A0A087Y8F3_POEFO Loading...

Si:dkey-166k12.1

AlphaFold DB , UniProt , Accession A0A087Y8F3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 536 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
1M50.6Low71.5Confident88 Ų8845.4 Ų45.443%0.43327%0.274SS..  0134.40-84.9176.8137.400107.8Q5 L297M1-Q5 HydrophobicContact CB-CB 4.44Å; M1-Q5 HydrophobicContact CG-CB 4.49Å; M1-L297 WeakPolarHBondContact O-CD2 3.26Å; M1-L297 WeakPolarHBondContact O-CG 3.42Å
2N66.4Low72.3Confident91 Ų9142.5 Ų42.549%0.48726%0.26SS..  trans-80.8155.4170.5-81.4-10.3000110.1D4 Q5 I6N2-D4 PolarHBondContact O-N 3Å; N2-D4 VanDerWaalsContact O-N 3.09Å; N2-Q5 WeakPolarHBondContact O-CA 3.47Å; N2-Q5 WeakPolarHBondContact O-CB 3.42Å; N2-Q5 PolarHBondContact O-N 2.85Å; N2-I6 PolarHBondContact O-N 2.88Å
3F70.3Confident72.8Confident24 Ų2442.5 Ų42.511%0.10525%0.254CS..Hα-helixtrans-54.9-32.9-178.3-178.9-89.9000112.2Q5 I6 L7 E200 A260 R261 L264F3-Q5 VanDerWaalsContact C-N 3.3Å; F3-Q5 PolarHBondContact O-N 2.68Å; F3-I6 WeakPolarHBondContact O-CB 3.3Å; F3-I6 PolarHBondContact O-N 2.84Å; F3-I6 VanDerWaalsContact O-N 3.14Å; F3-L7 HydrophobicContact CD1-CD1 3.75Å; F3-L7 HydrophobicContact CD1-CG 4.07Å; F3-L7 HydrophobicContact CE1-CD1 3.43Å; F3-L7 VanDerWaalsContact CE1-CD1 3.43Å; F3-L7 HydrophobicContact CE1-CD2 4.32Å; F3-L7 HydrophobicContact CE1-CG 3.69Å; F3-L7 HydrophobicContact CZ-CD1 4.45Å; F3-L7 HydrophobicContact CZ-CG 4.34Å; F3-L7 PolarHBondContact O-N 3.35Å; F3-E200 WeakPolarHBondContact CE1-O 3.27Å; F3-A260 HydrophobicContact CE2-CB 3.93Å; F3-A260 HydrophobicContact CZ-CB 3.87Å; F3-R261 HydrophobicContact CD1-CG 3.76Å; F3-R261 HydrophobicContact CD2-CG 3.84Å; F3-R261 HydrophobicContact CE1-CG 3.51Å; F3-R261 HydrophobicContact CE2-CG 3.65Å; F3-R261 HydrophobicContact CG-CG 3.88Å; F3-R261 HydrophobicContact CZ-CG 3.48Å; F3-R261 VanDerWaalsContact CZ-CG 3.48Å; F3-L264 HydrophobicContact CD2-CD1 3.88Å; F3-L264 HydrophobicContact CE2-CD1 4Å
4D71.3Confident73.5Confident49 Ų4940.4 Ų40.426%0.26225%0.246SC..Hα-helixtrans-67.1-28.9176.7-65.6-26.2000113.2N2 A8 T204 R207 R261N2-D4 PolarHBondContact O-N 3Å; N2-D4 VanDerWaalsContact O-N 3.09Å; D4-A8 WeakPolarHBondContact O-CB 3.4Å; D4-A8 PolarHBondContact O-N 3.03Å; D4-T204 PolarHBondContact OD2-OG1 3.2Å; D4-R207 VanDerWaalsContact CG-NH2 3.34Å; D4-R207 IonicContact OD1-NH2 2.74Å; D4-R207 PolarHBondContact OD1-NH2 3.27Å; D4-R207 IonicContact OD2-NH2 3.14Å; D4-R207 PolarHBondContact OD2-NH2 3.38Å; D4-R261 IonicContact OD1-NH2 3.27Å; D4-R261 PolarHBondContact OD1-NH2 2.71Å
5Q72.4Confident74.4Confident103 Ų10347.9 Ų47.948%0.48127%0.274SS..Hα-helixtrans-72.5-32.9172.5-65.8173.3-25.200111.4M1 N2 F3 A8 A9M1-Q5 HydrophobicContact CB-CB 4.44Å; M1-Q5 HydrophobicContact CG-CB 4.49Å; N2-Q5 WeakPolarHBondContact O-CA 3.47Å; N2-Q5 WeakPolarHBondContact O-CB 3.42Å; N2-Q5 PolarHBondContact O-N 2.85Å; F3-Q5 VanDerWaalsContact C-N 3.3Å; F3-Q5 PolarHBondContact O-N 2.68Å; Q5-A8 PolarHBondContact O-N 3.36Å; Q5-A9 WeakPolarHBondContact O-CB 3.29Å; Q5-A9 PolarHBondContact O-N 3.27Å
6I75.4Confident75.2Confident2 Ų246.6 Ų46.61%0.0126%0.264CS..Hα-helixtrans-67.6-45.7172.3-61.7-170.5000110.2N2 F3 A8 A9 I10 L276 P289 I294 L297N2-I6 PolarHBondContact O-N 2.88Å; F3-I6 WeakPolarHBondContact O-CB 3.3Å; F3-I6 PolarHBondContact O-N 2.84Å; F3-I6 VanDerWaalsContact O-N 3.14Å; I6-A8 VanDerWaalsContact C-N 3.28Å; I6-A8 PolarHBondContact O-N 3.27Å; I6-A9 PolarHBondContact O-N 2.74Å; I6-A9 VanDerWaalsContact O-N 3.13Å; I6-I10 WeakPolarHBondContact O-CG1 3.35Å; I6-I10 PolarHBondContact O-N 2.69Å; I6-L276 HydrophobicContact CG2-CD1 4.18Å; I6-L276 HydrophobicContact CG2-CD2 4.4Å; I6-P289 HydrophobicContact CG2-CB 4.29Å; I6-P289 HydrophobicContact CG2-CG 4.21Å; I6-I294 HydrophobicContact CD1-CG1 4.22Å; I6-L297 HydrophobicContact CD1-CD1 3.28Å; I6-L297 HydrophobicContact CD1-CG 4.4Å; I6-L297 HydrophobicContact CG1-CD1 4.36Å
7L77.8Confident75.9Confident0 Ų044.1 Ų44.10%025%0.249CC..Hα-helixtrans-57-43.2173.7-81.7173.2000111.7F3 I10 G12F3-L7 HydrophobicContact CD1-CD1 3.75Å; F3-L7 HydrophobicContact CD1-CG 4.07Å; F3-L7 HydrophobicContact CE1-CD1 3.43Å; F3-L7 VanDerWaalsContact CE1-CD1 3.43Å; F3-L7 HydrophobicContact CE1-CD2 4.32Å; F3-L7 HydrophobicContact CE1-CG 3.69Å; F3-L7 HydrophobicContact CZ-CD1 4.45Å; F3-L7 HydrophobicContact CZ-CG 4.34Å; F3-L7 PolarHBondContact O-N 3.35Å; L7-I10 HydrophobicContact CD2-CD1 4.08Å; L7-I10 VanDerWaalsContact O-CG1 3.24Å; L7-I10 WeakPolarHBondContact O-CG1 3.3Å; L7-I10 PolarHBondContact O-N 3.44Å; L7-G12 VanDerWaalsContact O-CA 3.26Å; L7-G12 WeakPolarHBondContact O-CA 3.38Å; L7-G12 PolarHBondContact O-N 3.42Å
8A77.6Confident76.5Confident61 Ų6147.9 Ų47.950%0.50426%0.263SS..Hα-helixtrans-62.2-42.6175.100000112D4 Q5 I6 I10 G11D4-A8 WeakPolarHBondContact O-CB 3.4Å; D4-A8 PolarHBondContact O-N 3.03Å; Q5-A8 PolarHBondContact O-N 3.36Å; I6-A8 VanDerWaalsContact C-N 3.28Å; I6-A8 PolarHBondContact O-N 3.27Å; A8-I10 VanDerWaalsContact C-N 3.34Å; A8-I10 PolarHBondContact O-N 3.31Å; A8-G11 PolarHBondContact O-N 3.22Å
9A75.6Confident77.1Confident51 Ų5150.1 Ų50.142%0.42127%0.273SS..Hα-helixtrans-65.1-32.917900000113.4Q5 I6 G11Q5-A9 WeakPolarHBondContact O-CB 3.29Å; Q5-A9 PolarHBondContact O-N 3.27Å; I6-A9 PolarHBondContact O-N 2.74Å; I6-A9 VanDerWaalsContact O-N 3.13Å; A9-G11 PolarHBondContact O-N 2.84Å
10I75.8Confident77.6Confident1 Ų148.1 Ų48.11%0.00526%0.262CS..THydrogen-bonded Turntrans-84.314177.368.1174.9000113.7I6 L7 A8 L276 A279 A280 N283I6-I10 WeakPolarHBondContact O-CG1 3.35Å; I6-I10 PolarHBondContact O-N 2.69Å; L7-I10 HydrophobicContact CD2-CD1 4.08Å; L7-I10 VanDerWaalsContact O-CG1 3.24Å; L7-I10 WeakPolarHBondContact O-CG1 3.3Å; L7-I10 PolarHBondContact O-N 3.44Å; A8-I10 VanDerWaalsContact C-N 3.34Å; A8-I10 PolarHBondContact O-N 3.31Å; I10-L276 HydrophobicContact CD1-CD2 3.96Å; I10-A279 HydrophobicContact CD1-CB 4.13Å; I10-A280 HydrophobicContact CB-CB 4.02Å; I10-A280 HydrophobicContact CG2-CB 3.95Å; I10-N283 WeakPolarHBondContact O-CB 3.28Å; I10-N283 PolarHBondContact O-ND2 2.92Å
11G72.9Confident78Confident29 Ų2946.3 Ų46.330%0.29925%0.252SS..THydrogen-bonded Turntrans1029.2176.900000115.4A8 A9 F13 G14A8-G11 PolarHBondContact O-N 3.22Å; A9-G11 PolarHBondContact O-N 2.84Å; G11-F13 PolarHBondContact O-N 3.28Å; G11-G14 PolarHBondContact O-N 2.97Å
12G81Confident79.8Confident11 Ų1147.4 Ų47.411%0.11326%0.258CS..SBendtrans62.2-126.5174.200000113.1L7 G14 Q17 C203L7-G12 VanDerWaalsContact O-CA 3.26Å; L7-G12 WeakPolarHBondContact O-CA 3.38Å; L7-G12 PolarHBondContact O-N 3.42Å; G12-G14 PolarHBondContact O-N 3.38Å; G12-Q17 WeakPolarHBondContact O-CG 3.22Å; G12-Q17 PolarHBondContact O-NE2 3.18Å; G12-Q17 PolarHBondContact O-OE1 3.45Å; G12-C203 VanDerWaalsContact CA-SG 3.6Å
13F79.6Confident80.8Confident42 Ų4246.9 Ų46.918%0.18425%0.249CC..SBendtrans-84.862.6174.7-163.8-111.5000111G11 Q17 K18 T202G11-F13 PolarHBondContact O-N 3.28Å; F13-Q17 HydrophobicContact CD2-CB 3.78Å; F13-Q17 HydrophobicContact CE2-CB 4.11Å; F13-Q17 HydrophobicContact CG-CB 4.5Å; F13-K18 HydrophobicContact CD1-CG 3.93Å; F13-K18 HydrophobicContact CE1-CD 4.48Å; F13-K18 HydrophobicContact CE1-CG 3.58Å; F13-K18 HydrophobicContact CZ-CG 4.05Å; F13-K18 WeakPolarHBondContact O-CE 3.45Å; F13-T202 HydrophobicContact CD2-CG2 3.81Å; F13-T202 HydrophobicContact CE2-CG2 3.59Å
14G82.8Confident81.6Confident14 Ų1445.9 Ų45.914%0.14425%0.245CC..  trans-80.8-168.8-177.800000114G11 G12 Y16 Q17 K18 N283G11-G14 PolarHBondContact O-N 2.97Å; G12-G14 PolarHBondContact O-N 3.38Å; G14-Y16 VanDerWaalsContact C-N 3.33Å; G14-Y16 PolarHBondContact O-N 3.49Å; G14-Q17 PolarHBondContact O-N 3.4Å; G14-K18 WeakPolarHBondContact O-CG 3.33Å; G14-K18 PolarHBondContact O-N 2.84Å; G14-N283 WeakPolarHBondContact CA-OD1 3.43Å
15K86.6Confident82.4Confident152 Ų15244 Ų4466%0.66124%0.235SC*.Hα-helixtrans-58.3-42.8-178.2-68.3-175.8-179.61790112.1Q17 K18 I19 V282 N283K15-Q17 PolarHBondContact O-N 2.94Å; K15-K18 PolarHBondContact O-N 2.97Å; K15-I19 VanDerWaalsContact O-CG1 3.29Å; K15-I19 WeakPolarHBondContact O-CG1 3.24Å; K15-I19 PolarHBondContact O-N 3.05Å; K15-V282 HydrophobicContact CB-CG1 4.46Å; K15-N283 PolarHBondContact N-OD1 2.63Å
16Y86.6Confident83.1Confident28 Ų2842.4 Ų42.411%0.1123%0.23CC..Hα-helixtrans-60.2-48.8179.5-178.5-95.3000111.7G14 K18 I19 L20 W201 P257 A279 V282 N283G14-Y16 VanDerWaalsContact C-N 3.33Å; G14-Y16 PolarHBondContact O-N 3.49Å; Y16-K18 PolarHBondContact O-N 3.4Å; Y16-I19 PolarHBondContact O-N 3.41Å; Y16-L20 HydrophobicContact CE1-CD2 4.27Å; Y16-L20 VanDerWaalsContact O-CB 3.31Å; Y16-L20 WeakPolarHBondContact O-CB 3.39Å; Y16-L20 PolarHBondContact O-N 3.14Å; Y16-W201 HydrophobicContact CD1-CE3 4.26Å; Y16-W201 HydrophobicContact CD1-CZ3 4.09Å; Y16-W201 HydrophobicContact CE1-CD2 4.37Å; Y16-W201 AromaticContact CE1-CE3 3.8Å; Y16-W201 HydrophobicContact CE1-CE3 3.8Å; Y16-W201 AromaticContact CE1-CH2 3.77Å; Y16-W201 HydrophobicContact CE1-CH2 3.77Å; Y16-W201 HydrophobicContact CE1-CZ2 4.33Å; Y16-W201 AromaticContact CE1-CZ3 3.48Å; Y16-W201 HydrophobicContact CE1-CZ3 3.48Å; Y16-W201 VanDerWaalsContact CE1-CZ3 3.48Å; Y16-P257 WeakPolarHBondContact OH-CB 3.38Å; Y16-A279 HydrophobicContact CD1-CB 3.64Å; Y16-A279 HydrophobicContact CD2-CB 4.44Å; Y16-A279 HydrophobicContact CE1-CB 3.87Å; Y16-A279 HydrophobicContact CG-CB 3.94Å; Y16-V282 HydrophobicContact CD2-CB 4.16Å; Y16-V282 HydrophobicContact CD2-CG1 4.2Å; Y16-V282 HydrophobicContact CD2-CG2 4.24Å; Y16-N283 WeakPolarHBondContact CB-OD1 3.36Å; Y16-N283 PolarHBondContact N-OD1 3.38Å
17Q87.3Confident83.6Confident3 Ų342.5 Ų42.51%0.01423%0.231CC..Hα-helixtrans-63.6-42.3179.9-69.478.11.800111.2G12 F13 G14 K15 L20 Y21 W201 N283G12-Q17 WeakPolarHBondContact O-CG 3.22Å; G12-Q17 PolarHBondContact O-NE2 3.18Å; G12-Q17 PolarHBondContact O-OE1 3.45Å; F13-Q17 HydrophobicContact CD2-CB 3.78Å; F13-Q17 HydrophobicContact CE2-CB 4.11Å; F13-Q17 HydrophobicContact CG-CB 4.5Å; G14-Q17 PolarHBondContact O-N 3.4Å; K15-Q17 PolarHBondContact O-N 2.94Å; Q17-L20 PolarHBondContact O-N 2.76Å; Q17-Y21 VanDerWaalsContact O-CB 3.32Å; Q17-Y21 WeakPolarHBondContact O-CB 3.37Å; Q17-Y21 PolarHBondContact O-N 3.16Å; Q17-W201 VanDerWaalsContact CG-O 3.24Å; Q17-W201 WeakPolarHBondContact CG-O 3.32Å; Q17-N283 PolarHBondContact NE2-ND2 2.86Å; Q17-N283 PolarHBondContact OE1-ND2 2.76Å; Q17-N283 PolarHBondContact OE1-OD1 3.07Å
