA 3.37Å; Y181-I236 PolarHBondContact OH-N 2.97Å
182Y96.2Very high94.6Very high2 Ų226.6 Ų26.61%0.00813%0.13CC..Hα-helixtrans-63.2-46.4177.3-97.9-103000113.1Q178 Y179 M186 S222 W223 Y227 I228 G231 T232 M235Q178-Y182 PolarHBondContact O-N 3.23Å; Y179-Y182 PolarHBondContact O-N 3.07Å; Y182-M186 WeakPolarHBondContact O-CB 3.34Å; Y182-M186 PolarHBondContact O-N 3.04Å; Y182-S222 PolarHBondContact OH-OG 2.83Å; Y182-W223 AromaticContact CD1-CE3 3.64Å; Y182-W223 HydrophobicContact CD1-CE3 3.64Å; Y182-W223 HydrophobicContact CD1-CZ3 4.25Å; Y182-W223 HydrophobicContact CD2-CE3 4.46Å; Y182-W223 HydrophobicContact CD2-CZ3 4.36Å; Y182-W223 HydrophobicContact CE1-CE3 4.26Å; Y182-W223 AromaticContact CG-CE3 3.73Å; Y182-W223 HydrophobicContact CG-CE3 3.73Å; Y182-W223 AromaticContact CG-CZ3 3.85Å; Y182-W223 HydrophobicContact CG-CZ3 3.85Å; Y182-Y227 PolarHBondContact OH-O 2.94Å; Y182-I228 HydrophobicContact CD2-CG2 4.37Å; Y182-I228 HydrophobicContact CE1-CD1 4.23Å; Y182-I228 HydrophobicContact CE2-CD1 4.2Å; Y182-I228 HydrophobicContact CE2-CG2 3.94Å; Y182-I228 PolarHBondContact OH-O 3.2Å; Y182-G231 WeakPolarHBondContact OH-CA 3.4Å; Y182-T232 HydrophobicContact CD2-CG2 4.08Å; Y182-T232 HydrophobicContact CE2-CG2 3.63Å; Y182-M235 HydrophobicContact CD2-CE 4.48Å; Y182-M235 HydrophobicContact CD2-SD 3.91Å; Y182-M235 HydrophobicContact CE1-SD 4.42Å; Y182-M235 HydrophobicContact CE2-SD 3.79Å; Y182-M235 HydrophobicContact CG-SD 4.29Å
183I96.1Very high94.4Very high0 Ų028.1 Ų28.10%014%0.138CC..Hα-helixtrans-64.7-44.5-176.1-67.1-62.9000110.1H38 T42 Y45 Y179 W180 S187H38-I183 WeakPolarHBondContact O-CD1 3.31Å; T42-I183 HydrophobicContact CG2-CD1 3.6Å; T42-I183 HydrophobicContact CG2-CG2 4.38Å; Y45-I183 HydrophobicContact CD2-CG2 3.64Å; Y45-I183 HydrophobicContact CE2-CG2 4.12Å; Y45-I183 HydrophobicContact CG-CG2 4.43Å; Y179-I183 HydrophobicContact CD1-CG1 4.17Å; Y179-I183 HydrophobicContact CD2-CG1 4.24Å; Y179-I183 HydrophobicContact CE1-CG1 3.85Å; Y179-I183 HydrophobicContact CE2-CD1 4.32Å; Y179-I183 HydrophobicContact CE2-CG1 3.95Å; Y179-I183 HydrophobicContact CG-CG1 4.34Å; Y179-I183 WeakPolarHBondContact O-CB 3.42Å; Y179-I183 VanDerWaalsContact O-CG1 3.23Å; Y179-I183 WeakPolarHBondContact O-CG1 3.16Å; Y179-I183 PolarHBondContact O-N 3.33Å; W180-I183 PolarHBondContact O-N 2.96Å; I183-S187 WeakPolarHBondContact O-CB 3.37Å; I183-S187 PolarHBondContact O-N 3.14Å; I183-S187 PolarHBondContact O-OG 3.14Å
184L96Very high94.2Very high58 Ų5828.9 Ų28.930%0.30414%0.137SC..Hα-helixtrans-66.2-46179.8-70.2172.6000112.1I145 W180 S187 F188I145-L184 HydrophobicContact CD1-CB 4.11Å; I145-L184 HydrophobicContact CD1-CD1 4.44Å; W180-L184 VanDerWaalsContact O-CB 3.28Å; W180-L184 WeakPolarHBondContact O-CB 3.33Å; W180-L184 WeakPolarHBondContact O-CG 3.42Å; W180-L184 PolarHBondContact O-N 3.34Å; L184-S187 WeakPolarHBondContact O-CB 3.23Å; L184-S187 PolarHBondContact O-N 3.34Å; L184-F188 PolarHBondContact O-N 3.43Å
185E95.6Very high93.6Very high1 Ų129.8 Ų29.81%0.00514%0.139CC..Hα-helixtrans-62.4-49.9179.2-164.760.4-139.800111I145 Y181 S187 F188 Y189 M219 M235I145-E185 WeakPolarHBondContact CG1-OE2 3.28Å; I145-E185 WeakPolarHBondContact CG2-OE2 3.5Å; Y181-E185 WeakPolarHBondContact O-CB 3.37Å; Y181-E185 PolarHBondContact O-N 2.94Å; Y181-E185 VanDerWaalsContact O-N 3.1Å; E185-S187 VanDerWaalsContact C-N 3.3Å; E185-S187 PolarHBondContact O-N 3.28Å; E185-F188 WeakPolarHBondContact O-CB 3.39Å; E185-F188 PolarHBondContact O-N 2.66Å; E185-Y189 HydrophobicContact CG-CD2 4.19Å; E185-Y189 HydrophobicContact CG-CE2 3.99Å; E185-Y189 WeakPolarHBondContact O-CD2 3.22Å; E185-Y189 PolarHBondContact O-N 3.34Å; E185-Y189 WeakPolarHBondContact OE1-CE2 3.47Å; E185-M219 HydrophobicContact CB-SD 4.49Å; E185-M219 HydrophobicContact CG-SD 4.14Å; E185-M235 HydrophobicContact CB-CE 3.37Å; E185-M235 HydrophobicContact CG-CE 3.62Å
186M95.7Very high92.6Very high2 Ų228 Ų281%0.0113%0.129CC..Hα-helixtrans-62.5-38.8178.7-168.8-178.4-62.400111.8L39 T42 Y182 F188 Y189 W190 M219L39-M186 HydrophobicContact CD2-CE 3.67Å; L39-M186 HydrophobicContact CD2-SD 3.82Å; T42-M186 HydrophobicContact CG2-CB 3.96Å; T42-M186 HydrophobicContact CG2-CG 4.03Å; T42-M186 HydrophobicContact CG2-SD 3.72Å; Y182-M186 WeakPolarHBondContact O-CB 3.34Å; Y182-M186 PolarHBondContact O-N 3.04Å; M186-F188 VanDerWaalsContact C-N 3.29Å; M186-F188 PolarHBondContact O-N 3.07Å; M186-Y189 PolarHBondContact O-N 3.21Å; M186-W190 PolarHBondContact O-N 2.76Å; M186-M219 HydrophobicContact CB-CE 3.97Å; M186-M219 HydrophobicContact CB-SD 4.3Å; M186-M219 HydrophobicContact CE-CB 3.43Å; M186-M219 VanDerWaalsContact CE-CB 3.43Å; M186-M219 HydrophobicContact CG-CE 3.93Å
187S96.6Very high91.3Very high0 Ų025.4 Ų25.40%013%0.133CC..Hα-helixtrans-62-37.6174.9-60.30000112.1T42 Y45 A46 I183 L184 E185 W190 S191T42-S187 WeakPolarHBondContact CA-OG 3.38Å; T42-S187 PolarHBondContact O-OG 3.02Å; T42-S187 VanDerWaalsContact O-OG 3.1Å; Y45-S187 WeakPolarHBondContact CB-OG 3.41Å; A46-S187 WeakPolarHBondContact CA-O 3.49Å; A46-S187 WeakPolarHBondContact CB-O 3.32Å; I183-S187 WeakPolarHBondContact O-CB 3.37Å; I183-S187 PolarHBondContact O-N 3.14Å; I183-S187 PolarHBondContact O-OG 3.14Å; L184-S187 WeakPolarHBondContact O-CB 3.23Å; L184-S187 PolarHBondContact O-N 3.34Å; E185-S187 VanDerWaalsContact C-N 3.3Å; E185-S187 PolarHBondContact O-N 3.28Å; S187-W190 PolarHBondContact O-N 3.13Å; S187-S191 WeakPolarHBondContact O-CB 3.49Å; S187-S191 PolarHBondContact O-N 3.24Å
188F95.3Very high89.8Confident0 Ų032.9 Ų32.90%016%0.163CC..Hα-helixtrans-66.4-46176.4177.5-106.6000111.6L49 W137 R138 F141 Y142 L184 E185 M186 W190 S191 L192L49-F188 HydrophobicContact CD1-CB 4.08Å; W137-F188 AromaticContact NE1-CE2 3.6Å; R138-F188 HydrophobicContact CG-CZ 4.22Å; F141-F188 HydrophobicContact CB-CD2 4.14Å; F141-F188 HydrophobicContact CB-CE2 3.68Å; F141-F188 HydrophobicContact CB-CZ 4.08Å; F141-F188 HydrophobicContact CD1-CB 4.14Å; F141-F188 AromaticContact CD1-CD1 3.53Å; F141-F188 HydrophobicContact CD1-CD1 3.53Å; F141-F188 AromaticContact CD1-CD2 3.53Å; F141-F188 HydrophobicContact CD1-CD2 3.53Å; F141-F188 AromaticContact CD1-CE1 3.63Å; F141-F188 HydrophobicContact CD1-CE1 3.63Å; F141-F188 AromaticContact CD1-CE2 3.62Å; F141-F188 HydrophobicContact CD1-CE2 3.62Å; F141-F188 AromaticContact CD1-CG 3.47Å; F141-F188 HydrophobicContact CD1-CG 3.47Å; F141-F188 VanDerWaalsContact CD1-CG 3.47Å; F141-F188 AromaticContact CD1-CZ 3.67Å; F141-F188 HydrophobicContact CD1-CZ 3.67Å; F141-F188 HydrophobicContact CD2-CB 4.31Å; F141-F188 AromaticContact CD2-CD2 3.58Å; F141-F188 HydrophobicContact CD2-CD2 3.58Å; F141-F188 HydrophobicContact CD2-CE2 4.03Å; F141-F188 HydrophobicContact CD2-CG 4.05Å; F141-F188 HydrophobicContact CE1-CB 3.47Å; F141-F188 VanDerWaalsContact CE1-CB 3.47Å; F141-F188 AromaticContact CE1-CD1 3.41Å; F141-F188 HydrophobicContact CE1-CD1 3.41Å; F141-F188 VanDerWaalsContact CE1-CD1 3.41Å; F141-F188 AromaticContact CE1-CD2 3.8Å; F141-F188 HydrophobicContact CE1-CD2 3.8Å; F141-F188 HydrophobicContact CE1-CE1 4Å; F141-F188 HydrophobicContact CE1-CE2 4.33Å; F141-F188 AromaticContact CE1-CG 3.29Å; F141-F188 HydrophobicContact CE1-CG 3.29Å; F141-F188 HydrophobicContact CE1-CZ 4.42Å; F141-F188 HydrophobicContact CE2-CB 3.66Å; F141-F188 AromaticContact CE2-CD2 3.83Å; F141-F188 HydrophobicContact CE2-CD2 3.83Å; F141-F188 AromaticContact CE2-CG 3.88Å; F141-F188 HydrophobicContact CE2-CG 3.88Å; F141-F188 HydrophobicContact CG-CD1 4.31Å; F141-F188 AromaticContact CG-CD2 3.43Å; F141-F188 HydrophobicContact CG-CD2 3.43Å; F141-F188 VanDerWaalsContact CG-CD2 3.43Å; F141-F188 HydrophobicContact CG-CE1 4.34Å; F141-F188 AromaticContact CG-CE2 3.46Å; F141-F188 HydrophobicContact CG-CE2 3.46Å; F141-F188 VanDerWaalsContact CG-CE2 3.46Å; F141-F188 AromaticContact CG-CG 3.86Å; F141-F188 HydrophobicContact CG-CG 3.86Å; F141-F188 AromaticContact CG-CZ 3.94Å; F141-F188 HydrophobicContact CG-CZ 3.94Å; F141-F188 HydrophobicContact CZ-CB 3.21Å; F141-F188 HydrophobicContact CZ-CD1 4.11Å; F141-F188 AromaticContact CZ-CD2 3.96Å; F141-F188 HydrophobicContact CZ-CD2 3.96Å; F141-F188 AromaticContact CZ-CG 3.53Å; F141-F188 HydrophobicContact CZ-CG 3.53Å; Y142-F188 AromaticContact CE1-CE1 3.97Å; Y142-F188 HydrophobicContact CE1-CE1 3.97Å; Y142-F188 HydrophobicContact CE2-CE1 4.26Å; Y142-F188 HydrophobicContact CE2-CZ 4.43Å; Y142-F188 AromaticContact CZ-CE1 3.71Å; L184-F188 PolarHBondContact O-N 3.43Å; E185-F188 WeakPolarHBondContact O-CB 3.39Å; E185-F188 PolarHBondContact O-N 2.66Å; M186-F188 VanDerWaalsContact C-N 3.29Å; M186-F188 PolarHBondContact O-N 3.07Å; F188-W190 VanDerWaalsContact C-N 3.34Å; F188-W190 PolarHBondContact O-N 3.49Å; F188-S191 WeakPolarHBondContact O-CA 3.48Å; F188-S191 WeakPolarHBondContact O-CB 3.42Å; F188-S191 PolarHBondContact O-N 3.14Å; F188-S191 PolarHBondContact O-OG 3.32Å; F188-L192 HydrophobicContact CD1-CD1 4.04Å; F188-L192 HydrophobicContact CE1-CD1 3.61Å; F188-L192 HydrophobicContact CE1-CG 4.24Å; F188-L192 HydrophobicContact CZ-CD1 4.03Å; F188-L192 HydrophobicContact CZ-CD2 4.29Å; F188-L192 HydrophobicContact CZ-CG 4.31Å; F188-L192 WeakPolarHBondContact O-CG 3.25Å; F188-L192 PolarHBondContact O-N 3.42Å
189Y92.9Very high88.3Confident17 Ų1734 Ų347%0.06717%0.169CC..Hα-helixtrans-60.4-40.3174.2-82.4-79.9000112.8E185 M186 S191 L192 L193 H212 A215 M219E185-Y189 HydrophobicContact CG-CD2 4.19Å; E185-Y189 HydrophobicContact CG-CE2 3.99Å; E185-Y189 WeakPolarHBondContact O-CD2 3.22Å; E185-Y189 PolarHBondContact O-N 3.34Å; E185-Y189 WeakPolarHBondContact OE1-CE2 3.47Å; M186-Y189 PolarHBondContact O-N 3.21Å; Y189-S191 VanDerWaalsContact C-N 3.34Å; Y189-S191 PolarHBondContact O-N 3.25Å; Y189-L192 PolarHBondContact O-N 3.41Å; Y189-L193 PolarHBondContact O-N 3.07Å; Y189-H212 AromaticContact CD1-CD2 3.92Å; Y189-A215 HydrophobicContact CD1-CB 4.14Å; Y189-A215 HydrophobicContact CE1-CB 3.94Å; Y189-M219 HydrophobicContact CD2-CE 3.72Å; Y189-M219 HydrophobicContact CD2-SD 4.3Å; Y189-M219 HydrophobicContact CE2-CE 4.4Å; Y189-M219 HydrophobicContact CG-CE 4.12Å
190W94.2Very high86.5Confident62 Ų6236 Ų3624%0.23519%0.185CC..Hα-helixtrans-60.3-42.6171-82.7116.6000112.1T42 I43 A46 M186 S187 F188 L192 L193 F194 I216T42-W190 PolarHBondContact OG1-NE1 3.1Å; I43-W190 HydrophobicContact CD1-CD2 3.71Å; I43-W190 HydrophobicContact CD1-CE3 4.1Å; I43-W190 HydrophobicContact CD1-CG 4.02Å; I43-W190 HydrophobicContact CD1-CZ2 4.15Å; I43-W190 HydrophobicContact CD1-CZ3 4.49Å; A46-W190 HydrophobicContact CB-CB 3.57Å; M186-W190 PolarHBondContact O-N 2.76Å; S187-W190 PolarHBondContact O-N 3.13Å; F188-W190 VanDerWaalsContact C-N 3.34Å; F188-W190 PolarHBondContact O-N 3.49Å; W190-L192 VanDerWaalsContact C-N 3.29Å; W190-L192 PolarHBondContact O-N 2.72Å; W190-L193 HydrophobicContact CE3-CD2 3.94Å; W190-L193 HydrophobicContact CZ3-CD2 3.75Å; W190-L193 PolarHBondContact O-N 2.98Å; W190-F194 HydrophobicContact CB-CE2 4.27Å; W190-F194 HydrophobicContact CD2-CZ 4.45Å; W190-F194 AromaticContact CE3-CE1 3.8Å; W190-F194 HydrophobicContact CE3-CE1 3.8Å; W190-F194 AromaticContact CE3-CZ 3.76Å; W190-F194 HydrophobicContact CE3-CZ 3.76Å; W190-F194 HydrophobicContact CZ3-CE1 4.18Å; W190-F194 HydrophobicContact CZ3-CZ 4.4Å; W190-F194 WeakPolarHBondContact O-CD2 3.24Å; W190-F194 VanDerWaalsContact O-CG 3.31Å; W190-F194 WeakPolarHBondContact O-CG 3.21Å; W190-F194 PolarHBondContact O-N 3.29Å; W190-I216 HydrophobicContact CD2-CD1 4.12Å; W190-I216 HydrophobicContact CE3-CD1 4.31Å; W190-I216 HydrophobicContact CG-CD1 4.45Å; W190-I216 HydrophobicContact CH2-CG2 4.41Å; W190-I216 HydrophobicContact CZ2-CG2 3.69Å
191S93.6Very high84.7Confident0 Ų039.9 Ų39.90%020%0.204CC..Hα-helixtrans-61.8-37.4177.885.90000112.1S187 F188 Y189 R195S187-S191 WeakPolarHBondContact O-CB 3.49Å; S187-S191 PolarHBondContact O-N 3.24Å; F188-S191 WeakPolarHBondContact O-CA 3.48Å; F188-S191 WeakPolarHBondContact O-CB 3.42Å; F188-S191 PolarHBondContact O-N 3.14Å; F188-S191 PolarHBondContact O-OG 3.32Å; Y189-S191 VanDerWaalsContact C-N 3.34Å; Y189-S191 PolarHBondContact O-N 3.25Å; S191-R195 PolarHBondContact O-N 3.48Å
192L89.4Confident83.2Confident6 Ų646.7 Ų46.73%0.03123%0.229CC..Hα-helixtrans-67.1-44.1174.8-66.8178.4000111F188 Y189 W190 R195 L196F188-L192 HydrophobicContact CD1-CD1 4.04Å; F188-L192 HydrophobicContact CE1-CD1 3.61Å; F188-L192 HydrophobicContact CE1-CG 4.24Å; F188-L192 HydrophobicContact CZ-CD1 4.03Å; F188-L192 HydrophobicContact CZ-CD2 4.29Å; F188-L192 HydrophobicContact CZ-CG 4.31Å; F188-L192 WeakPolarHBondContact O-CG 3.25Å; F188-L192 PolarHBondContact O-N 3.42Å; Y189-L192 PolarHBondContact O-N 3.41Å; W190-L192 VanDerWaalsContact C-N 3.29Å; W190-L192 PolarHBondContact O-N 2.72Å; L192-R195 PolarHBondContact O-N 3.36Å; L192-L196 PolarHBondContact O-N 3.47Å; L192-L196 VanDerWaalsContact O-N 3.11Å
193L88.8Confident81.2Confident37 Ų3756.5 Ų56.519%0.19427%0.272CS..Hα-helixtrans-63-42.8178.4-172.766.3000112.2Y189 W190 R195 L196 L213 I216Y189-L193 PolarHBondContact O-N 3.07Å; W190-L193 HydrophobicContact CE3-CD2 3.94Å; W190-L193 HydrophobicContact CZ3-CD2 3.75Å; W190-L193 PolarHBondContact O-N 2.98Å; L193-R195 VanDerWaalsContact C-N 3.34Å; L193-R195 PolarHBondContact O-N 2.94Å; L193-L196 WeakPolarHBondContact O-CB 3.15Å; L193-L196 PolarHBondContact O-N 3.46Å; L193-L213 HydrophobicContact CD1-CD2 4.19Å; L193-L213 HydrophobicContact CD2-CD2 3.86Å; L193-I216 HydrophobicContact CB-CD1 4.43Å; L193-I216 HydrophobicContact CD2-CD1 3.97Å
194F88.7Confident79.7Confident63 Ų6361.9 Ų61.928%0.27630%0.301SS..Hα-helixtrans-65.2-35.7177.5-64.8-30.3000112.9I43 A46 F47 L50 W190 L196I43-F194 HydrophobicContact CD1-CZ 4.16Å; A46-F194 HydrophobicContact CB-CD2 4.39Å; A46-F194 HydrophobicContact CB-CE2 4.02Å; F47-F194 HydrophobicContact CE1-CD2 4.44Å; F47-F194 HydrophobicContact CE2-CE2 4.1Å; F47-F194 HydrophobicContact CZ-CD2 4.35Å; F47-F194 HydrophobicContact CZ-CE2 4.06Å; L50-F194 HydrophobicContact CD1-CB 4.3Å; L50-F194 HydrophobicContact CD1-CD2 4.39Å; W190-F194 HydrophobicContact CB-CE2 4.27Å; W190-F194 HydrophobicContact CD2-CZ 4.45Å; W190-F194 AromaticContact CE3-CE1 3.8Å; W190-F194 HydrophobicContact CE3-CE1 3.8Å; W190-F194 AromaticContact CE3-CZ 3.76Å; W190-F194 HydrophobicContact CE3-CZ 3.76Å; W190-F194 HydrophobicContact CZ3-CE1 4.18Å; W190-F194 HydrophobicContact CZ3-CZ 4.4Å; W190-F194 WeakPolarHBondContact O-CD2 3.24Å; W190-F194 VanDerWaalsContact O-CG 3.31Å; W190-F194 WeakPolarHBondContact O-CG 3.21Å; W190-F194 PolarHBondContact O-N 3.29Å; F194-L196 VanDerWaalsContact C-N 3.27Å; F194-L196 PolarHBondContact O-N 2.99Å
195R81.5Confident78.5Confident38 Ų3861 Ų6114%0.14330%0.295CS..Hα-helixtrans-69.8-28.8175.2-173.2174.9-81.1-148.71.4111.7R53 E57 E134 S191 L192 L193 G197 F198 D199R53-R195 VanDerWaalsContact CD-NH2 3.25Å; E57-R195 IonicContact OE1-CZ 2.83Å; E57-R195 IonicContact OE1-NH1 2.83Å; E57-R195 PolarHBondContact OE1-NH1 3.32Å; E57-R195 IonicContact OE1-NH2 3.94Å; E57-R195 PolarHBondContact OE1-NH2 3.12Å; E57-R195 IonicContact OE2-NH1 3.69Å; E57-R195 IonicContact OE2-NH2 3.92Å; E57-R195 PolarHBondContact OE2-NH2 3.1Å; E134-R195 IonicContact OE1-NH1 2.96Å; S191-R195 PolarHBondContact O-N 3.48Å; L192-R195 PolarHBondContact O-N 3.36Å; L193-R195 VanDerWaalsContact C-N 3.34Å; L193-R195 PolarHBondContact O-N 2.94Å; R195-G197 PolarHBondContact O-N 2.8Å; R195-G197 VanDerWaalsContact O-N 3.11Å; R195-F198 WeakPolarHBondContact O-CA 3.29Å; R195-F198 WeakPolarHBondContact O-CB 3.24Å; R195-F198 PolarHBondContact O-N 3.22Å; R195-D199 PolarHBondContact O-N 3.5Å
196L73.9Confident77.6Confident18 Ų1866.5 Ų66.59%0.09432%0.324CS..Hα-helixtrans-59.7-27.4-175.9-143.593000114.2L192 L193 F194 F198 D199 F205 I209L192-L196 PolarHBondContact O-N 3.47Å; L192-L196 VanDerWaalsContact O-N 3.11Å; L193-L196 WeakPolarHBondContact O-CB 3.15Å; L193-L196 PolarHBondContact O-N 3.46Å; F194-L196 VanDerWaalsContact C-N 3.27Å; F194-L196 PolarHBondContact O-N 2.99Å; L196-F198 PolarHBondContact O-N 3.47Å; L196-D199 PolarHBondContact O-N 2.9Å; L196-F205 HydrophobicContact CD1-CE2 4.3Å; L196-F205 HydrophobicContact CD2-CD2 4.35Å; L196-F205 HydrophobicContact CD2-CE1 4.4Å; L196-F205 HydrophobicContact CD2-CE2 3.6Å; L196-F205 HydrophobicContact CD2-CZ 3.62Å; L196-F205 HydrophobicContact CG-CD2 4.48Å; L196-F205 HydrophobicContact CG-CE2 3.59Å; L196-F205 HydrophobicContact CG-CZ 3.94Å; L196-I209 HydrophobicContact CD2-CB 4.37Å; L196-I209 HydrophobicContact CD2-CD1 3.66Å; L196-I209 HydrophobicContact CD2-CG1 3.07Å
197G65.4Low76.4Confident72 Ų7268 Ų6874%0.74234%0.336SS*.THydrogen-bonded Turntrans-66.6-17.9173.200000114.5R195R195-G197 PolarHBondContact O-N 2.8Å; R195-G197 VanDerWaalsContact O-N 3.11Å
198F64.4Low75.3Confident183 Ų18371.3 Ų71.380%0.80335%0.351SS*.THydrogen-bonded Turntrans-106.8-5.7-179.8-59-80.2000113.2R195 L196R195-F198 WeakPolarHBondContact O-CA 3.29Å; R195-F198 WeakPolarHBondContact O-CB 3.24Å; R195-F198 PolarHBondContact O-N 3.22Å; L196-F198 PolarHBondContact O-N 3.47Å
199D63Low74.6Confident30 Ų3073 Ų7316%0.1636%0.36CS..SBendtrans-88.9150.6-177.4-74.6-22000112.4R195 L196 K201R195-D199 PolarHBondContact O-N 3.5Å; L196-D199 PolarHBondContact O-N 2.9Å; D199-K201 PolarHBondContact O-N 3.23Å