18K87.4Confident84.1Confident113 Ų11343 Ų4349%0.49123%0.233SC..Hα-helixtrans-62.2-48.1177.3-71.8175.8-176.7-174.30112.3F13 G14 K15 Y16 Y21 I22F13-K18 HydrophobicContact CD1-CG 3.93Å; F13-K18 HydrophobicContact CE1-CD 4.48Å; F13-K18 HydrophobicContact CE1-CG 3.58Å; F13-K18 HydrophobicContact CZ-CG 4.05Å; F13-K18 WeakPolarHBondContact O-CE 3.45Å; G14-K18 WeakPolarHBondContact O-CG 3.33Å; G14-K18 PolarHBondContact O-N 2.84Å; K15-K18 PolarHBondContact O-N 2.97Å; Y16-K18 PolarHBondContact O-N 3.4Å; K18-Y21 WeakPolarHBondContact O-CB 3.45Å; K18-Y21 PolarHBondContact O-N 2.99Å; K18-I22 WeakPolarHBondContact O-CG1 2.91Å; K18-I22 PolarHBondContact O-N 3.49Å
19I88.3Confident84.7Confident90 Ų9041.8 Ų41.846%0.46222%0.217SC..Hα-helixtrans-61-47.9177.9-67.9166000109.9K15 Y16 Y21 I22 W23K15-I19 VanDerWaalsContact O-CG1 3.29Å; K15-I19 WeakPolarHBondContact O-CG1 3.24Å; K15-I19 PolarHBondContact O-N 3.05Å; Y16-I19 PolarHBondContact O-N 3.41Å; I19-Y21 VanDerWaalsContact C-N 3.26Å; I19-Y21 PolarHBondContact O-N 2.95Å; I19-I22 PolarHBondContact O-N 2.92Å; I19-W23 PolarHBondContact O-N 3.48Å
20L86.9Confident85.4Confident10 Ų1040.4 Ų40.45%0.05220%0.203CC..Hα-helixtrans-58.4-40.5176.817859.9000111.9Y16 Q17 W23 I24 W201 L256 P257Y16-L20 HydrophobicContact CE1-CD2 4.27Å; Y16-L20 VanDerWaalsContact O-CB 3.31Å; Y16-L20 WeakPolarHBondContact O-CB 3.39Å; Y16-L20 PolarHBondContact O-N 3.14Å; Q17-L20 PolarHBondContact O-N 2.76Å; L20-W23 PolarHBondContact O-N 3.35Å; L20-I24 HydrophobicContact CD1-CD1 4.04Å; L20-I24 HydrophobicContact CD1-CG1 4.28Å; L20-I24 HydrophobicContact CD2-CD1 4.44Å; L20-I24 HydrophobicContact CG-CD1 3.84Å; L20-I24 HydrophobicContact CG-CG1 4.46Å; L20-I24 WeakPolarHBondContact O-CG1 3.25Å; L20-I24 PolarHBondContact O-N 3.36Å; L20-W201 HydrophobicContact CD2-CB 3.91Å; L20-W201 HydrophobicContact CD2-CD2 3.8Å; L20-W201 HydrophobicContact CD2-CG 3.47Å; L20-W201 VanDerWaalsContact CD2-CG 3.47Å; L20-L256 HydrophobicContact CD1-CD2 4.35Å; L20-P257 HydrophobicContact CD1-CG 3.71Å; L20-P257 HydrophobicContact CD2-CG 3.75Å; L20-P257 HydrophobicContact CG-CG 4.39Å
21Y86.2Confident86.1Confident11 Ų1140.5 Ų40.54%0.04320%0.203CC..Hα-helixtrans-63.7-44.2180-148-99.1000112.2Q17 K18 I19 W23 I24 C25 T202 A210 I213 T214Q17-Y21 VanDerWaalsContact O-CB 3.32Å; Q17-Y21 WeakPolarHBondContact O-CB 3.37Å; Q17-Y21 PolarHBondContact O-N 3.16Å; K18-Y21 WeakPolarHBondContact O-CB 3.45Å; K18-Y21 PolarHBondContact O-N 2.99Å; I19-Y21 VanDerWaalsContact C-N 3.26Å; I19-Y21 PolarHBondContact O-N 2.95Å; Y21-W23 VanDerWaalsContact C-N 3.26Å; Y21-W23 PolarHBondContact O-N 2.78Å; Y21-I24 PolarHBondContact O-N 2.96Å; Y21-C25 VanDerWaalsContact CD1-SG 3.58Å; Y21-C25 VanDerWaalsContact CE1-SG 3.51Å; Y21-C25 PolarHBondContact O-N 3.19Å; Y21-C25 PolarHBondContact O-SG 3.26Å; Y21-T202 HydrophobicContact CD2-CG2 4.23Å; Y21-T202 HydrophobicContact CE2-CG2 4.26Å; Y21-A210 HydrophobicContact CE1-CB 4.22Å; Y21-A210 WeakPolarHBondContact CE1-O 3.39Å; Y21-A210 HydrophobicContact CE2-CB 3.7Å; Y21-A210 VanDerWaalsContact CZ-O 3.28Å; Y21-A210 WeakPolarHBondContact OH-CA 3.41Å; Y21-A210 WeakPolarHBondContact OH-CB 3.3Å; Y21-A210 PolarHBondContact OH-O 3.19Å; Y21-I213 HydrophobicContact CD1-CG2 4.1Å; Y21-I213 HydrophobicContact CE1-CB 3.97Å; Y21-I213 HydrophobicContact CE1-CG2 3.9Å; Y21-T214 PolarHBondContact OH-OG1 2.69Å
22I87.6Confident87Confident111 Ų11139.1 Ų39.157%0.56919%0.189SC*.Hα-helixtrans-55.6-45.2174.8-67.1165.1000110.4K18 I19 I24 C25 L26K18-I22 WeakPolarHBondContact O-CG1 2.91Å; K18-I22 PolarHBondContact O-N 3.49Å; I19-I22 PolarHBondContact O-N 2.92Å; I22-I24 PolarHBondContact O-N 2.92Å; I22-C25 PolarHBondContact O-N 3.39Å; I22-L26 PolarHBondContact O-N 2.85Å
23W88.1Confident87.5Confident80 Ų8039.5 Ų39.530%0.30319%0.188SC..Hα-helixtrans-64.6-37.6176.4-69.1115.8000112.9I19 L20 Y21 C25 L26 P27 F251 Y252 V255I19-W23 PolarHBondContact O-N 3.48Å; L20-W23 PolarHBondContact O-N 3.35Å; Y21-W23 VanDerWaalsContact C-N 3.26Å; Y21-W23 PolarHBondContact O-N 2.78Å; W23-C25 VanDerWaalsContact C-N 3.31Å; W23-C25 PolarHBondContact O-N 3.1Å; W23-L26 HydrophobicContact CE3-CD1 3.62Å; W23-L26 HydrophobicContact CZ3-CD1 3.75Å; W23-P27 WeakPolarHBondContact O-CD 3.09Å; W23-F251 AromaticContact CE3-CE2 3.63Å; W23-F251 HydrophobicContact CE3-CE2 3.63Å; W23-F251 AromaticContact CE3-CZ 3.94Å; W23-F251 HydrophobicContact CE3-CZ 3.94Å; W23-F251 AromaticContact CH2-CE2 3.76Å; W23-F251 HydrophobicContact CH2-CE2 3.76Å; W23-F251 HydrophobicContact CH2-CZ 4.06Å; W23-F251 HydrophobicContact CZ3-CD2 4.43Å; W23-F251 AromaticContact CZ3-CE2 3.21Å; W23-F251 HydrophobicContact CZ3-CE2 3.21Å; W23-F251 AromaticContact CZ3-CZ 3.3Å; W23-F251 HydrophobicContact CZ3-CZ 3.3Å; W23-Y252 HydrophobicContact CE3-CE2 4.26Å; W23-Y252 WeakPolarHBondContact O-CE1 3.17Å; W23-Y252 VanDerWaalsContact O-CZ 3.31Å; W23-Y252 PolarHBondContact O-OH 3.25Å; W23-V255 HydrophobicContact CB-CG1 4Å; W23-V255 VanDerWaalsContact CD1-CG1 3.47Å; W23-V255 HydrophobicContact CD2-CG1 3.7Å; W23-V255 HydrophobicContact CE3-CG1 4.46Å; W23-V255 HydrophobicContact CG-CG1 3.46Å; W23-V255 VanDerWaalsContact CG-CG1 3.46Å
24I86.7Confident88.1Confident3 Ų337.7 Ų37.72%0.01518%0.18CC..Hα-helixtrans-69.7-28.9176.9-70.1172000112L20 Y21 I22 P27 A194 L197 L256L20-I24 HydrophobicContact CD1-CD1 4.04Å; L20-I24 HydrophobicContact CD1-CG1 4.28Å; L20-I24 HydrophobicContact CD2-CD1 4.44Å; L20-I24 HydrophobicContact CG-CD1 3.84Å; L20-I24 HydrophobicContact CG-CG1 4.46Å; L20-I24 WeakPolarHBondContact O-CG1 3.25Å; L20-I24 PolarHBondContact O-N 3.36Å; Y21-I24 PolarHBondContact O-N 2.96Å; I22-I24 PolarHBondContact O-N 2.92Å; I24-P27 WeakPolarHBondContact O-CD 2.95Å; I24-A194 HydrophobicContact CG2-CB 4.13Å; I24-A194 VanDerWaalsContact CG2-O 3.29Å; I24-A194 WeakPolarHBondContact CG2-O 3.45Å; I24-L197 HydrophobicContact CD1-CB 4.41Å; I24-L197 HydrophobicContact CD1-CD2 4.28Å; I24-L197 HydrophobicContact CD1-CG 4.11Å; I24-L256 HydrophobicContact CG1-CD2 4.12Å
25C86.9Confident88.5Confident8 Ų837.1 Ų37.15%0.05417%0.174CC..Hα-helixtrans-74.2-38.1178.5-70.20000112.9Y21 I22 W23 Q28 T217Y21-C25 VanDerWaalsContact CD1-SG 3.58Å; Y21-C25 VanDerWaalsContact CE1-SG 3.51Å; Y21-C25 PolarHBondContact O-N 3.19Å; Y21-C25 PolarHBondContact O-SG 3.26Å; I22-C25 PolarHBondContact O-N 3.39Å; W23-C25 VanDerWaalsContact C-N 3.31Å; W23-C25 PolarHBondContact O-N 3.1Å; C25-Q28 WeakPolarHBondContact O-CA 3.47Å; C25-Q28 WeakPolarHBondContact O-CB 3.44Å; C25-Q28 VanDerWaalsContact O-CG 3.3Å; C25-Q28 WeakPolarHBondContact O-CG 3.43Å; C25-Q28 PolarHBondContact O-N 3.43Å; C25-T217 HydrophobicContact CB-CG2 4.06Å; C25-T217 WeakPolarHBondContact O-CG2 3.4Å
26L87.6Confident88.8Confident70 Ų7029.9 Ų29.937%0.36614%0.142SC..Hα-helixtrans-53.5-43.7-176-80.4171.5000115.2I22 W23 Q28 I29 Y252I22-L26 PolarHBondContact O-N 2.85Å; W23-L26 HydrophobicContact CE3-CD1 3.62Å; W23-L26 HydrophobicContact CZ3-CD1 3.75Å; L26-Q28 PolarHBondContact O-N 2.68Å; L26-Q28 VanDerWaalsContact O-N 3.16Å; L26-I29 HydrophobicContact CD2-CD1 4.3Å; L26-I29 WeakPolarHBondContact O-CB 3.33Å; L26-I29 PolarHBondContact O-N 2.96Å; L26-I29 VanDerWaalsContact O-N 3.12Å; L26-Y252 WeakPolarHBondContact CB-OH 2.96Å
27P87.2Confident89Confident5 Ų528.6 Ų28.63%0.03214%0.137CC..Hα-helixtrans-62.7-19.9175.5-24.335.5000113.9W23 I24 I29 L30 L31 I157 V190 L249 Y252W23-P27 WeakPolarHBondContact O-CD 3.09Å; I24-P27 WeakPolarHBondContact O-CD 2.95Å; P27-I29 PolarHBondContact O-N 3.46Å; P27-L30 PolarHBondContact O-N 3.36Å; P27-L31 WeakPolarHBondContact O-CB 3.49Å; P27-L31 PolarHBondContact O-N 3.28Å; P27-I157 HydrophobicContact CB-CD1 4.45Å; P27-I157 HydrophobicContact CG-CD1 4.39Å; P27-V190 HydrophobicContact CB-CG1 4.35Å; P27-L249 HydrophobicContact CB-CD1 4.47Å; P27-Y252 WeakPolarHBondContact CD-OH 3.39Å; P27-Y252 HydrophobicContact CG-CD1 4.34Å; P27-Y252 HydrophobicContact CG-CE1 3.53Å
28Q87.3Confident89.1Confident10 Ų1029 Ų295%0.04714%0.14CC..Hα-helixtrans-67.9-26.2176.4-55.1-65.9-26.800112.2C25 L26 L31 A32 T214 T217C25-Q28 WeakPolarHBondContact O-CA 3.47Å; C25-Q28 WeakPolarHBondContact O-CB 3.44Å; C25-Q28 VanDerWaalsContact O-CG 3.3Å; C25-Q28 WeakPolarHBondContact O-CG 3.43Å; C25-Q28 PolarHBondContact O-N 3.43Å; L26-Q28 PolarHBondContact O-N 2.68Å; L26-Q28 VanDerWaalsContact O-N 3.16Å; Q28-L31 WeakPolarHBondContact O-CB 3.3Å; Q28-L31 PolarHBondContact O-N 3.42Å; Q28-A32 PolarHBondContact O-N 2.96Å; Q28-T214 HydrophobicContact CG-CG2 3.61Å; Q28-T217 HydrophobicContact CB-CG2 4.26Å
29I90.3Very high89.3Confident35 Ų3524.1 Ų24.118%0.17912%0.119CC..Hα-helixtrans-64.7-50.8174.1-57.4-177.5000109.4L26 P27 L31 A32 F33 T217 L224L26-I29 HydrophobicContact CD2-CD1 4.3Å; L26-I29 WeakPolarHBondContact O-CB 3.33Å; L26-I29 PolarHBondContact O-N 2.96Å; L26-I29 VanDerWaalsContact O-N 3.12Å; P27-I29 PolarHBondContact O-N 3.46Å; I29-L31 VanDerWaalsContact C-N 3.27Å; I29-L31 PolarHBondContact O-N 3.01Å; I29-A32 WeakPolarHBondContact O-CB 3.49Å; I29-A32 PolarHBondContact O-N 3.27Å; I29-F33 HydrophobicContact CG2-CE1 3.99Å; I29-F33 HydrophobicContact CG2-CZ 3.91Å; I29-F33 WeakPolarHBondContact O-CD1 3.34Å; I29-F33 PolarHBondContact O-N 2.94Å; I29-F33 VanDerWaalsContact O-N 3.13Å; I29-T217 HydrophobicContact CD1-CG2 3.98Å; I29-T217 HydrophobicContact CG1-CG2 3.41Å; I29-T217 VanDerWaalsContact CG1-CG2 3.41Å; I29-L224 HydrophobicContact CG2-CD1 4.06Å
30L89.6Confident89.4Confident22 Ų2220 Ų2012%0.11510%0.098CC..Hα-helixtrans-64.6-35.3177.3-61.9-172.3000111.7P27 A32 F33 H34 P245 L249P27-L30 PolarHBondContact O-N 3.36Å; L30-A32 VanDerWaalsContact C-N 3.34Å; L30-A32 PolarHBondContact O-N 2.99Å; L30-F33 HydrophobicContact CD2-CD2 3.87Å; L30-F33 HydrophobicContact CD2-CE2 4Å; L30-F33 WeakPolarHBondContact O-CB 3.25Å; L30-F33 PolarHBondContact O-N 3.12Å; L30-H34 PolarHBondContact O-CD2 3.41Å; L30-H34 VanDerWaalsContact O-CD2 3.27Å; L30-H34 PolarHBondContact O-N 3.42Å; L30-H34 VanDerWaalsContact O-N 3.1Å; L30-P245 HydrophobicContact CD2-CB 4.44Å; L30-L249 HydrophobicContact CD1-CD1 3.44Å; L30-L249 VanDerWaalsContact CD1-CD1 3.44Å; L30-L249 HydrophobicContact CD1-CG 4.07Å
31L90.3Very high89.6Confident3 Ų319.6 Ų19.62%0.01610%0.096CC..Hα-helixtrans-57.7-48.1173.3-171.492.7000111.4P27 Q28 I29 F33 H34 M35 I187 V190 I191 F218P27-L31 WeakPolarHBondContact O-CB 3.49Å; P27-L31 PolarHBondContact O-N 3.28Å; Q28-L31 WeakPolarHBondContact O-CB 3.3Å; Q28-L31 PolarHBondContact O-N 3.42Å; I29-L31 VanDerWaalsContact C-N 3.27Å; I29-L31 PolarHBondContact O-N 3.01Å; L31-F33 VanDerWaalsContact C-N 3.26Å; L31-F33 PolarHBondContact O-N 3.1Å; L31-H34 PolarHBondContact O-N 2.84Å; L31-M35 HydrophobicContact CG-CG 4.33Å; L31-M35 WeakPolarHBondContact O-CB 3.07Å; L31-M35 VanDerWaalsContact O-CG 3.29Å; L31-M35 WeakPolarHBondContact O-CG 3.38Å; L31-M35 PolarHBondContact O-N 3.34Å; L31-I187 HydrophobicContact CD1-CB 4.06Å; L31-I187 HydrophobicContact CD1-CG1 4.17Å; L31-I187 HydrophobicContact CD1-CG2 3.59Å; L31-I187 HydrophobicContact CG-CG2 4.28Å; L31-V190 HydrophobicContact CD1-CB 4.11Å; L31-V190 HydrophobicContact CD1-CG1 4.23Å; L31-I191 HydrophobicContact CD1-CD1 4.11Å; L31-I191 HydrophobicContact CD1-CG1 3.67Å; L31-I191 HydrophobicContact CD2-CD1 3.74Å; L31-I191 HydrophobicContact CD2-CG1 3.26Å; L31-I191 HydrophobicContact CG-CD1 4.37Å; L31-I191 HydrophobicContact CG-CG1 4.04Å; L31-F218 HydrophobicContact CD2-CD2 4.1Å; L31-F218 HydrophobicContact CD2-CE2 4.18Å
32A92Very high89.6Confident0 Ų019.6 Ų19.60%010%0.1CC..Hα-helixtrans-58.6-39.9176.800000111.5Q28 I29 L30 M35 M36 F218Q28-A32 PolarHBondContact O-N 2.96Å; I29-A32 WeakPolarHBondContact O-CB 3.49Å; I29-A32 PolarHBondContact O-N 3.27Å; L30-A32 VanDerWaalsContact C-N 3.34Å; L30-A32 PolarHBondContact O-N 2.99Å; A32-M35 PolarHBondContact O-N 2.91Å; A32-M36 PolarHBondContact O-N 3.42Å; A32-F218 HydrophobicContact CB-CD2 3.7Å; A32-F218 HydrophobicContact CB-CE2 3.75Å; A32-F218 HydrophobicContact CB-CG 4.13Å; A32-F218 HydrophobicContact CB-CZ 4.19Å; A32-F218 WeakPolarHBondContact CB-O 3.42Å
33F92.9Very high89.6Confident19 Ų1914.7 Ų14.78%0.0838%0.075CC..Hα-helixtrans-56.6-56.7175.4-65.2-5.2000111.2I29 L30 L31 M35 M36 V37 G221 L224 L225 I242I29-F33 HydrophobicContact CG2-CE1 3.99Å; I29-F33 HydrophobicContact CG2-CZ 3.91Å; I29-F33 WeakPolarHBondContact O-CD1 3.34Å; I29-F33 PolarHBondContact O-N 2.94Å; I29-F33 VanDerWaalsContact O-N 3.13Å; L30-F33 HydrophobicContact CD2-CD2 3.87Å; L30-F33 HydrophobicContact CD2-CE2 4Å; L30-F33 WeakPolarHBondContact O-CB 3.25Å; L30-F33 PolarHBondContact O-N 3.12Å; L31-F33 VanDerWaalsContact C-N 3.26Å; L31-F33 PolarHBondContact O-N 3.1Å; F33-M35 VanDerWaalsContact C-N 3.32Å; F33-M35 PolarHBondContact O-N 3.38Å; F33-M36 PolarHBondContact O-N 2.86Å; F33-V37 VanDerWaalsContact O-CB 3.25Å; F33-V37 WeakPolarHBondContact O-CB 3.19Å; F33-V37 PolarHBondContact O-N 2.81Å; F33-G221 WeakPolarHBondContact CD1-O 3.29Å; F33-G221 WeakPolarHBondContact CE1-O 3.38Å; F33-L224 HydrophobicContact CE1-CB 3.76Å; F33-L224 HydrophobicContact CZ-CB 4Å; F33-L225 HydrophobicContact CB-CD1 4.19Å; F33-L225 HydrophobicContact CD1-CB 3.76Å; F33-L225 HydrophobicContact CD1-CD1 4.24Å; F33-L225 HydrophobicContact CE1-CB 4.12Å; F33-L225 HydrophobicContact CG-CD1 4.32Å; F33-I242 HydrophobicContact CB-CB 3.96Å; F33-I242 HydrophobicContact CB-CG2 4.04Å; F33-I242 HydrophobicContact CD2-CB 3.96Å; F33-I242 HydrophobicContact CD2-CG2 4Å; F33-I242 HydrophobicContact CG-CB 4.36Å; F33-I242 HydrophobicContact CG-CG2 4.21Å
34H92.4Very high89.4Confident4 Ų414.6 Ų14.62%0.0198%0.084CC..Hα-helixtrans-66.5-33.2-178.3-73.2-86000113.2L30 L31 Y129 Q160 V183 I187 S243L30-H34 PolarHBondContact O-CD2 3.41Å; L30-H34 VanDerWaalsContact O-CD2 3.27Å; L30-H34 PolarHBondContact O-N 3.42Å; L30-H34 VanDerWaalsContact O-N 3.1Å; L31-H34 PolarHBondContact O-N 2.84Å; H34-Y129 PolarHBondContact O-OH 2.97Å; H34-Q160 PolarHBondContact CD2-NE2 2.95Å; H34-V183 HydrophobicContact CB-CG1 4.46Å; H34-I187 HydrophobicContact CB-CD1 3.69Å; H34-I187 HydrophobicContact CB-CG1 4.49Å; H34-S243 PolarHBondContact CE1-OG 2.82Å
35M91.2Very high89.3Confident3 Ų314.8 Ų14.82%0.0159%0.085CC..Hα-helixtrans-65-39.7176.9-76-131.364.200113.4L31 A32 F33 Y129 M130 L133 I187 I191 F218 Y343L31-M35 HydrophobicContact CG-CG 4.33Å; L31-M35 WeakPolarHBondContact O-CB 3.07Å; L31-M35 VanDerWaalsContact O-CG 3.29Å; L31-M35 WeakPolarHBondContact O-CG 3.38Å; L31-M35 PolarHBondContact O-N 3.34Å; A32-M35 PolarHBondContact O-N 2.91Å; F33-M35 VanDerWaalsContact C-N 3.32Å; F33-M35 PolarHBondContact O-N 3.38Å; M35-Y129 WeakPolarHBondContact CA-OH 3.35Å; M35-M130 HydrophobicContact CE-CE 4.21Å; M35-M130 HydrophobicContact CE-SD 4.34Å; M35-L133 HydrophobicContact CE-CD2 3.45Å; M35-L133 VanDerWaalsContact CE-CD2 3.45Å; M35-L133 HydrophobicContact SD-CD2 4.11Å; M35-I187 HydrophobicContact CG-CG2 3.93Å; M35-I187 HydrophobicContact SD-CG2 4.08Å; M35-I191 HydrophobicContact SD-CD1 4.36Å; M35-F218 HydrophobicContact CB-CE2 4.41Å; M35-F218 HydrophobicContact CB-CZ 4.45Å; M35-F218 HydrophobicContact CG-CE2 4.44Å; M35-F218 HydrophobicContact SD-CE2 4.44Å; M35-Y343 HydrophobicContact CE-CE1 3.72Å; M35-Y343 WeakPolarHBondContact CE-OH 3.48Å
36M91.1Very high89Confident0 Ų018.7 Ų18.70%011%0.111CC..Hα-helixtrans-105.5-8.8-171.4-62.2-59.2156.900113.8A32 F33 S38 I39 F218 Y222 L225 Y342 Y343A32-M36 PolarHBondContact O-N 3.42Å; F33-M36 PolarHBondContact O-N 2.86Å; M36-S38 PolarHBondContact O-N 3.34Å; M36-S38 VanDerWaalsContact O-N 3.1Å; M36-I39 HydrophobicContact CB-CD1 4.17Å; M36-I39 WeakPolarHBondContact O-CB 3.48Å; M36-I39 WeakPolarHBondContact O-CG1 3.35Å; M36-I39 PolarHBondContact O-N 3.27Å; M36-I39 HydrophobicContact SD-CD1 3.9Å; M36-F218 HydrophobicContact CE-CE1 4.41Å; M36-F218 HydrophobicContact CE-CZ 3.96Å; M36-Y222 HydrophobicContact CB-CD2 4.13Å; M36-Y222 HydrophobicContact CB-CE2 3.86Å; M36-Y222 HydrophobicContact CE-CE1 4.41Å; M36-Y222 HydrophobicContact CG-CD1 4.28Å; M36-Y222 HydrophobicContact CG-CD2 3.94Å; M36-Y222 HydrophobicContact CG-CE1 4.06Å; M36-Y222 HydrophobicContact CG-CE2 3.71Å; M36-Y222 HydrophobicContact CG-CG 4.23Å; M36-Y222 HydrophobicContact SD-CE1 4.09Å; M36-Y222 HydrophobicContact SD-CE2 4.29Å; M36-L225 HydrophobicContact CB-CD2 3.52Å; M36-Y342 HydrophobicContact CE-CE1 3.84Å; M36-Y343 HydrophobicContact CE-CD1 4.24Å; M36-Y343 HydrophobicContact CE-CE1 3.64Å
37V92.4Very high88.6Confident1 Ų118.3 Ų18.31%0.00610%0.104CC..THydrogen-bonded Turntrans-61.4-23.3-17873.50000113.8F33 I39 F40 T41 L238 I242F33-V37 VanDerWaalsContact O-CB 3.25Å; F33-V37 WeakPolarHBondContact O-CB 3.19Å; F33-V37 PolarHBondContact O-N 2.81Å; V37-I39 PolarHBondContact O-N 3.25Å; V37-F40 PolarHBondContact O-N 2.73Å; V37-T41 HydrophobicContact CG2-CG2 3.63Å; V37-T41 WeakPolarHBondContact O-CB 3.37Å; V37-T41 WeakPolarHBondContact O-CG2 3.44Å; V37-T41 PolarHBondContact O-N 3.3Å; V37-T41 PolarHBondContact O-OG1 3.13Å; V37-L238 HydrophobicContact CG2-CD2 4.1Å; V37-L238 HydrophobicContact CG2-CG 4.2Å; V37-I242 HydrophobicContact CB-CD1 3.81Å; V37-I242 HydrophobicContact CG1-CD1 3.89Å; V37-I242 HydrophobicContact CG2-CD1 3.64Å
38S89.4Confident88.2Confident11 Ų1125.1 Ų25.18%0.07713%0.13CC..Hα-helixtrans-58.2-27.1175.350.10000112.8M36 F40 T41 G42 L347M36-S38 PolarHBondContact O-N 3.34Å; M36-S38 VanDerWaalsContact O-N 3.1Å; S38-F40 VanDerWaalsContact C-N 3.33Å; S38-F40 PolarHBondContact O-N 2.97Å; S38-T41 WeakPolarHBondContact CA-OG1 3.24Å; S38-G42 WeakPolarHBondContact O-CA 3.48Å; S38-G42 PolarHBondContact O-N 3.02Å; S38-L347 WeakPolarHBondContact OG-CD2 3.31Å
39I90.6Very high87.7Confident10 Ų1025.5 Ų25.55%0.05113%0.133CC..Hα-helixtrans-64.9-39.7180-60.8169.1000111M36 V37 S346 L347 V349 L356 Q360M36-I39 HydrophobicContact CB-CD1 4.17Å; M36-I39 WeakPolarHBondContact O-CB 3.48Å; M36-I39 WeakPolarHBondContact O-CG1 3.35Å; M36-I39 PolarHBondContact O-N 3.27Å; M36-I39 HydrophobicContact SD-CD1 3.9Å; V37-I39 PolarHBondContact O-N 3.25Å; I39-S346 VanDerWaalsContact CD1-O 3.27Å; I39-S346 WeakPolarHBondContact CD1-O 3.44Å; I39-L347 HydrophobicContact CD1-CD2 4.39Å; I39-L347 HydrophobicContact CG1-CD2 3.75Å; I39-V349 HydrophobicContact CG2-CG1 3.42Å; I39-V349 VanDerWaalsContact CG2-CG1 3.42Å; I39-L356 HydrophobicContact CG2-CD1 4.15Å; I39-Q360 HydrophobicContact CG2-CG 4.09Å
40F91.6Very high86.9Confident5 Ų530 Ų302%0.02215%0.148CC..Hα-helixtrans-87.7-47179-58.2-73.7000111.7V37 S38 G42 A43 L225 A226 A229 L238 L356 Y357 Q360V37-F40 PolarHBondContact O-N 2.73Å; S38-F40 VanDerWaalsContact C-N 3.33Å; S38-F40 PolarHBondContact O-N 2.97Å; F40-G42 VanDerWaalsContact C-N 3.33Å; F40-G42 PolarHBondContact O-N 3.48Å; F40-A43 WeakPolarHBondContact O-CB 3.24Å; F40-A43 PolarHBondContact O-N 3.18Å; F40-L225 HydrophobicContact CD2-CD2 4.26Å; F40-L225 HydrophobicContact CD2-CG 4.28Å; F40-L225 HydrophobicContact CE2-CD2 3.97Å; F40-L225 HydrophobicContact CE2-CG 3.94Å; F40-A226 HydrophobicContact CZ-CB 4.23Å; F40-A229 HydrophobicContact CB-CB 4.27Å; F40-A229 HydrophobicContact CD1-CB 3.69Å; F40-A229 HydrophobicContact CD2-CB 3.73Å; F40-A229 HydrophobicContact CE1-CB 3.9Å; F40-A229 HydrophobicContact CE2-CB 3.93Å; F40-A229 HydrophobicContact CG-CB 3.61Å; F40-A229 HydrophobicContact CZ-CB 4.01Å; F40-L238 HydrophobicContact CB-CD2 3.98Å; F40-L356 HydrophobicContact CD1-CD2 3.74Å; F40-L356 HydrophobicContact CD1-CG 4.47Å; F40-L356 HydrophobicContact CE1-CD2 3.98Å; F40-L356 HydrophobicContact CE1-CG 4.22Å; F40-Y357 HydrophobicContact CD1-CD1 4.01Å; F40-Y357 AromaticContact CD1-CE1 3.74Å; F40-Y357 HydrophobicContact CD1-CE1 3.74Å; F40-Y357 AromaticContact CE1-CD1 3.51Å; F40-Y357 HydrophobicContact CE1-CD1 3.51Å; F40-Y357 AromaticContact CE1-CE1 3.76Å; F40-Y357 HydrophobicContact CE1-CE1 3.76Å; F40-Y357 HydrophobicContact CE1-CG 4.4Å; F40-Y357 HydrophobicContact CZ-CD1 4.39Å; F40-Q360 HydrophobicContact CE1-CG 4.36Å; F40-Q360 HydrophobicContact CZ-CB 3.88Å; F40-Q360 HydrophobicContact CZ-CG 3.93Å
41T90.7Very high85.8Confident1 Ų133.4 Ų33.41%0.00616%0.163CC..Hα-helixtrans-68.9-31.3-175.651.50000113.2V37 S38 T107 T108 R180 W235 L238V37-T41 HydrophobicContact CG2-CG2 3.63Å; V37-T41 WeakPolarHBondContact O-CB 3.37Å; V37-T41 WeakPolarHBondContact O-CG2 3.44Å; V37-T41 PolarHBondContact O-N 3.3Å; V37-T41 PolarHBondContact O-OG1 3.13Å; S38-T41 WeakPolarHBondContact CA-OG1 3.24Å; T41-T107 WeakPolarHBondContact O-CB 3.31Å; T41-T108 PolarHBondContact O-N 3.48Å; T41-T108 PolarHBondContact O-OG1 2.91Å; T41-R180 PolarHBondContact OG1-NH2 3.5Å; T41-W235 HydrophobicContact CG2-CB 3.94Å; T41-L238 HydrophobicContact CG2-CD2 4.22Å
42G86.6Confident84.3Confident11 Ų1135.5 Ų35.511%0.11318%0.178CC..THydrogen-bonded Turntrans-98.311.5178.300000114.3S38 F40 N122S38-G42 WeakPolarHBondContact O-CA 3.48Å; S38-G42 PolarHBondContact O-N 3.02Å; F40-G42 VanDerWaalsContact C-N 3.33Å; F40-G42 PolarHBondContact O-N 3.48Å; G42-N122 PolarHBondContact O-ND2 3.37Å
43A86.6Confident82.4Confident7 Ų741.4 Ų41.46%0.05822%0.219CC..  trans-66.1141.5177.500000111.3F40 P45 F104 T107F40-A43 WeakPolarHBondContact O-CB 3.24Å; F40-A43 PolarHBondContact O-N 3.18Å; A43-P45 VanDerWaalsContact O-CD 3.27Å; A43-P45 WeakPolarHBondContact O-CD 3.36Å; A43-F104 HydrophobicContact CB-CD2 4.34Å; A43-F104 HydrophobicContact CB-CE1 4.41Å; A43-F104 HydrophobicContact CB-CE2 3.65Å; A43-F104 HydrophobicContact CB-CZ 3.7Å; A43-T107 WeakPolarHBondContact O-CB 3.48Å; A43-T107 PolarHBondContact O-OG1 3.03Å
44T84.3Confident80.1Confident79 Ų7944.7 Ų44.749%0.48524%0.244SC..  trans-98.7100.1177.251.60000108.9V109T44-V109 HydrophobicContact CG2-CB 4.43Å; T44-V109 HydrophobicContact CG2-CG1 3.94Å; T44-V109 HydrophobicContact CG2-CG2 3.93Å