200V57.8Low74.2Confident76 Ų7676.9 Ų76.946%0.46138%0.381SS..  trans-68.8125.5177.6-1780000109.6E124 R202E124-V200 WeakPolarHBondContact O-CG2 3.46Å; V200-R202 PolarHBondContact O-N 2.93Å; V200-R202 VanDerWaalsContact O-N 3.14Å
201K58.6Low73.7Confident171 Ų17175.1 Ų75.174%0.74338%0.376SS*.  trans-64112.1-179.8-62.9-177.8-178.8179.40110.4D199 F205D199-K201 PolarHBondContact O-N 3.23Å; K201-F205 HydrophobicContact CB-CD1 4.42Å; K201-F205 HydrophobicContact CB-CG 4.47Å; K201-F205 HydrophobicContact CD-CE1 4.43Å; K201-F205 HydrophobicContact CG-CD1 4.16Å; K201-F205 HydrophobicContact CG-CE1 3.95Å; K201-F205 HydrophobicContact CG-CZ 4.17Å
202R63.4Low73.4Confident144 Ų14475.5 Ų75.554%0.54338%0.377SS..  trans-92.4165.3174.3-71.2179.3-89.9-158.3-5.9111.1V200 D204 F205V200-R202 PolarHBondContact O-N 2.93Å; V200-R202 VanDerWaalsContact O-N 3.14Å; R202-D204 PolarHBondContact O-N 3.49Å; R202-F205 WeakPolarHBondContact O-CB 3.12Å; R202-F205 PolarHBondContact O-N 3.32Å; R202-F205 VanDerWaalsContact O-N 3.07Å
203K55.2Low73.4Confident208 Ų20879.4 Ų79.490%0.90440%0.398SS*.THydrogen-bonded Turntrans-60.1-33.4179.7-69.3-179.8180172.60112.6
204D64.1Low73.4Confident113 Ų11379.4 Ų79.460%0.60440%0.403SS*.THydrogen-bonded Turntrans-94.512.4177.6-51.9-44.2000114.1R202 L206 A207 H208R202-D204 PolarHBondContact O-N 3.49Å; D204-L206 VanDerWaalsContact C-N 3.3Å; D204-L206 PolarHBondContact O-N 3.47Å; D204-A207 PolarHBondContact O-N 3.04Å; D204-H208 PolarHBondContact O-N 3.49Å; D204-H208 VanDerWaalsContact O-N 3.16Å
205F69.7Low73.6Confident39 Ų3977 Ų7717%0.17140%0.395CS..Hα-helixtrans-60-39-176.4-179-105000112.6L196 K201 R202 H208 I209L196-F205 HydrophobicContact CD1-CE2 4.3Å; L196-F205 HydrophobicContact CD2-CD2 4.35Å; L196-F205 HydrophobicContact CD2-CE1 4.4Å; L196-F205 HydrophobicContact CD2-CE2 3.6Å; L196-F205 HydrophobicContact CD2-CZ 3.62Å; L196-F205 HydrophobicContact CG-CD2 4.48Å; L196-F205 HydrophobicContact CG-CE2 3.59Å; L196-F205 HydrophobicContact CG-CZ 3.94Å; K201-F205 HydrophobicContact CB-CD1 4.42Å; K201-F205 HydrophobicContact CB-CG 4.47Å; K201-F205 HydrophobicContact CD-CE1 4.43Å; K201-F205 HydrophobicContact CG-CD1 4.16Å; K201-F205 HydrophobicContact CG-CE1 3.95Å; K201-F205 HydrophobicContact CG-CZ 4.17Å; R202-F205 WeakPolarHBondContact O-CB 3.12Å; R202-F205 PolarHBondContact O-N 3.32Å; R202-F205 VanDerWaalsContact O-N 3.07Å; F205-H208 PolarHBondContact O-N 3.36Å; F205-I209 HydrophobicContact CD1-CD1 3.47Å; F205-I209 VanDerWaalsContact CD1-CD1 3.47Å; F205-I209 HydrophobicContact CD1-CG1 4.43Å; F205-I209 HydrophobicContact CE1-CD1 3.17Å; F205-I209 HydrophobicContact CE1-CG1 4.25Å; F205-I209 HydrophobicContact CE2-CD1 4.47Å; F205-I209 HydrophobicContact CG-CD1 4.25Å; F205-I209 HydrophobicContact CZ-CD1 3.73Å; F205-I209 HydrophobicContact CZ-CG1 4.47Å; F205-I209 WeakPolarHBondContact O-CG1 3.42Å; F205-I209 PolarHBondContact O-N 3.28Å
206L76.6Confident74.2Confident118 Ų11875.7 Ų75.762%0.61839%0.39SS*.Hα-helixtrans-67.9-43.9-178.6-172.267.8000111.9D204 H208 I209 I210D204-L206 VanDerWaalsContact C-N 3.3Å; D204-L206 PolarHBondContact O-N 3.47Å; L206-H208 VanDerWaalsContact C-N 3.29Å; L206-H208 PolarHBondContact O-N 3.32Å; L206-I209 PolarHBondContact O-N 3.4Å; L206-I210 HydrophobicContact CD1-CD1 4.34Å; L206-I210 HydrophobicContact CD2-CD1 4.43Å; L206-I210 HydrophobicContact CG-CD1 3.87Å; L206-I210 HydrophobicContact CG-CG1 4.49Å; L206-I210 VanDerWaalsContact O-CG1 3.29Å; L206-I210 WeakPolarHBondContact O-CG1 2.86Å; L206-I210 PolarHBondContact O-N 3.13Å
207A72.1Confident75.1Confident32 Ų3276.3 Ų76.326%0.26440%0.396SS..Hα-helixtrans-61.5-40.7176.900000111.1D204 I210 H211D204-A207 PolarHBondContact O-N 3.04Å; A207-I210 PolarHBondContact O-N 2.96Å; A207-H211 WeakPolarHBondContact O-CB 3.46Å; A207-H211 PolarHBondContact O-N 3.13Å
208H72.4Confident76.5Confident70 Ų7073.7 Ų73.732%0.32437%0.365SS..Hα-helixtrans-65-41.9176.1-153.270.1000112.1D204 F205 L206 H211 H212D204-H208 PolarHBondContact O-N 3.49Å; D204-H208 VanDerWaalsContact O-N 3.16Å; F205-H208 PolarHBondContact O-N 3.36Å; L206-H208 VanDerWaalsContact C-N 3.29Å; L206-H208 PolarHBondContact O-N 3.32Å; H208-H211 PolarHBondContact O-N 3.31Å; H208-H212 AromaticContact CD2-CE1 3.34Å; H208-H212 PolarHBondContact CD2-CE1 2.75Å; H208-H212 AromaticContact CD2-ND1 3.83Å; H208-H212 AromaticContact CE1-CE1 3.42Å; H208-H212 PolarHBondContact CE1-CE1 3.14Å; H208-H212 VanDerWaalsContact CE1-CE1 3.42Å; H208-H212 AromaticContact CG-CE1 3.77Å; H208-H212 AromaticContact ND1-CE1 3.79Å; H208-H212 AromaticContact NE2-CE1 3.14Å; H208-H212 PolarHBondContact NE2-CE1 3.37Å; H208-H212 AromaticContact NE2-NE2 3.71Å; H208-H212 PolarHBondContact O-N 2.96Å; H208-H212 PolarHBondContact O-ND1 3.06Å
209I81.4Confident78Confident36 Ų3665.7 Ų65.719%0.18533%0.331CS..Hα-helixtrans-58.8-53.3173.9-73.2165.9000111.3L196 F205 L206 H211 H212 L213L196-I209 HydrophobicContact CD2-CB 4.37Å; L196-I209 HydrophobicContact CD2-CD1 3.66Å; L196-I209 HydrophobicContact CD2-CG1 3.07Å; F205-I209 HydrophobicContact CD1-CD1 3.47Å; F205-I209 VanDerWaalsContact CD1-CD1 3.47Å; F205-I209 HydrophobicContact CD1-CG1 4.43Å; F205-I209 HydrophobicContact CE1-CD1 3.17Å; F205-I209 HydrophobicContact CE1-CG1 4.25Å; F205-I209 HydrophobicContact CE2-CD1 4.47Å; F205-I209 HydrophobicContact CG-CD1 4.25Å; F205-I209 HydrophobicContact CZ-CD1 3.73Å; F205-I209 HydrophobicContact CZ-CG1 4.47Å; F205-I209 WeakPolarHBondContact O-CG1 3.42Å; F205-I209 PolarHBondContact O-N 3.28Å; L206-I209 PolarHBondContact O-N 3.4Å; I209-H211 PolarHBondContact O-N 3Å; I209-H212 PolarHBondContact O-N 3.21Å; I209-L213 HydrophobicContact CG2-CD1 3.68Å; I209-L213 HydrophobicContact CG2-CG 4.17Å; I209-L213 WeakPolarHBondContact O-CG 3.34Å; I209-L213 PolarHBondContact O-N 3.36Å
210I83Confident79.5Confident99 Ų9965.5 Ų65.551%0.50833%0.332SS..Hα-helixtrans-58.2-41.7-175.7-69.8168.3000109.2L206 A207 A214L206-I210 HydrophobicContact CD1-CD1 4.34Å; L206-I210 HydrophobicContact CD2-CD1 4.43Å; L206-I210 HydrophobicContact CG-CD1 3.87Å; L206-I210 HydrophobicContact CG-CG1 4.49Å; L206-I210 VanDerWaalsContact O-CG1 3.29Å; L206-I210 WeakPolarHBondContact O-CG1 2.86Å; L206-I210 PolarHBondContact O-N 3.13Å; A207-I210 PolarHBondContact O-N 2.96Å; I210-A214 VanDerWaalsContact O-CB 3.24Å; I210-A214 WeakPolarHBondContact O-CB 3.33Å; I210-A214 PolarHBondContact O-N 3.27Å
211H85.4Confident81.3Confident25 Ų2563.5 Ų63.512%0.11632%0.317CS..Hα-helixtrans-60.5-47.6174.4177.165.9000113.3A207 H208 I209 L213 A214 A215 L314 W318A207-H211 WeakPolarHBondContact O-CB 3.46Å; A207-H211 PolarHBondContact O-N 3.13Å; H208-H211 PolarHBondContact O-N 3.31Å; I209-H211 PolarHBondContact O-N 3Å; H211-L213 PolarHBondContact O-N 3.42Å; H211-A214 WeakPolarHBondContact O-CB 3.29Å; H211-A214 PolarHBondContact O-N 2.76Å; H211-A215 WeakPolarHBondContact O-CB 3.39Å; H211-A215 PolarHBondContact O-N 2.83Å; H211-L314 HydrophobicContact CB-CD2 3.85Å; H211-L314 WeakPolarHBondContact ND1-CD2 3.4Å; H211-W318 HydrophobicContact CB-CH2 4.13Å; H211-W318 HydrophobicContact CB-CZ2 4.44Å; H211-W318 AromaticContact CD2-CH2 3.92Å; H211-W318 AromaticContact CE1-CH2 3.76Å; H211-W318 AromaticContact CG-CH2 3.58Å; H211-W318 AromaticContact ND1-CH2 3.5Å; H211-W318 WeakPolarHBondContact ND1-CH2 3.37Å
212H87.5Confident83Confident7 Ų755.6 Ų55.63%0.03228%0.283CS..Hα-helixtrans-65.2-41.1-178.7-74.158.2000111.5Y189 H208 I209 A214 A215 I216Y189-H212 AromaticContact CD1-CD2 3.92Å; H208-H212 AromaticContact CD2-CE1 3.34Å; H208-H212 PolarHBondContact CD2-CE1 2.75Å; H208-H212 AromaticContact CD2-ND1 3.83Å; H208-H212 AromaticContact CE1-CE1 3.42Å; H208-H212 PolarHBondContact CE1-CE1 3.14Å; H208-H212 VanDerWaalsContact CE1-CE1 3.42Å; H208-H212 AromaticContact CG-CE1 3.77Å; H208-H212 AromaticContact ND1-CE1 3.79Å; H208-H212 AromaticContact NE2-CE1 3.14Å; H208-H212 PolarHBondContact NE2-CE1 3.37Å; H208-H212 AromaticContact NE2-NE2 3.71Å; H208-H212 PolarHBondContact O-N 2.96Å; H208-H212 PolarHBondContact O-ND1 3.06Å; I209-H212 PolarHBondContact O-N 3.21Å; H212-A214 VanDerWaalsContact C-N 3.33Å; H212-A215 PolarHBondContact O-N 3.23Å; H212-I216 VanDerWaalsContact O-CG1 3.3Å; H212-I216 WeakPolarHBondContact O-CG1 3.28Å; H212-I216 PolarHBondContact O-N 3.37Å
213L88.8Confident84.5Confident89 Ų8948.7 Ų48.747%0.46626%0.257SS..Hα-helixtrans-64-39.9174.2-69.1176.8000111.5L193 I209 H211 S217L193-L213 HydrophobicContact CD1-CD2 4.19Å; L193-L213 HydrophobicContact CD2-CD2 3.86Å; I209-L213 HydrophobicContact CG2-CD1 3.68Å; I209-L213 HydrophobicContact CG2-CG 4.17Å; I209-L213 WeakPolarHBondContact O-CG 3.34Å; I209-L213 PolarHBondContact O-N 3.36Å; H211-L213 PolarHBondContact O-N 3.42Å; L213-S217 WeakPolarHBondContact O-CB 3.31Å; L213-S217 PolarHBondContact O-N 3.01Å
214A89.3Confident86.4Confident36 Ų3639.4 Ų39.430%0.29822%0.218SC..Hα-helixtrans-64.3-44.4175.100000111.7I210 H211 H212 S217 L218I210-A214 VanDerWaalsContact O-CB 3.24Å; I210-A214 WeakPolarHBondContact O-CB 3.33Å; I210-A214 PolarHBondContact O-N 3.27Å; H211-A214 WeakPolarHBondContact O-CB 3.29Å; H211-A214 PolarHBondContact O-N 2.76Å; H212-A214 VanDerWaalsContact C-N 3.33Å; A214-S217 PolarHBondContact O-N 3.33Å; A214-L218 VanDerWaalsContact O-CB 3.26Å; A214-L218 WeakPolarHBondContact O-CB 3.37Å; A214-L218 PolarHBondContact O-N 3.4Å
215A92.1Very high87.7Confident13 Ų1334.1 Ų34.111%0.10719%0.19CC..Hα-helixtrans-61.8-48.5177.100000111.7Y189 H211 H212 S217 L218 M219Y189-A215 HydrophobicContact CD1-CB 4.14Å; Y189-A215 HydrophobicContact CE1-CB 3.94Å; H211-A215 WeakPolarHBondContact O-CB 3.39Å; H211-A215 PolarHBondContact O-N 2.83Å; H212-A215 PolarHBondContact O-N 3.23Å; A215-S217 VanDerWaalsContact C-N 3.3Å; A215-S217 PolarHBondContact O-N 3.29Å; A215-L218 PolarHBondContact O-N 2.92Å; A215-M219 WeakPolarHBondContact O-CE 3.09Å; A215-M219 WeakPolarHBondContact O-CG 3.36Å; A215-M219 PolarHBondContact O-N 3.15Å
216I93.9Very high88.8Confident10 Ų1032.4 Ų32.45%0.05118%0.182CC..Hα-helixtrans-60-43175.8-67.3167.4000110.6W190 L193 H212 M219 S220W190-I216 HydrophobicContact CD2-CD1 4.12Å; W190-I216 HydrophobicContact CE3-CD1 4.31Å; W190-I216 HydrophobicContact CG-CD1 4.45Å; W190-I216 HydrophobicContact CH2-CG2 4.41Å; W190-I216 HydrophobicContact CZ2-CG2 3.69Å; L193-I216 HydrophobicContact CB-CD1 4.43Å; L193-I216 HydrophobicContact CD2-CD1 3.97Å; H212-I216 VanDerWaalsContact O-CG1 3.3Å; H212-I216 WeakPolarHBondContact O-CG1 3.28Å; H212-I216 PolarHBondContact O-N 3.37Å; I216-M219 HydrophobicContact CG1-CE 4.37Å; I216-S220 VanDerWaalsContact O-CB 3.25Å; I216-S220 WeakPolarHBondContact O-CB 3.43Å; I216-S220 PolarHBondContact O-N 3.39Å; I216-S220 PolarHBondContact O-OG 3.24Å
217S93.7Very high89.7Confident31 Ų3127 Ų2722%0.21715%0.153CC..Hα-helixtrans-63.1-46.3177.4-174.50000111.7L213 A214 A215 S220 F221 Q307L213-S217 WeakPolarHBondContact O-CB 3.31Å; L213-S217 PolarHBondContact O-N 3.01Å; A214-S217 PolarHBondContact O-N 3.33Å; A215-S217 VanDerWaalsContact C-N 3.3Å; A215-S217 PolarHBondContact O-N 3.29Å; S217-S220 PolarHBondContact O-N 3.3Å; S217-F221 WeakPolarHBondContact O-CD2 3.31Å; S217-F221 PolarHBondContact O-N 3.23Å; S217-Q307 PolarHBondContact OG-NE2 2.77Å
218L94.5Very high90.7Very high18 Ų1825.6 Ų25.69%0.09414%0.142CC..Hα-helixtrans-61.3-48.2-179.6-172.578.1000111.3A214 A215 S220 S222 V234 L304 Q307 L308 L311A214-L218 VanDerWaalsContact O-CB 3.26Å; A214-L218 WeakPolarHBondContact O-CB 3.37Å; A214-L218 PolarHBondContact O-N 3.4Å; A215-L218 PolarHBondContact O-N 2.92Å; L218-S220 VanDerWaalsContact C-N 3.35Å; L218-S220 PolarHBondContact O-N 2.76Å; L218-S222 WeakPolarHBondContact O-CB 3.46Å; L218-S222 PolarHBondContact O-N 2.65Å; L218-V234 HydrophobicContact CD2-CG1 4.29Å; L218-L304 HydrophobicContact CD1-CD1 3.8Å; L218-L304 HydrophobicContact CD1-CG 3.96Å; L218-L304 HydrophobicContact CG-CD1 4.4Å; L218-Q307 HydrophobicContact CD1-CB 3.71Å; L218-L308 HydrophobicContact CD1-CD2 3.77Å; L218-L308 HydrophobicContact CD1-CG 3.86Å; L218-L308 HydrophobicContact CD2-CD2 3.65Å; L218-L308 HydrophobicContact CG-CD2 4.27Å; L218-L311 HydrophobicContact CD2-CD2 4.19Å
219M95.8Very high91.8Very high15 Ų1524.1 Ų24.17%0.07413%0.133CC..Hα-helixtrans-65.2-38.4177.1-66.5-179.8-61.800111.8E185 M186 Y189 A215 I216 W223E185-M219 HydrophobicContact CB-SD 4.49Å; E185-M219 HydrophobicContact CG-SD 4.14Å; M186-M219 HydrophobicContact CB-CE 3.97Å; M186-M219 HydrophobicContact CB-SD 4.3Å; M186-M219 HydrophobicContact CE-CB 3.43Å; M186-M219 VanDerWaalsContact CE-CB 3.43Å; M186-M219 HydrophobicContact CG-CE 3.93Å; Y189-M219 HydrophobicContact CD2-CE 3.72Å; Y189-M219 HydrophobicContact CD2-SD 4.3Å; Y189-M219 HydrophobicContact CE2-CE 4.4Å; Y189-M219 HydrophobicContact CG-CE 4.12Å; A215-M219 WeakPolarHBondContact O-CE 3.09Å; A215-M219 WeakPolarHBondContact O-CG 3.36Å; A215-M219 PolarHBondContact O-N 3.15Å; I216-M219 HydrophobicContact CG1-CE 4.37Å; M219-W223 WeakPolarHBondContact O-CB 3.3Å; M219-W223 PolarHBondContact O-N 3.42Å
220S94.9Very high92.5Very high26 Ų2622.7 Ų22.718%0.18213%0.126CC..Hα-helixtrans-67.2-45.7179.3-60.30000112I216 S217 L218 W223 C224I216-S220 VanDerWaalsContact O-CB 3.25Å; I216-S220 WeakPolarHBondContact O-CB 3.43Å; I216-S220 PolarHBondContact O-N 3.39Å; I216-S220 PolarHBondContact O-OG 3.24Å; S217-S220 PolarHBondContact O-N 3.3Å; L218-S220 VanDerWaalsContact C-N 3.35Å; L218-S220 PolarHBondContact O-N 2.76Å; S220-W223 PolarHBondContact O-N 2.94Å; S220-C224 PolarHBondContact O-N 2.69Å; S220-C224 PolarHBondContact O-SG 3.48Å
221F93.9Very high93.1Very high34 Ų3418.4 Ų18.415%0.14911%0.107CC..Hα-helixtrans-68-39.5176.4-90-99.5000111.6W15 S217 W223 C224 A225 F299 F303 L304W15-F221 AromaticContact CH2-CD1 3.46Å; W15-F221 HydrophobicContact CH2-CD1 3.46Å; W15-F221 VanDerWaalsContact CH2-CD1 3.46Å; W15-F221 AromaticContact CH2-CE1 3.27Å; W15-F221 HydrophobicContact CH2-CE1 3.27Å; W15-F221 HydrophobicContact CH2-CG 4.17Å; W15-F221 AromaticContact CH2-CZ 3.86Å; W15-F221 HydrophobicContact CH2-CZ 3.86Å; W15-F221 HydrophobicContact CZ2-CD1 4.49Å; W15-F221 AromaticContact CZ2-CE1 3.95Å; W15-F221 HydrophobicContact CZ2-CE1 3.95Å; W15-F221 HydrophobicContact CZ2-CZ 4.44Å; W15-F221 AromaticContact CZ3-CD1 3.5Å; W15-F221 HydrophobicContact CZ3-CD1 3.5Å; W15-F221 AromaticContact CZ3-CE1 3.81Å; W15-F221 HydrophobicContact CZ3-CE1 3.81Å; W15-F221 HydrophobicContact CZ3-CG 4.21Å; S217-F221 WeakPolarHBondContact O-CD2 3.31Å; S217-F221 PolarHBondContact O-N 3.23Å; F221-W223 VanDerWaalsContact C-N 3.28Å; F221-W223 PolarHBondContact O-N 2.79Å; F221-C224 PolarHBondContact O-N 2.95Å; F221-A225 WeakPolarHBondContact O-CB 3.39Å; F221-A225 PolarHBondContact O-N 3.25Å; F221-F299 HydrophobicContact CE1-CE1 4.49Å; F221-F303 AromaticContact CD1-CD1 3.55Å; F221-F303 HydrophobicContact CD1-CD1 3.55Å; F221-F303 AromaticContact CD1-CE1 3.81Å; F221-F303 HydrophobicContact CD1-CE1 3.81Å; F221-F303 HydrophobicContact CD2-CD1 4.28Å; F221-F303 AromaticContact CD2-CE1 3.71Å; F221-F303 HydrophobicContact CD2-CE1 3.71Å; F221-F303 AromaticContact CE1-CD1 3.57Å; F221-F303 HydrophobicContact CE1-CD1 3.57Å; F221-F303 AromaticContact CE1-CE1 3.66Å; F221-F303 HydrophobicContact CE1-CE1 3.66Å; F221-F303 HydrophobicContact CE1-CG 4.46Å; F221-F303 HydrophobicContact CE2-CD1 4.3Å; F221-F303 AromaticContact CE2-CE1 3.56Å; F221-F303 HydrophobicContact CE2-CE1 3.56Å; F221-F303 HydrophobicContact CE2-CZ 4.27Å; F221-F303 AromaticContact CG-CD1 3.92Å; F221-F303 HydrophobicContact CG-CD1 3.92Å; F221-F303 AromaticContact CG-CE1 3.83Å; F221-F303 HydrophobicContact CG-CE1 3.83Å; F221-F303 AromaticContact CZ-CD1 3.95Å; F221-F303 HydrophobicContact CZ-CD1 3.95Å; F221-F303 AromaticContact CZ-CE1 3.53Å; F221-F303 HydrophobicContact CZ-CE1 3.53Å; F221-F303 HydrophobicContact CZ-CZ 4.2Å; F221-L304 HydrophobicContact CB-CD1 3.92Å
222S95.8Very high93.6Very high4 Ų417.2 Ų17.23%0.02810%0.101CC..Hα-helixtrans-56-44.1172.31700000111.4Y182 L218 N226 Y227Y182-S222 PolarHBondContact OH-OG 2.83Å; L218-S222 WeakPolarHBondContact O-CB 3.46Å; L218-S222 PolarHBondContact O-N 2.65Å; S222-N226 PolarHBondContact O-N 3.28Å; S222-Y227 PolarHBondContact O-N 2.82Å; S222-Y227 PolarHBondContact OG-O 3.5Å