45P84.3Confident77.8Confident6 Ų650.8 Ų50.84%0.03929%0.288CS..  trans-67.9159173.428-32.4000110.6A43 Y47 Y99 F104 T110A43-P45 VanDerWaalsContact O-CD 3.27Å; A43-P45 WeakPolarHBondContact O-CD 3.36Å; P45-Y47 WeakPolarHBondContact O-CD1 3.3Å; P45-Y47 PolarHBondContact O-N 3.48Å; P45-Y99 HydrophobicContact CG-CD1 4.01Å; P45-Y99 HydrophobicContact CG-CG 4.46Å; P45-F104 HydrophobicContact CB-CD2 4.46Å; P45-T110 HydrophobicContact CG-CG2 3.44Å; P45-T110 VanDerWaalsContact CG-CG2 3.44Å
46P81.3Confident75.4Confident91 Ų9153.7 Ų53.759%0.59132%0.318SS*.  trans-52.9137.1171.9-24.433.7000111.1S100P46-S100 PolarHBondContact O-N 3.38Å
47Y79.3Confident73.1Confident61 Ų6159 Ų5924%0.23936%0.363CS..EExtended strand (participates in β ladder)trans-137.8153-17460.5-89.9000111.6P45 C74 W97 V98 Y99 V115P45-Y47 WeakPolarHBondContact O-CD1 3.3Å; P45-Y47 PolarHBondContact O-N 3.48Å; Y47-C74 PolarHBondContact OH-SG 3.17Å; Y47-W97 AromaticContact CD2-CE3 3.68Å; Y47-W97 HydrophobicContact CD2-CE3 3.68Å; Y47-W97 AromaticContact CD2-CZ3 3.77Å; Y47-W97 HydrophobicContact CD2-CZ3 3.77Å; Y47-W97 HydrophobicContact CE2-CE3 4.21Å; Y47-W97 AromaticContact CE2-CZ3 3.86Å; Y47-W97 HydrophobicContact CE2-CZ3 3.86Å; Y47-V98 WeakPolarHBondContact CA-O 2.84Å; Y47-Y99 VanDerWaalsContact CB-CD1 3.47Å; Y47-Y99 HydrophobicContact CD1-CE1 4.42Å; Y47-Y99 HydrophobicContact CG-CD1 4.43Å; Y47-Y99 HydrophobicContact CG-CE1 4.12Å; Y47-V115 HydrophobicContact CD1-CG1 4.05Å; Y47-V115 HydrophobicContact CD2-CG1 3.8Å; Y47-V115 HydrophobicContact CE1-CG1 3.56Å; Y47-V115 HydrophobicContact CE2-CG1 3.24Å; Y47-V115 HydrophobicContact CG-CG1 4.18Å; Y47-V115 WeakPolarHBondContact OH-CG1 3.22Å
48R78.8Confident70.6Confident149 Ų14961.7 Ų61.756%0.56239%0.39SS*.EExtended strand (participates in β ladder)trans-137.2160.7173.464.1-179.9-179.2135.8-3.7110.5E51 V98R48-E51 IonicContact NH1-OE1 3.62Å; R48-V98 HydrophobicContact CG-CB 4.12Å; R48-V98 PolarHBondContact N-O 3Å; R48-V98 PolarHBondContact O-N 2.48Å
49C75.7Confident68.3Low17 Ų1769.2 Ų69.212%0.11543%0.43CS..EExtended strand (participates in β ladder)trans-71.4144.1175.3-66.50000111.9E51 S77 M80 C93 W97C49-E51 PolarHBondContact O-N 2.88Å; C49-S77 PolarHBondContact SG-O 3.07Å; C49-M80 HydrophobicContact CB-CE 3.41Å; C49-M80 VanDerWaalsContact CB-CE 3.41Å; C49-M80 HydrophobicContact CB-CG 4.29Å; C49-C93 HydrophobicContact CB-CB 3.84Å; C49-C93 WeakPolarHBondContact CB-SG 3.22Å; C49-C93 WeakPolarHBondContact SG-CB 3.46Å; C49-C93 CovalentContact SG-SG 2.01Å; C49-C93 PolarHBondContact SG-SG 3.05Å; C49-W97 WeakPolarHBondContact SG-CZ3 3.42Å
50R73.8Confident66.1Low130 Ų13074 Ų7449%0.49145%0.452SS..PPolyproline II helixtrans-74.6119.3175.5-170.5173.8-61172.93.8110.4M80 H95 G96 W97 V98R50-M80 WeakPolarHBondContact O-CE 3.34Å; R50-H95 WeakPolarHBondContact CD-O 3.33Å; R50-G96 VanDerWaalsContact CB-O 3.28Å; R50-G96 WeakPolarHBondContact CB-O 3.48Å; R50-G96 PolarHBondContact N-O 2.92Å; R50-W97 PolarHBondContact NH2-O 3.43Å; R50-V98 HydrophobicContact CB-CG2 3.91Å; R50-V98 HydrophobicContact CG-CG2 4.04Å
51E67.5Low64Low93 Ų9378 Ų7844%0.43548%0.477SS..PPolyproline II helixtrans-64.8138.9174.9-70.8170.8-153.400111.4R48 C49 S53 M80R48-E51 IonicContact NH1-OE1 3.62Å; C49-E51 PolarHBondContact O-N 2.88Å; E51-S53 PolarHBondContact O-N 3.09Å; E51-M80 HydrophobicContact CG-CE 4.17Å
52S58.8Low61.8Low48 Ų4880.4 Ų80.434%0.33649%0.494SS..PPolyproline II helixtrans-71.6119.3171.463.70000108.7S54S52-S54 PolarHBondContact O-N 3.17Å
53S50.7Low59.9Low124 Ų12484.7 Ų84.787%0.86751%0.514SS*.  trans-70.766.6172.157.20000111E51E51-S53 PolarHBondContact O-N 3.09Å
54S45.8Very low57.9Low87 Ų8787.2 Ų87.261%0.60853%0.529SS*.  trans-126.857.6170.6670000110S52 G56S52-S54 PolarHBondContact O-N 3.17Å; S54-G56 PolarHBondContact O-N 3.18Å
55S44.3Very low56Low132 Ų13285 Ų8592%0.92352%0.519SS*.  trans-7664.6154.540.70000109.2
56G40.7Very low53.9Low64 Ų6492.6 Ų92.666%0.6655%0.554SS**SBendtrans-122.993.8170.400000109S54S54-G56 PolarHBondContact O-N 3.18Å
57A41.3Very low51.5Low113 Ų11396.2 Ų96.293%0.93457%0.568SS**SBendtrans42.493.2162.600000117.8
58G39.8Very low49.5Very low57 Ų5797.2 Ų97.259%0.58858%0.581SS**SBendtrans145.6100.6154.700000114.3Q60G58-Q60 WeakPolarHBondContact O-CG 3.24Å; G58-Q60 PolarHBondContact O-N 2.97Å
59N42.1Very low47.2Very low169 Ų16994.5 Ų94.590%0.90459%0.585SS**SBendtrans20.547.6162.7-69.8-0.5000118.4
60Q44.2Very low45.4Very low109 Ų109102.8 Ų102.851%0.50963%0.627SS.*  trans-128.990174.1-71-175.536.500107.8G58 S62G58-Q60 WeakPolarHBondContact O-CG 3.24Å; G58-Q60 PolarHBondContact O-N 2.97Å; Q60-S62 PolarHBondContact O-N 3.1Å
61T47.1Very low43.7Very low91 Ų9199.4 Ų99.456%0.55862%0.623SS**  trans-85.2103.316933.40000108.4L63T61-L63 PolarHBondContact O-N 2.98Å
62S45.9Very low42.5Very low50 Ų50102.6 Ų102.635%0.3564%0.643SS.*EExtended strand (participates in β ladder)trans-74.198.5160.450.90000107.4Q60Q60-S62 PolarHBondContact O-N 3.1Å
63L46.1Very low42Very low102 Ų102102.5 Ų102.553%0.53464%0.643SS.*EExtended strand (participates in β ladder)trans-84.2135.5173.4-73.5166.9000108.7T61 L83T61-L63 PolarHBondContact O-N 2.98Å; L63-L83 HydrophobicContact CD1-CD1 3.76Å; L63-L83 HydrophobicContact CG-CD1 4.41Å
64P44.9Very low42Very low59 Ų5998.3 Ų98.338%0.38361%0.613SS.*  trans-56.3142159.725.6-30.8000107.7E66P64-E66 HydrophobicContact CB-CG 4.49Å; P64-E66 HydrophobicContact CG-CG 4.28Å; P64-E66 PolarHBondContact O-N 3.16Å
65A44Very low42.1Very low34 Ų34101.5 Ų101.528%0.28162%0.616SS.*  trans-69.468.6174.900000109.8N67 L81A65-N67 PolarHBondContact O-N 3.49Å; A65-L81 HydrophobicContact CB-CD1 3.69Å; A65-L81 HydrophobicContact CB-CG 4.38Å
66E39Very low42.2Very low164 Ų16497 Ų9777%0.76658%0.584SS**THydrogen-bonded Turntrans-77.70.1-169.1-114.2177.4177.800114.1P64P64-E66 HydrophobicContact CB-CG 4.49Å; P64-E66 HydrophobicContact CG-CG 4.28Å; P64-E66 PolarHBondContact O-N 3.16Å
67N31.6Very low42.7Very low167 Ų16795.5 Ų95.589%0.89356%0.564SS**THydrogen-bonded Turntrans-122.618.8177.9-78.6-14.8000114.4A65A65-N67 PolarHBondContact O-N 3.49Å
68V37Very low42.9Very low82 Ų8293.6 Ų93.650%0.49754%0.535SS..SBendtrans-104113.2161.9-175.50000105.9L70V68-L70 PolarHBondContact O-N 2.89Å
69S30.1Very low43.3Very low93 Ų9392.5 Ų92.565%0.6552%0.517SS*.  trans-34.1128.5174.541.90000110.8S71S69-S71 PolarHBondContact O-N 3.43Å; S69-S71 PolarHBondContact O-OG 2.99Å; S69-S71 VanDerWaalsContact O-OG 3.12Å
70L39.6Very low43.7Very low191 Ų19186.4 Ų86.4100%148%0.484SS*.  trans-50.482.1164.8-82.9122.1000108.5V68V68-L70 PolarHBondContact O-N 2.89Å
71S36.5Very low44.1Very low58 Ų5883.6 Ų83.641%0.40647%0.472SS..  trans-120.1134.5174.358.90000104.5S69 S73S69-S71 PolarHBondContact O-N 3.43Å; S69-S71 PolarHBondContact O-OG 2.99Å; S69-S71 VanDerWaalsContact O-OG 3.12Å; S71-S73 PolarHBondContact O-N 3.41Å
72D43.3Very low44.1Very low161 Ų16184.7 Ų84.786%0.86147%0.466SS*.SBendtrans-55.120.7-171.7-72.3-48.1000116.7C74D72-C74 PolarHBondContact O-N 3.31Å
73S47.7Very low44.3Very low46 Ų4684.8 Ų84.832%0.32246%0.462SS..  trans-84.8114.5-179.468.50000111S71 F75 S76 S77S71-S73 PolarHBondContact O-N 3.41Å; S73-F75 PolarHBondContact O-N 3.13Å; S73-S76 PolarHBondContact O-N 2.92Å; S73-S77 PolarHBondContact O-N 2.96Å
74C51.4Low44.3Very low35 Ų3585.4 Ų85.424%0.23646%0.462CS..Hα-helixtrans-52.4-18.3161.2-90.20000113.2Y47 D72 S76 S77 E78 C116Y47-C74 PolarHBondContact OH-SG 3.17Å; D72-C74 PolarHBondContact O-N 3.31Å; C74-S76 VanDerWaalsContact C-N 3.32Å; C74-S76 PolarHBondContact O-N 3.25Å; C74-S77 PolarHBondContact O-N 3.39Å; C74-E78 VanDerWaalsContact O-CB 3.24Å; C74-E78 WeakPolarHBondContact O-CB 3Å; C74-E78 VanDerWaalsContact O-CG 3.26Å; C74-E78 WeakPolarHBondContact O-CG 3.12Å; C74-E78 PolarHBondContact O-N 3.33Å; C74-C116 HydrophobicContact CB-CB 3.65Å; C74-C116 WeakPolarHBondContact CB-SG 3.26Å; C74-C116 WeakPolarHBondContact SG-CA 3.14Å; C74-C116 WeakPolarHBondContact SG-CB 3.24Å; C74-C116 CovalentContact SG-SG 2.04Å; C74-C116 PolarHBondContact SG-SG 2.95Å
75F46.6Very low44.9Very low155 Ų15585.7 Ų85.768%0.6848%0.476SS*.Hα-helixtrans-63.7-31.4173.9-126.2-90.6000114.3S73S73-F75 PolarHBondContact O-N 3.13Å
76S47.8Very low45.3Very low36 Ų3692.5 Ų92.525%0.25251%0.508SS..Hα-helixtrans-87.2-35.5173.7-168.30000111.2S73 C74S73-S76 PolarHBondContact O-N 2.92Å; C74-S76 VanDerWaalsContact C-N 3.32Å; C74-S76 PolarHBondContact O-N 3.25Å
77S50Low45.8Very low34 Ų3494.4 Ų94.424%0.23851%0.508CS..Hα-helixtrans-83.4-17.8-174.9-53.10000114.1C49 S73 C74 V79 C93 W97C49-S77 PolarHBondContact SG-O 3.07Å; S73-S77 PolarHBondContact O-N 2.96Å; C74-S77 PolarHBondContact O-N 3.39Å; S77-V79 PolarHBondContact O-N 3.14Å; S77-C93 PolarHBondContact O-SG 3.45Å; S77-W97 WeakPolarHBondContact O-CH2 3.25Å; S77-W97 WeakPolarHBondContact O-CZ3 3.36Å
78E46.3Very low47Very low72 Ų7291 Ų9134%0.33649%0.493SS..THydrogen-bonded Turntrans-77.8-7174.2-80.2-175.8163.400112.6C74 P92 C93 C116C74-E78 VanDerWaalsContact O-CB 3.24Å; C74-E78 WeakPolarHBondContact O-CB 3Å; C74-E78 VanDerWaalsContact O-CG 3.26Å; C74-E78 WeakPolarHBondContact O-CG 3.12Å; C74-E78 PolarHBondContact O-N 3.33Å; E78-P92 CarbonylContact O-C 3.56Å; E78-P92 WeakPolarHBondContact O-CA 3.42Å; E78-C93 VanDerWaalsContact C-SG 3.52Å; E78-C93 PolarHBondContact O-N 3.35Å; E78-C93 PolarHBondContact O-SG 3.35Å; E78-C93 VanDerWaalsContact O-SG 3.42Å; E78-C116 HydrophobicContact CG-CB 3.83Å; E78-C116 WeakPolarHBondContact OE1-CB 3.44Å
79V49.1Very low47.7Very low34 Ų3492.3 Ų92.321%0.20649%0.494CS..EExtended strand (participates in β ladder)trans-125.4122.2-163.2174.50000111.6S77 R90 V91S77-V79 PolarHBondContact O-N 3.14Å; V79-R90 HydrophobicContact CB-CB 4.4Å; V79-R90 HydrophobicContact CG1-CB 3.27Å; V79-R90 HydrophobicContact CG1-CG 3.53Å; V79-R90 HydrophobicContact CG2-CB 4.22Å; V79-V91 CarbonylContact C-O 3.6Å; V79-V91 VanDerWaalsContact CA-O 3.3Å; V79-V91 WeakPolarHBondContact CA-O 2.9Å
80M50.3Low48.9Very low42 Ų4296.1 Ų96.121%0.20749%0.494CS..EExtended strand (participates in β ladder)trans-83.4133.8157.2-72.2-153.7170.900109.9C49 R50 E51 R82 V91C49-M80 HydrophobicContact CB-CE 3.41Å; C49-M80 VanDerWaalsContact CB-CE 3.41Å; C49-M80 HydrophobicContact CB-CG 4.29Å; R50-M80 WeakPolarHBondContact O-CE 3.34Å; E51-M80 HydrophobicContact CG-CE 4.17Å; M80-R82 PolarHBondContact O-N 3.41Å; M80-V91 PolarHBondContact N-O 3.49Å; M80-V91 PolarHBondContact O-N 3.44Å
81L52.4Low49.8Very low49 Ų4989.4 Ų89.426%0.25746%0.461SS..EExtended strand (participates in β ladder)trans-79.5106.9167.6-70.6171.4000108.1A65 R90A65-L81 HydrophobicContact CB-CD1 3.69Å; A65-L81 HydrophobicContact CB-CG 4.38Å; L81-R90 HydrophobicContact CD2-CG 4.3Å