223W95.2Very high94Very high0 Ų017.3 Ų17.30%010%0.102CC..Hα-helixtrans-65.2-50.7176.7-172.7-90.7000113V34 K35 H38 L39 L174 Y179 Y182 M219 S220 F221 A225 N226 I228V34-W223 HydrophobicContact CB-CZ2 4.49Å; V34-W223 HydrophobicContact CG1-CD2 4.36Å; V34-W223 HydrophobicContact CG1-CH2 4.35Å; V34-W223 HydrophobicContact CG1-CZ2 4.15Å; V34-W223 WeakPolarHBondContact CG2-O 3.46Å; K35-W223 PolarHBondContact O-NE1 3.24Å; H38-W223 HydrophobicContact CB-CZ2 3.65Å; H38-W223 AromaticContact CG-CZ2 3.99Å; H38-W223 AromaticContact ND1-CZ2 3.53Å; L39-W223 HydrophobicContact CD1-CB 4.34Å; L39-W223 HydrophobicContact CD1-CG 4.39Å; L39-W223 HydrophobicContact CD2-CB 3.88Å; L39-W223 HydrophobicContact CD2-CD2 4.06Å; L39-W223 HydrophobicContact CD2-CG 3.55Å; L39-W223 HydrophobicContact CG-CB 4.45Å; L39-W223 HydrophobicContact CG-CG 4.05Å; L174-W223 HydrophobicContact CD1-CH2 3.74Å; L174-W223 HydrophobicContact CD1-CZ3 4.12Å; L174-W223 HydrophobicContact CD2-CH2 3.88Å; L174-W223 HydrophobicContact CD2-CZ2 4.05Å; L174-W223 HydrophobicContact CG-CH2 4.48Å; Y179-W223 AromaticContact CD2-CH2 3.63Å; Y179-W223 HydrophobicContact CD2-CH2 3.63Å; Y179-W223 AromaticContact CD2-CZ2 3.94Å; Y179-W223 HydrophobicContact CD2-CZ2 3.94Å; Y179-W223 HydrophobicContact CE2-CH2 4.4Å; Y179-W223 HydrophobicContact CE2-CZ2 4.36Å; Y179-W223 HydrophobicContact CG-CH2 4.32Å; Y182-W223 AromaticContact CD1-CE3 3.64Å; Y182-W223 HydrophobicContact CD1-CE3 3.64Å; Y182-W223 HydrophobicContact CD1-CZ3 4.25Å; Y182-W223 HydrophobicContact CD2-CE3 4.46Å; Y182-W223 HydrophobicContact CD2-CZ3 4.36Å; Y182-W223 HydrophobicContact CE1-CE3 4.26Å; Y182-W223 AromaticContact CG-CE3 3.73Å; Y182-W223 HydrophobicContact CG-CE3 3.73Å; Y182-W223 AromaticContact CG-CZ3 3.85Å; Y182-W223 HydrophobicContact CG-CZ3 3.85Å; M219-W223 WeakPolarHBondContact O-CB 3.3Å; M219-W223 PolarHBondContact O-N 3.42Å; S220-W223 PolarHBondContact O-N 2.94Å; F221-W223 VanDerWaalsContact C-N 3.28Å; F221-W223 PolarHBondContact O-N 2.79Å; W223-A225 VanDerWaalsContact C-N 3.28Å; W223-A225 PolarHBondContact O-N 2.96Å; W223-N226 PolarHBondContact O-N 3.4Å; W223-N226 VanDerWaalsContact O-N 3.17Å; W223-I228 HydrophobicContact CB-CD1 4.5Å; W223-I228 HydrophobicContact CD2-CD1 3.99Å; W223-I228 HydrophobicContact CE3-CD1 3.32Å; W223-I228 HydrophobicContact CZ3-CD1 3.76Å
224C93.3Very high94.4Very high13 Ų1313.7 Ų13.79%0.0888%0.084CC..Hα-helixtrans-65.7-29-176-680000113.4W10 W15 S220 F221W10-C224 HydrophobicContact CH2-CB 4.06Å; W10-C224 HydrophobicContact CZ3-CB 4.26Å; W15-C224 HydrophobicContact CE3-CB 3.87Å; W15-C224 HydrophobicContact CH2-CB 4.03Å; W15-C224 HydrophobicContact CZ3-CB 3.39Å; S220-C224 PolarHBondContact O-N 2.69Å; S220-C224 PolarHBondContact O-SG 3.48Å; F221-C224 PolarHBondContact O-N 2.95Å
225A92Very high94.7Very high1 Ų112.6 Ų12.61%0.0087%0.072CC..THydrogen-bonded Turntrans-96.88.6177.400000113.6W15 Y169 F221 W223 Y227W15-A225 HydrophobicContact CE3-CB 4.25Å; Y169-A225 WeakPolarHBondContact CE2-O 3.31Å; Y169-A225 PolarHBondContact OH-O 2.96Å; Y169-A225 VanDerWaalsContact OH-O 3.07Å; F221-A225 WeakPolarHBondContact O-CB 3.39Å; F221-A225 PolarHBondContact O-N 3.25Å; W223-A225 VanDerWaalsContact C-N 3.28Å; W223-A225 PolarHBondContact O-N 2.96Å; A225-Y227 VanDerWaalsContact C-N 3.31Å; A225-Y227 HydrophobicContact CB-CD2 3.56Å; A225-Y227 HydrophobicContact CB-CE2 3.3Å; A225-Y227 HydrophobicContact CB-CG 4.3Å; A225-Y227 PolarHBondContact O-N 3.07Å
226N93.7Very high94.8Very high3 Ų313 Ų132%0.0167%0.072CC..THydrogen-bonded Turntrans5835.1-178.2-156.121000115.1V34 P170 Q172 S222 W223 I228V34-N226 HydrophobicContact CG2-CB 3.57Å; V34-N226 WeakPolarHBondContact CG2-OD1 3.43Å; P170-N226 PolarHBondContact O-ND2 3.29Å; Q172-N226 PolarHBondContact O-ND2 3.48Å; S222-N226 PolarHBondContact O-N 3.28Å; W223-N226 PolarHBondContact O-N 3.4Å; W223-N226 VanDerWaalsContact O-N 3.17Å; N226-I228 PolarHBondContact O-N 3.38Å; N226-I228 VanDerWaalsContact O-N 3.17Å
227Y94.1Very high94.9Very high4 Ų413.4 Ų13.42%0.0168%0.076CC..  trans-85.339.1171.5-58.1-48.5000111.9W166 Y169 Y182 S222 A225 S230 G231 F298 Y301 L304W166-Y227 AromaticContact CH2-CD1 3.64Å; W166-Y227 HydrophobicContact CH2-CD1 3.64Å; W166-Y227 AromaticContact CH2-CE1 3.68Å; W166-Y227 HydrophobicContact CH2-CE1 3.68Å; W166-Y227 AromaticContact CZ3-CD1 3.68Å; W166-Y227 HydrophobicContact CZ3-CD1 3.68Å; W166-Y227 AromaticContact CZ3-CE1 3.6Å; W166-Y227 HydrophobicContact CZ3-CE1 3.6Å; Y169-Y227 HydrophobicContact CD2-CD1 4.23Å; Y169-Y227 HydrophobicContact CD2-CE1 4.39Å; Y169-Y227 HydrophobicContact CE1-CE1 4.18Å; Y169-Y227 AromaticContact CE2-CD1 3.4Å; Y169-Y227 HydrophobicContact CE2-CD1 3.4Å; Y169-Y227 VanDerWaalsContact CE2-CD1 3.4Å; Y169-Y227 AromaticContact CE2-CE1 3.38Å; Y169-Y227 HydrophobicContact CE2-CE1 3.38Å; Y169-Y227 AromaticContact CZ-CD1 3.84Å; Y169-Y227 AromaticContact CZ-CE1 3.26Å; Y169-Y227 WeakPolarHBondContact OH-CE1 3.45Å; Y169-Y227 PolarHBondContact OH-OH 2.91Å; Y182-Y227 PolarHBondContact OH-O 2.94Å; S222-Y227 PolarHBondContact O-N 2.82Å; S222-Y227 PolarHBondContact OG-O 3.5Å; A225-Y227 VanDerWaalsContact C-N 3.31Å; A225-Y227 HydrophobicContact CB-CD2 3.56Å; A225-Y227 HydrophobicContact CB-CE2 3.3Å; A225-Y227 HydrophobicContact CB-CG 4.3Å; A225-Y227 PolarHBondContact O-N 3.07Å; Y227-S230 PolarHBondContact O-OG 3.42Å; Y227-S230 VanDerWaalsContact O-OG 3.09Å; Y227-G231 PolarHBondContact O-N 3.05Å; Y227-F298 VanDerWaalsContact OH-CE2 3.26Å; Y227-F298 WeakPolarHBondContact OH-CE2 3.36Å; Y227-F298 VanDerWaalsContact OH-CZ 3.22Å; Y227-F298 WeakPolarHBondContact OH-CZ 3.25Å; Y227-Y301 WeakPolarHBondContact OH-CA 3.47Å; Y227-Y301 PolarHBondContact OH-N 3.47Å; Y227-L304 HydrophobicContact CD2-CD1 4.37Å; Y227-L304 HydrophobicContact CD2-CD2 3.54Å; Y227-L304 HydrophobicContact CD2-CG 4.38Å; Y227-L304 HydrophobicContact CE2-CB 4.37Å; Y227-L304 HydrophobicContact CE2-CD2 4Å; Y227-L304 HydrophobicContact CG-CD2 4.16Å
228I95.1Very high94.9Very high3 Ų312.8 Ų12.82%0.0157%0.069CC..Hα-helixtrans-65.8-44.2-170.7-58.2-55000111.4V34 Q178 Y182 W223 N226 G231 T232V34-I228 HydrophobicContact CG1-CD1 3.9Å; V34-I228 HydrophobicContact CG1-CG1 3.68Å; Q178-I228 HydrophobicContact CB-CG2 3.71Å; Q178-I228 HydrophobicContact CG-CG2 4.15Å; Y182-I228 HydrophobicContact CD2-CG2 4.37Å; Y182-I228 HydrophobicContact CE1-CD1 4.23Å; Y182-I228 HydrophobicContact CE2-CD1 4.2Å; Y182-I228 HydrophobicContact CE2-CG2 3.94Å; Y182-I228 PolarHBondContact OH-O 3.2Å; W223-I228 HydrophobicContact CB-CD1 4.5Å; W223-I228 HydrophobicContact CD2-CD1 3.99Å; W223-I228 HydrophobicContact CE3-CD1 3.32Å; W223-I228 HydrophobicContact CZ3-CD1 3.76Å; N226-I228 PolarHBondContact O-N 3.38Å; N226-I228 VanDerWaalsContact O-N 3.17Å; I228-G231 PolarHBondContact O-N 3.43Å; I228-T232 HydrophobicContact CG2-CG2 4.38Å; I228-T232 WeakPolarHBondContact O-CG2 3.46Å; I228-T232 PolarHBondContact O-N 2.9Å; I228-T232 PolarHBondContact O-OG1 2.87Å
229R95.4Very high94.9Very high39 Ų3912 Ų1215%0.1477%0.065CC..Hα-helixtrans-60.1-53179.9-64.5-177-175.9174.95.1111W158 E164 V165 N167 G231 T232 L233W158-R229 HydrophobicContact CD2-CB 4.26Å; W158-R229 HydrophobicContact CD2-CG 3.84Å; W158-R229 HydrophobicContact CE3-CG 4.11Å; W158-R229 HydrophobicContact CG-CB 4.12Å; W158-R229 HydrophobicContact CG-CG 4.22Å; W158-R229 HydrophobicContact CZ2-CG 4.34Å; W158-R229 HydrophobicContact CZ3-CG 4.45Å; E164-R229 PolarHBondContact O-NH1 3.02Å; V165-R229 HydrophobicContact CG1-CB 4.17Å; N167-R229 PolarHBondContact O-NH1 3.46Å; N167-R229 VanDerWaalsContact O-NH1 3.12Å; R229-G231 PolarHBondContact O-N 2.92Å; R229-T232 PolarHBondContact O-N 3.36Å; R229-T232 PolarHBondContact O-OG1 3.01Å; R229-L233 PolarHBondContact O-N 3.29Å
230S95.3Very high94.8Very high6 Ų613.6 Ų13.64%0.0428%0.075CC..Hα-helixtrans-63.7-42.2179.258.10000112.2Y227 T232 L233 V234Y227-S230 PolarHBondContact O-OG 3.42Å; Y227-S230 VanDerWaalsContact O-OG 3.09Å; S230-T232 PolarHBondContact O-N 2.99Å; S230-L233 WeakPolarHBondContact O-CB 3.34Å; S230-L233 PolarHBondContact O-N 3.06Å; S230-L233 VanDerWaalsContact O-N 3.17Å; S230-V234 WeakPolarHBondContact O-CG2 3.24Å; S230-V234 PolarHBondContact O-N 2.95Å
231G95.7Very high94.8Very high9 Ų912.3 Ų12.39%0.0937%0.067CC..Hα-helixtrans-70.8-30.8-179.500000113.6Y182 Y227 I228 R229 L233 V234 M235Y182-G231 WeakPolarHBondContact OH-CA 3.4Å; Y227-G231 PolarHBondContact O-N 3.05Å; I228-G231 PolarHBondContact O-N 3.43Å; R229-G231 PolarHBondContact O-N 2.92Å; G231-L233 VanDerWaalsContact C-N 3.28Å; G231-L233 PolarHBondContact O-N 3.16Å; G231-V234 WeakPolarHBondContact O-CB 3.27Å; G231-V234 PolarHBondContact O-N 3.36Å; G231-M235 VanDerWaalsContact O-CG 3.25Å; G231-M235 WeakPolarHBondContact O-CG 3.39Å; G231-M235 PolarHBondContact O-N 3.05Å
232T95.9Very high94.8Very high0 Ų011.7 Ų11.70%07%0.065CC..Hα-helixtrans-61.3-36169.155.90000112.7L153 Q178 Y181 Y182 I228 R229 S230 I236L153-T232 HydrophobicContact CD2-CG2 4.49Å; Q178-T232 HydrophobicContact CB-CG2 4.4Å; Q178-T232 HydrophobicContact CG-CG2 4.17Å; Y181-T232 HydrophobicContact CD1-CG2 3.85Å; Y181-T232 HydrophobicContact CE1-CG2 4.3Å; Y182-T232 HydrophobicContact CD2-CG2 4.08Å; Y182-T232 HydrophobicContact CE2-CG2 3.63Å; I228-T232 HydrophobicContact CG2-CG2 4.38Å; I228-T232 WeakPolarHBondContact O-CG2 3.46Å; I228-T232 PolarHBondContact O-N 2.9Å; I228-T232 PolarHBondContact O-OG1 2.87Å; R229-T232 PolarHBondContact O-N 3.36Å; R229-T232 PolarHBondContact O-OG1 3.01Å; S230-T232 PolarHBondContact O-N 2.99Å; T232-I236 WeakPolarHBondContact O-CG2 3.18Å; T232-I236 PolarHBondContact O-N 3.35Å; T232-I236 VanDerWaalsContact O-N 3.15Å
233L96.3Very high94.8Very high9 Ų912.5 Ų12.55%0.0477%0.069CC..Hα-helixtrans-68.2-42.1174.4-62.1178.2000111.5L159 L162 V165 R229 S230 G231 I236 V237 I283L159-L233 HydrophobicContact CD1-CD2 3.84Å; L162-L233 HydrophobicContact CD2-CD1 3.91Å; V165-L233 HydrophobicContact CG2-CD1 3.69Å; R229-L233 PolarHBondContact O-N 3.29Å; S230-L233 WeakPolarHBondContact O-CB 3.34Å; S230-L233 PolarHBondContact O-N 3.06Å; S230-L233 VanDerWaalsContact O-N 3.17Å; G231-L233 VanDerWaalsContact C-N 3.28Å; G231-L233 PolarHBondContact O-N 3.16Å; L233-I236 WeakPolarHBondContact O-CG2 3.3Å; L233-V237 WeakPolarHBondContact O-CB 3.43Å; L233-V237 VanDerWaalsContact O-CG2 3.25Å; L233-V237 WeakPolarHBondContact O-CG2 3.1Å; L233-V237 PolarHBondContact O-N 3.41Å; L233-I283 HydrophobicContact CB-CD1 3.75Å; L233-I283 HydrophobicContact CD1-CD1 4.15Å
234V95.9Very high94.9Very high14 Ų1416.7 Ų16.79%0.0859%0.085CC..Hα-helixtrans-56.4-53.1173.3174.50000109.5L218 S230 G231 I236 V237 H238 F279 I283 L308L218-V234 HydrophobicContact CD2-CG1 4.29Å; S230-V234 WeakPolarHBondContact O-CG2 3.24Å; S230-V234 PolarHBondContact O-N 2.95Å; G231-V234 WeakPolarHBondContact O-CB 3.27Å; G231-V234 PolarHBondContact O-N 3.36Å; V234-I236 PolarHBondContact O-N 3.35Å; V234-V237 PolarHBondContact O-N 3.05Å; V234-H238 PolarHBondContact O-N 3.11Å; V234-H238 PolarHBondContact O-ND1 2.82Å; V234-F279 HydrophobicContact CG1-CE2 4.18Å; V234-F279 HydrophobicContact CG2-CE2 4.27Å; V234-I283 HydrophobicContact CG2-CG2 3.64Å; V234-L308 HydrophobicContact CG1-CD2 4.44Å; V234-L308 HydrophobicContact CG2-CD2 4.15Å
235M95.5Very high94.9Very high12 Ų1218.1 Ų18.16%0.0599%0.091CC..Hα-helixtrans-55.6-53.5-178.2-66158.268.800112.2Y181 Y182 E185 G231 V237 H238 D239Y181-M235 HydrophobicContact CD1-CE 4.1Å; Y181-M235 HydrophobicContact CD2-CE 3.69Å; Y181-M235 HydrophobicContact CE1-CB 4.27Å; Y181-M235 HydrophobicContact CE1-CE 4.12Å; Y181-M235 HydrophobicContact CE2-CE 3.73Å; Y181-M235 HydrophobicContact CG-CE 3.89Å; Y182-M235 HydrophobicContact CD2-CE 4.48Å; Y182-M235 HydrophobicContact CD2-SD 3.91Å; Y182-M235 HydrophobicContact CE1-SD 4.42Å; Y182-M235 HydrophobicContact CE2-SD 3.79Å; Y182-M235 HydrophobicContact CG-SD 4.29Å; E185-M235 HydrophobicContact CB-CE 3.37Å; E185-M235 HydrophobicContact CG-CE 3.62Å; G231-M235 VanDerWaalsContact O-CG 3.25Å; G231-M235 WeakPolarHBondContact O-CG 3.39Å; G231-M235 PolarHBondContact O-N 3.05Å; M235-V237 VanDerWaalsContact C-N 3.28Å; M235-V237 PolarHBondContact O-N 3.25Å; M235-H238 PolarHBondContact O-N 3.36Å; M235-D239 VanDerWaalsContact O-CG 3.23Å; M235-D239 PolarHBondContact O-N 2.92Å
236I95.1Very high95Very high21 Ų2118.5 Ų18.511%0.1089%0.093CC..Hα-helixtrans-63.2-34.5-175.2-168.4158.6000113.2V150 L153 Y181 T232 L233 V234 H238 V240V150-I236 HydrophobicContact CB-CD1 4.49Å; V150-I236 HydrophobicContact CG2-CD1 3.84Å; L153-I236 HydrophobicContact CD1-CB 4.26Å; L153-I236 HydrophobicContact CD1-CD1 4.06Å; L153-I236 HydrophobicContact CD1-CG2 3.9Å; Y181-I236 WeakPolarHBondContact OH-CA 3.37Å; Y181-I236 PolarHBondContact OH-N 2.97Å; T232-I236 WeakPolarHBondContact O-CG2 3.18Å; T232-I236 PolarHBondContact O-N 3.35Å; T232-I236 VanDerWaalsContact O-N 3.15Å; L233-I236 WeakPolarHBondContact O-CG2 3.3Å; V234-I236 PolarHBondContact O-N 3.35Å; I236-H238 VanDerWaalsContact C-N 3.25Å; I236-H238 PolarHBondContact O-N 3.06Å; I236-V240 PolarHBondContact O-N 3.38Å
237V95.4Very high95Very high20 Ų2019 Ų1912%0.12110%0.096CC..Hα-helixtrans-66.4-31.7177.1168.70000110.6L233 V234 M235 S274 I278 F279 I283L233-V237 WeakPolarHBondContact O-CB 3.43Å; L233-V237 VanDerWaalsContact O-CG2 3.25Å; L233-V237 WeakPolarHBondContact O-CG2 3.1Å; L233-V237 PolarHBondContact O-N 3.41Å; V234-V237 PolarHBondContact O-N 3.05Å; M235-V237 VanDerWaalsContact C-N 3.28Å; M235-V237 PolarHBondContact O-N 3.25Å; V237-S274 WeakPolarHBondContact CG1-O 3.39Å; V237-S274 VanDerWaalsContact O-CB 3.24Å; V237-S274 WeakPolarHBondContact O-CB 3.31Å; V237-I278 HydrophobicContact CG1-CG2 4.37Å; V237-I278 HydrophobicContact CG2-CG2 3.89Å; V237-F279 HydrophobicContact CG1-CB 4.27Å; V237-I283 HydrophobicContact CG2-CG1 4.5Å
238H94.1Very high94.9Very high17 Ų1719 Ų198%0.07910%0.097CC..Hα-helixtrans-83.8-42.5179.7-6765.6000111.9V234 M235 I236 V240 R275 F279 H315V234-H238 PolarHBondContact O-N 3.11Å; V234-H238 PolarHBondContact O-ND1 2.82Å; M235-H238 PolarHBondContact O-N 3.36Å; I236-H238 VanDerWaalsContact C-N 3.25Å; I236-H238 PolarHBondContact O-N 3.06Å; H238-V240 VanDerWaalsContact C-N 3.33Å; H238-V240 PolarHBondContact O-N 3.26Å; H238-R275 PolarHBondContact O-NH2 3.43Å; H238-F279 AromaticContact CE1-CD2 3.48Å; H238-F279 VanDerWaalsContact CE1-CD2 3.48Å; H238-F279 WeakPolarHBondContact CE1-CD2 3.48Å; H238-F279 AromaticContact CE1-CE2 3.51Å; H238-H315 AromaticContact CD2-CE1 3.72Å; H238-H315 AromaticContact CD2-NE2 3.44Å; H238-H315 PolarHBondContact CD2-NE2 3.33Å; H238-H315 AromaticContact NE2-CE1 3.03Å; H238-H315 PolarHBondContact NE2-CE1 3.45Å; H238-H315 AromaticContact NE2-NE2 3.27Å; H238-H315 PolarHBondContact NE2-NE2 3.27Å
239D93.8Very high94.6Very high2 Ų221.7 Ų21.71%0.01111%0.109CC..Hα-helixtrans-68.1-33-170.9-59.6-21.2000112.9I145 T146 M235 A241 D242I145-D239 HydrophobicContact CG2-CB 4.46Å; T146-D239 WeakPolarHBondContact OG1-CB 3.46Å; M235-D239 VanDerWaalsContact O-CG 3.23Å; M235-D239 PolarHBondContact O-N 2.92Å; D239-A241 VanDerWaalsContact C-N 3.29Å; D239-A241 PolarHBondContact O-N 3.42Å; D239-D242 PolarHBondContact O-N 3.48Å
240V94.9Very high94.5Very high48 Ų4820.5 Ų20.529%0.29111%0.105SC..Hα-helixtrans-55.8-39.2-177.11380000113.2T146 I236 H238 W244 I270T146-V240 HydrophobicContact CG2-CG2 3.55Å; I236-V240 PolarHBondContact O-N 3.38Å; H238-V240 VanDerWaalsContact C-N 3.33Å; H238-V240 PolarHBondContact O-N 3.26Å; V240-W244 VanDerWaalsContact O-CD1 3.23Å; V240-I270 HydrophobicContact CG1-CG2 3.34Å
241A95.1Very high94.3Very high0 Ų022.4 Ų22.40%011%0.113CC..Hα-helixtrans-74-32.2-178.800000111.8D239 I243 W244 L245 F267 I270D239-A241 VanDerWaalsContact C-N 3.29Å; D239-A241 PolarHBondContact O-N 3.42Å; A241-I243 VanDerWaalsContact C-N 3.31Å; A241-I243 PolarHBondContact O-N 3.34Å; A241-W244 PolarHBondContact O-N 2.79Å; A241-W244 VanDerWaalsContact O-N 3.14Å; A241-L245 PolarHBondContact O-N 3.35Å; A241-F267 HydrophobicContact CB-CD2 4.41Å; A241-F267 HydrophobicContact CB-CE2 4.33Å; A241-F267 WeakPolarHBondContact O-CD2 3.41Å; A241-I270 HydrophobicContact CB-CG2 3.96Å
242D93.6Very high93.9Very high21 Ų2124.2 Ų24.211%0.11212%0.124CC..Hα-helixtrans-74.7-24-168.2-67.9-6.8000112.5Y142 D239 W244 L245 E246 R275Y142-D242 HydrophobicContact CD1-CB 4.25Å; Y142-D242 HydrophobicContact CD2-CB 3.87Å; Y142-D242 HydrophobicContact CE1-CB 4.3Å; Y142-D242 HydrophobicContact CE2-CB 3.93Å; Y142-D242 HydrophobicContact CG-CB 4.05Å; D239-D242 PolarHBondContact O-N 3.48Å; D242-W244 VanDerWaalsContact C-N 3.28Å; D242-W244 PolarHBondContact O-N 2.82Å; D242-L245 PolarHBondContact O-N 3Å; D242-E246 WeakPolarHBondContact O-CG 3.11Å; D242-E246 PolarHBondContact O-N 3.31Å; D242-R275 VanDerWaalsContact CG-NH2 3.3Å; D242-R275 IonicContact OD1-CZ 3.77Å; D242-R275 IonicContact OD1-NH1 2.79Å; D242-R275 PolarHBondContact OD1-NH1 3.36Å; D242-R275 IonicContact OD1-NH2 3.83Å; D242-R275 PolarHBondContact OD1-NH2 3.28Å; D242-R275 IonicContact OD2-NH2 3.73Å; D242-R275 PolarHBondContact OD2-NH2 2.88Å
243I95.9Very high93.5Very high21 Ų2126.2 Ų26.211%0.10813%0.132CC..Hα-helixtrans-52.7-49168.1-60.2174.2000110.4F139 L143 T146 A241 S247F139-I243 HydrophobicContact CD2-CG2 3.98Å; F139-I243 WeakPolarHBondContact CD2-O 3.23Å; F139-I243 HydrophobicContact CE2-CG2 3.59Å; L143-I243 HydrophobicContact CD1-CD1 4.3Å; L143-I243 HydrophobicContact CD1-CG2 4.44Å; T146-I243 HydrophobicContact CG2-CD1 3.89Å; A241-I243 VanDerWaalsContact C-N 3.31Å; A241-I243 PolarHBondContact O-N 3.34Å; I243-S247 WeakPolarHBondContact O-CB 3.36Å; I243-S247 PolarHBondContact O-N 2.95Å; I243-S247 PolarHBondContact O-OG 3.47Å
244W96Very high93.1Very high88 Ų8826.3 Ų26.333%0.33313%0.134SC..Hα-helixtrans-72.9-36.7-175.7-57.696.5000111.7V240 A241 D242 S247 A248 L263 I266 F267 I270V240-W244 VanDerWaalsContact O-CD1 3.23Å; A241-W244 PolarHBondContact O-N 2.79Å; A241-W244 VanDerWaalsContact O-N 3.14Å; D242-W244 VanDerWaalsContact C-N 3.28Å; D242-W244 PolarHBondContact O-N 2.82Å; W244-S247 PolarHBondContact O-N 2.76Å; W244-A248 WeakPolarHBondContact O-CB 3.4Å; W244-A248 PolarHBondContact O-N 3.22Å; W244-L263 HydrophobicContact CE3-CD2 3.78Å; W244-L263 HydrophobicContact CZ3-CD2 3.93Å; W244-I266 HydrophobicContact CD2-CB 4.49Å; W244-I266 HydrophobicContact CD2-CG2 3.52Å; W244-I266 HydrophobicContact CE3-CB 4.17Å; W244-I266 HydrophobicContact CE3-CD1 4.44Å; W244-I266 HydrophobicContact CE3-CG2 3.51Å; W244-I266 HydrophobicContact CG-CG2 4.07Å; W244-I266 HydrophobicContact CH2-CG2 4.13Å; W244-I266 HydrophobicContact CZ2-CG2 4.15Å; W244-I266 HydrophobicContact CZ3-CD1 4.11Å; W244-I266 HydrophobicContact CZ3-CG2 3.83Å; W244-F267 HydrophobicContact CB-CB 3.66Å; W244-I270 VanDerWaalsContact CD1-CD1 3.42Å; W244-I270 HydrophobicContact CD2-CD1 4.22Å; W244-I270 HydrophobicContact CG-CD1 4.08Å; W244-I270 HydrophobicContact CZ2-CD1 4.3Å
245L93.1Very high92.5Very high43 Ų4327.4 Ų27.423%0.22515%0.148CC..Hα-helixtrans-61.4-51.1175.5-178.858.8000111.8A241 D242 S247 A248 K249 F267A241-L245 PolarHBondContact O-N 3.35Å; D242-L245 PolarHBondContact O-N 3Å; L245-S247 VanDerWaalsContact C-N 3.32Å; L245-A248 PolarHBondContact O-N 3.4Å; L245-K249 WeakPolarHBondContact O-CG 3.26Å; L245-K249 PolarHBondContact O-N 3.44Å; L245-K249 VanDerWaalsContact O-N 3.09Å; L245-F267 HydrophobicContact CB-CD2 3.62Å; L245-F267 HydrophobicContact CB-CE2 3.64Å; L245-F267 HydrophobicContact CB-CG 4.18Å; L245-F267 HydrophobicContact CB-CZ 4.22Å; L245-F267 HydrophobicContact CD1-CD1 4.17Å; L245-F267 HydrophobicContact CD1-CD2 4.45Å; L245-F267 HydrophobicContact CD1-CE1 3.87Å; L245-F267 HydrophobicContact CD1-CE2 4.16Å; L245-F267 HydrophobicContact CD1-CG 4.44Å; L245-F267 HydrophobicContact CD1-CZ 3.85Å; L245-F267 HydrophobicContact CD2-CE2 4.13Å; L245-F267 HydrophobicContact CD2-CZ 4.15Å; L245-F267 HydrophobicContact CG-CE2 4.18Å; L245-F267 HydrophobicContact CG-CZ 4.29Å
246E94.5Very high92.1Very high9 Ų932.7 Ų32.74%0.04217%0.168CC..Hα-helixtrans-69.8-33.2-178.2-63.5-60.414400111.1A135 R138 F139 Y142 D242 K249 M250A135-E246 WeakPolarHBondContact CA-OE2 3.33Å; R138-E246 HydrophobicContact CB-CB 4.48Å; R138-E246 HydrophobicContact CB-CG 3.78Å; R138-E246 IonicContact NH1-OE1 3.24Å; F139-E246 HydrophobicContact CB-CB 3.92Å; Y142-E246 HydrophobicContact CD2-CG 4.19Å; Y142-E246 HydrophobicContact CE2-CG 4.33Å; D242-E246 WeakPolarHBondContact O-CG 3.11Å; D242-E246 PolarHBondContact O-N 3.31Å; E246-K249 PolarHBondContact O-N 3.01Å; E246-K249 IonicContact OE1-NZ 2.65Å; E246-K249 PolarHBondContact OE1-NZ 3.34Å; E246-K249 IonicContact OE2-NZ 2.76Å; E246-M250 WeakPolarHBondContact O-CG 3.43Å; E246-M250 PolarHBondContact O-N 3.26Å
247S93.5Very high91.6Very high12 Ų1235.1 Ų35.18%0.08418%0.183CC..Hα-helixtrans-59.8-49.7169.3-58.60000111.8F139 I243 W244 L245 K249 M250 F251F139-S247 WeakPolarHBondContact CD2-OG 3.29Å; F139-S247 WeakPolarHBondContact CE2-OG 3.03Å; I243-S247 WeakPolarHBondContact O-CB 3.36Å; I243-S247 PolarHBondContact O-N 2.95Å; I243-S247 PolarHBondContact O-OG 3.47Å; W244-S247 PolarHBondContact O-N 2.76Å; L245-S247 VanDerWaalsContact C-N 3.32Å; S247-K249 VanDerWaalsContact C-N 3.29Å; S247-K249 PolarHBondContact O-N 2.82Å; S247-M250 WeakPolarHBondContact O-CB 3.5Å; S247-M250 PolarHBondContact O-N 3.25Å; S247-M250 VanDerWaalsContact O-N 3.11Å; S247-F251 VanDerWaalsContact O-CD2 3.23Å; S247-F251 WeakPolarHBondContact O-CD2 3.39Å; S247-F251 PolarHBondContact O-N 3.39Å; S247-F251 VanDerWaalsContact O-N 3.09Å
248A92.3Very high91.1Very high5 Ų541.8 Ų41.84%0.04121%0.214CC..Hα-helixtrans-58.2-42.2179.500000111.5W244 L245 F251 S252 C260 L263 F264W244-A248 WeakPolarHBondContact O-CB 3.4Å; W244-A248 PolarHBondContact O-N 3.22Å; L245-A248 PolarHBondContact O-N 3.4Å; A248-F251 PolarHBondContact O-N 2.76Å; A248-S252 WeakPolarHBondContact O-CB 3.1Å; A248-S252 PolarHBondContact O-N 2.9Å; A248-C260 PolarHBondContact O-SG 3.44Å; A248-L263 HydrophobicContact CB-CB 3.93Å; A248-F264 HydrophobicContact CB-CB 4.47Å
249K89.6Confident90.9Very high60 Ų6043.8 Ų43.826%0.26123%0.227SC..Hα-helixtrans-61-44.4174.3-69.8174.2-171165.90112.5A135 L245 E246 S247 F251 S252 Y253A135-K249 HydrophobicContact CB-CB 4.12Å; L245-K249 WeakPolarHBondContact O-CG 3.26Å; L245-K249 PolarHBondContact O-N 3.44Å; L245-K249 VanDerWaalsContact O-N 3.09Å; E246-K249 PolarHBondContact O-N 3.01Å; E246-K249 IonicContact OE1-NZ 2.65Å; E246-K249 PolarHBondContact OE1-NZ 3.34Å; E246-K249 IonicContact OE2-NZ 2.76Å; S247-K249 VanDerWaalsContact C-N 3.29Å; S247-K249 PolarHBondContact O-N 2.82Å; K249-F251 VanDerWaalsContact C-N 3.33Å; K249-F251 PolarHBondContact O-N 3.42Å; K249-S252 WeakPolarHBondContact O-CB 3.38Å; K249-S252 PolarHBondContact O-N 2.77Å; K249-Y253 HydrophobicContact CB-CE2 3.97Å; K249-Y253 WeakPolarHBondContact O-CD2 3.44Å; K249-Y253 VanDerWaalsContact O-CG 3.26Å; K249-Y253 PolarHBondContact O-N 3.15Å
250M92.5Very high90.7Very high14 Ų1444.6 Ų44.67%0.06923%0.233CC..Hα-helixtrans-57.5-46.2177.2-71.8171.562.800111.6L64 F132 A135 C136 F139 E246 S247 Y253 A254L64-M250 HydrophobicContact CD2-CE 4.12Å; F132-M250 HydrophobicContact CD2-CB 4.14Å; F132-M250 HydrophobicContact CD2-CG 4.41Å; F132-M250 WeakPolarHBondContact CD2-O 3.07Å; F132-M250 HydrophobicContact CE1-CE 4.48Å; F132-M250 HydrophobicContact CE2-CB 3.79Å; F132-M250 HydrophobicContact CE2-CE 4.15Å; F132-M250 HydrophobicContact CE2-CG 4.2Å; F132-M250 WeakPolarHBondContact CE2-O 3.31Å; F132-M250 HydrophobicContact CZ-CE 3.8Å; A135-M250 HydrophobicContact CB-CG 3.84Å; C136-M250 VanDerWaalsContact CA-SD 3.58Å; C136-M250 HydrophobicContact CB-CE 3.93Å; C136-M250 HydrophobicContact CB-CG 4.43Å; C136-M250 HydrophobicContact CB-SD 4.03Å; F139-M250 HydrophobicContact CB-SD 3.81Å; F139-M250 HydrophobicContact CD1-SD 4.11Å; F139-M250 HydrophobicContact CG-SD 3.98Å; E246-M250 WeakPolarHBondContact O-CG 3.43Å; E246-M250 PolarHBondContact O-N 3.26Å; S247-M250 WeakPolarHBondContact O-CB 3.5Å; S247-M250 PolarHBondContact O-N 3.25Å; S247-M250 VanDerWaalsContact O-N 3.11Å; M250-Y253 PolarHBondContact O-N 3.49Å; M250-A254 PolarHBondContact O-N 3.21Å
251F91.1Very high90.5Very high46 Ų4645.8 Ų45.820%0.20224%0.237CC..Hα-helixtrans-73.1-31.8179.4-73.8-73.2000113.4F68 S247 A248 K249 A254 G255 W256 T259 C260 L263F68-F251 HydrophobicContact CE1-CE1 4.1Å; F68-F251 HydrophobicContact CZ-CE1 4.32Å; S247-F251 VanDerWaalsContact O-CD2 3.23Å; S247-F251 WeakPolarHBondContact O-CD2 3.39Å; S247-F251 PolarHBondContact O-N 3.39Å; S247-F251 VanDerWaalsContact O-N 3.09Å; A248-F251 PolarHBondContact O-N 2.76Å; K249-F251 VanDerWaalsContact C-N 3.33Å; K249-F251 PolarHBondContact O-N 3.42Å; F251-A254 PolarHBondContact O-N 2.9Å; F251-A254 VanDerWaalsContact O-N 3.17Å; F251-G255 PolarHBondContact O-N 3.43Å; F251-G255 VanDerWaalsContact O-N 3.17Å; F251-W256 HydrophobicContact CB-CB 4.36Å; F251-W256 HydrophobicContact CD1-CB 4.17Å; F251-W256 HydrophobicContact CD1-CD2 4.05Å; F251-W256 AromaticContact CD1-CE3 3.41Å; F251-W256 HydrophobicContact CD1-CE3 3.41Å; F251-W256 VanDerWaalsContact CD1-CE3 3.41Å; F251-W256 HydrophobicContact CD1-CG 4.41Å; F251-W256 HydrophobicContact CD1-CZ3 4.09Å; F251-W256 HydrophobicContact CE1-CD2 4.39Å; F251-W256 AromaticContact CE1-CE3 3.42Å; F251-W256 HydrophobicContact CE1-CE3 3.42Å; F251-W256 VanDerWaalsContact CE1-CE3 3.42Å; F251-W256 AromaticContact CE1-CZ3 3.6Å; F251-W256 HydrophobicContact CE1-CZ3 3.6Å; F251-W256 PolarHBondContact O-N 3.26Å; F251-T259 HydrophobicContact CB-CG2 4.47Å; F251-T259 HydrophobicContact CD1-CG2 3.96Å; F251-T259 HydrophobicContact CD2-CG2 4.1Å; F251-T259 HydrophobicContact CE1-CG2 4.19Å; F251-T259 HydrophobicContact CE2-CG2 4.32Å; F251-T259 HydrophobicContact CG-CG2 3.9Å; F251-T259 HydrophobicContact CZ-CG2 4.36Å; F251-C260 HydrophobicContact CB-CB 4.29Å; F251-L263 HydrophobicContact CD2-CD1 3.22Å; F251-L263 HydrophobicContact CE2-CD1 3.66Å; F251-L263 HydrophobicContact CG-CD1 4.13Å
252S88.9Confident90.3Very high47 Ų4749.8 Ų49.833%0.32926%0.262SS..Hα-helixtrans-57.4-50.8167.9168.40000110.4A248 K249 A254 G255A248-S252 WeakPolarHBondContact O-CB 3.1Å; A248-S252 PolarHBondContact O-N 2.9Å; K249-S252 WeakPolarHBondContact O-CB 3.38Å; K249-S252 PolarHBondContact O-N 2.77Å; S252-A254 PolarHBondContact O-N 3.22Å; S252-G255 PolarHBondContact O-N 3.34Å
253Y87.3Confident90.3Very high41 Ų4149.9 Ų49.916%0.16126%0.262CS..Hα-helixtrans-68.4-17.9176.3-55.7-39.6000113.4I70 R128 K131 F132 A135 K249 M250 G255I70-Y253 WeakPolarHBondContact CD1-O 3.3Å; R128-Y253 PolarHBondContact NE-O 3.41Å; R128-Y253 PolarHBondContact NH2-O 3.38Å; K131-Y253 HydrophobicContact CB-CD1 4.43Å; K131-Y253 HydrophobicContact CB-CD2 4.03Å; K131-Y253 HydrophobicContact CB-CE1 4.08Å; K131-Y253 HydrophobicContact CB-CE2 3.6Å; K131-Y253 HydrophobicContact CB-CG 4.42Å; K131-Y253 HydrophobicContact CD-CE1 3.85Å; F132-Y253 HydrophobicContact CB-CD2 4.2Å; A135-Y253 HydrophobicContact CB-CE2 4.27Å; K249-Y253 HydrophobicContact CB-CE2 3.97Å; K249-Y253 WeakPolarHBondContact O-CD2 3.44Å; K249-Y253 VanDerWaalsContact O-CG 3.26Å; K249-Y253 PolarHBondContact O-N 3.15Å; M250-Y253 PolarHBondContact O-N 3.49Å; Y253-G255 VanDerWaalsContact C-N 3.32Å
254A87.6Confident90.1Very high11 Ų1149.6 Ų49.69%0.09126%0.26CS..THydrogen-bonded Turntrans-83.1-7.1170.100000113.2F68 M250 F251 S252 W256F68-A254 HydrophobicContact CB-CB 4.02Å; F68-A254 HydrophobicContact CD1-CB 4.44Å; F68-A254 HydrophobicContact CG-CB 4.33Å; M250-A254 PolarHBondContact O-N 3.21Å; F251-A254 PolarHBondContact O-N 2.9Å; F251-A254 VanDerWaalsContact O-N 3.17Å; S252-A254 PolarHBondContact O-N 3.22Å; A254-W256 VanDerWaalsContact C-N 3.31Å; A254-W256 HydrophobicContact CB-CG 4.34Å
255G83.4Confident90Very high38 Ų3849.1 Ų49.139%0.39226%0.26SS..THydrogen-bonded Turntrans79.112-176.300000113.7R128 F251 S252 Y253 T257R128-G255 VanDerWaalsContact NH2-N 3.11Å; F251-G255 PolarHBondContact O-N 3.43Å; F251-G255 VanDerWaalsContact O-N 3.17Å; S252-G255 PolarHBondContact O-N 3.34Å; Y253-G255 VanDerWaalsContact C-N 3.32Å; G255-T257 PolarHBondContact O-N 3.23Å; G255-T257 VanDerWaalsContact O-N 3.14Å
256W85.6Confident90.1Very high123 Ų12349.9 Ų49.947%0.46626%0.264SS..  trans-90.474.1-177.6-68.213.2000110.2F68 F251 A254 Q258 T259 C260F68-W256 AromaticContact CD1-CH2 3.75Å; F68-W256 HydrophobicContact CD1-CH2 3.75Å; F68-W256 AromaticContact CD1-CZ2 3.7Å; F68-W256 HydrophobicContact CD1-CZ2 3.7Å; F68-W256 HydrophobicContact CD1-CZ3 4.31Å; F68-W256 AromaticContact CE1-CH2 3.53Å; F68-W256 HydrophobicContact CE1-CH2 3.53Å; F68-W256 HydrophobicContact CE1-CZ2 4.01Å; F68-W256 AromaticContact CE1-CZ3 3.84Å; F68-W256 HydrophobicContact CE1-CZ3 3.84Å; F251-W256 HydrophobicContact CB-CB 4.36Å; F251-W256 HydrophobicContact CD1-CB 4.17Å; F251-W256 HydrophobicContact CD1-CD2 4.05Å; F251-W256 AromaticContact CD1-CE3 3.41Å; F251-W256 HydrophobicContact CD1-CE3 3.41Å; F251-W256 VanDerWaalsContact CD1-CE3 3.41Å; F251-W256 HydrophobicContact CD1-CG 4.41Å; F251-W256 HydrophobicContact CD1-CZ3 4.09Å; F251-W256 HydrophobicContact CE1-CD2 4.39Å; F251-W256 AromaticContact CE1-CE3 3.42Å; F251-W256 HydrophobicContact CE1-CE3 3.42Å; F251-W256 VanDerWaalsContact CE1-CE3 3.42Å; F251-W256 AromaticContact CE1-CZ3 3.6Å; F251-W256 HydrophobicContact CE1-CZ3 3.6Å; F251-W256 PolarHBondContact O-N 3.26Å; A254-W256 VanDerWaalsContact C-N 3.31Å; A254-W256 HydrophobicContact CB-CG 4.34Å; W256-Q258 PolarHBondContact O-N 2.95Å; W256-T259 PolarHBondContact O-N 3.44Å; W256-C260 VanDerWaalsContact O-CB 3.29Å; W256-C260 WeakPolarHBondContact O-CB 3.21Å; W256-C260 PolarHBondContact O-N 3.25Å
257T85.3Confident90.2Very high71 Ų7149.8 Ų49.844%0.43626%0.264SS..Hα-helixtrans-59.4-41.2-171.256.90000113.4G255 C260 N261G255-T257 PolarHBondContact O-N 3.23Å; G255-T257 VanDerWaalsContact O-N 3.14Å; T257-C260 PolarHBondContact O-N 2.74Å; T257-N261 WeakPolarHBondContact O-CB 3.42Å; T257-N261 PolarHBondContact O-N 3.16Å; T257-N261 PolarHBondContact O-ND2 2.89Å
258Q86.2Confident90.3Very high161 Ų16149.4 Ų49.475%0.75226%0.261SS*.Hα-helixtrans-62.9-50.8178-70.6-121.7-9.100112.3W256 C260 N261 T262W256-Q258 PolarHBondContact O-N 2.95Å; Q258-C260 VanDerWaalsContact C-N 3.35Å; Q258-C260 PolarHBondContact O-N 3.3Å; Q258-N261 PolarHBondContact O-N 2.95Å; Q258-T262 PolarHBondContact O-N 3.41Å; Q258-T262 PolarHBondContact O-OG1 2.71Å
259T89.4Confident90.5Very high58 Ų5851.7 Ų51.736%0.35628%0.28SS..Hα-helixtrans-63.1-42.5178-51.50000111.3F251 W256 N261 T262 L263F251-T259 HydrophobicContact CB-CG2 4.47Å; F251-T259 HydrophobicContact CD1-CG2 3.96Å; F251-T259 HydrophobicContact CD2-CG2 4.1Å; F251-T259 HydrophobicContact CE1-CG2 4.19Å; F251-T259 HydrophobicContact CE2-CG2 4.32Å; F251-T259 HydrophobicContact CG-CG2 3.9Å; F251-T259 HydrophobicContact CZ-CG2 4.36Å; W256-T259 PolarHBondContact O-N 3.44Å; T259-N261 PolarHBondContact O-N 2.67Å; T259-T262 PolarHBondContact O-N 3.21Å; T259-L263 HydrophobicContact CG2-CD1 3.96Å; T259-L263 HydrophobicContact CG2-CG 4.42Å; T259-L263 WeakPolarHBondContact O-CB 3.4Å; T259-L263 VanDerWaalsContact O-CG 3.31Å; T259-L263 WeakPolarHBondContact O-CG 3.35Å; T259-L263 PolarHBondContact O-N 3Å
260C89.4Confident90.9Very high20 Ų2050.7 Ų50.714%0.13528%0.277CS..Hα-helixtrans-56.1-49.9174.4175.40000111.6A248 F251 W256 T257 Q258 T262 L263 F264A248-C260 PolarHBondContact O-SG 3.44Å; F251-C260 HydrophobicContact CB-CB 4.29Å; W256-C260 VanDerWaalsContact O-CB 3.29Å; W256-C260 WeakPolarHBondContact O-CB 3.21Å; W256-C260 PolarHBondContact O-N 3.25Å; T257-C260 PolarHBondContact O-N 2.74Å; Q258-C260 VanDerWaalsContact C-N 3.35Å; Q258-C260 PolarHBondContact O-N 3.3Å; C260-T262 PolarHBondContact O-N 3.39Å; C260-L263 PolarHBondContact O-N 3.39Å; C260-F264 WeakPolarHBondContact O-CB 3.35Å; C260-F264 PolarHBondContact O-N 2.91Å
261N89.4Confident91.1Very high73 Ų7350.2 Ų50.239%0.3927%0.274SS..Hα-helixtrans-61-46.1179.4-72.5-19.6000111.6T257 Q258 T259 L263 F264 F265T257-N261 WeakPolarHBondContact O-CB 3.42Å; T257-N261 PolarHBondContact O-N 3.16Å; T257-N261 PolarHBondContact O-ND2 2.89Å; Q258-N261 PolarHBondContact O-N 2.95Å; T259-N261 PolarHBondContact O-N 2.67Å; N261-L263 PolarHBondContact O-N 3.44Å; N261-F264 PolarHBondContact O-N 3.31Å; N261-F265 WeakPolarHBondContact O-CD2 3.22Å; N261-F265 PolarHBondContact O-N 3.43Å
262T91.4Very high91.4Very high84 Ų8450.7 Ų50.752%0.51528%0.277SS..Hα-helixtrans-60.4-46.3177-630000111.7Q258 T259 C260 F264 F265 I266Q258-T262 PolarHBondContact O-N 3.41Å; Q258-T262 PolarHBondContact O-OG1 2.71Å; T259-T262 PolarHBondContact O-N 3.21Å; C260-T262 PolarHBondContact O-N 3.39Å; T262-F264 VanDerWaalsContact C-N 3.3Å; T262-F264 PolarHBondContact O-N 2.92Å; T262-F265 PolarHBondContact O-N 3.5Å; T262-I266 HydrophobicContact CG2-CD1 4.18Å; T262-I266 WeakPolarHBondContact O-CG1 3.34Å; T262-I266 PolarHBondContact O-N 2.76Å
263L93.1Very high91.8Very high22 Ų2252.8 Ų52.812%0.11528%0.283CS..Hα-helixtrans-64.2-36176.8-70.4170.3000112.2W244 A248 F251 T259 C260 N261 I266 F267W244-L263 HydrophobicContact CE3-CD2 3.78Å; W244-L263 HydrophobicContact CZ3-CD2 3.93Å; A248-L263 HydrophobicContact CB-CB 3.93Å; F251-L263 HydrophobicContact CD2-CD1 3.22Å; F251-L263 HydrophobicContact CE2-CD1 3.66Å; F251-L263 HydrophobicContact CG-CD1 4.13Å; T259-L263 HydrophobicContact CG2-CD1 3.96Å; T259-L263 HydrophobicContact CG2-CG 4.42Å; T259-L263 WeakPolarHBondContact O-CB 3.4Å; T259-L263 VanDerWaalsContact O-CG 3.31Å; T259-L263 WeakPolarHBondContact O-CG 3.35Å; T259-L263 PolarHBondContact O-N 3Å; C260-L263 PolarHBondContact O-N 3.39Å; N261-L263 PolarHBondContact O-N 3.44Å; L263-I266 PolarHBondContact O-N 3.44Å; L263-F267 VanDerWaalsContact O-CB 3.31Å; L263-F267 WeakPolarHBondContact O-CB 3.36Å; L263-F267 PolarHBondContact O-N 3.27Å
264F92.2Very high92.3Very high16 Ų1651.1 Ų51.17%0.0728%0.277CS..Hα-helixtrans-65.7-38.7175.2179.6-103000112.3A248 C260 N261 T262 F267 S268 I322 M325 L326A248-F264 HydrophobicContact CB-CB 4.47Å; C260-F264 WeakPolarHBondContact O-CB 3.35Å; C260-F264 PolarHBondContact O-N 2.91Å; N261-F264 PolarHBondContact O-N 3.31Å; T262-F264 VanDerWaalsContact C-N 3.3Å; T262-F264 PolarHBondContact O-N 2.92Å; F264-F267 AromaticContact CD2-CD1 3.75Å; F264-F267 HydrophobicContact CD2-CD1 3.75Å; F264-F267 HydrophobicContact CD2-CE1 4.37Å; F264-F267 AromaticContact CE2-CD1 3.6Å; F264-F267 HydrophobicContact CE2-CD1 3.6Å; F264-F267 AromaticContact CE2-CE1 3.82Å; F264-F267 HydrophobicContact CE2-CE1 3.82Å; F264-S268 WeakPolarHBondContact CE1-OG 3.27Å; F264-S268 VanDerWaalsContact CZ-OG 3.27Å; F264-S268 WeakPolarHBondContact CZ-OG 3.31Å; F264-S268 WeakPolarHBondContact O-CB 3.37Å; F264-S268 PolarHBondContact O-N 3.25Å; F264-S268 PolarHBondContact O-OG 2.92Å; F264-I322 HydrophobicContact CZ-CG2 4Å; F264-M325 HydrophobicContact CD1-CE 3.76Å; F264-M325 HydrophobicContact CD2-CE 3.42Å; F264-M325 VanDerWaalsContact CD2-CE 3.42Å; F264-M325 HydrophobicContact CE1-CB 4.49Å; F264-M325 HydrophobicContact CE1-CE 3.32Å; F264-M325 HydrophobicContact CE1-CG 4.41Å; F264-M325 HydrophobicContact CE2-CE 2.97Å; F264-M325 HydrophobicContact CG-CE 3.82Å; F264-M325 HydrophobicContact CZ-CB 4.35Å; F264-M325 HydrophobicContact CZ-CE 2.94Å; F264-M325 HydrophobicContact CZ-SD 4.49Å; F264-L326 HydrophobicContact CD1-CD2 4.15Å; F264-L326 HydrophobicContact CE1-CD2 3.6Å; F264-L326 HydrophobicContact CE1-CG 3.89Å; F264-L326 HydrophobicContact CZ-CG 4.45Å