82R47.1Very low51.1Low115 Ų11591.5 Ų91.543%0.43447%0.473SS..EExtended strand (participates in β ladder)trans-92.5115.4171.9-155.4174-174.2176.91.8108.1M80 Q84 E89 V91M80-R82 PolarHBondContact O-N 3.41Å; R82-Q84 PolarHBondContact O-N 3.49Å; R82-E89 PolarHBondContact N-O 2.87Å; R82-E89 PolarHBondContact O-N 2.89Å; R82-V91 HydrophobicContact CB-CG2 4.06Å
83L50.2Low52.2Low52 Ų5285 Ų8527%0.27244%0.44SS..EExtended strand (participates in β ladder)trans-80.7107.1169-89.1146.8000108.4L63 T88L63-L83 HydrophobicContact CD1-CD1 3.76Å; L63-L83 HydrophobicContact CG-CD1 4.41Å; L83-T88 HydrophobicContact CD2-CG2 4.25Å; L83-T88 HydrophobicContact CG-CG2 4.45Å
84Q46.2Very low52.9Low114 Ų11486.2 Ų86.253%0.53346%0.459SS..EExtended strand (participates in β ladder)trans-115.985.6172.6-149.6173.1-4.900107.6R82 R87R82-Q84 PolarHBondContact O-N 3.49Å; Q84-R87 PolarHBondContact N-O 3.31Å
85G57.3Low53.7Low65 Ų6590.3 Ų90.367%0.6748%0.475SS*.THydrogen-bonded Turntrans69-138.1-168.600000112.3R87G85-R87 PolarHBondContact O-N 3.35Å
86N52Low55Low177 Ų17783.9 Ų83.995%0.94745%0.453SS*.THydrogen-bonded Turntrans-83.314.5-177.4-13918.6000114
87R49.1Very low56.5Low205 Ų20583.8 Ų83.877%0.77445%0.447SS*.EExtended strand (participates in β ladder)trans-120.6127.9179.7-73.4-177.3174.7176.1-1.3109.9Q84 G85Q84-R87 PolarHBondContact N-O 3.31Å; G85-R87 PolarHBondContact O-N 3.35Å
88T56.6Low58Low94 Ų9484.6 Ų84.658%0.57745%0.45SS*.EExtended strand (participates in β ladder)trans-88.3110.3169.250.80000108.7L83L83-T88 HydrophobicContact CD2-CG2 4.25Å; L83-T88 HydrophobicContact CG-CG2 4.45Å
89E51.5Low59.9Low111 Ų11182.8 Ų82.852%0.51944%0.44SS..EExtended strand (participates in β ladder)trans-99.5137.9174.9-162.6170.1-157.300110.3R82R82-E89 PolarHBondContact N-O 2.87Å; R82-E89 PolarHBondContact O-N 2.89Å
90R56Low61.4Low172 Ų17282.8 Ų82.865%0.64944%0.442SS*.EExtended strand (participates in β ladder)trans-92.9110.3-179.2-69.4-164.4-164-167.85.7109.3V79 L81V79-R90 HydrophobicContact CB-CB 4.4Å; V79-R90 HydrophobicContact CG1-CB 3.27Å; V79-R90 HydrophobicContact CG1-CG 3.53Å; V79-R90 HydrophobicContact CG2-CB 4.22Å; L81-R90 HydrophobicContact CD2-CG 4.3Å
91V58.8Low63Low50 Ų5085.1 Ų85.130%0.30346%0.458SS..EExtended strand (participates in β ladder)trans-110.1131.6-177.4-1730000111V79 M80 R82V79-V91 CarbonylContact C-O 3.6Å; V79-V91 VanDerWaalsContact CA-O 3.3Å; V79-V91 WeakPolarHBondContact CA-O 2.9Å; M80-V91 PolarHBondContact N-O 3.49Å; M80-V91 PolarHBondContact O-N 3.44Å; R82-V91 HydrophobicContact CB-CG2 4.06Å
92P63.5Low64.3Low102 Ų10290.2 Ų90.266%0.66248%0.481SS*.EExtended strand (participates in β ladder)trans-58.4140.7175.221.8-31.2000112.1E78 G94E78-P92 CarbonylContact O-C 3.56Å; E78-P92 WeakPolarHBondContact O-CA 3.42Å; P92-G94 PolarHBondContact O-N 2.94Å
93C66.8Low65.9Low26 Ų2687.8 Ų87.818%0.17648%0.479CS..  trans-67.190.7-178.4-65.80000112.8C49 S77 E78 W97C49-C93 HydrophobicContact CB-CB 3.84Å; C49-C93 WeakPolarHBondContact CB-SG 3.22Å; C49-C93 WeakPolarHBondContact SG-CB 3.46Å; C49-C93 CovalentContact SG-SG 2.01Å; C49-C93 PolarHBondContact SG-SG 3.05Å; S77-C93 PolarHBondContact O-SG 3.45Å; E78-C93 VanDerWaalsContact C-SG 3.52Å; E78-C93 PolarHBondContact O-N 3.35Å; E78-C93 PolarHBondContact O-SG 3.35Å; E78-C93 VanDerWaalsContact O-SG 3.42Å; C93-W97 HydrophobicContact CB-CH2 4.3Å; C93-W97 HydrophobicContact CB-CZ2 4.45Å
94G63Low67.6Low70 Ų7086.2 Ų86.272%0.72247%0.47SS*.THydrogen-bonded Turntrans-83.5-14.8-177.300000115.7P92P92-G94 PolarHBondContact O-N 2.94Å
95H67.6Low69.4Low122 Ų12286.1 Ų86.157%0.56547%0.469SS*.THydrogen-bonded Turntrans-100.811.4-173.7-65-66.8000114.5R50R50-H95 WeakPolarHBondContact CD-O 3.33Å
96G73.3Confident70.9Confident20 Ų2084.5 Ų84.521%0.20645%0.447CS..  trans85.6-173.4179.600000114R50R50-G96 VanDerWaalsContact CB-O 3.28Å; R50-G96 WeakPolarHBondContact CB-O 3.48Å; R50-G96 PolarHBondContact N-O 2.92Å
97W80Confident72.7Confident34 Ų3476.1 Ų76.113%0.12940%0.402CS..EExtended strand (participates in β ladder)trans-112.6155.4-170.5-55.296.6000112Y47 C49 R50 S77 C93 Y99Y47-W97 AromaticContact CD2-CE3 3.68Å; Y47-W97 HydrophobicContact CD2-CE3 3.68Å; Y47-W97 AromaticContact CD2-CZ3 3.77Å; Y47-W97 HydrophobicContact CD2-CZ3 3.77Å; Y47-W97 HydrophobicContact CE2-CE3 4.21Å; Y47-W97 AromaticContact CE2-CZ3 3.86Å; Y47-W97 HydrophobicContact CE2-CZ3 3.86Å; C49-W97 WeakPolarHBondContact SG-CZ3 3.42Å; R50-W97 PolarHBondContact NH2-O 3.43Å; S77-W97 WeakPolarHBondContact O-CH2 3.25Å; S77-W97 WeakPolarHBondContact O-CZ3 3.36Å; C93-W97 HydrophobicContact CB-CH2 4.3Å; C93-W97 HydrophobicContact CB-CZ2 4.45Å; W97-Y99 HydrophobicContact CB-CD2 4.47Å; W97-Y99 HydrophobicContact CB-CE2 3.73Å
98V81.4Confident74.6Confident50 Ų5066.3 Ų66.330%0.30337%0.366SS..EExtended strand (participates in β ladder)trans-123.6120.8169.8-1790000107.8Y47 R48 R50Y47-V98 WeakPolarHBondContact CA-O 2.84Å; R48-V98 HydrophobicContact CG-CB 4.12Å; R48-V98 PolarHBondContact N-O 3Å; R48-V98 PolarHBondContact O-N 2.48Å; R50-V98 HydrophobicContact CB-CG2 3.91Å; R50-V98 HydrophobicContact CG-CG2 4.04Å
99Y85Confident76Confident35 Ų3561.9 Ų61.914%0.13734%0.338CS..EExtended strand (participates in β ladder)trans-101.7143.3-177.5-62.8-80.2000110.9P45 Y47 W97 T110 D113 V115P45-Y99 HydrophobicContact CG-CD1 4.01Å; P45-Y99 HydrophobicContact CG-CG 4.46Å; Y47-Y99 VanDerWaalsContact CB-CD1 3.47Å; Y47-Y99 HydrophobicContact CD1-CE1 4.42Å; Y47-Y99 HydrophobicContact CG-CD1 4.43Å; Y47-Y99 HydrophobicContact CG-CE1 4.12Å; W97-Y99 HydrophobicContact CB-CD2 4.47Å; W97-Y99 HydrophobicContact CB-CE2 3.73Å; Y99-T110 HydrophobicContact CD1-CG2 3.76Å; Y99-T110 HydrophobicContact CD2-CG2 3.87Å; Y99-T110 HydrophobicContact CE1-CG2 4.31Å; Y99-T110 HydrophobicContact CE2-CG2 4.38Å; Y99-T110 HydrophobicContact CG-CG2 3.54Å; Y99-D113 WeakPolarHBondContact CE2-OD1 3.4Å; Y99-D113 PolarHBondContact OH-OD1 2.93Å; Y99-V115 HydrophobicContact CE1-CG2 3.81Å; Y99-V115 WeakPolarHBondContact OH-CG2 3.35Å
100S82.3Confident77.7Confident34 Ų3457.9 Ų57.924%0.23832%0.321CS..  trans-68.1136.5170.1178.30000110.5P46 E102P46-S100 PolarHBondContact O-N 3.38Å; S100-E102 PolarHBondContact OG-N 3.35Å
101T83.1Confident79.2Confident90 Ų9053 Ų5355%0.55231%0.306SS*.  trans-103.67.2-179.453.10000113.7F104T101-F104 CarbonylContact C-O 3.47Å; T101-F104 VanDerWaalsContact CA-O 3.29Å; T101-F104 WeakPolarHBondContact CA-O 3.29Å
102E80.7Confident80.6Confident156 Ų15652.6 Ų52.673%0.72930%0.299SS*.SBendtrans-65.5-43.9-175.4-67.2176.1179.500112.5S100 R233S100-E102 PolarHBondContact OG-N 3.35Å; E102-R233 PolarHBondContact O-NH1 3Å
103V79.8Confident81.7Confident65 Ų6550.7 Ų50.739%0.39428%0.283SS..SBendtrans-97.1-37.6-176.4-173.90000112.3Y357V103-Y357 HydrophobicContact CG1-CE2 4.16Å; V103-Y357 PolarHBondContact O-OH 3.1Å
104F85.1Confident82.5Confident19 Ų1949.8 Ų49.88%0.08328%0.277CS..  trans-133.6136.5-178.5-60.5-74.5000110.4A43 P45 T101 T107 L356 Y357A43-F104 HydrophobicContact CB-CD2 4.34Å; A43-F104 HydrophobicContact CB-CE1 4.41Å; A43-F104 HydrophobicContact CB-CE2 3.65Å; A43-F104 HydrophobicContact CB-CZ 3.7Å; P45-F104 HydrophobicContact CB-CD2 4.46Å; T101-F104 CarbonylContact C-O 3.47Å; T101-F104 VanDerWaalsContact CA-O 3.29Å; T101-F104 WeakPolarHBondContact CA-O 3.29Å; F104-T107 HydrophobicContact CB-CG2 3.65Å; F104-T107 HydrophobicContact CD1-CG2 4.13Å; F104-T107 HydrophobicContact CD2-CG2 4.24Å; F104-T107 HydrophobicContact CG-CG2 3.75Å; F104-L356 HydrophobicContact CE1-CD2 4.47Å; F104-L356 HydrophobicContact CE2-CD2 4.5Å; F104-L356 HydrophobicContact CZ-CD2 3.62Å; F104-Y357 AromaticContact CE1-CZ 3.99Å; F104-Y357 WeakPolarHBondContact CE1-OH 3.38Å
105H85.3Confident83.3Confident112 Ų11246.7 Ų46.752%0.51924%0.244SC..SBendtrans-79.1-41.8173-74.8-57.1000111.5R233 D234H105-R233 PolarHBondContact N-O 3.42Å; H105-D234 WeakPolarHBondContact CB-OD1 3.39Å
106S88.1Confident83.8Confident30 Ų3041.7 Ų41.721%0.2122%0.223CC..BIsolated β-bridgetrans-155133.7176.9-178.80000110.4W235S106-W235 WeakPolarHBondContact O-CB 3.36Å; S106-W235 PolarHBondContact O-N 3.4Å
107T90.8Very high83.9Confident1 Ų145.8 Ų45.81%0.00625%0.248CC..  trans-123.7165.3171.378.20000111T41 A43 F104 V109 T110 E111 W235T41-T107 WeakPolarHBondContact O-CB 3.31Å; A43-T107 WeakPolarHBondContact O-CB 3.48Å; A43-T107 PolarHBondContact O-OG1 3.03Å; F104-T107 HydrophobicContact CB-CG2 3.65Å; F104-T107 HydrophobicContact CD1-CG2 4.13Å; F104-T107 HydrophobicContact CD2-CG2 4.24Å; F104-T107 HydrophobicContact CG-CG2 3.75Å; T107-V109 PolarHBondContact O-N 3.09Å; T107-V109 PolarHBondContact OG1-N 3.43Å; T107-T110 PolarHBondContact N-OG1 3.4Å; T107-T110 PolarHBondContact O-N 3.15Å; T107-T110 VanDerWaalsContact O-N 3.07Å; T107-T110 PolarHBondContact O-OG1 3.45Å; T107-T110 PolarHBondContact OG1-N 3.31Å; T107-E111 PolarHBondContact O-N 3.44Å; T107-W235 VanDerWaalsContact C-CD1 3.41Å
108T88.1Confident84Confident0 Ų049.3 Ų49.30%026%0.264CS..Hα-helixtrans-62.7-24.7176.259.40000112.1T41 W112 Y176 W235T41-T108 PolarHBondContact O-N 3.48Å; T41-T108 PolarHBondContact O-OG1 2.91Å; T108-W112 HydrophobicContact CG2-CZ3 3.97Å; T108-Y176 HydrophobicContact CG2-CE1 4.39Å; T108-Y176 HydrophobicContact CG2-CE2 3.9Å; T108-W235 HydrophobicContact CG2-CD2 3.72Å; T108-W235 HydrophobicContact CG2-CE3 3.82Å; T108-W235 HydrophobicContact CG2-CG 4.17Å; T108-W235 HydrophobicContact CG2-CH2 4.46Å; T108-W235 HydrophobicContact CG2-CZ2 4.36Å; T108-W235 HydrophobicContact CG2-CZ3 4.2Å
109V86.2Confident83.8Confident0 Ų048 Ų480%026%0.258CS..Hα-helixtrans-70.6-47.4173.4178.40000110.4T44 T107 E111 D113 L114 V115T44-V109 HydrophobicContact CG2-CB 4.43Å; T44-V109 HydrophobicContact CG2-CG1 3.94Å; T44-V109 HydrophobicContact CG2-CG2 3.93Å; T107-V109 PolarHBondContact O-N 3.09Å; T107-V109 PolarHBondContact OG1-N 3.43Å; V109-E111 VanDerWaalsContact C-N 3.32Å; V109-E111 PolarHBondContact O-N 3.4Å; V109-D113 WeakPolarHBondContact O-CA 3.47Å; V109-D113 PolarHBondContact O-N 2.68Å; V109-L114 HydrophobicContact CG1-CB 4.23Å; V109-L114 PolarHBondContact O-N 2.93Å; V109-V115 HydrophobicContact CG1-CG2 3.61Å
110T86.4Confident83.8Confident27 Ų2747.6 Ų47.617%0.16627%0.265CS..Hα-helixtrans-69.2-28.1-177.760.90000113.6P45 Y99 T107P45-T110 HydrophobicContact CG-CG2 3.44Å; P45-T110 VanDerWaalsContact CG-CG2 3.44Å; Y99-T110 HydrophobicContact CD1-CG2 3.76Å; Y99-T110 HydrophobicContact CD2-CG2 3.87Å; Y99-T110 HydrophobicContact CE1-CG2 4.31Å; Y99-T110 HydrophobicContact CE2-CG2 4.38Å; Y99-T110 HydrophobicContact CG-CG2 3.54Å; T107-T110 PolarHBondContact N-OG1 3.4Å; T107-T110 PolarHBondContact O-N 3.15Å; T107-T110 VanDerWaalsContact O-N 3.07Å; T107-T110 PolarHBondContact O-OG1 3.45Å; T107-T110 PolarHBondContact OG1-N 3.31Å