265F94.2Very high92.7Very high77 Ų7751.3 Ų51.334%0.33828%0.276SS..Hα-helixtrans-63.7-43.7172.3-79.8-69.7000111.8N261 T262 S268 A269 L326 C329 I330N261-F265 WeakPolarHBondContact O-CD2 3.22Å; N261-F265 PolarHBondContact O-N 3.43Å; T262-F265 PolarHBondContact O-N 3.5Å; F265-S268 PolarHBondContact O-N 3.33Å; F265-A269 PolarHBondContact O-N 3.35Å; F265-L326 HydrophobicContact CD1-CD2 3.45Å; F265-L326 VanDerWaalsContact CD1-CD2 3.45Å; F265-L326 HydrophobicContact CE1-CD2 3.39Å; F265-L326 HydrophobicContact CG-CD2 4.43Å; F265-L326 HydrophobicContact CZ-CD2 4.31Å; F265-C329 HydrophobicContact CZ-CB 4.45Å; F265-I330 HydrophobicContact CE1-CG1 4.47Å; F265-I330 HydrophobicContact CZ-CG1 4.43Å
266I95.9Very high93.3Very high60 Ų6051 Ų5131%0.30827%0.265SS..Hα-helixtrans-61.9-49.1176.3-65.1166.7000110.4W244 T262 L263 S268 A269 I270W244-I266 HydrophobicContact CD2-CB 4.49Å; W244-I266 HydrophobicContact CD2-CG2 3.52Å; W244-I266 HydrophobicContact CE3-CB 4.17Å; W244-I266 HydrophobicContact CE3-CD1 4.44Å; W244-I266 HydrophobicContact CE3-CG2 3.51Å; W244-I266 HydrophobicContact CG-CG2 4.07Å; W244-I266 HydrophobicContact CH2-CG2 4.13Å; W244-I266 HydrophobicContact CZ2-CG2 4.15Å; W244-I266 HydrophobicContact CZ3-CD1 4.11Å; W244-I266 HydrophobicContact CZ3-CG2 3.83Å; T262-I266 HydrophobicContact CG2-CD1 4.18Å; T262-I266 WeakPolarHBondContact O-CG1 3.34Å; T262-I266 PolarHBondContact O-N 2.76Å; L263-I266 PolarHBondContact O-N 3.44Å; I266-S268 VanDerWaalsContact C-N 3.29Å; I266-S268 PolarHBondContact O-N 2.99Å; I266-A269 PolarHBondContact O-N 3.38Å; I266-I270 HydrophobicContact CG2-CD1 3.7Å; I266-I270 HydrophobicContact CG2-CG1 4.47Å; I266-I270 WeakPolarHBondContact O-CG1 3.42Å; I266-I270 PolarHBondContact O-N 3.04Å
267F96.3Very high93.8Very high7 Ų748.9 Ų48.93%0.03126%0.262CS..Hα-helixtrans-51.6-49.6173.5159.8-109.1000111.3A241 W244 L245 L263 F264 I270 F271 I322A241-F267 HydrophobicContact CB-CD2 4.41Å; A241-F267 HydrophobicContact CB-CE2 4.33Å; A241-F267 WeakPolarHBondContact O-CD2 3.41Å; W244-F267 HydrophobicContact CB-CB 3.66Å; L245-F267 HydrophobicContact CB-CD2 3.62Å; L245-F267 HydrophobicContact CB-CE2 3.64Å; L245-F267 HydrophobicContact CB-CG 4.18Å; L245-F267 HydrophobicContact CB-CZ 4.22Å; L245-F267 HydrophobicContact CD1-CD1 4.17Å; L245-F267 HydrophobicContact CD1-CD2 4.45Å; L245-F267 HydrophobicContact CD1-CE1 3.87Å; L245-F267 HydrophobicContact CD1-CE2 4.16Å; L245-F267 HydrophobicContact CD1-CG 4.44Å; L245-F267 HydrophobicContact CD1-CZ 3.85Å; L245-F267 HydrophobicContact CD2-CE2 4.13Å; L245-F267 HydrophobicContact CD2-CZ 4.15Å; L245-F267 HydrophobicContact CG-CE2 4.18Å; L245-F267 HydrophobicContact CG-CZ 4.29Å; L263-F267 VanDerWaalsContact O-CB 3.31Å; L263-F267 WeakPolarHBondContact O-CB 3.36Å; L263-F267 PolarHBondContact O-N 3.27Å; F264-F267 AromaticContact CD2-CD1 3.75Å; F264-F267 HydrophobicContact CD2-CD1 3.75Å; F264-F267 HydrophobicContact CD2-CE1 4.37Å; F264-F267 AromaticContact CE2-CD1 3.6Å; F264-F267 HydrophobicContact CE2-CD1 3.6Å; F264-F267 AromaticContact CE2-CE1 3.82Å; F264-F267 HydrophobicContact CE2-CE1 3.82Å; F267-I270 PolarHBondContact O-N 3.27Å; F267-F271 HydrophobicContact CE2-CB 4.24Å; F267-F271 AromaticContact CE2-CD2 3.99Å; F267-F271 HydrophobicContact CE2-CD2 3.99Å; F267-F271 HydrophobicContact CZ-CB 4.36Å; F267-F271 AromaticContact CZ-CD2 3.82Å; F267-F271 HydrophobicContact CZ-CD2 3.82Å; F267-F271 HydrophobicContact CZ-CG 4.41Å; F267-F271 VanDerWaalsContact O-CB 3.28Å; F267-F271 WeakPolarHBondContact O-CB 3.46Å; F267-F271 PolarHBondContact O-N 3.17Å; F267-I322 HydrophobicContact CE1-CD1 3.67Å; F267-I322 HydrophobicContact CE1-CG1 4.04Å; F267-I322 HydrophobicContact CZ-CD1 3.71Å; F267-I322 HydrophobicContact CZ-CG1 4.5Å
268S95.8Very high94.4Very high3 Ų348.5 Ų48.52%0.02126%0.257CS..Hα-helixtrans-61.7-48.7-177.6-60.40000111.3F264 F265 I266 I270 F271 F272 I322F264-S268 WeakPolarHBondContact CE1-OG 3.27Å; F264-S268 VanDerWaalsContact CZ-OG 3.27Å; F264-S268 WeakPolarHBondContact CZ-OG 3.31Å; F264-S268 WeakPolarHBondContact O-CB 3.37Å; F264-S268 PolarHBondContact O-N 3.25Å; F264-S268 PolarHBondContact O-OG 2.92Å; F265-S268 PolarHBondContact O-N 3.33Å; I266-S268 VanDerWaalsContact C-N 3.29Å; I266-S268 PolarHBondContact O-N 2.99Å; S268-I270 VanDerWaalsContact C-N 3.33Å; S268-I270 PolarHBondContact O-N 2.92Å; S268-F271 WeakPolarHBondContact O-CB 3.25Å; S268-F271 PolarHBondContact O-N 3.3Å; S268-F272 WeakPolarHBondContact O-CD2 3.4Å; S268-F272 PolarHBondContact O-N 2.9Å; S268-I322 WeakPolarHBondContact OG-CG2 3.28Å
269A97Very high94.8Very high53 Ų5340.8 Ų40.844%0.43822%0.221SC..Hα-helixtrans-57.6-46.917800000111.7F265 I266 F271 F272 I273F265-A269 PolarHBondContact O-N 3.35Å; I266-A269 PolarHBondContact O-N 3.38Å; A269-F271 PolarHBondContact O-N 2.99Å; A269-F272 PolarHBondContact O-N 3.4Å; A269-I273 VanDerWaalsContact O-CG1 3.31Å; A269-I273 WeakPolarHBondContact O-CG1 3.41Å; A269-I273 PolarHBondContact O-N 3.33Å
270I97.4Very high95.2Very high39 Ų3939.4 Ų39.420%0.221%0.213CC..Hα-helixtrans-65.7-39.3178.6-67.7173.5000111.1V240 A241 W244 I266 F267 S268 I273 S274V240-I270 HydrophobicContact CG1-CG2 3.34Å; A241-I270 HydrophobicContact CB-CG2 3.96Å; W244-I270 VanDerWaalsContact CD1-CD1 3.42Å; W244-I270 HydrophobicContact CD2-CD1 4.22Å; W244-I270 HydrophobicContact CG-CD1 4.08Å; W244-I270 HydrophobicContact CZ2-CD1 4.3Å; I266-I270 HydrophobicContact CG2-CD1 3.7Å; I266-I270 HydrophobicContact CG2-CG1 4.47Å; I266-I270 WeakPolarHBondContact O-CG1 3.42Å; I266-I270 PolarHBondContact O-N 3.04Å; F267-I270 PolarHBondContact O-N 3.27Å; S268-I270 VanDerWaalsContact C-N 3.33Å; S268-I270 PolarHBondContact O-N 2.92Å; I270-I273 PolarHBondContact O-N 2.88Å; I270-S274 VanDerWaalsContact O-CB 3.27Å; I270-S274 WeakPolarHBondContact O-CB 3.43Å; I270-S274 PolarHBondContact O-N 2.89Å; I270-S274 PolarHBondContact O-OG 2.8Å
271F97.2Very high95.4Very high4 Ų445.2 Ų45.22%0.01824%0.236CC..Hα-helixtrans-58.4-49.6174.6-177.9-76.4000111.3F267 S268 A269 S274 R275 L276 W318 I322F267-F271 HydrophobicContact CE2-CB 4.24Å; F267-F271 AromaticContact CE2-CD2 3.99Å; F267-F271 HydrophobicContact CE2-CD2 3.99Å; F267-F271 HydrophobicContact CZ-CB 4.36Å; F267-F271 AromaticContact CZ-CD2 3.82Å; F267-F271 HydrophobicContact CZ-CD2 3.82Å; F267-F271 HydrophobicContact CZ-CG 4.41Å; F267-F271 VanDerWaalsContact O-CB 3.28Å; F267-F271 WeakPolarHBondContact O-CB 3.46Å; F267-F271 PolarHBondContact O-N 3.17Å; S268-F271 WeakPolarHBondContact O-CB 3.25Å; S268-F271 PolarHBondContact O-N 3.3Å; A269-F271 PolarHBondContact O-N 2.99Å; F271-S274 PolarHBondContact O-OG 3.19Å; F271-R275 HydrophobicContact CE1-CB 4.45Å; F271-R275 VanDerWaalsContact CE2-NH1 3.34Å; F271-R275 WeakPolarHBondContact O-CB 3.48Å; F271-R275 PolarHBondContact O-N 3.31Å; F271-L276 HydrophobicContact CE1-CD1 4.36Å; F271-L276 HydrophobicContact CE1-CG 4.45Å; F271-W318 HydrophobicContact CE2-CB 4.48Å; F271-W318 HydrophobicContact CZ-CB 4.04Å; F271-I322 HydrophobicContact CB-CD1 4.35Å; F271-I322 HydrophobicContact CD1-CD1 3.74Å; F271-I322 HydrophobicContact CD2-CD1 3.58Å; F271-I322 HydrophobicContact CE1-CD1 3.9Å; F271-I322 HydrophobicContact CE2-CD1 3.77Å; F271-I322 HydrophobicContact CG-CD1 3.62Å; F271-I322 HydrophobicContact CZ-CD1 3.94Å
272F97.3Very high95.6Very high57 Ų5747.8 Ų47.825%0.2524%0.24CC..Iπ-helixtrans-62.8-45.3179.6-80.5-76.5000111.4S268 A269 L276 I277 I322 L323 L326S268-F272 WeakPolarHBondContact O-CD2 3.4Å; S268-F272 PolarHBondContact O-N 2.9Å; A269-F272 PolarHBondContact O-N 3.4Å; F272-L276 HydrophobicContact CD1-CB 4.39Å; F272-L276 HydrophobicContact CD1-CD1 3.3Å; F272-L276 HydrophobicContact CD1-CG 4.31Å; F272-L276 HydrophobicContact CE1-CD1 3.42Å; F272-L276 VanDerWaalsContact CE1-CD1 3.42Å; F272-L276 HydrophobicContact CG-CD1 4.34Å; F272-L276 CarbonylContact O-C 3.5Å; F272-L276 WeakPolarHBondContact O-CA 3.15Å; F272-L276 WeakPolarHBondContact O-CB 3.47Å; F272-L276 PolarHBondContact O-N 3.44Å; F272-I277 PolarHBondContact O-N 3.44Å; F272-I277 VanDerWaalsContact O-N 3.11Å; F272-I322 HydrophobicContact CE2-CG2 3.96Å; F272-L323 HydrophobicContact CZ-CB 4.38Å; F272-L323 HydrophobicContact CZ-CD1 4.42Å; F272-L326 HydrophobicContact CE2-CD1 4.25Å
273I97.3Very high95.8Very high90 Ų9044.2 Ų44.246%0.46222%0.218SC..Iπ-helixtrans-63.9-51.1179-66.6166.1000111A269 I270 I277 I278A269-I273 VanDerWaalsContact O-CG1 3.31Å; A269-I273 WeakPolarHBondContact O-CG1 3.41Å; A269-I273 PolarHBondContact O-N 3.33Å; I270-I273 PolarHBondContact O-N 2.88Å; I273-I277 WeakPolarHBondContact O-CB 3.16Å; I273-I277 PolarHBondContact O-N 3.32Å; I273-I278 HydrophobicContact CG2-CD1 3.88Å; I273-I278 HydrophobicContact CG2-CG1 4.35Å; I273-I278 WeakPolarHBondContact O-CG1 3.48Å; I273-I278 PolarHBondContact O-N 3.4Å
274S96.8Very high95.9Very high6 Ų643.6 Ų43.64%0.04222%0.215CC..Iπ-helixtrans-68.3-50.1-17654.80000112.7V237 I270 F271 I278 F279V237-S274 WeakPolarHBondContact CG1-O 3.39Å; V237-S274 VanDerWaalsContact O-CB 3.24Å; V237-S274 WeakPolarHBondContact O-CB 3.31Å; I270-S274 VanDerWaalsContact O-CB 3.27Å; I270-S274 WeakPolarHBondContact O-CB 3.43Å; I270-S274 PolarHBondContact O-N 2.89Å; I270-S274 PolarHBondContact O-OG 2.8Å; F271-S274 PolarHBondContact O-OG 3.19Å; S274-I278 WeakPolarHBondContact O-CB 3.12Å; S274-F279 WeakPolarHBondContact O-CB 3.41Å; S274-F279 PolarHBondContact O-N 2.89Å
275R96.3Very high95.9Very high15 Ų1548.1 Ų48.16%0.05723%0.232CC..Iπ-helixtrans-100-23-166.6-67166.9176.2148-5.5114.3H238 D242 F271 P280 Q312 H315H238-R275 PolarHBondContact O-NH2 3.43Å; D242-R275 VanDerWaalsContact CG-NH2 3.3Å; D242-R275 IonicContact OD1-CZ 3.77Å; D242-R275 IonicContact OD1-NH1 2.79Å; D242-R275 PolarHBondContact OD1-NH1 3.36Å; D242-R275 IonicContact OD1-NH2 3.83Å; D242-R275 PolarHBondContact OD1-NH2 3.28Å; D242-R275 IonicContact OD2-NH2 3.73Å; D242-R275 PolarHBondContact OD2-NH2 2.88Å; F271-R275 HydrophobicContact CE1-CB 4.45Å; F271-R275 VanDerWaalsContact CE2-NH1 3.34Å; F271-R275 WeakPolarHBondContact O-CB 3.48Å; F271-R275 PolarHBondContact O-N 3.31Å; R275-P280 WeakPolarHBondContact O-CD 3.34Å; R275-Q312 PolarHBondContact O-NE2 3.44Å; R275-Q312 PolarHBondContact O-OE1 3.14Å; R275-H315 HydrophobicContact CB-CB 4.29Å
276L96.2Very high95.9Very high32 Ų3244.5 Ų44.517%0.16822%0.216CC..Iπ-helixtrans-108.8-12.2-179.9-61.2-179.5000113.5F271 F272 P280 H315 L316F271-L276 HydrophobicContact CE1-CD1 4.36Å; F271-L276 HydrophobicContact CE1-CG 4.45Å; F272-L276 HydrophobicContact CD1-CB 4.39Å; F272-L276 HydrophobicContact CD1-CD1 3.3Å; F272-L276 HydrophobicContact CD1-CG 4.31Å; F272-L276 HydrophobicContact CE1-CD1 3.42Å; F272-L276 VanDerWaalsContact CE1-CD1 3.42Å; F272-L276 HydrophobicContact CG-CD1 4.34Å; F272-L276 CarbonylContact O-C 3.5Å; F272-L276 WeakPolarHBondContact O-CA 3.15Å; F272-L276 WeakPolarHBondContact O-CB 3.47Å; F272-L276 PolarHBondContact O-N 3.44Å; L276-P280 VanDerWaalsContact O-CG 3.26Å; L276-P280 WeakPolarHBondContact O-CG 3.35Å; L276-H315 HydrophobicContact CD2-CB 4.13Å; L276-L316 HydrophobicContact CD2-CD2 3.7Å; L276-L316 HydrophobicContact CD2-CG 4.32Å
277I96.1Very high95.8Very high79 Ų7941.7 Ų41.741%0.40520%0.202SC..Iπ-helixtrans-114.7-69.7174.5-59.7175.9000109.7F272 I273 F279 P280 F281 W282F272-I277 PolarHBondContact O-N 3.44Å; F272-I277 VanDerWaalsContact O-N 3.11Å; I273-I277 WeakPolarHBondContact O-CB 3.16Å; I273-I277 PolarHBondContact O-N 3.32Å; I277-F279 PolarHBondContact O-N 3.05Å; I277-P280 WeakPolarHBondContact O-CD 3.37Å; I277-F281 VanDerWaalsContact O-CD2 3.27Å; I277-F281 WeakPolarHBondContact O-CD2 3.37Å; I277-F281 PolarHBondContact O-N 2.76Å; I277-W282 HydrophobicContact CG2-CH2 3.84Å; I277-W282 HydrophobicContact CG2-CZ3 3.42Å; I277-W282 VanDerWaalsContact CG2-CZ3 3.42Å; I277-W282 VanDerWaalsContact O-CE3 3.31Å; I277-W282 WeakPolarHBondContact O-CZ3 3.44Å
278I96.7Very high95.6Very high62 Ų6244 Ų4432%0.31821%0.214SC..Iπ-helixtrans-60-50.8-174.1-65.4171.8000111.6V237 I273 S274 W282 I283V237-I278 HydrophobicContact CG1-CG2 4.37Å; V237-I278 HydrophobicContact CG2-CG2 3.89Å; I273-I278 HydrophobicContact CG2-CD1 3.88Å; I273-I278 HydrophobicContact CG2-CG1 4.35Å; I273-I278 WeakPolarHBondContact O-CG1 3.48Å; I273-I278 PolarHBondContact O-N 3.4Å; S274-I278 WeakPolarHBondContact O-CB 3.12Å; I278-W282 VanDerWaalsContact CA-CE3 3.47Å; I278-W282 WeakPolarHBondContact O-CA 3.4Å; I278-W282 VanDerWaalsContact O-CB 3.31Å; I278-W282 WeakPolarHBondContact O-CB 3.48Å; I278-W282 PolarHBondContact O-N 3.47Å; I278-I283 HydrophobicContact CG2-CG1 4.49Å; I278-I283 PolarHBondContact O-N 3.15Å
279F96.5Very high95.4Very high0 Ų047.2 Ų47.20%023%0.23CC..Iπ-helixtrans-59.8-54-176.4-175.5-97.5000113.9V234 V237 H238 S274 I277 I283 L284 L308 L311 Q312V234-F279 HydrophobicContact CG1-CE2 4.18Å; V234-F279 HydrophobicContact CG2-CE2 4.27Å; V237-F279 HydrophobicContact CG1-CB 4.27Å; H238-F279 AromaticContact CE1-CD2 3.48Å; H238-F279 VanDerWaalsContact CE1-CD2 3.48Å; H238-F279 WeakPolarHBondContact CE1-CD2 3.48Å; H238-F279 AromaticContact CE1-CE2 3.51Å; S274-F279 WeakPolarHBondContact O-CB 3.41Å; S274-F279 PolarHBondContact O-N 2.89Å; I277-F279 PolarHBondContact O-N 3.05Å; F279-I283 HydrophobicContact CD2-CB 4.07Å; F279-I283 HydrophobicContact CD2-CG1 4.49Å; F279-I283 HydrophobicContact CD2-CG2 4.16Å; F279-I283 HydrophobicContact CE2-CG2 4.22Å; F279-I283 CarbonylContact O-C 3.56Å; F279-I283 WeakPolarHBondContact O-CA 3.42Å; F279-I283 WeakPolarHBondContact O-CB 3.37Å; F279-I283 PolarHBondContact O-N 2.97Å; F279-I283 VanDerWaalsContact O-N 3.12Å; F279-L284 HydrophobicContact CD1-CD1 4.26Å; F279-L284 HydrophobicContact CD1-CG 4.09Å; F279-L284 HydrophobicContact CE1-CD1 4.02Å; F279-L284 HydrophobicContact CE1-CD2 3.86Å; F279-L284 HydrophobicContact CE1-CG 3.82Å; F279-L284 HydrophobicContact CZ-CD2 3.98Å; F279-L284 HydrophobicContact CZ-CG 4.32Å; F279-L284 PolarHBondContact O-N 2.62Å; F279-L308 HydrophobicContact CE2-CD2 4.18Å; F279-L308 HydrophobicContact CZ-CB 4.37Å; F279-L308 HydrophobicContact CZ-CD2 3.93Å; F279-L311 HydrophobicContact CZ-CD2 4.16Å; F279-Q312 HydrophobicContact CE1-CB 4.06Å
280P95.9Very high95.1Very high29 Ų2945.2 Ų45.219%0.18821%0.212CC..Iπ-helixtrans-73.6-37.6-177.227.1-35.6000114.6R275 L276 I277 L284R275-P280 WeakPolarHBondContact O-CD 3.34Å; L276-P280 VanDerWaalsContact O-CG 3.26Å; L276-P280 WeakPolarHBondContact O-CG 3.35Å; I277-P280 WeakPolarHBondContact O-CD 3.37Å; P280-L284 HydrophobicContact CB-CD1 4.18Å; P280-L284 WeakPolarHBondContact O-CB 3.01Å
281F94.3Very high94.7Very high141 Ų14143.5 Ų43.562%0.61820%0.204SC*.Iπ-helixtrans-88.4-26.4-173.2-64.9-75.6000113.3I277 Y285I277-F281 VanDerWaalsContact O-CD2 3.27Å; I277-F281 WeakPolarHBondContact O-CD2 3.37Å; I277-F281 PolarHBondContact O-N 2.76Å; F281-Y285 WeakPolarHBondContact O-CB 3.38Å
282W94.9Very high94.3Very high128 Ų12847.8 Ų47.849%0.48523%0.225SC..Iπ-helixtrans-107.3-55.4178.4-69.8-100.5000111.6L162 I277 I278 C286L162-W282 HydrophobicContact CD1-CB 3.86Å; L162-W282 HydrophobicContact CD1-CG 4.32Å; I277-W282 HydrophobicContact CG2-CH2 3.84Å; I277-W282 HydrophobicContact CG2-CZ3 3.42Å; I277-W282 VanDerWaalsContact CG2-CZ3 3.42Å; I277-W282 VanDerWaalsContact O-CE3 3.31Å; I277-W282 WeakPolarHBondContact O-CZ3 3.44Å; I278-W282 VanDerWaalsContact CA-CE3 3.47Å; I278-W282 WeakPolarHBondContact O-CA 3.4Å; I278-W282 VanDerWaalsContact O-CB 3.31Å; I278-W282 WeakPolarHBondContact O-CB 3.48Å; I278-W282 PolarHBondContact O-N 3.47Å; W282-C286 WeakPolarHBondContact O-CB 3.43Å; W282-C286 PolarHBondContact O-N 3.3Å
283I95.1Very high93.8Very high8 Ų851.9 Ų51.94%0.04124%0.24CC..Iπ-helixtrans-73.7-50.6-172.3-55-59.2000112L233 V234 V237 I278 F279 Y285 C286 T287L233-I283 HydrophobicContact CB-CD1 3.75Å; L233-I283 HydrophobicContact CD1-CD1 4.15Å; V234-I283 HydrophobicContact CG2-CG2 3.64Å; V237-I283 HydrophobicContact CG2-CG1 4.5Å; I278-I283 HydrophobicContact CG2-CG1 4.49Å; I278-I283 PolarHBondContact O-N 3.15Å; F279-I283 HydrophobicContact CD2-CB 4.07Å; F279-I283 HydrophobicContact CD2-CG1 4.49Å; F279-I283 HydrophobicContact CD2-CG2 4.16Å; F279-I283 HydrophobicContact CE2-CG2 4.22Å; F279-I283 CarbonylContact O-C 3.56Å; F279-I283 WeakPolarHBondContact O-CA 3.42Å; F279-I283 WeakPolarHBondContact O-CB 3.37Å; F279-I283 PolarHBondContact O-N 2.97Å; F279-I283 VanDerWaalsContact O-N 3.12Å; I283-Y285 VanDerWaalsContact C-N 3.3Å; I283-Y285 PolarHBondContact O-N 3.2Å; I283-C286 WeakPolarHBondContact O-CB 3.44Å; I283-C286 PolarHBondContact O-N 3.43Å; I283-C286 VanDerWaalsContact O-N 3.17Å; I283-T287 WeakPolarHBondContact O-CG2 3.49Å; I283-T287 PolarHBondContact O-N 3.36Å; I283-T287 PolarHBondContact O-OG1 3.26Å
284L94.7Very high93.1Very high10 Ų1055.5 Ų55.55%0.05225%0.249CC..Hα-helixtrans-63.1-38.9176.1-70.1-177000111.4F279 P280 C286 T287 L288 L308 M309 Q312F279-L284 HydrophobicContact CD1-CD1 4.26Å; F279-L284 HydrophobicContact CD1-CG 4.09Å; F279-L284 HydrophobicContact CE1-CD1 4.02Å; F279-L284 HydrophobicContact CE1-CD2 3.86Å; F279-L284 HydrophobicContact CE1-CG 3.82Å; F279-L284 HydrophobicContact CZ-CD2 3.98Å; F279-L284 HydrophobicContact CZ-CG 4.32Å; F279-L284 PolarHBondContact O-N 2.62Å; P280-L284 HydrophobicContact CB-CD1 4.18Å; P280-L284 WeakPolarHBondContact O-CB 3.01Å; L284-C286 VanDerWaalsContact C-N 3.34Å; L284-T287 PolarHBondContact O-N 3.03Å; L284-T287 PolarHBondContact O-OG1 2.9Å; L284-L288 HydrophobicContact CB-CD1 4.24Å; L284-L288 WeakPolarHBondContact O-CB 3.45Å; L284-L288 WeakPolarHBondContact O-CG 3.44Å; L284-L288 PolarHBondContact O-N 2.85Å; L284-L308 HydrophobicContact CD2-CB 3.56Å; L284-L308 HydrophobicContact CD2-CD1 4.44Å; L284-M309 HydrophobicContact CD1-SD 3.87Å; L284-M309 HydrophobicContact CD2-SD 4.44Å; L284-Q312 HydrophobicContact CD1-CB 4.08Å; L284-Q312 HydrophobicContact CD1-CG 4.13Å
285Y93.2Very high92.6Very high110 Ų11057 Ų5743%0.43126%0.256SS..Hα-helixtrans-60-46173.3177.2-101.4000111.4F281 I283 T287 I289 L290F281-Y285 WeakPolarHBondContact O-CB 3.38Å; I283-Y285 VanDerWaalsContact C-N 3.3Å; I283-Y285 PolarHBondContact O-N 3.2Å; Y285-T287 VanDerWaalsContact C-N 3.31Å; Y285-T287 PolarHBondContact O-N 3.5Å; Y285-I289 HydrophobicContact CD2-CB 3.84Å; Y285-I289 HydrophobicContact CD2-CG1 3.61Å; Y285-I289 HydrophobicContact CD2-CG2 4.3Å; Y285-I289 HydrophobicContact CE2-CB 3.72Å; Y285-I289 HydrophobicContact CE2-CG1 3.84Å; Y285-I289 HydrophobicContact CE2-CG2 3.67Å; Y285-I289 HydrophobicContact CG-CG1 4.46Å; Y285-I289 WeakPolarHBondContact O-CB 3.3Å; Y285-I289 PolarHBondContact O-N 3.4Å; Y285-L290 HydrophobicContact CD1-CD1 3.7Å; Y285-L290 HydrophobicContact CE1-CD1 3.25Å; Y285-L290 PolarHBondContact O-N 3.17Å
286C93.7Very high92.1Very high1 Ų163.1 Ų63.11%0.00729%0.285CS..Hα-helixtrans-59.4-38.1175.2178.20000112L162 W166 W282 I283 L284 L290 P291L162-C286 HydrophobicContact CB-CB 4.23Å; L162-C286 HydrophobicContact CD1-CB 4.21Å; L162-C286 HydrophobicContact CD2-CB 4.33Å; L162-C286 HydrophobicContact CG-CB 4.5Å; W166-C286 PolarHBondContact NE1-O 2.83Å; W282-C286 WeakPolarHBondContact O-CB 3.43Å; W282-C286 PolarHBondContact O-N 3.3Å; I283-C286 WeakPolarHBondContact O-CB 3.44Å; I283-C286 PolarHBondContact O-N 3.43Å; I283-C286 VanDerWaalsContact O-N 3.17Å; L284-C286 VanDerWaalsContact C-N 3.34Å; C286-L290 WeakPolarHBondContact O-CB 3.27Å; C286-P291 WeakPolarHBondContact O-CD 3.2Å
287T93.3Very high91.7Very high2 Ų264.9 Ų64.91%0.01230%0.299CS..Hα-helixtrans-88.4-27.3-177.663.60000114.7W166 I283 L284 Y285 Y301 N305 L308W166-T287 HydrophobicContact CZ2-CG2 4.32Å; I283-T287 WeakPolarHBondContact O-CG2 3.49Å; I283-T287 PolarHBondContact O-N 3.36Å; I283-T287 PolarHBondContact O-OG1 3.26Å; L284-T287 PolarHBondContact O-N 3.03Å; L284-T287 PolarHBondContact O-OG1 2.9Å; Y285-T287 VanDerWaalsContact C-N 3.31Å; Y285-T287 PolarHBondContact O-N 3.5Å; T287-Y301 WeakPolarHBondContact O-CE2 3.4Å; T287-Y301 PolarHBondContact O-OH 2.98Å; T287-N305 VanDerWaalsContact CB-OD1 3.27Å; T287-N305 WeakPolarHBondContact CB-OD1 3.41Å; T287-N305 PolarHBondContact O-ND2 3.36Å; T287-N305 PolarHBondContact O-OD1 3.03Å; T287-N305 PolarHBondContact OG1-OD1 3.48Å; T287-L308 HydrophobicContact CG2-CD1 4.07Å
288L92.6Very high91.5Very high55 Ų5561.9 Ų61.929%0.28828%0.283SS..Hα-helixtrans-94.1-33.8-177-74.2166.6000113.8L284 M292 Y301 N305 M309L284-L288 HydrophobicContact CB-CD1 4.24Å; L284-L288 WeakPolarHBondContact O-CB 3.45Å; L284-L288 WeakPolarHBondContact O-CG 3.44Å; L284-L288 PolarHBondContact O-N 2.85Å; L288-M292 WeakPolarHBondContact O-CG 3.42Å; L288-Y301 WeakPolarHBondContact CA-OH 3.34Å; L288-Y301 PolarHBondContact O-OH 3.46Å; L288-N305 HydrophobicContact CD2-CB 3.6Å; L288-N305 WeakPolarHBondContact CD2-OD1 3.37Å; L288-N305 HydrophobicContact CG-CB 4.46Å; L288-N305 WeakPolarHBondContact CG-OD1 3.27Å; L288-M309 HydrophobicContact CD1-SD 3.94Å
289I91.7Very high91.2Very high70 Ų7063.6 Ų63.636%0.35929%0.288SS..THydrogen-bonded Turntrans-108.1-49-167.6-52.8-58.3000111.5Y285 M292 Y293Y285-I289 HydrophobicContact CD2-CB 3.84Å; Y285-I289 HydrophobicContact CD2-CG1 3.61Å; Y285-I289 HydrophobicContact CD2-CG2 4.3Å; Y285-I289 HydrophobicContact CE2-CB 3.72Å; Y285-I289 HydrophobicContact CE2-CG1 3.84Å; Y285-I289 HydrophobicContact CE2-CG2 3.67Å; Y285-I289 HydrophobicContact CG-CG1 4.46Å; Y285-I289 WeakPolarHBondContact O-CB 3.3Å; Y285-I289 PolarHBondContact O-N 3.4Å; I289-M292 WeakPolarHBondContact O-CB 3.48Å; I289-M292 PolarHBondContact O-N 3.35Å; I289-M292 VanDerWaalsContact O-N 3.16Å; I289-Y293 HydrophobicContact CG2-CE2 4.03Å
290L90.6Very high91Very high11 Ų1163.7 Ų63.76%0.05829%0.289CS..SBendtrans-57-46.6-176.7-91.960.9000113.7L162 W163 Y285 C286 M292 Y293L162-L290 HydrophobicContact CB-CD2 4.24Å; L162-L290 WeakPolarHBondContact O-CD2 3.44Å; W163-L290 HydrophobicContact CE3-CD2 3.86Å; W163-L290 HydrophobicContact CE3-CG 3.87Å; W163-L290 HydrophobicContact CZ3-CD2 4.48Å; W163-L290 HydrophobicContact CZ3-CG 3.98Å; Y285-L290 HydrophobicContact CD1-CD1 3.7Å; Y285-L290 HydrophobicContact CE1-CD1 3.25Å; Y285-L290 PolarHBondContact O-N 3.17Å; C286-L290 WeakPolarHBondContact O-CB 3.27Å; L290-M292 PolarHBondContact O-N 3Å; L290-Y293 WeakPolarHBondContact O-CD2 3.44Å; L290-Y293 PolarHBondContact O-N 2.88Å
291P89.3Confident90.8Very high3 Ų363.1 Ų63.12%0.01928%0.283CS..G310 helixtrans-61.2-33.1179.1-30.340.3000113.3W166 C286 Y293 Y294 L295 Y301W166-P291 HydrophobicContact CD2-CB 4.43Å; W166-P291 HydrophobicContact CD2-CG 3.52Å; W166-P291 HydrophobicContact CE3-CG 3.94Å; W166-P291 HydrophobicContact CG-CG 4.04Å; W166-P291 HydrophobicContact CH2-CG 3.82Å; W166-P291 HydrophobicContact CZ2-CG 3.4Å; W166-P291 VanDerWaalsContact CZ2-CG 3.4Å; W166-P291 HydrophobicContact CZ3-CG 4.06Å; C286-P291 WeakPolarHBondContact O-CD 3.2Å; P291-Y293 PolarHBondContact O-N 2.91Å; P291-Y293 VanDerWaalsContact O-N 3.09Å; P291-Y294 PolarHBondContact O-N 3.27Å; P291-L295 HydrophobicContact CB-CD1 4.28Å; P291-L295 WeakPolarHBondContact O-CB 3.25Å; P291-L295 PolarHBondContact O-N 3.2Å; P291-Y301 HydrophobicContact CB-CE2 3.79Å; P291-Y301 HydrophobicContact CG-CE2 3.99Å
292M88.2Confident90.7Very high95 Ų9560.9 Ų60.947%0.46828%0.277SS..G310 helixtrans-64-17.3-175.5-64.3-66.3-59.800113.3L288 I289 L290 Y294 P297 Y301L288-M292 WeakPolarHBondContact O-CG 3.42Å; I289-M292 WeakPolarHBondContact O-CB 3.48Å; I289-M292 PolarHBondContact O-N 3.35Å; I289-M292 VanDerWaalsContact O-N 3.16Å; L290-M292 PolarHBondContact O-N 3Å; M292-Y294 VanDerWaalsContact C-N 3.3Å; M292-P297 HydrophobicContact CE-CG 3.62Å; M292-P297 HydrophobicContact SD-CG 3.6Å; M292-Y301 WeakPolarHBondContact CG-OH 3.39Å; M292-Y301 HydrophobicContact SD-CE1 3.91Å
293Y86.9Confident90.6Very high143 Ų14357.5 Ų57.556%0.56127%0.265SS*.G310 helixtrans-72.5-21.9174.4-68.8-70.9000113.3I289 L290 P291I289-Y293 HydrophobicContact CG2-CE2 4.03Å; L290-Y293 WeakPolarHBondContact O-CD2 3.44Å; L290-Y293 PolarHBondContact O-N 2.88Å; P291-Y293 PolarHBondContact O-N 2.91Å; P291-Y293 VanDerWaalsContact O-N 3.09Å
294Y83.3Confident90.5Very high166 Ų16657.5 Ų57.565%0.65127%0.265SS*.THydrogen-bonded Turntrans-136.1-15.5-172.5-50-77.5000114.6W163 P291 M292W163-Y294 HydrophobicContact CH2-CD2 4.48Å; W163-Y294 AromaticContact CH2-CE2 3.25Å; W163-Y294 HydrophobicContact CH2-CE2 3.25Å; W163-Y294 AromaticContact CH2-CZ 3.6Å; W163-Y294 WeakPolarHBondContact CH2-OH 2.99Å; W163-Y294 HydrophobicContact CZ2-CD2 4.46Å; W163-Y294 AromaticContact CZ2-CE2 3.29Å; W163-Y294 HydrophobicContact CZ2-CE2 3.29Å; W163-Y294 AromaticContact CZ2-CZ 3.46Å; W163-Y294 VanDerWaalsContact CZ2-CZ 3.46Å; W163-Y294 WeakPolarHBondContact CZ2-OH 3.33Å; W163-Y294 HydrophobicContact CZ3-CE2 4.27Å; P291-Y294 PolarHBondContact O-N 3.27Å; M292-Y294 VanDerWaalsContact C-N 3.3Å
295L85.3Confident90.5Very high36 Ų3657.3 Ų57.319%0.18826%0.264CS..  trans-123.6128.5-175.1-62173.9000110.2P17 Y169 P291P17-L295 HydrophobicContact CB-CD2 4.29Å; P17-L295 HydrophobicContact CG-CD2 4.08Å; Y169-L295 HydrophobicContact CD1-CD1 3.54Å; Y169-L295 HydrophobicContact CE1-CD1 3.88Å; P291-L295 HydrophobicContact CB-CD1 4.28Å; P291-L295 WeakPolarHBondContact O-CB 3.25Å; P291-L295 PolarHBondContact O-N 3.2Å
296E86.6Confident90.6Very high144 Ų14456.8 Ų56.867%0.67327%0.268SS*.  trans-69.8138.4167.6-65.8-175.2168.800109.8F298E296-F298 WeakPolarHBondContact O-CD1 3.19Å; E296-F298 PolarHBondContact O-N 2.96Å
297P88Confident90.6Very high69 Ų6958 Ų5845%0.44827%0.274SS..  trans-59.8128.8176.7-24.733.3000112.7M292 Y301 I302M292-P297 HydrophobicContact CE-CG 3.62Å; M292-P297 HydrophobicContact SD-CG 3.6Å; P297-Y301 HydrophobicContact CB-CD1 4.04Å; P297-Y301 HydrophobicContact CB-CE1 4.29Å; P297-Y301 HydrophobicContact CG-CE1 4.49Å; P297-I302 HydrophobicContact CB-CD1 4.09Å; P297-I302 HydrophobicContact CB-CG1 4.11Å
298F90Very high90.7Very high17 Ų1758.1 Ų58.18%0.07527%0.274CS..  trans-121.1174169.852-82000110.3W15 P17 Y169 Y227 E296 S300 Y301 I302W15-F298 WeakPolarHBondContact O-CE2 3.45Å; P17-F298 HydrophobicContact CB-CE1 4.46Å; P17-F298 HydrophobicContact CG-CE1 3.93Å; P17-F298 HydrophobicContact CG-CZ 4.2Å; Y169-F298 HydrophobicContact CE1-CZ 4.27Å; Y227-F298 VanDerWaalsContact OH-CE2 3.26Å; Y227-F298 WeakPolarHBondContact OH-CE2 3.36Å; Y227-F298 VanDerWaalsContact OH-CZ 3.22Å; Y227-F298 WeakPolarHBondContact OH-CZ 3.25Å; E296-F298 WeakPolarHBondContact O-CD1 3.19Å; E296-F298 PolarHBondContact O-N 2.96Å; F298-S300 WeakPolarHBondContact CD2-OG 3.44Å; F298-S300 WeakPolarHBondContact CE2-OG 3.25Å; F298-S300 PolarHBondContact O-N 3.47Å; F298-Y301 WeakPolarHBondContact O-CB 3.37Å; F298-Y301 PolarHBondContact O-N 2.89Å; F298-I302 WeakPolarHBondContact O-CG1 2.99Å; F298-I302 PolarHBondContact O-N 3.32Å
299F91.7Very high90.8Very high98 Ų9859.6 Ų59.643%0.4328%0.281SS..Hα-helixtrans-57.8-52.1-169.3172.7-96.1000113.6F14 F221 Y301 I302 F303F14-F299 HydrophobicContact CB-CB 4.36Å; F14-F299 HydrophobicContact CB-CD1 4.15Å; F14-F299 HydrophobicContact CD1-CB 3.94Å; F14-F299 HydrophobicContact CD1-CD1 4.45Å; F14-F299 HydrophobicContact CD1-CG 4.17Å; F221-F299 HydrophobicContact CE1-CE1 4.49Å; F299-Y301 VanDerWaalsContact C-N 3.31Å; F299-Y301 PolarHBondContact O-N 2.91Å; F299-I302 PolarHBondContact O-N 2.85Å; F299-F303 HydrophobicContact CE1-CB 4.36Å; F299-F303 HydrophobicContact CE1-CG 4.49Å; F299-F303 HydrophobicContact CZ-CB 4.35Å; F299-F303 HydrophobicContact CZ-CD2 4.21Å; F299-F303 HydrophobicContact CZ-CG 4.35Å; F299-F303 VanDerWaalsContact O-CB 3.25Å; F299-F303 WeakPolarHBondContact O-CB 3.27Å; F299-F303 PolarHBondContact O-N 3.05Å
300S91.2Very high90.8Very high1 Ų161 Ų611%0.00729%0.288CS..Hα-helixtrans-64.7-34.7-177.259.50000112.5F14 W15 F298 F303 L304F14-S300 VanDerWaalsContact O-CB 3.25Å; F14-S300 WeakPolarHBondContact O-CB 2.96Å; F14-S300 PolarHBondContact O-N 2.99Å; F14-S300 PolarHBondContact O-OG 3.21Å; W15-S300 WeakPolarHBondContact CA-OG 3.39Å; W15-S300 PolarHBondContact O-OG 3Å; F298-S300 WeakPolarHBondContact CD2-OG 3.44Å; F298-S300 WeakPolarHBondContact CE2-OG 3.25Å; F298-S300 PolarHBondContact O-N 3.47Å; S300-F303 PolarHBondContact O-N 3.22Å; S300-L304 VanDerWaalsContact O-CB 3.3Å; S300-L304 WeakPolarHBondContact O-CB 3.45Å; S300-L304 PolarHBondContact O-N 2.87Å
301Y92Very high90.9Very high17 Ų1761.3 Ų61.37%0.06729%0.29CS..Hα-helixtrans-59.7-50.9171.4170.7-96.6000112.1Y227 T287 L288 P291 M292 P297 F298 F299 N305Y227-Y301 WeakPolarHBondContact OH-CA 3.47Å; Y227-Y301 PolarHBondContact OH-N 3.47Å; T287-Y301 WeakPolarHBondContact O-CE2 3.4Å; T287-Y301 PolarHBondContact O-OH 2.98Å; L288-Y301 WeakPolarHBondContact CA-OH 3.34Å; L288-Y301 PolarHBondContact O-OH 3.46Å; P291-Y301 HydrophobicContact CB-CE2 3.79Å; P291-Y301 HydrophobicContact CG-CE2 3.99Å; M292-Y301 WeakPolarHBondContact CG-OH 3.39Å; M292-Y301 HydrophobicContact SD-CE1 3.91Å; P297-Y301 HydrophobicContact CB-CD1 4.04Å; P297-Y301 HydrophobicContact CB-CE1 4.29Å; P297-Y301 HydrophobicContact CG-CE1 4.49Å; F298-Y301 WeakPolarHBondContact O-CB 3.37Å; F298-Y301 PolarHBondContact O-N 2.89Å; F299-Y301 VanDerWaalsContact C-N 3.31Å; F299-Y301 PolarHBondContact O-N 2.91Å; Y301-N305 WeakPolarHBondContact CD2-ND2 3.49Å; Y301-N305 WeakPolarHBondContact CE2-ND2 3.45Å; Y301-N305 WeakPolarHBondContact O-CB 3.35Å; Y301-N305 PolarHBondContact O-N 2.94Å; Y301-N305 VanDerWaalsContact O-N 3.13Å; Y301-N305 PolarHBondContact O-ND2 3.27Å
302I93Very high91.2Very high95 Ų9562 Ų6249%0.48729%0.293SS..Hα-helixtrans-63.8-44.9179.6-64.9169.7000110P297 F298 F299 N305 L306P297-I302 HydrophobicContact CB-CD1 4.09Å; P297-I302 HydrophobicContact CB-CG1 4.11Å; F298-I302 WeakPolarHBondContact O-CG1 2.99Å; F298-I302 PolarHBondContact O-N 3.32Å; F299-I302 PolarHBondContact O-N 2.85Å; I302-N305 PolarHBondContact O-N 2.8Å; I302-L306 VanDerWaalsContact O-CB 3.31Å; I302-L306 WeakPolarHBondContact O-CB 3.41Å; I302-L306 PolarHBondContact O-N 3.24Å
303F93.2Very high91.4Very high56 Ų5662.1 Ų62.125%0.24630%0.298CS..Hα-helixtrans-63.8-46.3-177.5-176.7-101.1000112.1F221 F299 S300 L306 Q307F221-F303 AromaticContact CD1-CD1 3.55Å; F221-F303 HydrophobicContact CD1-CD1 3.55Å; F221-F303 AromaticContact CD1-CE1 3.81Å; F221-F303 HydrophobicContact CD1-CE1 3.81Å; F221-F303 HydrophobicContact CD2-CD1 4.28Å; F221-F303 AromaticContact CD2-CE1 3.71Å; F221-F303 HydrophobicContact CD2-CE1 3.71Å; F221-F303 AromaticContact CE1-CD1 3.57Å; F221-F303 HydrophobicContact CE1-CD1 3.57Å; F221-F303 AromaticContact CE1-CE1 3.66Å; F221-F303 HydrophobicContact CE1-CE1 3.66Å; F221-F303 HydrophobicContact CE1-CG 4.46Å; F221-F303 HydrophobicContact CE2-CD1 4.3Å; F221-F303 AromaticContact CE2-CE1 3.56Å; F221-F303 HydrophobicContact CE2-CE1 3.56Å; F221-F303 HydrophobicContact CE2-CZ 4.27Å; F221-F303 AromaticContact CG-CD1 3.92Å; F221-F303 HydrophobicContact CG-CD1 3.92Å; F221-F303 AromaticContact CG-CE1 3.83Å; F221-F303 HydrophobicContact CG-CE1 3.83Å; F221-F303 AromaticContact CZ-CD1 3.95Å; F221-F303 HydrophobicContact CZ-CD1 3.95Å; F221-F303 AromaticContact CZ-CE1 3.53Å; F221-F303 HydrophobicContact CZ-CE1 3.53Å; F221-F303 HydrophobicContact CZ-CZ 4.2Å; F299-F303 HydrophobicContact CE1-CB 4.36Å; F299-F303 HydrophobicContact CE1-CG 4.49Å; F299-F303 HydrophobicContact CZ-CB 4.35Å; F299-F303 HydrophobicContact CZ-CD2 4.21Å; F299-F303 HydrophobicContact CZ-CG 4.35Å; F299-F303 VanDerWaalsContact O-CB 3.25Å; F299-F303 WeakPolarHBondContact O-CB 3.27Å; F299-F303 PolarHBondContact O-N 3.05Å; S300-F303 PolarHBondContact O-N 3.22Å; F303-L306 PolarHBondContact O-N 2.97Å; F303-Q307 HydrophobicContact CE1-CG 4.4Å; F303-Q307 WeakPolarHBondContact O-CG 3.37Å; F303-Q307 PolarHBondContact O-N 2.84Å; F303-Q307 VanDerWaalsContact O-N 3.08Å
304L93.3Very high91.5Very high8 Ų857 Ų574%0.04228%0.28CS..Hα-helixtrans-64.1-45.8178.4-166.492.7000111.3L218 F221 Y227 S300 L306 Q307 L308L218-L304 HydrophobicContact CD1-CD1 3.8Å; L218-L304 HydrophobicContact CD1-CG 3.96Å; L218-L304 HydrophobicContact CG-CD1 4.4Å; F221-L304 HydrophobicContact CB-CD1 3.92Å; Y227-L304 HydrophobicContact CD2-CD1 4.37Å; Y227-L304 HydrophobicContact CD2-CD2 3.54Å; Y227-L304 HydrophobicContact CD2-CG 4.38Å; Y227-L304 HydrophobicContact CE2-CB 4.37Å; Y227-L304 HydrophobicContact CE2-CD2 4Å; Y227-L304 HydrophobicContact CG-CD2 4.16Å; S300-L304 VanDerWaalsContact O-CB 3.3Å; S300-L304 WeakPolarHBondContact O-CB 3.45Å; S300-L304 PolarHBondContact O-N 2.87Å; L304-L306 VanDerWaalsContact C-N 3.33Å; L304-L306 PolarHBondContact O-N 2.82Å; L304-Q307 WeakPolarHBondContact O-CB 3.31Å; L304-Q307 PolarHBondContact O-N 3.17Å; L304-Q307 VanDerWaalsContact O-N 3.14Å; L304-L308 HydrophobicContact CD2-CD1 4.39Å; L304-L308 WeakPolarHBondContact O-CG 3.5Å; L304-L308 PolarHBondContact O-N 3.09Å
305N94Very high92Very high6 Ų649.1 Ų49.13%0.03225%0.25CC..Hα-helixtrans-65.1-36.6178.8-84.1-65.8000112.3T287 L288 Y301 I302 Q307 L308 M309T287-N305 VanDerWaalsContact CB-OD1 3.27Å; T287-N305 WeakPolarHBondContact CB-OD1 3.41Å; T287-N305 PolarHBondContact O-ND2 3.36Å; T287-N305 PolarHBondContact O-OD1 3.03Å; T287-N305 PolarHBondContact OG1-OD1 3.48Å; L288-N305 HydrophobicContact CD2-CB 3.6Å; L288-N305 WeakPolarHBondContact CD2-OD1 3.37Å; L288-N305 HydrophobicContact CG-CB 4.46Å; L288-N305 WeakPolarHBondContact CG-OD1 3.27Å; Y301-N305 WeakPolarHBondContact CD2-ND2 3.49Å; Y301-N305 WeakPolarHBondContact CE2-ND2 3.45Å; Y301-N305 WeakPolarHBondContact O-CB 3.35Å; Y301-N305 PolarHBondContact O-N 2.94Å; Y301-N305 VanDerWaalsContact O-N 3.13Å; Y301-N305 PolarHBondContact O-ND2 3.27Å; I302-N305 PolarHBondContact O-N 2.8Å; N305-Q307 VanDerWaalsContact C-N 3.32Å; N305-Q307 PolarHBondContact O-N 3.33Å; N305-L308 PolarHBondContact O-N 3.4Å; N305-M309 WeakPolarHBondContact O-CG 3.36Å; N305-M309 PolarHBondContact O-N 3.05Å
306L94.8Very high92.4Very high99 Ų9952.2 Ų52.252%0.51827%0.266SS..Hα-helixtrans-59.4-43.6171.617966.5000111.4I302 F303 L304 M309 I310I302-L306 VanDerWaalsContact O-CB 3.31Å; I302-L306 WeakPolarHBondContact O-CB 3.41Å; I302-L306 PolarHBondContact O-N 3.24Å; F303-L306 PolarHBondContact O-N 2.97Å; L304-L306 VanDerWaalsContact C-N 3.33Å; L304-L306 PolarHBondContact O-N 2.82Å; L306-M309 PolarHBondContact O-N 3.46Å; L306-I310 HydrophobicContact CG-CD1 4.3Å; L306-I310 WeakPolarHBondContact O-CG1 3.35Å; L306-I310 PolarHBondContact O-N 3.16Å