111E88.2Confident84Confident71 Ų7149.1 Ų49.133%0.33227%0.27SS..Hα-helixtrans-81.7-30.2-176.6-174.6162.7179.800113T107 V109 W235 R236T107-E111 PolarHBondContact O-N 3.44Å; V109-E111 VanDerWaalsContact C-N 3.32Å; V109-E111 PolarHBondContact O-N 3.4Å; E111-W235 WeakPolarHBondContact OE2-CZ2 3.5Å; E111-W235 PolarHBondContact OE2-NE1 2.82Å; E111-R236 VanDerWaalsContact CD-NH2 3.32Å; E111-R236 IonicContact OE1-CZ 2.68Å; E111-R236 IonicContact OE1-NE 3.18Å; E111-R236 PolarHBondContact OE1-NE 3.45Å; E111-R236 IonicContact OE1-NH2 2.82Å; E111-R236 PolarHBondContact OE1-NH2 2.85Å; E111-R236 IonicContact OE2-CZ 3.67Å; E111-R236 IonicContact OE2-NE 2.84Å; E111-R236 PolarHBondContact OE2-NE 2.97Å; E111-R236 VanDerWaalsContact OE2-NE 3.07Å; E111-R236 IonicContact OE2-NH2 3.88Å; E111-R236 PolarHBondContact OE2-NH2 3.42Å
112W89Confident84.1Confident41 Ų4146 Ų4616%0.15525%0.25CC..THydrogen-bonded Turntrans-116.716.3-178.6-60.3-47.8000113.5T108 L114 F173 Y176 W235T108-W112 HydrophobicContact CG2-CZ3 3.97Å; W112-L114 VanDerWaalsContact C-N 3.33Å; W112-L114 HydrophobicContact CB-CD1 4.47Å; W112-L114 HydrophobicContact CB-CD2 4.11Å; W112-L114 HydrophobicContact CB-CG 4.02Å; W112-L114 HydrophobicContact CE3-CD1 4.44Å; W112-L114 PolarHBondContact O-N 3.21Å; W112-F173 HydrophobicContact CB-CB 4.44Å; W112-F173 HydrophobicContact CD2-CB 3.87Å; W112-F173 HydrophobicContact CD2-CD2 4.22Å; W112-F173 HydrophobicContact CE3-CB 3.95Å; W112-F173 AromaticContact CE3-CD2 3.44Å; W112-F173 HydrophobicContact CE3-CD2 3.44Å; W112-F173 VanDerWaalsContact CE3-CD2 3.44Å; W112-F173 HydrophobicContact CE3-CE2 4.4Å; W112-F173 HydrophobicContact CE3-CG 4.18Å; W112-F173 HydrophobicContact CG-CB 4.12Å; W112-F173 HydrophobicContact CZ3-CB 4.49Å; W112-F173 AromaticContact CZ3-CD2 3.73Å; W112-F173 HydrophobicContact CZ3-CD2 3.73Å; W112-Y176 HydrophobicContact CH2-CD1 4.17Å; W112-Y176 AromaticContact CH2-CD2 3.82Å; W112-Y176 HydrophobicContact CH2-CD2 3.82Å; W112-Y176 AromaticContact CH2-CG 3.54Å; W112-Y176 HydrophobicContact CH2-CG 3.54Å; W112-Y176 AromaticContact CZ3-CD1 3.79Å; W112-Y176 HydrophobicContact CZ3-CD1 3.79Å; W112-Y176 HydrophobicContact CZ3-CD2 4.08Å; W112-Y176 HydrophobicContact CZ3-CE1 4.32Å; W112-Y176 AromaticContact CZ3-CG 3.65Å; W112-Y176 HydrophobicContact CZ3-CG 3.65Å; W112-W235 AromaticContact CH2-CH2 3.92Å; W112-W235 HydrophobicContact CH2-CH2 3.92Å; W112-W235 HydrophobicContact CH2-CZ2 4.02Å; W112-W235 HydrophobicContact CZ2-CH2 4.45Å; W112-W235 HydrophobicContact CZ2-CZ2 4.34Å
113D85.8Confident84.5Confident62 Ų6239.7 Ų39.733%0.33222%0.223SC..THydrogen-bonded Turntrans46.950.7179.6-64.5-38.7000113Y99 V109 V115Y99-D113 WeakPolarHBondContact CE2-OD1 3.4Å; Y99-D113 PolarHBondContact OH-OD1 2.93Å; V109-D113 WeakPolarHBondContact O-CA 3.47Å; V109-D113 PolarHBondContact O-N 2.68Å; D113-V115 PolarHBondContact O-N 3.5Å
114L83.4Confident85Confident6 Ų640.7 Ų40.73%0.03123%0.226CC..  trans-83.554.8-175.1-56.2176.5000112.3V109 W112 A119 L121 N122 F173V109-L114 HydrophobicContact CG1-CB 4.23Å; V109-L114 PolarHBondContact O-N 2.93Å; W112-L114 VanDerWaalsContact C-N 3.33Å; W112-L114 HydrophobicContact CB-CD1 4.47Å; W112-L114 HydrophobicContact CB-CD2 4.11Å; W112-L114 HydrophobicContact CB-CG 4.02Å; W112-L114 HydrophobicContact CE3-CD1 4.44Å; W112-L114 PolarHBondContact O-N 3.21Å; L114-A119 WeakPolarHBondContact O-CA 3.15Å; L114-L121 HydrophobicContact CD2-CB 4.18Å; L114-L121 HydrophobicContact CD2-CD1 4.11Å; L114-N122 HydrophobicContact CD1-CB 4.29Å; L114-F173 HydrophobicContact CD1-CD2 3.64Å; L114-F173 HydrophobicContact CD1-CE2 3.42Å; L114-F173 VanDerWaalsContact CD1-CE2 3.42Å; L114-F173 HydrophobicContact CD1-CG 4.4Å; L114-F173 HydrophobicContact CD1-CZ 4.07Å; L114-F173 HydrophobicContact CD2-CD2 4.42Å; L114-F173 HydrophobicContact CD2-CG 4.39Å
115V80.7Confident85.2Confident6 Ų640.1 Ų40.14%0.03623%0.225CC..  trans-120.5156.2-173.5-178.30000110.5Y47 Y99 V109 D113 S117 K118Y47-V115 HydrophobicContact CD1-CG1 4.05Å; Y47-V115 HydrophobicContact CD2-CG1 3.8Å; Y47-V115 HydrophobicContact CE1-CG1 3.56Å; Y47-V115 HydrophobicContact CE2-CG1 3.24Å; Y47-V115 HydrophobicContact CG-CG1 4.18Å; Y47-V115 WeakPolarHBondContact OH-CG1 3.22Å; Y99-V115 HydrophobicContact CE1-CG2 3.81Å; Y99-V115 WeakPolarHBondContact OH-CG2 3.35Å; V109-V115 HydrophobicContact CG1-CG2 3.61Å; D113-V115 PolarHBondContact O-N 3.5Å; V115-S117 PolarHBondContact O-N 3.39Å; V115-K118 PolarHBondContact O-N 3.45Å
116C76.7Confident85.4Confident17 Ų1735.9 Ų35.912%0.11521%0.208CC..G310 helixtrans50.8-114.6-179.8-58.90000114.9C74 E78 K118 A119C74-C116 HydrophobicContact CB-CB 3.65Å; C74-C116 WeakPolarHBondContact CB-SG 3.26Å; C74-C116 WeakPolarHBondContact SG-CA 3.14Å; C74-C116 WeakPolarHBondContact SG-CB 3.24Å; C74-C116 CovalentContact SG-SG 2.04Å; C74-C116 PolarHBondContact SG-SG 2.95Å; E78-C116 HydrophobicContact CG-CB 3.83Å; E78-C116 WeakPolarHBondContact OE1-CB 3.44Å; C116-K118 PolarHBondContact O-N 2.95Å; C116-A119 VanDerWaalsContact O-CB 3.22Å; C116-A119 WeakPolarHBondContact O-CB 3.41Å; C116-A119 PolarHBondContact O-N 3.5Å
117S75.9Confident85.6Confident106 Ų10634.6 Ų34.674%0.74120%0.199SC*.G310 helixtrans-50.7-28.8176.959.90000113.7V115V115-S117 PolarHBondContact O-N 3.39Å
118K81.3Confident85.8Confident108 Ų10837 Ų3747%0.4721%0.211SC..G310 helixtrans-98.5-0.4178.9-65.8-179.9-176.41740114.4V115 C116 G120 L121V115-K118 PolarHBondContact O-N 3.45Å; C116-K118 PolarHBondContact O-N 2.95Å; K118-G120 PolarHBondContact O-N 3.37Å; K118-L121 HydrophobicContact CB-CD1 4.13Å; K118-L121 HydrophobicContact CG-CD1 4.28Å; K118-L121 VanDerWaalsContact O-CB 3.32Å; K118-L121 WeakPolarHBondContact O-CB 3.27Å; K118-L121 PolarHBondContact O-N 2.99Å
119A79.1Confident86.1Confident21 Ų2137.1 Ų37.117%0.17421%0.212CC..Hα-helixtrans-59.3-33.3-178.500000112.9L114 C116 L121 N122L114-A119 WeakPolarHBondContact O-CA 3.15Å; C116-A119 VanDerWaalsContact O-CB 3.22Å; C116-A119 WeakPolarHBondContact O-CB 3.41Å; C116-A119 PolarHBondContact O-N 3.5Å; A119-L121 PolarHBondContact O-N 2.98Å; A119-N122 PolarHBondContact O-N 3.34Å
120G83.4Confident86.4Confident27 Ų2737.4 Ų37.428%0.27821%0.213SC..Hα-helixtrans-62.5-24.6177.500000114K118 N122 S123 L124 M465K118-G120 PolarHBondContact O-N 3.37Å; G120-N122 PolarHBondContact O-N 2.84Å; G120-S123 PolarHBondContact O-N 3.07Å; G120-L124 VanDerWaalsContact O-CB 3.32Å; G120-L124 WeakPolarHBondContact O-CB 3.33Å; G120-L124 PolarHBondContact O-N 3.5Å; G120-M465 VanDerWaalsContact CA-SD 3.56Å
121L86.8Confident86.8Confident67 Ų6740.8 Ų40.835%0.35123%0.226SC..Hα-helixtrans-65.5-37.7179.8-66.7177.2000112L114 K118 A119 L124 G125 F173L114-L121 HydrophobicContact CD2-CB 4.18Å; L114-L121 HydrophobicContact CD2-CD1 4.11Å; K118-L121 HydrophobicContact CB-CD1 4.13Å; K118-L121 HydrophobicContact CG-CD1 4.28Å; K118-L121 VanDerWaalsContact O-CB 3.32Å; K118-L121 WeakPolarHBondContact O-CB 3.27Å; K118-L121 PolarHBondContact O-N 2.99Å; A119-L121 PolarHBondContact O-N 2.98Å; L121-L124 PolarHBondContact O-N 3.05Å; L121-G125 PolarHBondContact O-N 3.35Å; L121-F173 HydrophobicContact CB-CE1 3.74Å; L121-F173 HydrophobicContact CB-CZ 4.07Å; L121-F173 VanDerWaalsContact O-CZ 3.26Å; L121-F173 WeakPolarHBondContact O-CZ 3.49Å
122N86.4Confident87.1Confident24 Ų2437.4 Ų37.413%0.12821%0.21CC..Hα-helixtrans-66.3-43.8178.9-171.737.8000111.7G42 L114 A119 G120 G125 S126G42-N122 PolarHBondContact O-ND2 3.37Å; L114-N122 HydrophobicContact CD1-CB 4.29Å; A119-N122 PolarHBondContact O-N 3.34Å; G120-N122 PolarHBondContact O-N 2.84Å; N122-G125 PolarHBondContact O-N 3.15Å; N122-S126 PolarHBondContact O-N 3.35Å; N122-S126 VanDerWaalsContact O-N 3.13Å; N122-S126 PolarHBondContact O-OG 3.46Å
123S87.7Confident87.2Confident23 Ų2335.4 Ų35.416%0.16120%0.203CC..Hα-helixtrans-63.3-43.2173.5-63.50000111.6G120 G125 S126 S127G120-S123 PolarHBondContact O-N 3.07Å; S123-G125 VanDerWaalsContact C-N 3.32Å; S123-G125 PolarHBondContact O-N 3.23Å; S123-S126 WeakPolarHBondContact O-CB 3.47Å; S123-S126 PolarHBondContact O-N 2.99Å; S123-S126 VanDerWaalsContact O-N 3.15Å; S123-S127 PolarHBondContact O-N 3.45Å; S123-S127 PolarHBondContact O-OG 3.07Å
124L89.8Confident87.5Confident87 Ų8733.8 Ų33.846%0.45519%0.194SC..Hα-helixtrans-59.8-41.7175.3-178.264.3000111.6G120 L121 S126 S127 I128G120-L124 VanDerWaalsContact O-CB 3.32Å; G120-L124 WeakPolarHBondContact O-CB 3.33Å; G120-L124 PolarHBondContact O-N 3.5Å; L121-L124 PolarHBondContact O-N 3.05Å; L124-S126 VanDerWaalsContact C-N 3.32Å; L124-S126 PolarHBondContact O-N 2.92Å; L124-S127 PolarHBondContact O-N 3.31Å; L124-I128 HydrophobicContact CD1-CD1 4.27Å; L124-I128 HydrophobicContact CD1-CG1 4.4Å; L124-I128 HydrophobicContact CD2-CD1 4.49Å; L124-I128 HydrophobicContact CG-CD1 3.88Å; L124-I128 HydrophobicContact CG-CG1 4.43Å; L124-I128 WeakPolarHBondContact O-CB 3.15Å; L124-I128 VanDerWaalsContact O-CG1 3.29Å; L124-I128 WeakPolarHBondContact O-CG1 3.45Å; L124-I128 PolarHBondContact O-N 3.39Å
125G90.1Very high88Confident7 Ų735.4 Ų35.47%0.07220%0.204CC..Hα-helixtrans-59.1-41.2174.300000112.8L121 N122 S123 I128 Y129L121-G125 PolarHBondContact O-N 3.35Å; N122-G125 PolarHBondContact O-N 3.15Å; S123-G125 VanDerWaalsContact C-N 3.32Å; S123-G125 PolarHBondContact O-N 3.23Å; G125-I128 PolarHBondContact O-N 3.15Å; G125-Y129 WeakPolarHBondContact O-CB 3.19Å; G125-Y129 PolarHBondContact O-N 3.03Å
126S90.3Very high88.5Confident22 Ų2235.1 Ų35.115%0.15420%0.202CC..Hα-helixtrans-67.3-38.2174.6-63.20000112.5N122 S123 L124 Y129 M130N122-S126 PolarHBondContact O-N 3.35Å; N122-S126 VanDerWaalsContact O-N 3.13Å; N122-S126 PolarHBondContact O-OG 3.46Å; S123-S126 WeakPolarHBondContact O-CB 3.47Å; S123-S126 PolarHBondContact O-N 2.99Å; S123-S126 VanDerWaalsContact O-N 3.15Å; L124-S126 VanDerWaalsContact C-N 3.32Å; L124-S126 PolarHBondContact O-N 2.92Å; S126-Y129 WeakPolarHBondContact O-CB 3.29Å; S126-Y129 PolarHBondContact O-N 3.38Å; S126-M130 WeakPolarHBondContact O-CG 3.41Å; S126-M130 PolarHBondContact O-N 2.98Å
127S92.6Very high89Confident4 Ų435.1 Ų35.13%0.02820%0.202CC..Hα-helixtrans-67.6-40.1174.5-70.90000112.6S123 L124 Y129 M130 F131 V458 I462S123-S127 PolarHBondContact O-N 3.45Å; S123-S127 PolarHBondContact O-OG 3.07Å; L124-S127 PolarHBondContact O-N 3.31Å; S127-Y129 VanDerWaalsContact C-N 3.32Å; S127-M130 PolarHBondContact O-N 2.96Å; S127-F131 WeakPolarHBondContact O-CB 3.15Å; S127-F131 PolarHBondContact O-N 3.46Å; S127-V458 WeakPolarHBondContact CB-O 3.3Å; S127-V458 PolarHBondContact OG-O 2.84Å; S127-I462 WeakPolarHBondContact OG-CG1 3Å
128I94.6Very high89.6Confident50 Ų5033.6 Ų33.626%0.25619%0.188SC..Hα-helixtrans-63.6-40.9174.7-71.2166.8000110.3L124 G125 M130 F131 G132 V177 F181L124-I128 HydrophobicContact CD1-CD1 4.27Å; L124-I128 HydrophobicContact CD1-CG1 4.4Å; L124-I128 HydrophobicContact CD2-CD1 4.49Å; L124-I128 HydrophobicContact CG-CD1 3.88Å; L124-I128 HydrophobicContact CG-CG1 4.43Å; L124-I128 WeakPolarHBondContact O-CB 3.15Å; L124-I128 VanDerWaalsContact O-CG1 3.29Å; L124-I128 WeakPolarHBondContact O-CG1 3.45Å; L124-I128 PolarHBondContact O-N 3.39Å; G125-I128 PolarHBondContact O-N 3.15Å; I128-M130 PolarHBondContact O-N 3.22Å; I128-F131 WeakPolarHBondContact O-CB 3.4Å; I128-F131 PolarHBondContact O-N 2.87Å; I128-G132 PolarHBondContact O-N 2.95Å; I128-V177 HydrophobicContact CB-CG1 4.03Å; I128-V177 HydrophobicContact CD1-CG1 3.49Å; I128-V177 VanDerWaalsContact CD1-CG1 3.49Å; I128-V177 HydrophobicContact CG1-CG1 4.36Å; I128-V177 HydrophobicContact CG2-CG1 3.7Å; I128-F181 HydrophobicContact CG2-CB 3.88Å; I128-F181 HydrophobicContact CG2-CD2 4.06Å; I128-F181 HydrophobicContact CG2-CG 4.37Å
129Y93.4Very high90Very high4 Ų432.9 Ų32.92%0.01619%0.189CC..Hα-helixtrans-57.1-48.9171.7169.1-97.4000111.8H34 M35 G125 S126 S127 F131 G132 L133 R180 V183 I187H34-Y129 PolarHBondContact O-OH 2.97Å; M35-Y129 WeakPolarHBondContact CA-OH 3.35Å; G125-Y129 WeakPolarHBondContact O-CB 3.19Å; G125-Y129 PolarHBondContact O-N 3.03Å; S126-Y129 WeakPolarHBondContact O-CB 3.29Å; S126-Y129 PolarHBondContact O-N 3.38Å; S127-Y129 VanDerWaalsContact C-N 3.32Å; Y129-F131 VanDerWaalsContact C-N 3.3Å; Y129-F131 PolarHBondContact O-N 3.35Å; Y129-G132 WeakPolarHBondContact O-CA 3.25Å; Y129-G132 PolarHBondContact O-N 3.4Å; Y129-L133 HydrophobicContact CD1-CD1 4.15Å; Y129-L133 HydrophobicContact CE1-CD1 3.85Å; Y129-L133 HydrophobicContact CE2-CD1 4.25Å; Y129-L133 HydrophobicContact CG-CD1 4.5Å; Y129-L133 WeakPolarHBondContact O-CD1 3.41Å; Y129-L133 PolarHBondContact O-N 3.41Å; Y129-R180 HydrophobicContact CD2-CB 4.4Å; Y129-R180 VanDerWaalsContact CD2-O 3.3Å; Y129-R180 WeakPolarHBondContact CD2-O 3.32Å; Y129-V183 HydrophobicContact CE2-CG1 4.28Å; Y129-I187 HydrophobicContact CE2-CD1 3.92Å; Y129-I187 WeakPolarHBondContact OH-CD1 3.35Å
130M92.8Very high90.5Very high5 Ų532.6 Ų32.63%0.02518%0.184CC..Hα-helixtrans-63.5-33.7175.9-69.4-64.4-179.700113.1M35 S126 S127 I128 G132 L133 L134 Y343 G457 V458M35-M130 HydrophobicContact CE-CE 4.21Å; M35-M130 HydrophobicContact CE-SD 4.34Å; S126-M130 WeakPolarHBondContact O-CG 3.41Å; S126-M130 PolarHBondContact O-N 2.98Å; S127-M130 PolarHBondContact O-N 2.96Å; I128-M130 PolarHBondContact O-N 3.22Å; M130-G132 VanDerWaalsContact C-N 3.29Å; M130-L133 WeakPolarHBondContact O-CB 3.45Å; M130-L133 PolarHBondContact O-N 2.93Å; M130-L133 VanDerWaalsContact O-N 3.12Å; M130-L133 HydrophobicContact SD-CD2 4.34Å; M130-L134 PolarHBondContact O-N 3.38Å; M130-Y343 HydrophobicContact CE-CD1 3.43Å; M130-Y343 VanDerWaalsContact CE-CD1 3.43Å; M130-Y343 HydrophobicContact CE-CD2 4.12Å; M130-Y343 HydrophobicContact CE-CE1 3.51Å; M130-Y343 HydrophobicContact CE-CE2 4.19Å; M130-Y343 HydrophobicContact CE-CG 3.78Å; M130-Y343 HydrophobicContact SD-CD2 4.5Å; M130-Y343 HydrophobicContact SD-CE2 4.33Å; M130-G457 WeakPolarHBondContact CG-O 3.31Å; M130-V458 HydrophobicContact CB-CG2 3.95Å
131F94.5Very high90.5Very high98 Ų9832.1 Ų32.143%0.4318%0.178SC..Hα-helixtrans-66-36.2173.6179.7-110.1000111S127 I128 Y129 L133 L134 V135 F181 V458S127-F131 WeakPolarHBondContact O-CB 3.15Å; S127-F131 PolarHBondContact O-N 3.46Å; I128-F131 WeakPolarHBondContact O-CB 3.4Å; I128-F131 PolarHBondContact O-N 2.87Å; Y129-F131 VanDerWaalsContact C-N 3.3Å; Y129-F131 PolarHBondContact O-N 3.35Å; F131-L133 VanDerWaalsContact C-N 3.27Å; F131-L133 PolarHBondContact O-N 3.46Å; F131-L134 HydrophobicContact CD2-CD2 4.14Å; F131-L134 HydrophobicContact CE2-CD2 4.15Å; F131-L134 WeakPolarHBondContact O-CB 3.25Å; F131-L134 PolarHBondContact O-N 3.1Å; F131-L134 VanDerWaalsContact O-N 3.12Å; F131-V135 HydrophobicContact CD1-CG2 4.31Å; F131-V135 HydrophobicContact CE1-CG2 3.85Å; F131-V135 HydrophobicContact CE2-CG2 4.32Å; F131-V135 HydrophobicContact CZ-CG2 3.85Å; F131-V135 PolarHBondContact O-N 2.84Å; F131-F181 HydrophobicContact CD1-CD2 4.27Å; F131-F181 AromaticContact CD1-CE2 3.63Å; F131-F181 HydrophobicContact CD1-CE2 3.63Å; F131-F181 HydrophobicContact CE1-CE2 4.03Å; F131-V458 HydrophobicContact CB-CG2 3.97Å
132G94.6Very high90.4Very high0 Ų032 Ų320%019%0.187CC..Hα-helixtrans-52.4-44167.900000112.4I128 Y129 M130 L134 V135 G136 F181 T185I128-G132 PolarHBondContact O-N 2.95Å; Y129-G132 WeakPolarHBondContact O-CA 3.25Å; Y129-G132 PolarHBondContact O-N 3.4Å; M130-G132 VanDerWaalsContact C-N 3.29Å; G132-L134 VanDerWaalsContact C-N 3.33Å; G132-L134 PolarHBondContact O-N 3.35Å; G132-V135 PolarHBondContact O-N 3.48Å; G132-G136 PolarHBondContact O-N 3.36Å; G132-F181 VanDerWaalsContact CA-CE2 3.46Å; G132-T185 WeakPolarHBondContact O-CA 3.4Å; G132-T185 PolarHBondContact O-N 2.66Å; G132-T185 PolarHBondContact O-OG1 3.35Å
133L92.1Very high90.4Very high0 Ų033.8 Ų33.80%020%0.196CC..Hα-helixtrans-64.3-36.3178.5-78.473.7000112.3M35 Y129 M130 F131 S137 G184 I187 S188M35-L133 HydrophobicContact CE-CD2 3.45Å; M35-L133 VanDerWaalsContact CE-CD2 3.45Å; M35-L133 HydrophobicContact SD-CD2 4.11Å; Y129-L133 HydrophobicContact CD1-CD1 4.15Å; Y129-L133 HydrophobicContact CE1-CD1 3.85Å; Y129-L133 HydrophobicContact CE2-CD1 4.25Å; Y129-L133 HydrophobicContact CG-CD1 4.5Å; Y129-L133 WeakPolarHBondContact O-CD1 3.41Å; Y129-L133 PolarHBondContact O-N 3.41Å; M130-L133 WeakPolarHBondContact O-CB 3.45Å; M130-L133 PolarHBondContact O-N 2.93Å; M130-L133 VanDerWaalsContact O-N 3.12Å; M130-L133 HydrophobicContact SD-CD2 4.34Å; F131-L133 VanDerWaalsContact C-N 3.27Å; F131-L133 PolarHBondContact O-N 3.46Å; L133-S137 PolarHBondContact O-N 3.47Å; L133-G184 WeakPolarHBondContact CA-O 3.13Å; L133-G184 WeakPolarHBondContact CD1-O 3.28Å; L133-G184 VanDerWaalsContact CG-O 3.32Å; L133-G184 WeakPolarHBondContact CG-O 3.35Å; L133-I187 HydrophobicContact CD2-CG2 3.88Å; L133-I187 HydrophobicContact CG-CB 4.48Å; L133-I187 HydrophobicContact CG-CG2 4.07Å; L133-S188 WeakPolarHBondContact O-CB 3.24Å; L133-S188 PolarHBondContact O-OG 3.08Å
134L91.4Very high90.3Very high28 Ų2832.9 Ų32.915%0.14719%0.189CC..Hα-helixtrans-63.4-53.1174.2174.865.8000110.5M130 F131 G132 G136 S137 M451 R454M130-L134 PolarHBondContact O-N 3.38Å; F131-L134 HydrophobicContact CD2-CD2 4.14Å; F131-L134 HydrophobicContact CE2-CD2 4.15Å; F131-L134 WeakPolarHBondContact O-CB 3.25Å; F131-L134 PolarHBondContact O-N 3.1Å; F131-L134 VanDerWaalsContact O-N 3.12Å; G132-L134 VanDerWaalsContact C-N 3.33Å; G132-L134 PolarHBondContact O-N 3.35Å; L134-G136 VanDerWaalsContact C-N 3.29Å; L134-G136 PolarHBondContact O-N 2.91Å; L134-S137 PolarHBondContact O-N 2.88Å; L134-S137 VanDerWaalsContact O-N 3.14Å; L134-S137 PolarHBondContact O-OG 3.31Å; L134-M451 HydrophobicContact CD1-CB 3.92Å; L134-M451 HydrophobicContact CD1-CE 4.24Å; L134-M451 HydrophobicContact CD1-CG 4.16Å; L134-R454 HydrophobicContact CB-CB 3.9Å; L134-R454 HydrophobicContact CB-CG 4.48Å; L134-R454 HydrophobicContact CD1-CB 3.93Å; L134-R454 HydrophobicContact CD1-CG 4.41Å; L134-R454 HydrophobicContact CG-CB 4.47Å
135V93.6Very high90Very high40 Ų4033.4 Ų33.424%0.24219%0.193CC..Hα-helixtrans-59.2-43178.81750000110.8F131 G132 S137 V138 L139 F181F131-V135 HydrophobicContact CD1-CG2 4.31Å; F131-V135 HydrophobicContact CE1-CG2 3.85Å; F131-V135 HydrophobicContact CE2-CG2 4.32Å; F131-V135 HydrophobicContact CZ-CG2 3.85Å; F131-V135 PolarHBondContact O-N 2.84Å; G132-V135 PolarHBondContact O-N 3.48Å; V135-S137 VanDerWaalsContact C-N 3.29Å; V135-S137 PolarHBondContact O-N 3.45Å; V135-V138 PolarHBondContact O-N 2.96Å; V135-L139 HydrophobicContact CG1-CD1 3.65Å; V135-L139 HydrophobicContact CG1-CG 4.2Å; V135-L139 WeakPolarHBondContact O-CG 3.41Å; V135-L139 PolarHBondContact O-N 3.42Å; V135-F181 HydrophobicContact CB-CZ 4.34Å; V135-F181 HydrophobicContact CG1-CZ 4.37Å; V135-F181 HydrophobicContact CG2-CE2 4.3Å; V135-F181 HydrophobicContact CG2-CZ 4.22Å
136G91.3Very high89.7Confident0 Ų042 Ų420%022%0.223CC..Hα-helixtrans-61.9-34.4178.100000113.6G132 L134 V138 F140 T185G132-G136 PolarHBondContact O-N 3.36Å; L134-G136 VanDerWaalsContact C-N 3.29Å; L134-G136 PolarHBondContact O-N 2.91Å; G136-V138 VanDerWaalsContact C-N 3.31Å; G136-V138 PolarHBondContact O-N 3.5Å; G136-F140 WeakPolarHBondContact O-CB 3.39Å; G136-F140 PolarHBondContact O-N 2.86Å; G136-T185 WeakPolarHBondContact CA-O 3.17Å
137S87.8Confident89.5Confident16 Ų1646.2 Ų46.211%0.11224%0.236CC..Hα-helixtrans-64.2-38.9179.5700000112.2L133 L134 V135 G141 S188L133-S137 PolarHBondContact O-N 3.47Å; L134-S137 PolarHBondContact O-N 2.88Å; L134-S137 VanDerWaalsContact O-N 3.14Å; L134-S137 PolarHBondContact O-OG 3.31Å; V135-S137 VanDerWaalsContact C-N 3.29Å; V135-S137 PolarHBondContact O-N 3.45Å; S137-G141 WeakPolarHBondContact O-CA 3.36Å; S137-G141 PolarHBondContact O-N 2.69Å; S137-G141 VanDerWaalsContact O-N 3.17Å; S137-S188 WeakPolarHBondContact CA-OG 3.49Å; S137-S188 VanDerWaalsContact CB-OG 3.22Å; S137-S188 WeakPolarHBondContact CB-OG 3.2Å; S137-S188 PolarHBondContact N-OG 2.96Å; S137-S188 VanDerWaalsContact N-OG 3.11Å
138V88Confident89.1Confident75 Ų7546 Ų4646%0.45524%0.235SC..Hα-helixtrans-74.4-49.1179.6-179.90000110.2V135 G136 A142 M451V135-V138 PolarHBondContact O-N 2.96Å; G136-V138 VanDerWaalsContact C-N 3.31Å; G136-V138 PolarHBondContact O-N 3.5Å; V138-A142 WeakPolarHBondContact O-CB 3.21Å; V138-A142 PolarHBondContact O-N 2.95Å; V138-A142 VanDerWaalsContact O-N 3.1Å; V138-M451 HydrophobicContact CG2-CE 3.68Å; V138-M451 HydrophobicContact CG2-SD 4.37Å
139L90.9Very high88.8Confident92 Ų9245.2 Ų45.248%0.48223%0.229SC..Hα-helixtrans-66.1-57.8-176.8-68.1178.4000112.1V135 G141 A142 M143 T185V135-L139 HydrophobicContact CG1-CD1 3.65Å; V135-L139 HydrophobicContact CG1-CG 4.2Å; V135-L139 WeakPolarHBondContact O-CG 3.41Å; V135-L139 PolarHBondContact O-N 3.42Å; L139-G141 VanDerWaalsContact C-N 3.31Å; L139-G141 PolarHBondContact O-N 2.98Å; L139-A142 PolarHBondContact O-N 3.28Å; L139-M143 WeakPolarHBondContact O-CB 3.37Å; L139-M143 VanDerWaalsContact O-CG 3.25Å; L139-M143 WeakPolarHBondContact O-CG 3.44Å; L139-M143 PolarHBondContact O-N 3.48Å; L139-T185 HydrophobicContact CD1-CG2 4.46Å