307Q93.9Very high92.6Very high28 Ų2849.6 Ų49.613%0.13125%0.251CS..Hα-helixtrans-64.3-40.8176.1-70.4-175.5-22.700112.5S217 L218 F303 L304 N305 M309 I310 L311S217-Q307 PolarHBondContact OG-NE2 2.77Å; L218-Q307 HydrophobicContact CD1-CB 3.71Å; F303-Q307 HydrophobicContact CE1-CG 4.4Å; F303-Q307 WeakPolarHBondContact O-CG 3.37Å; F303-Q307 PolarHBondContact O-N 2.84Å; F303-Q307 VanDerWaalsContact O-N 3.08Å; L304-Q307 WeakPolarHBondContact O-CB 3.31Å; L304-Q307 PolarHBondContact O-N 3.17Å; L304-Q307 VanDerWaalsContact O-N 3.14Å; N305-Q307 VanDerWaalsContact C-N 3.32Å; N305-Q307 PolarHBondContact O-N 3.33Å; Q307-M309 VanDerWaalsContact C-N 3.3Å; Q307-M309 PolarHBondContact O-N 3.32Å; Q307-I310 PolarHBondContact O-N 3.36Å; Q307-L311 WeakPolarHBondContact O-CB 3.26Å; Q307-L311 PolarHBondContact O-N 2.97Å
308L94.6Very high92.7Very high3 Ų349.7 Ų49.72%0.01624%0.242CC..Hα-helixtrans-62.3-37.1174.7-68.3172.4000112L218 V234 F279 L284 T287 L304 N305 L311 Q312L218-L308 HydrophobicContact CD1-CD2 3.77Å; L218-L308 HydrophobicContact CD1-CG 3.86Å; L218-L308 HydrophobicContact CD2-CD2 3.65Å; L218-L308 HydrophobicContact CG-CD2 4.27Å; V234-L308 HydrophobicContact CG1-CD2 4.44Å; V234-L308 HydrophobicContact CG2-CD2 4.15Å; F279-L308 HydrophobicContact CE2-CD2 4.18Å; F279-L308 HydrophobicContact CZ-CB 4.37Å; F279-L308 HydrophobicContact CZ-CD2 3.93Å; L284-L308 HydrophobicContact CD2-CB 3.56Å; L284-L308 HydrophobicContact CD2-CD1 4.44Å; T287-L308 HydrophobicContact CG2-CD1 4.07Å; L304-L308 HydrophobicContact CD2-CD1 4.39Å; L304-L308 WeakPolarHBondContact O-CG 3.5Å; L304-L308 PolarHBondContact O-N 3.09Å; N305-L308 PolarHBondContact O-N 3.4Å; L308-L311 WeakPolarHBondContact O-CB 3.38Å; L308-L311 PolarHBondContact O-N 3.4Å; L308-Q312 PolarHBondContact O-N 3.04Å
309M94.7Very high92.9Very high87 Ų8749.1 Ų49.143%0.42924%0.241SC..Hα-helixtrans-67-42.2174-70.5-61-62.900112.3L284 L288 N305 L306 Q307 L311 Q312 V313L284-M309 HydrophobicContact CD1-SD 3.87Å; L284-M309 HydrophobicContact CD2-SD 4.44Å; L288-M309 HydrophobicContact CD1-SD 3.94Å; N305-M309 WeakPolarHBondContact O-CG 3.36Å; N305-M309 PolarHBondContact O-N 3.05Å; L306-M309 PolarHBondContact O-N 3.46Å; Q307-M309 VanDerWaalsContact C-N 3.3Å; Q307-M309 PolarHBondContact O-N 3.32Å; M309-L311 VanDerWaalsContact C-N 3.28Å; M309-L311 PolarHBondContact O-N 2.9Å; M309-Q312 WeakPolarHBondContact O-CB 3.22Å; M309-Q312 PolarHBondContact O-N 3.07Å; M309-Q312 VanDerWaalsContact O-N 3.15Å; M309-V313 PolarHBondContact O-N 2.94Å
310I92.6Very high93Very high98 Ų9851.1 Ų51.150%0.50325%0.247SC..Hα-helixtrans-60.4-42.4173.5-68.5166.8000110.2L306 Q307 Q312 V313 L314L306-I310 HydrophobicContact CG-CD1 4.3Å; L306-I310 WeakPolarHBondContact O-CG1 3.35Å; L306-I310 PolarHBondContact O-N 3.16Å; Q307-I310 PolarHBondContact O-N 3.36Å; I310-Q312 VanDerWaalsContact C-N 3.27Å; I310-Q312 PolarHBondContact O-N 3.44Å; I310-V313 PolarHBondContact O-N 3.28Å; I310-L314 PolarHBondContact O-N 3.26Å; I310-L314 VanDerWaalsContact O-N 3.07Å
311L92.3Very high92.8Very high18 Ų1856.1 Ų56.19%0.09427%0.266CS..Hα-helixtrans-60.5-39176-173.262.7000111.2L218 F279 Q307 L308 M309 L314 H315L218-L311 HydrophobicContact CD2-CD2 4.19Å; F279-L311 HydrophobicContact CZ-CD2 4.16Å; Q307-L311 WeakPolarHBondContact O-CB 3.26Å; Q307-L311 PolarHBondContact O-N 2.97Å; L308-L311 WeakPolarHBondContact O-CB 3.38Å; L308-L311 PolarHBondContact O-N 3.4Å; M309-L311 VanDerWaalsContact C-N 3.28Å; M309-L311 PolarHBondContact O-N 2.9Å; L311-L314 WeakPolarHBondContact O-CB 3.27Å; L311-L314 PolarHBondContact O-N 2.88Å; L311-H315 PolarHBondContact O-N 2.89Å; L311-H315 PolarHBondContact O-ND1 3.18Å
312Q94.9Very high92.8Very high19 Ų1956.1 Ų56.19%0.08927%0.267CS..Hα-helixtrans-65-40175.2-172.854.611.500113.6R275 F279 L284 L308 M309 I310 L314 H315 L316R275-Q312 PolarHBondContact O-NE2 3.44Å; R275-Q312 PolarHBondContact O-OE1 3.14Å; F279-Q312 HydrophobicContact CE1-CB 4.06Å; L284-Q312 HydrophobicContact CD1-CB 4.08Å; L284-Q312 HydrophobicContact CD1-CG 4.13Å; L308-Q312 PolarHBondContact O-N 3.04Å; M309-Q312 WeakPolarHBondContact O-CB 3.22Å; M309-Q312 PolarHBondContact O-N 3.07Å; M309-Q312 VanDerWaalsContact O-N 3.15Å; I310-Q312 VanDerWaalsContact C-N 3.27Å; I310-Q312 PolarHBondContact O-N 3.44Å; Q312-L314 PolarHBondContact O-N 2.88Å; Q312-H315 WeakPolarHBondContact O-CB 3.33Å; Q312-H315 PolarHBondContact O-N 3.4Å; Q312-H315 PolarHBondContact OE1-ND1 3.36Å; Q312-H315 VanDerWaalsContact OE1-ND1 3.16Å; Q312-L316 PolarHBondContact O-N 3.04Å
313V93.3Very high92.7Very high96 Ų9655.5 Ų55.558%0.58226%0.264SS*.Hα-helixtrans-60.5-38.71741740000110.6M309 I310 L316 Y317M309-V313 PolarHBondContact O-N 2.94Å; I310-V313 PolarHBondContact O-N 3.28Å; V313-L316 WeakPolarHBondContact O-CB 3.49Å; V313-L316 PolarHBondContact O-N 3.18Å; V313-Y317 PolarHBondContact O-N 3.44Å
314L90Very high92.6Very high35 Ų3558.7 Ų58.718%0.18328%0.278CS..Hα-helixtrans-67.4-35.9176.6-168.563.7000112.4H211 I310 L311 Q312 Y317 W318H211-L314 HydrophobicContact CB-CD2 3.85Å; H211-L314 WeakPolarHBondContact ND1-CD2 3.4Å; I310-L314 PolarHBondContact O-N 3.26Å; I310-L314 VanDerWaalsContact O-N 3.07Å; L311-L314 WeakPolarHBondContact O-CB 3.27Å; L311-L314 PolarHBondContact O-N 2.88Å; Q312-L314 PolarHBondContact O-N 2.88Å; L314-Y317 HydrophobicContact CD1-CD1 4.21Å; L314-Y317 WeakPolarHBondContact O-CB 3.47Å; L314-Y317 PolarHBondContact O-N 2.96Å; L314-W318 HydrophobicContact CB-CZ3 4.45Å; L314-W318 HydrophobicContact CD1-CD2 4.41Å; L314-W318 HydrophobicContact CD1-CH2 4.23Å; L314-W318 HydrophobicContact CD1-CZ2 3.86Å; L314-W318 HydrophobicContact CD2-CE3 4.39Å; L314-W318 HydrophobicContact CD2-CH2 3.18Å; L314-W318 HydrophobicContact CD2-CZ2 3.6Å; L314-W318 HydrophobicContact CD2-CZ3 3.61Å; L314-W318 HydrophobicContact CG-CD2 4.05Å; L314-W318 HydrophobicContact CG-CE3 3.84Å; L314-W318 HydrophobicContact CG-CH2 3.47Å; L314-W318 VanDerWaalsContact CG-CH2 3.47Å; L314-W318 HydrophobicContact CG-CZ2 3.62Å; L314-W318 HydrophobicContact CG-CZ3 3.56Å; L314-W318 PolarHBondContact O-N 3.15Å
315H92.8Very high92.2Very high1 Ų162.1 Ų62.11%0.00530%0.295CS..Hα-helixtrans-63.8-39171.4-62.3142.9000112.8H238 R275 L276 L311 Q312 Y317 W318 G319H238-H315 AromaticContact CD2-CE1 3.72Å; H238-H315 AromaticContact CD2-NE2 3.44Å; H238-H315 PolarHBondContact CD2-NE2 3.33Å; H238-H315 AromaticContact NE2-CE1 3.03Å; H238-H315 PolarHBondContact NE2-CE1 3.45Å; H238-H315 AromaticContact NE2-NE2 3.27Å; H238-H315 PolarHBondContact NE2-NE2 3.27Å; R275-H315 HydrophobicContact CB-CB 4.29Å; L276-H315 HydrophobicContact CD2-CB 4.13Å; L311-H315 PolarHBondContact O-N 2.89Å; L311-H315 PolarHBondContact O-ND1 3.18Å; Q312-H315 WeakPolarHBondContact O-CB 3.33Å; Q312-H315 PolarHBondContact O-N 3.4Å; Q312-H315 PolarHBondContact OE1-ND1 3.36Å; Q312-H315 VanDerWaalsContact OE1-ND1 3.16Å; H315-Y317 VanDerWaalsContact C-N 3.34Å; H315-W318 PolarHBondContact O-N 2.98Å; H315-G319 WeakPolarHBondContact O-CA 3.17Å; H315-G319 PolarHBondContact O-N 3.07Å
316L94.2Very high92Very high101 Ų10162.8 Ų62.853%0.52930%0.298SS..Hα-helixtrans-63.8-42.2174-67.7171.4000111L276 Q312 V313 G319 Y320L276-L316 HydrophobicContact CD2-CD2 3.7Å; L276-L316 HydrophobicContact CD2-CG 4.32Å; Q312-L316 PolarHBondContact O-N 3.04Å; V313-L316 WeakPolarHBondContact O-CB 3.49Å; V313-L316 PolarHBondContact O-N 3.18Å; L316-G319 PolarHBondContact O-N 2.97Å; L316-Y320 PolarHBondContact O-N 3.06Å
317Y90.8Very high91.5Very high90 Ų9061.4 Ų61.435%0.35329%0.291SS..Hα-helixtrans-57.1-52.1174.7173.3-94.9000111.3V313 L314 H315 Y320 Y321V313-Y317 PolarHBondContact O-N 3.44Å; L314-Y317 HydrophobicContact CD1-CD1 4.21Å; L314-Y317 WeakPolarHBondContact O-CB 3.47Å; L314-Y317 PolarHBondContact O-N 2.96Å; H315-Y317 VanDerWaalsContact C-N 3.34Å; Y317-Y320 WeakPolarHBondContact O-CB 3.17Å; Y317-Y320 PolarHBondContact O-N 3.22Å; Y317-Y321 HydrophobicContact CD1-CD2 4.37Å; Y317-Y321 HydrophobicContact CD1-CE2 4.17Å; Y317-Y321 AromaticContact CD2-CE2 3.97Å; Y317-Y321 HydrophobicContact CD2-CE2 3.97Å; Y317-Y321 HydrophobicContact CE1-CD2 4.09Å; Y317-Y321 AromaticContact CE1-CE2 3.65Å; Y317-Y321 HydrophobicContact CE1-CE2 3.65Å; Y317-Y321 HydrophobicContact CE2-CD2 4.48Å; Y317-Y321 AromaticContact CE2-CE2 3.45Å; Y317-Y321 HydrophobicContact CE2-CE2 3.45Å; Y317-Y321 VanDerWaalsContact CE2-CE2 3.45Å; Y317-Y321 HydrophobicContact CG-CE2 4.3Å; Y317-Y321 AromaticContact CZ-CE2 3.25Å; Y317-Y321 AromaticContact CZ-CZ 3.87Å; Y317-Y321 WeakPolarHBondContact O-CD2 3.4Å; Y317-Y321 PolarHBondContact O-N 2.96Å; Y317-Y321 WeakPolarHBondContact OH-CE2 3.22Å; Y317-Y321 PolarHBondContact OH-OH 3.28Å
318W90.3Very high90.9Very high70 Ų7064.7 Ų64.727%0.26530%0.302SS..Hα-helixtrans-69.9-36.2178.2-66.4-43.4000113.6H211 F271 L314 H315 Y320 Y321 I322H211-W318 HydrophobicContact CB-CH2 4.13Å; H211-W318 HydrophobicContact CB-CZ2 4.44Å; H211-W318 AromaticContact CD2-CH2 3.92Å; H211-W318 AromaticContact CE1-CH2 3.76Å; H211-W318 AromaticContact CG-CH2 3.58Å; H211-W318 AromaticContact ND1-CH2 3.5Å; H211-W318 WeakPolarHBondContact ND1-CH2 3.37Å; F271-W318 HydrophobicContact CE2-CB 4.48Å; F271-W318 HydrophobicContact CZ-CB 4.04Å; L314-W318 HydrophobicContact CB-CZ3 4.45Å; L314-W318 HydrophobicContact CD1-CD2 4.41Å; L314-W318 HydrophobicContact CD1-CH2 4.23Å; L314-W318 HydrophobicContact CD1-CZ2 3.86Å; L314-W318 HydrophobicContact CD2-CE3 4.39Å; L314-W318 HydrophobicContact CD2-CH2 3.18Å; L314-W318 HydrophobicContact CD2-CZ2 3.6Å; L314-W318 HydrophobicContact CD2-CZ3 3.61Å; L314-W318 HydrophobicContact CG-CD2 4.05Å; L314-W318 HydrophobicContact CG-CE3 3.84Å; L314-W318 HydrophobicContact CG-CH2 3.47Å; L314-W318 VanDerWaalsContact CG-CH2 3.47Å; L314-W318 HydrophobicContact CG-CZ2 3.62Å; L314-W318 HydrophobicContact CG-CZ3 3.56Å; L314-W318 PolarHBondContact O-N 3.15Å; H315-W318 PolarHBondContact O-N 2.98Å; W318-Y320 PolarHBondContact O-N 3.46Å; W318-Y321 PolarHBondContact O-N 3.38Å; W318-I322 WeakPolarHBondContact O-CG1 3.26Å; W318-I322 PolarHBondContact O-N 2.98Å
319G93.6Very high90.1Very high5 Ų566.3 Ų66.35%0.05231%0.314CS..Hα-helixtrans-57.4-37.6174.300000112H315 L316 I322 L323H315-G319 WeakPolarHBondContact O-CA 3.17Å; H315-G319 PolarHBondContact O-N 3.07Å; L316-G319 PolarHBondContact O-N 2.97Å; G319-I322 PolarHBondContact O-N 3.17Å; G319-L323 WeakPolarHBondContact O-CB 3.46Å; G319-L323 PolarHBondContact O-N 2.91Å
320Y93.1Very high89.1Confident141 Ų14166.5 Ų66.555%0.55332%0.316SS*.Hα-helixtrans-61.1-45.3172.2168.8-97.1000112.6L316 Y317 W318 L323 K324L316-Y320 PolarHBondContact O-N 3.06Å; Y317-Y320 WeakPolarHBondContact O-CB 3.17Å; Y317-Y320 PolarHBondContact O-N 3.22Å; W318-Y320 PolarHBondContact O-N 3.46Å; Y320-L323 PolarHBondContact O-N 3.43Å; Y320-K324 WeakPolarHBondContact O-CB 3.43Å; Y320-K324 PolarHBondContact O-N 3.39Å
321Y88.6Confident88Confident106 Ų10668.7 Ų68.742%0.41632%0.322SS..Hα-helixtrans-67.7-39.1177.3-74-83.2000112.6Y317 W318 L323 K324 M325Y317-Y321 HydrophobicContact CD1-CD2 4.37Å; Y317-Y321 HydrophobicContact CD1-CE2 4.17Å; Y317-Y321 AromaticContact CD2-CE2 3.97Å; Y317-Y321 HydrophobicContact CD2-CE2 3.97Å; Y317-Y321 HydrophobicContact CE1-CD2 4.09Å; Y317-Y321 AromaticContact CE1-CE2 3.65Å; Y317-Y321 HydrophobicContact CE1-CE2 3.65Å; Y317-Y321 HydrophobicContact CE2-CD2 4.48Å; Y317-Y321 AromaticContact CE2-CE2 3.45Å; Y317-Y321 HydrophobicContact CE2-CE2 3.45Å; Y317-Y321 VanDerWaalsContact CE2-CE2 3.45Å; Y317-Y321 HydrophobicContact CG-CE2 4.3Å; Y317-Y321 AromaticContact CZ-CE2 3.25Å; Y317-Y321 AromaticContact CZ-CZ 3.87Å; Y317-Y321 WeakPolarHBondContact O-CD2 3.4Å; Y317-Y321 PolarHBondContact O-N 2.96Å; Y317-Y321 WeakPolarHBondContact OH-CE2 3.22Å; Y317-Y321 PolarHBondContact OH-OH 3.28Å; W318-Y321 PolarHBondContact O-N 3.38Å; Y321-L323 VanDerWaalsContact C-N 3.34Å; Y321-K324 PolarHBondContact O-N 2.99Å; Y321-M325 PolarHBondContact O-N 2.85Å
322I90.7Very high86.3Confident16 Ų1671.3 Ų71.38%0.08233%0.334CS..Hα-helixtrans-60.4-47.3174.8-68169000109.5F264 F267 S268 F271 F272 W318 G319 K324 M325 L326F264-I322 HydrophobicContact CZ-CG2 4Å; F267-I322 HydrophobicContact CE1-CD1 3.67Å; F267-I322 HydrophobicContact CE1-CG1 4.04Å; F267-I322 HydrophobicContact CZ-CD1 3.71Å; F267-I322 HydrophobicContact CZ-CG1 4.5Å; S268-I322 WeakPolarHBondContact OG-CG2 3.28Å; F271-I322 HydrophobicContact CB-CD1 4.35Å; F271-I322 HydrophobicContact CD1-CD1 3.74Å; F271-I322 HydrophobicContact CD2-CD1 3.58Å; F271-I322 HydrophobicContact CE1-CD1 3.9Å; F271-I322 HydrophobicContact CE2-CD1 3.77Å; F271-I322 HydrophobicContact CG-CD1 3.62Å; F271-I322 HydrophobicContact CZ-CD1 3.94Å; F272-I322 HydrophobicContact CE2-CG2 3.96Å; W318-I322 WeakPolarHBondContact O-CG1 3.26Å; W318-I322 PolarHBondContact O-N 2.98Å; G319-I322 PolarHBondContact O-N 3.17Å; I322-K324 PolarHBondContact O-N 3.25Å; I322-M325 PolarHBondContact O-N 2.87Å; I322-L326 HydrophobicContact CG2-CD1 4.13Å; I322-L326 HydrophobicContact CG2-CG 4.47Å; I322-L326 WeakPolarHBondContact O-CG 3.41Å; I322-L326 PolarHBondContact O-N 3.5Å
323L92.3Very high84.2Confident82 Ų8278.7 Ų78.743%0.42937%0.366SS..Hα-helixtrans-62.9-41.8177.3-168.970.8000112F272 G319 Y320 Y321 M325 L326 N327F272-L323 HydrophobicContact CZ-CB 4.38Å; F272-L323 HydrophobicContact CZ-CD1 4.42Å; G319-L323 WeakPolarHBondContact O-CB 3.46Å; G319-L323 PolarHBondContact O-N 2.91Å; Y320-L323 PolarHBondContact O-N 3.43Å; Y321-L323 VanDerWaalsContact C-N 3.34Å; L323-M325 VanDerWaalsContact C-N 3.3Å; L323-M325 PolarHBondContact O-N 3.39Å; L323-L326 PolarHBondContact O-N 3.18Å; L323-N327 WeakPolarHBondContact O-CB 3.46Å; L323-N327 VanDerWaalsContact O-CG 3.24Å; L323-N327 PolarHBondContact O-N 2.83Å
324K89.1Confident81.4Confident124 Ų12481 Ų8154%0.53938%0.375SS..Hα-helixtrans-58.7-43.3175-175.1-179.2177.9-176.40111.2Y320 Y321 I322 R328Y320-K324 WeakPolarHBondContact O-CB 3.43Å; Y320-K324 PolarHBondContact O-N 3.39Å; Y321-K324 PolarHBondContact O-N 2.99Å; I322-K324 PolarHBondContact O-N 3.25Å; K324-R328 PolarHBondContact O-N 3.13Å
325M85.5Confident79Confident80 Ų8085.6 Ų85.639%0.39440%0.399SS..Hα-helixtrans-69.7-41.2177.7-165.7165.775.400112.1F264 Y321 I322 L323 N327 R328 C329F264-M325 HydrophobicContact CD1-CE 3.76Å; F264-M325 HydrophobicContact CD2-CE 3.42Å; F264-M325 VanDerWaalsContact CD2-CE 3.42Å; F264-M325 HydrophobicContact CE1-CB 4.49Å; F264-M325 HydrophobicContact CE1-CE 3.32Å; F264-M325 HydrophobicContact CE1-CG 4.41Å; F264-M325 HydrophobicContact CE2-CE 2.97Å; F264-M325 HydrophobicContact CG-CE 3.82Å; F264-M325 HydrophobicContact CZ-CB 4.35Å; F264-M325 HydrophobicContact CZ-CE 2.94Å; F264-M325 HydrophobicContact CZ-SD 4.49Å; Y321-M325 PolarHBondContact O-N 2.85Å; I322-M325 PolarHBondContact O-N 2.87Å; L323-M325 VanDerWaalsContact C-N 3.3Å; L323-M325 PolarHBondContact O-N 3.39Å; M325-N327 VanDerWaalsContact C-N 3.34Å; M325-N327 PolarHBondContact O-N 3.08Å; M325-R328 WeakPolarHBondContact O-CB 3.45Å; M325-R328 PolarHBondContact O-N 3.46Å; M325-R328 VanDerWaalsContact O-N 3.16Å; M325-C329 PolarHBondContact O-N 2.99Å; M325-C329 PolarHBondContact O-SG 2.93Å
326L89.1Confident76.2Confident20 Ų2094.4 Ų94.411%0.10544%0.44CS..Hα-helixtrans-58.8-45.4174.1-73.9171.3000111.9F264 F265 F272 I322 L323 R328 C329 I330F264-L326 HydrophobicContact CD1-CD2 4.15Å; F264-L326 HydrophobicContact CE1-CD2 3.6Å; F264-L326 HydrophobicContact CE1-CG 3.89Å; F264-L326 HydrophobicContact CZ-CG 4.45Å; F265-L326 HydrophobicContact CD1-CD2 3.45Å; F265-L326 VanDerWaalsContact CD1-CD2 3.45Å; F265-L326 HydrophobicContact CE1-CD2 3.39Å; F265-L326 HydrophobicContact CG-CD2 4.43Å; F265-L326 HydrophobicContact CZ-CD2 4.31Å; F272-L326 HydrophobicContact CE2-CD1 4.25Å; I322-L326 HydrophobicContact CG2-CD1 4.13Å; I322-L326 HydrophobicContact CG2-CG 4.47Å; I322-L326 WeakPolarHBondContact O-CG 3.41Å; I322-L326 PolarHBondContact O-N 3.5Å; L323-L326 PolarHBondContact O-N 3.18Å; L326-R328 VanDerWaalsContact C-N 3.32Å; L326-R328 PolarHBondContact O-N 2.96Å; L326-C329 PolarHBondContact O-N 3.22Å; L326-I330 VanDerWaalsContact O-CG1 3.28Å; L326-I330 WeakPolarHBondContact O-CG1 3.4Å; L326-I330 PolarHBondContact O-N 3Å
327N84.9Confident73.8Confident69 Ų6996.6 Ų96.637%0.36945%0.452SS..Hα-helixtrans-59.2-46.2175.5-72.4-13.5000110.1L323 M325 C329 I330 F331L323-N327 WeakPolarHBondContact O-CB 3.46Å; L323-N327 VanDerWaalsContact O-CG 3.24Å; L323-N327 PolarHBondContact O-N 2.83Å; M325-N327 VanDerWaalsContact C-N 3.34Å; M325-N327 PolarHBondContact O-N 3.08Å; N327-C329 VanDerWaalsContact C-N 3.35Å; N327-C329 PolarHBondContact O-N 3.12Å; N327-I330 PolarHBondContact O-N 2.83Å; N327-F331 HydrophobicContact CB-CD2 4.05Å; N327-F331 HydrophobicContact CB-CE2 4.22Å; N327-F331 WeakPolarHBondContact O-CB 3.31Å; N327-F331 WeakPolarHBondContact O-CD2 3.33Å; N327-F331 PolarHBondContact O-N 3.33Å
328R81.2Confident71.2Confident97 Ų9797.9 Ų97.937%0.36647%0.469SS..Hα-helixtrans-55.7-48.9174.9-168.7176.5-162.6178.411.1111.2K324 M325 L326 I330 M332 D341 D342K324-R328 PolarHBondContact O-N 3.13Å; M325-R328 WeakPolarHBondContact O-CB 3.45Å; M325-R328 PolarHBondContact O-N 3.46Å; M325-R328 VanDerWaalsContact O-N 3.16Å; L326-R328 VanDerWaalsContact C-N 3.32Å; L326-R328 PolarHBondContact O-N 2.96Å; R328-I330 PolarHBondContact O-N 3.17Å; R328-M332 HydrophobicContact CG-CG 4.31Å; R328-M332 HydrophobicContact CG-SD 3.3Å; R328-M332 WeakPolarHBondContact CG-SD 3.23Å; R328-M332 PolarHBondContact NE-SD 3.13Å; R328-M332 WeakPolarHBondContact O-CB 3.32Å; R328-M332 WeakPolarHBondContact O-CG 3.47Å; R328-M332 PolarHBondContact O-N 2.93Å; R328-D341 IonicContact NH1-OD1 3.98Å; R328-D342 IonicContact CZ-OD2 2.78Å; R328-D342 IonicContact NH1-OD2 2.87Å; R328-D342 IonicContact NH2-OD2 3.94Å; R328-D342 PolarHBondContact NH2-OD2 3.15Å
329C77.3Confident69.1Low37 Ų37101.6 Ų101.625%0.2548%0.483CS..Hα-helixtrans-63.2-34.9179.1-65.30000114F265 M325 L326 N327 K333F265-C329 HydrophobicContact CZ-CB 4.45Å; M325-C329 PolarHBondContact O-N 2.99Å; M325-C329 PolarHBondContact O-SG 2.93Å; L326-C329 PolarHBondContact O-N 3.22Å; N327-C329 VanDerWaalsContact C-N 3.35Å; N327-C329 PolarHBondContact O-N 3.12Å; C329-K333 WeakPolarHBondContact O-CB 3.37Å; C329-K333 PolarHBondContact O-N 2.73Å
330I75.8Confident66.3Low92 Ų92103.3 Ų103.347%0.47249%0.494SS..Hα-helixtrans-80.6-47.1-178.9-65.9165.2000110.9F265 L326 N327 R328 K333F265-I330 HydrophobicContact CE1-CG1 4.47Å; F265-I330 HydrophobicContact CZ-CG1 4.43Å; L326-I330 VanDerWaalsContact O-CG1 3.28Å; L326-I330 WeakPolarHBondContact O-CG1 3.4Å; L326-I330 PolarHBondContact O-N 3Å; N327-I330 PolarHBondContact O-N 2.83Å; R328-I330 PolarHBondContact O-N 3.17Å; I330-K333 WeakPolarHBondContact O-CB 3.13Å; I330-K333 PolarHBondContact O-N 3.13Å
331F67.8Low63.7Low143 Ų143100.5 Ų100.563%0.62749%0.489SS*.Hα-helixtrans-71-35.4-179.2-74.5-72.3000112.2N327 K333 N334N327-F331 HydrophobicContact CB-CD2 4.05Å; N327-F331 HydrophobicContact CB-CE2 4.22Å; N327-F331 WeakPolarHBondContact O-CB 3.31Å; N327-F331 WeakPolarHBondContact O-CD2 3.33Å; N327-F331 PolarHBondContact O-N 3.33Å; F331-K333 VanDerWaalsContact C-N 3.28Å; F331-K333 PolarHBondContact O-N 3.32Å; F331-N334 PolarHBondContact O-N 3.12Å
332M56.2Low61.5Low74 Ų7499.8 Ų99.837%0.36549%0.492SS..G310 helixtrans-73.3-17.8171.9-72171.357.300113R328 N334 I335 S340R328-M332 HydrophobicContact CG-CG 4.31Å; R328-M332 HydrophobicContact CG-SD 3.3Å; R328-M332 WeakPolarHBondContact CG-SD 3.23Å; R328-M332 PolarHBondContact NE-SD 3.13Å; R328-M332 WeakPolarHBondContact O-CB 3.32Å; R328-M332 WeakPolarHBondContact O-CG 3.47Å; R328-M332 PolarHBondContact O-N 2.93Å; M332-N334 PolarHBondContact O-N 3.29Å; M332-I335 PolarHBondContact O-N 3.44Å; M332-S340 WeakPolarHBondContact CE-OG 3.42Å
333K51.3Low59.2Low173 Ų173106.3 Ų106.375%0.75252%0.522SS*.G310 helixtrans-70.8-18.6170.6-124.5177.9178.5179.40113.1C329 I330 F331C329-K333 WeakPolarHBondContact O-CB 3.37Å; C329-K333 PolarHBondContact O-N 2.73Å; I330-K333 WeakPolarHBondContact O-CB 3.13Å; I330-K333 PolarHBondContact O-N 3.13Å; F331-K333 VanDerWaalsContact C-N 3.28Å; F331-K333 PolarHBondContact O-N 3.32Å
334N36Very low56.6Low145 Ų145105.3 Ų105.378%0.77552%0.517SS*.G310 helixtrans-89.1-4.5179.7-128.3-3.6000113F331 M332F331-N334 PolarHBondContact O-N 3.12Å; M332-N334 PolarHBondContact O-N 3.29Å
335I38.4Very low54.1Low131 Ų131101.9 Ų101.967%0.67250%0.502SS*.SBendtrans-115.9103.8169.1-60.4173.3000105M332 D337M332-I335 PolarHBondContact O-N 3.44Å; I335-D337 PolarHBondContact O-N 3.25Å; I335-D337 VanDerWaalsContact O-N 3.15Å
336Q33.3Very low51.8Low186 Ų186103.7 Ų103.787%0.86951%0.509SS*.  trans-51.3121.6-178.8-146.8167.1-1.500110
337D44.3Very low49.5Very low148 Ų148104.2 Ų104.279%0.79151%0.511SS*.  trans67.470.4151.1-150.213.1000117.7I335I335-D337 PolarHBondContact O-N 3.25Å; I335-D337 VanDerWaalsContact O-N 3.15Å
338V36.8Very low47.3Very low116 Ų116103.7 Ų103.770%0.70351%0.506SS*.  trans-145.9111.3147.6-175.40000110S340V338-S340 PolarHBondContact O-N 2.99Å
339R45.8Very low45.2Very low148 Ų148105 Ų10556%0.55852%0.517SS*.  trans-43.4108.9158.1-84.8172.183.9139.212.3110.5Y345 E348R339-Y345 HydrophobicContact CB-CD1 3.51Å; R339-Y345 HydrophobicContact CB-CE1 3.35Å; R339-Y345 HydrophobicContact CB-CG 4.38Å; R339-Y345 HydrophobicContact CG-CD1 3.93Å; R339-Y345 HydrophobicContact CG-CE1 3.32Å; R339-E348 IonicContact CZ-OE2 3.5Å; R339-E348 IonicContact NH2-OE2 3.52Å; R339-E348 PolarHBondContact NH2-OE2 3.43Å
340S34.9Very low43.7Very low41 Ų41106.2 Ų106.229%0.28752%0.519SS..  trans-157.186.4167.255.50000112.9M332 V338M332-S340 WeakPolarHBondContact CE-OG 3.42Å; V338-S340 PolarHBondContact O-N 2.99Å
341D37.5Very low42Very low82 Ų82106 Ų10644%0.43952%0.516SS..  trans-93105.4148.6-136.46.8000106.1R328 E343 D344 Y345R328-D341 IonicContact NH1-OD1 3.98Å; D341-E343 PolarHBondContact O-N 2.82Å; D341-D344 PolarHBondContact O-N 3.2Å; D341-Y345 HydrophobicContact CB-CD2 3.54Å; D341-Y345 HydrophobicContact CB-CE2 3.54Å; D341-Y345 WeakPolarHBondContact O-CD2 3.18Å; D341-Y345 PolarHBondContact O-N 3.47Å; D341-Y345 VanDerWaalsContact O-N 3.14Å
342D43.2Very low40.6Very low92 Ų92105.9 Ų105.949%0.49252%0.517SS..THydrogen-bonded Turntrans-63.521.8-173-60.7-53.7000115.2R328R328-D342 IonicContact CZ-OD2 2.78Å; R328-D342 IonicContact NH1-OD2 2.87Å; R328-D342 IonicContact NH2-OD2 3.94Å; R328-D342 PolarHBondContact NH2-OD2 3.15Å
343E42Very low39.8Very low152 Ų152109 Ų10971%0.7153%0.531SS*.THydrogen-bonded Turntrans-132.1-21.1170.5-67-163-176.600114.1D341D341-E343 PolarHBondContact O-N 2.82Å
344D39.3Very low39.6Very low62 Ų62107.7 Ų107.733%0.33253%0.527SS..THydrogen-bonded Turntrans-114.1-20179.2-76.9-24.6000112.7D341 E347 E348D341-D344 PolarHBondContact O-N 3.2Å; D344-E347 PolarHBondContact O-N 3.11Å; D344-E348 PolarHBondContact O-N 3.35Å
345Y35.6Very low39.9Very low52 Ų52108.1 Ų108.120%0.20453%0.525CS..Hα-helixtrans-85.5-30.3176.7-71.1-91.3000113.3R339 D341 E347 E348 E349R339-Y345 HydrophobicContact CB-CD1 3.51Å; R339-Y345 HydrophobicContact CB-CE1 3.35Å; R339-Y345 HydrophobicContact CB-CG 4.38Å; R339-Y345 HydrophobicContact CG-CD1 3.93Å; R339-Y345 HydrophobicContact CG-CE1 3.32Å; D341-Y345 HydrophobicContact CB-CD2 3.54Å; D341-Y345 HydrophobicContact CB-CE2 3.54Å; D341-Y345 WeakPolarHBondContact O-CD2 3.18Å; D341-Y345 PolarHBondContact O-N 3.47Å; D341-Y345 VanDerWaalsContact O-N 3.14Å; Y345-E347 PolarHBondContact O-N 3.02Å; Y345-E348 PolarHBondContact O-N 3.43Å; Y345-E349 WeakPolarHBondContact O-CB 3.37Å; Y345-E349 PolarHBondContact O-N 3.38Å
346E37.3Very low39.9Very low118 Ų118107.6 Ų107.655%0.55152%0.519SS*.Hα-helixtrans-59.9-36.7162.4-73.3-170.7171.500109.8E350E346-E350 WeakPolarHBondContact O-CB 3.19Å; E346-E350 WeakPolarHBondContact O-CG 3.21Å; E346-E350 PolarHBondContact O-N 2.92Å
347E41.5Very low40.2Very low31 Ų31103.2 Ų103.215%0.14550%0.502CS..Hα-helixtrans-70.8-31.3179-69.2-166.4-178.300113.1R75 R125 D344 Y345 E351R75-E347 IonicContact CZ-OE2 3.81Å; R75-E347 IonicContact NH2-OE2 3.96Å; R75-E347 PolarHBondContact NH2-OE2 2.85Å; R125-E347 IonicContact NH1-OE1 3.49Å; R125-E347 PolarHBondContact NH1-OE1 2.76Å; D344-E347 PolarHBondContact O-N 3.11Å; Y345-E347 PolarHBondContact O-N 3.02Å; E347-E351 WeakPolarHBondContact O-CB 3.5Å; E347-E351 VanDerWaalsContact O-CG 3.28Å; E347-E351 WeakPolarHBondContact O-CG 3.41Å; E347-E351 PolarHBondContact O-N 2.96Å
348E37.3Very low40Very low58 Ų5898.2 Ų98.227%0.27149%0.485SS..Hα-helixtrans-85-36.4176.7-72.9-17517000113.1R128 R339 D344 Y345 E352R128-E348 IonicContact CZ-OE1 2.77Å; R128-E348 IonicContact NH1-OE1 2.91Å; R128-E348 PolarHBondContact NH1-OE1 3.28Å; R339-E348 IonicContact CZ-OE2 3.5Å; R339-E348 IonicContact NH2-OE2 3.52Å; R339-E348 PolarHBondContact NH2-OE2 3.43Å; D344-E348 PolarHBondContact O-N 3.35Å; Y345-E348 PolarHBondContact O-N 3.43Å; E348-E352 WeakPolarHBondContact O-CG 3.45Å; E348-E352 PolarHBondContact O-N 3.17Å
349E36.7Very low40.3Very low125 Ų12596.9 Ų96.958%0.58448%0.477SS*.Hα-helixtrans-71-35.4171.2-73.3-173.4174.600111.9Y345 E352 E353Y345-E349 WeakPolarHBondContact O-CB 3.37Å; Y345-E349 PolarHBondContact O-N 3.38Å; E349-E352 PolarHBondContact O-N 3.17Å; E349-E353 WeakPolarHBondContact O-CG 3.42Å; E349-E353 PolarHBondContact O-N 3.25Å
350E46.1Very low40Very low62 Ų6295.3 Ų95.329%0.2947%0.474SS..Hα-helixtrans-68.8-32.4174.2-74.4-176.3164.600112.2R118 E346 E354R118-E350 IonicContact NH1-OE1 3.3Å; R118-E350 PolarHBondContact NH1-OE1 2.82Å; R118-E350 IonicContact NH1-OE2 2.74Å; E346-E350 WeakPolarHBondContact O-CB 3.19Å; E346-E350 WeakPolarHBondContact O-CG 3.21Å; E346-E350 PolarHBondContact O-N 2.92Å; E350-E354 WeakPolarHBondContact O-CG 3.49Å; E350-E354 PolarHBondContact O-N 3.39Å; E350-E354 VanDerWaalsContact O-N 3.11Å
351E40.4Very low40Very low88 Ų8895 Ų9541%0.41148%0.478SS..Hα-helixtrans-71.1-34.6173.6-80-176.9-172.400111.9E347 E355E347-E351 WeakPolarHBondContact O-CB 3.5Å; E347-E351 VanDerWaalsContact O-CG 3.28Å; E347-E351 WeakPolarHBondContact O-CG 3.41Å; E347-E351 PolarHBondContact O-N 2.96Å; E351-E355 PolarHBondContact O-N 3.43Å
352E37.9Very low40.1Very low139 Ų13998.8 Ų98.865%0.6549%0.491SS*.Hα-helixtrans-71.5-37.2173.3-73.1-176.4-176.500112.4E348 E349 E355 E356E348-E352 WeakPolarHBondContact O-CG 3.45Å; E348-E352 PolarHBondContact O-N 3.17Å; E349-E352 PolarHBondContact O-N 3.17Å; E352-E355 PolarHBondContact O-N 3.31Å; E352-E356 PolarHBondContact O-N 3.32Å; E352-E356 VanDerWaalsContact O-N 3.17Å
353E40.8Very low39.6Very low140 Ų140100.7 Ų100.765%0.65450%0.497SS*.Hα-helixtrans-66.3-34.1172.7-76.7-167171.400112.9E349 E356 D357E349-E353 WeakPolarHBondContact O-CG 3.42Å; E349-E353 PolarHBondContact O-N 3.25Å; E353-E356 PolarHBondContact O-N 3.21Å; E353-D357 WeakPolarHBondContact O-CB 3.06Å; E353-D357 PolarHBondContact O-N 2.99Å
354E46.2Very low39.2Very low145 Ų14599.5 Ų99.568%0.67849%0.492SS*.Hα-helixtrans-70.3-33.7176.3-79.5-169.8175.600113E350 G358E350-E354 WeakPolarHBondContact O-CG 3.49Å; E350-E354 PolarHBondContact O-N 3.39Å; E350-E354 VanDerWaalsContact O-N 3.11Å; E354-G358 PolarHBondContact O-N 3.27Å; E354-G358 VanDerWaalsContact O-N 3.11Å
355E42.7Very low39.1Very low155 Ų155101.4 Ų101.472%0.72450%0.503SS*.Hα-helixtrans-71.2-37.4172.3-76-161167.300111.9E351 E352 T359E351-E355 PolarHBondContact O-N 3.43Å; E352-E355 PolarHBondContact O-N 3.31Å; E355-T359 WeakPolarHBondContact O-CB 3.12Å; E355-T359 PolarHBondContact O-N 3.29Å; E355-T359 VanDerWaalsContact O-N 3.16Å; E355-T359 PolarHBondContact O-OG1 3.32Å
356E38.3Very low39Very low119 Ų119103.5 Ų103.556%0.55652%0.524SS*.Hα-helixtrans-68.7-44175.8-94.7-151.4-179.500113.5E352 E353 T359 K360E352-E356 PolarHBondContact O-N 3.32Å; E352-E356 VanDerWaalsContact O-N 3.17Å; E353-E356 PolarHBondContact O-N 3.21Å; E356-T359 PolarHBondContact O-N 3.09Å; E356-K360 WeakPolarHBondContact O-CG 3.39Å; E356-K360 PolarHBondContact O-N 3.38Å; E356-K360 IonicContact OE2-NZ 3.82Å; E356-K360 PolarHBondContact OE2-NZ 3.13Å
357D39.8Very low38.8Very low95 Ų95103.3 Ų103.351%0.50853%0.526SS..Hα-helixtrans-71.2-35.6179.8-164.623.9000111.4E353 T359 K360 G361E353-D357 WeakPolarHBondContact O-CB 3.06Å; E353-D357 PolarHBondContact O-N 2.99Å; D357-T359 VanDerWaalsContact C-N 3.29Å; D357-T359 PolarHBondContact O-N 2.92Å; D357-K360 PolarHBondContact O-N 3.35Å; D357-G361 PolarHBondContact O-N 2.83Å
358G40.9Very low38.6Very low42 Ų42109 Ų10943%0.43355%0.55SS..Hα-helixtrans-65.2-30.1172.900000113.8E354 K362E354-G358 PolarHBondContact O-N 3.27Å; E354-G358 VanDerWaalsContact O-N 3.11Å; G358-K362 PolarHBondContact O-N 2.95Å
359T41.8Very low38.5Very low88 Ų88112.8 Ų112.854%0.5457%0.572SS.*Hα-helixtrans-79.7-43.1176.8-49.60000111E355 E356 D357 G361 K362 E363E355-T359 WeakPolarHBondContact O-CB 3.12Å; E355-T359 PolarHBondContact O-N 3.29Å; E355-T359 VanDerWaalsContact O-N 3.16Å; E355-T359 PolarHBondContact O-OG1 3.32Å; E356-T359 PolarHBondContact O-N 3.09Å; D357-T359 VanDerWaalsContact C-N 3.29Å; D357-T359 PolarHBondContact O-N 2.92Å; T359-G361 PolarHBondContact O-N 3.06Å; T359-K362 PolarHBondContact O-N 3.21Å; T359-E363 PolarHBondContact O-N 3.47Å
360K39Very low38.3Very low115 Ų115109.7 Ų109.750%0.557%0.574SS.*Hα-helixtrans-64.3-36.3174.2-72.6170.7-174.6154.10112.7E356 D357 E363 M364E356-K360 WeakPolarHBondContact O-CG 3.39Å; E356-K360 PolarHBondContact O-N 3.38Å; E356-K360 IonicContact OE2-NZ 3.82Å; E356-K360 PolarHBondContact OE2-NZ 3.13Å; D357-K360 PolarHBondContact O-N 3.35Å; K360-E363 PolarHBondContact O-N 2.92Å; K360-M364 WeakPolarHBondContact O-CB 3.12Å; K360-M364 PolarHBondContact O-N 3.49Å
361G36Very low37.7Very low36 Ų36113.4 Ų113.437%0.37160%0.595SS.*Hα-helixtrans-65-39.2174.400000113.5D357 T359 D365D357-G361 PolarHBondContact O-N 2.83Å; T359-G361 PolarHBondContact O-N 3.06Å; G361-D365 PolarHBondContact O-N 2.9Å; G361-D365 VanDerWaalsContact O-N 3.13Å
362K40Very low37.3Very low161 Ų161112.6 Ų112.670%0.761%0.611SS**Hα-helixtrans-73-35.9175.2-84.6177.9175.9170.80113.3G358 T359 C366G358-K362 PolarHBondContact O-N 2.95Å; T359-K362 PolarHBondContact O-N 3.21Å; K362-C366 WeakPolarHBondContact O-CB 3.38Å; K362-C366 PolarHBondContact O-N 2.85Å; K362-C366 PolarHBondContact O-SG 2.95Å
363E33Very low37.1Very low132 Ų132110.5 Ų110.562%0.61762%0.617SS**Hα-helixtrans-66.5-40.3175.3-120.6177.5174.800111.6T359 K360 C366 L367T359-E363 PolarHBondContact O-N 3.47Å; K360-E363 PolarHBondContact O-N 2.92Å; E363-C366 PolarHBondContact O-N 3.48Å; E363-L367 PolarHBondContact O-N 2.83Å
364M32.8Very low37.1Very low126 Ų126112 Ų11262%0.62162%0.624SS**Hα-helixtrans-72.9-30.1178-165.3151.461.200113.2K360 K368K360-M364 WeakPolarHBondContact O-CB 3.12Å; K360-M364 PolarHBondContact O-N 3.49Å; M364-K368 PolarHBondContact O-N 2.78Å; M364-K368 VanDerWaalsContact O-N 3.16Å
365D36.6Very low36.5Very low103 Ų103116.3 Ų116.355%0.55163%0.634SS**Hα-helixtrans-74.8-33.7171-109.85.8000112.7G361 N369G361-D365 PolarHBondContact O-N 2.9Å; G361-D365 VanDerWaalsContact O-N 3.13Å; D365-N369 PolarHBondContact O-N 3.09Å; D365-N369 PolarHBondContact O-ND2 2.86Å
366C35.1Very low35.9Very low95 Ų95117.4 Ų117.464%0.64264%0.639SS**Hα-helixtrans-67.5-37.7171.7-73.90000112K362 E363 N369 G370K362-C366 WeakPolarHBondContact O-CB 3.38Å; K362-C366 PolarHBondContact O-N 2.85Å; K362-C366 PolarHBondContact O-SG 2.95Å; E363-C366 PolarHBondContact O-N 3.48Å; C366-N369 PolarHBondContact O-N 3Å; C366-G370 PolarHBondContact O-N 3.33Å
367L32.9Very low35.6Very low114 Ų114120.1 Ų120.160%0.59766%0.657SS**Hα-helixtrans-69.3-34.5176.3-109.1122.7000113.1E363 G370 L371E363-L367 PolarHBondContact O-N 2.83Å; L367-G370 PolarHBondContact O-N 3.28Å; L367-L371 HydrophobicContact CD2-CD1 4.29Å; L367-L371 PolarHBondContact O-N 3.16Å
368K36.5Very low35.2Very low150 Ų150122.8 Ų122.865%0.65267%0.669SS**Hα-helixtrans-70.7-32.3175.6-87179.8175.4174.60113.4M364M364-K368 PolarHBondContact O-N 2.78Å; M364-K368 VanDerWaalsContact O-N 3.16Å
369N36.1Very low35.3Very low138 Ų138126.1 Ų126.174%0.73868%0.683SS**Hα-helixtrans-80.7-16.1177.2-70.7-24.9000113.6D365 C366D365-N369 PolarHBondContact O-N 3.09Å; D365-N369 PolarHBondContact O-ND2 2.86Å; C366-N369 PolarHBondContact O-N 3Å
370G31.8Very low34.8Very low61 Ų61130 Ų13063%0.62970%0.701SS**Hα-helixtrans-86.6-21.4174.600000115.3C366 L367C366-G370 PolarHBondContact O-N 3.33Å; L367-G370 PolarHBondContact O-N 3.28Å
371L32.5Very low34.3Very low139 Ų139127.5 Ų127.573%0.72871%0.708SS**SBendtrans-97.84.5-175.3-91.8148.5000114.5L367L367-L371 HydrophobicContact CD2-CD1 4.29Å; L367-L371 PolarHBondContact O-N 3.16Å
372G32.8Very low34Very low72 Ų72134.1 Ų134.174%0.74273%0.729SS**SBendtrans-94.91-178.500000116.3
373A34.7Very low33.5Very low95 Ų95133.8 Ų133.879%0.78573%0.729SS**SBendtrans-110.68.2-171.700000115.8
374E39.9Very low33.4Very low171 Ų171132.2 Ų132.280%0.79973%0.733SS**  trans-132101.5169.5-86.3-165.715600110.7
375R32.7Very low33.5Very low236 Ų236136.2 Ų136.289%0.89177%0.771SS**  trans163.295.4134.7-88.3168-147.3-166.36.7109.9
376H31.1Very low33.3Very low177 Ų177137.9 Ų137.982%0.81978%0.782SS**  trans-156.679.7143.3-109.1-70.6000109.8
377L30.8Very low33.3Very low177 Ų177140.2 Ų140.293%0.92779%0.789SS**  trans-135.698.4152.4-76.1174.1000106.9
378I32.8Very low33.3Very low151 Ų151141.6 Ų141.677%0.77480%0.8SS**  trans-104146.1165.9-76.2-175.2000107.1
379P43.2Very low33.1Very low112 Ų112141.1 Ų141.173%0.72781%0.809SS**  trans-97.3164.7-152.436.8-28.4000111.9
380N30Very low32.9Very low170 Ų170141.3 Ų141.391%0.90981%0.813SS**  trans-148.9112155.6-134.1-0.5000112.7
381G29.8Very low33Very low62 Ų62146.7 Ų146.764%0.63983%0.826SS**  44.9119127.800000121.8
382Q29.4Very low33Very low175 Ų175147.2 Ų147.282%0.81883%0.833SS**  96.4130.3128.7-74.3-175.9-27.100120.9
383H29.3Very low33Very low154 Ų154153 Ų15371%0.71384%0.839SS**  trans108.8108135-90.2-57.1000119.5
384S31.1Very low32.9Very low99 Ų99157.8 Ų157.869%0.69284%0.844SS**  101.8122.9125.4-53.40000119.3
385C34.3Very low32.2Very low210 Ų210156.6 Ų156.6100%1.41985%0.848SS**  trans75.60159-71.20000119

Retrieved 385 of 385 residues in 582.3 ms (Link to these results)

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