140F88.6Confident88.6Confident16 Ų1648.4 Ų48.47%0.0724%0.241CC..Hα-helixtrans-74.1-24.5-175.9-70.3-63.2000112.5G136 M143 A144 V152 L155 L159 T185 T186G136-F140 WeakPolarHBondContact O-CB 3.39Å; G136-F140 PolarHBondContact O-N 2.86Å; F140-M143 HydrophobicContact CD1-SD 4.11Å; F140-M143 HydrophobicContact CE1-SD 4.34Å; F140-A144 VanDerWaalsContact O-CB 3.22Å; F140-A144 WeakPolarHBondContact O-CB 3.43Å; F140-A144 PolarHBondContact O-N 3.32Å; F140-V152 HydrophobicContact CB-CG1 3.99Å; F140-V152 HydrophobicContact CD1-CG1 3.64Å; F140-V152 HydrophobicContact CG-CG1 4.24Å; F140-L155 HydrophobicContact CE1-CD2 4.4Å; F140-L159 HydrophobicContact CZ-CD1 4.14Å; F140-T185 HydrophobicContact CD2-CG2 4.27Å; F140-T185 WeakPolarHBondContact CD2-O 3.35Å; F140-T185 HydrophobicContact CE2-CG2 3.79Å; F140-T185 WeakPolarHBondContact CE2-O 3.35Å; F140-T186 HydrophobicContact CE2-CG2 4.48Å
141G83.8Confident88.5Confident16 Ų1652.9 Ų52.917%0.16526%0.264CS..Hα-helixtrans-62.3-54.8168.300000111.5S137 L139 M143 A144 D145S137-G141 WeakPolarHBondContact O-CA 3.36Å; S137-G141 PolarHBondContact O-N 2.69Å; S137-G141 VanDerWaalsContact O-N 3.17Å; L139-G141 VanDerWaalsContact C-N 3.31Å; L139-G141 PolarHBondContact O-N 2.98Å; G141-M143 VanDerWaalsContact C-N 3.34Å; G141-M143 PolarHBondContact O-N 3.02Å; G141-A144 WeakPolarHBondContact O-CB 3.48Å; G141-A144 PolarHBondContact O-N 2.82Å; G141-A144 VanDerWaalsContact O-N 3.15Å; G141-D145 PolarHBondContact O-N 3.02Å
142A84.2Confident88.4Confident65 Ų6548.2 Ų48.254%0.53724%0.244SC..Hα-helixtrans-63.1-39.4178.900000112.7V138 L139 A144 D145 R146V138-A142 WeakPolarHBondContact O-CB 3.21Å; V138-A142 PolarHBondContact O-N 2.95Å; V138-A142 VanDerWaalsContact O-N 3.1Å; L139-A142 PolarHBondContact O-N 3.28Å; A142-A144 VanDerWaalsContact C-N 3.3Å; A142-A144 PolarHBondContact O-N 2.84Å; A142-D145 PolarHBondContact O-N 3.18Å; A142-R146 PolarHBondContact O-N 2.79Å
143M87.4Confident88.2Confident62 Ų6248.3 Ų48.331%0.30524%0.244SC..Hα-helixtrans-63.1-36.5175.5-7417868.500112.3L139 F140 G141 D145 R146 Y147 V152 L155L139-M143 WeakPolarHBondContact O-CB 3.37Å; L139-M143 VanDerWaalsContact O-CG 3.25Å; L139-M143 WeakPolarHBondContact O-CG 3.44Å; L139-M143 PolarHBondContact O-N 3.48Å; F140-M143 HydrophobicContact CD1-SD 4.11Å; F140-M143 HydrophobicContact CE1-SD 4.34Å; G141-M143 VanDerWaalsContact C-N 3.34Å; G141-M143 PolarHBondContact O-N 3.02Å; M143-D145 VanDerWaalsContact C-N 3.3Å; M143-D145 PolarHBondContact O-N 3.25Å; M143-R146 PolarHBondContact O-N 2.92Å; M143-Y147 HydrophobicContact CB-CD2 4.17Å; M143-Y147 HydrophobicContact CE-CD2 4.47Å; M143-Y147 HydrophobicContact CG-CD2 4.41Å; M143-Y147 HydrophobicContact CG-CE2 4.43Å; M143-Y147 WeakPolarHBondContact O-CB 3.42Å; M143-Y147 WeakPolarHBondContact O-CD2 3.3Å; M143-Y147 PolarHBondContact O-N 3.25Å; M143-V152 HydrophobicContact CB-CG2 3.97Å; M143-L155 HydrophobicContact CE-CD2 4.02Å
144A85.8Confident88.2Confident3 Ų349.8 Ų49.83%0.02525%0.252CS..Hα-helixtrans-66.9-32.6-177.900000113.2F140 G141 A142 G148 R149 V152 N193F140-A144 VanDerWaalsContact O-CB 3.22Å; F140-A144 WeakPolarHBondContact O-CB 3.43Å; F140-A144 PolarHBondContact O-N 3.32Å; G141-A144 WeakPolarHBondContact O-CB 3.48Å; G141-A144 PolarHBondContact O-N 2.82Å; G141-A144 VanDerWaalsContact O-N 3.15Å; A142-A144 VanDerWaalsContact C-N 3.3Å; A142-A144 PolarHBondContact O-N 2.84Å; A144-G148 CarbonylContact O-C 3.57Å; A144-G148 VanDerWaalsContact O-C 3.31Å; A144-G148 WeakPolarHBondContact O-CA 3.48Å; A144-G148 PolarHBondContact O-N 2.78Å; A144-R149 HydrophobicContact CB-CG 4.4Å; A144-V152 HydrophobicContact CB-CB 4.34Å; A144-V152 HydrophobicContact CB-CG1 4.48Å; A144-V152 HydrophobicContact CB-CG2 4.32Å; A144-N193 WeakPolarHBondContact CB-OD1 3.34Å
145D82.8Confident88.3Confident98 Ų9851.7 Ų51.752%0.52426%0.262SS..Hα-helixtrans-71.2-41.4175.8-68.5-24000111.2G141 A142 M143 R149 W262G141-D145 PolarHBondContact O-N 3.02Å; A142-D145 PolarHBondContact O-N 3.18Å; M143-D145 VanDerWaalsContact C-N 3.3Å; M143-D145 PolarHBondContact O-N 3.25Å; D145-R149 IonicContact OD1-CZ 2.85Å; D145-R149 IonicContact OD1-NE 3.12Å; D145-R149 IonicContact OD1-NH2 2.68Å; D145-R149 PolarHBondContact OD1-NH2 3.37Å; D145-W262 PolarHBondContact O-NE1 3.28Å
146R82.8Confident88.3Confident187 Ų18749.8 Ų49.871%0.70625%0.25SS*.Hα-helixtrans-76-48.4-178.9-170.2171.9-177.5172.4-0.7113.6A142 M143A142-R146 PolarHBondContact O-N 2.79Å; M143-R146 PolarHBondContact O-N 2.92Å
147Y86.6Confident88.4Confident111 Ų11150.4 Ų50.444%0.43525%0.253SS..Hα-helixtrans-101.8-10.9-171.5-58.4-67.8000113.8M143M143-Y147 HydrophobicContact CB-CD2 4.17Å; M143-Y147 HydrophobicContact CE-CD2 4.47Å; M143-Y147 HydrophobicContact CG-CD2 4.41Å; M143-Y147 HydrophobicContact CG-CE2 4.43Å; M143-Y147 WeakPolarHBondContact O-CB 3.42Å; M143-Y147 WeakPolarHBondContact O-CD2 3.3Å; M143-Y147 PolarHBondContact O-N 3.25Å
148G84.7Confident88.6Confident0 Ų052 Ų520%027%0.267CS..  trans95.6145.5179.100000113.4A144 R150 L151 V152 W262A144-G148 CarbonylContact O-C 3.57Å; A144-G148 VanDerWaalsContact O-C 3.31Å; A144-G148 WeakPolarHBondContact O-CA 3.48Å; A144-G148 PolarHBondContact O-N 2.78Å; G148-R150 PolarHBondContact O-N 3.45Å; G148-L151 PolarHBondContact O-N 3.04Å; G148-V152 PolarHBondContact O-N 2.89Å; G148-W262 VanDerWaalsContact CA-CE2 3.42Å
149R87.1Confident88.9Confident33 Ų3351 Ų5113%0.12526%0.26CS..Hα-helixtrans-61.8-38.8-171.1-6786.5-156.3-160.29.6113.6A144 D145 L153 V196 E200A144-R149 HydrophobicContact CB-CG 4.4Å; D145-R149 IonicContact OD1-CZ 2.85Å; D145-R149 IonicContact OD1-NE 3.12Å; D145-R149 IonicContact OD1-NH2 2.68Å; D145-R149 PolarHBondContact OD1-NH2 3.37Å; R149-L153 VanDerWaalsContact O-CB 3.24Å; R149-L153 WeakPolarHBondContact O-CB 3.24Å; R149-L153 PolarHBondContact O-N 2.91Å; R149-V196 HydrophobicContact CG-CG1 4.19Å; R149-E200 IonicContact CZ-OE1 2.76Å; R149-E200 IonicContact NH1-OE1 2.63Å; R149-E200 PolarHBondContact NH1-OE1 3.19Å; R149-E200 VanDerWaalsContact NH1-OE1 3.1Å
150R89.8Confident89.1Confident71 Ų7147.1 Ų47.127%0.26824%0.239SC..Hα-helixtrans-61.8-48.8179176.7-174.9174.4-166.65.2112G148 L153 L154 I253 L256G148-R150 PolarHBondContact O-N 3.45Å; R150-L153 PolarHBondContact O-N 3.06Å; R150-L154 HydrophobicContact CG-CD1 3.96Å; R150-L154 VanDerWaalsContact O-CG 3.3Å; R150-L154 WeakPolarHBondContact O-CG 3.49Å; R150-L154 PolarHBondContact O-N 3.1Å; R150-I253 PolarHBondContact NH2-O 3.17Å; R150-L256 VanDerWaalsContact CD-O 3.24Å; R150-L256 WeakPolarHBondContact CD-O 3.35Å; R150-L256 HydrophobicContact CG-CB 4.29Å; R150-L256 VanDerWaalsContact CZ-O 3.27Å; R150-L256 PolarHBondContact NE-O 3.04Å
151L91Very high89.3Confident99 Ų9946.8 Ų46.852%0.51824%0.238SC..Hα-helixtrans-64-46.1-177.3-178.867.2000110.4G148 L153 L154 L155G148-L151 PolarHBondContact O-N 3.04Å; L151-L153 PolarHBondContact O-N 3.4Å; L151-L154 PolarHBondContact O-N 3.2Å; L151-L155 WeakPolarHBondContact O-CB 3.36Å; L151-L155 PolarHBondContact O-N 3.45Å
152V92.1Very high89.8Confident1 Ų149.8 Ų49.81%0.00625%0.253CS..Hα-helixtrans-67-37.7-178.9-178.50000112F140 M143 A144 G148 L155 S156 N193F140-V152 HydrophobicContact CB-CG1 3.99Å; F140-V152 HydrophobicContact CD1-CG1 3.64Å; F140-V152 HydrophobicContact CG-CG1 4.24Å; M143-V152 HydrophobicContact CB-CG2 3.97Å; A144-V152 HydrophobicContact CB-CB 4.34Å; A144-V152 HydrophobicContact CB-CG1 4.48Å; A144-V152 HydrophobicContact CB-CG2 4.32Å; G148-V152 PolarHBondContact O-N 2.89Å; V152-L155 PolarHBondContact O-N 2.9Å; V152-S156 VanDerWaalsContact O-CB 3.31Å; V152-S156 WeakPolarHBondContact O-CB 3.17Å; V152-S156 PolarHBondContact O-N 3.26Å; V152-S156 PolarHBondContact O-OG 3.01Å; V152-N193 VanDerWaalsContact CG1-ND2 3.35Å; V152-N193 WeakPolarHBondContact CG1-ND2 3.4Å
153L90.9Very high90.4Very high2 Ų249.9 Ų49.91%0.0124%0.242CC..Hα-helixtrans-61.9-48.1173.8-179.156.5000111.8R149 R150 L151 S156 I157 V190 N193 A194 L197 L256R149-L153 VanDerWaalsContact O-CB 3.24Å; R149-L153 WeakPolarHBondContact O-CB 3.24Å; R149-L153 PolarHBondContact O-N 2.91Å; R150-L153 PolarHBondContact O-N 3.06Å; L151-L153 PolarHBondContact O-N 3.4Å; L153-S156 PolarHBondContact O-N 3.3Å; L153-I157 HydrophobicContact CD1-CD1 4.03Å; L153-I157 HydrophobicContact CD1-CG1 4.37Å; L153-I157 HydrophobicContact CG-CD1 4.09Å; L153-I157 WeakPolarHBondContact O-CG1 3.14Å; L153-I157 PolarHBondContact O-N 3.34Å; L153-V190 HydrophobicContact CD1-CB 4.34Å; L153-V190 HydrophobicContact CD1-CG1 3.99Å; L153-N193 HydrophobicContact CB-CB 3.94Å; L153-N193 HydrophobicContact CD1-CB 4.33Å; L153-A194 HydrophobicContact CD1-CB 4.14Å; L153-A194 HydrophobicContact CD2-CB 4.37Å; L153-L197 HydrophobicContact CD2-CD2 4.26Å; L153-L256 HydrophobicContact CD2-CD1 3.6Å; L153-L256 HydrophobicContact CG-CD1 4.19Å
154L92.3Very high90.7Very high30 Ų3047 Ų4716%0.15723%0.227CC..Hα-helixtrans-63.3-42.8178.2-69.1170.6000111.9R150 L151 S156 I157 A158 I253 L256R150-L154 HydrophobicContact CG-CD1 3.96Å; R150-L154 VanDerWaalsContact O-CG 3.3Å; R150-L154 WeakPolarHBondContact O-CG 3.49Å; R150-L154 PolarHBondContact O-N 3.1Å; L151-L154 PolarHBondContact O-N 3.2Å; L154-S156 VanDerWaalsContact C-N 3.35Å; L154-I157 PolarHBondContact O-N 3.21Å; L154-A158 WeakPolarHBondContact O-CB 3.32Å; L154-A158 PolarHBondContact O-N 3.33Å; L154-I253 HydrophobicContact CD1-CG1 4.18Å; L154-I253 HydrophobicContact CD2-CG1 4.05Å; L154-L256 HydrophobicContact CD2-CD1 4.17Å
155L93.4Very high91.1Very high68 Ų6848.1 Ų48.136%0.35623%0.234SC..Hα-helixtrans-60.6-44.7174.7179.165.1000111.2F140 M143 L151 V152 I157 A158 L159F140-L155 HydrophobicContact CE1-CD2 4.4Å; M143-L155 HydrophobicContact CE-CD2 4.02Å; L151-L155 WeakPolarHBondContact O-CB 3.36Å; L151-L155 PolarHBondContact O-N 3.45Å; V152-L155 PolarHBondContact O-N 2.9Å; L155-I157 PolarHBondContact O-N 3.06Å; L155-A158 PolarHBondContact O-N 3.31Å; L155-L159 HydrophobicContact CD1-CD1 4.01Å; L155-L159 HydrophobicContact CD1-CG 4.1Å; L155-L159 HydrophobicContact CG-CD1 3.93Å; L155-L159 HydrophobicContact CG-CG 4.38Å; L155-L159 WeakPolarHBondContact O-CB 3.35Å; L155-L159 VanDerWaalsContact O-CG 3.29Å; L155-L159 WeakPolarHBondContact O-CG 3.5Å; L155-L159 PolarHBondContact O-N 3.07Å
156S93.4Very high91.8Very high0 Ų045 Ų450%022%0.221CC..Hα-helixtrans-63.5-43.2-180-56.90000111.4V152 L153 L154 L159 Q160V152-S156 VanDerWaalsContact O-CB 3.31Å; V152-S156 WeakPolarHBondContact O-CB 3.17Å; V152-S156 PolarHBondContact O-N 3.26Å; V152-S156 PolarHBondContact O-OG 3.01Å; L153-S156 PolarHBondContact O-N 3.3Å; L154-S156 VanDerWaalsContact C-N 3.35Å; S156-L159 PolarHBondContact O-N 3.06Å; S156-Q160 WeakPolarHBondContact O-CB 3.17Å; S156-Q160 PolarHBondContact O-N 3.49Å
157I92.3Very high92.4Very high13 Ų1336 Ų367%0.06719%0.188CC..Hα-helixtrans-63.1-44.6175.7-66.9167000110.9P27 L153 L154 L155 Q160 T161 V190 L249P27-I157 HydrophobicContact CB-CD1 4.45Å; P27-I157 HydrophobicContact CG-CD1 4.39Å; L153-I157 HydrophobicContact CD1-CD1 4.03Å; L153-I157 HydrophobicContact CD1-CG1 4.37Å; L153-I157 HydrophobicContact CG-CD1 4.09Å; L153-I157 WeakPolarHBondContact O-CG1 3.14Å; L153-I157 PolarHBondContact O-N 3.34Å; L154-I157 PolarHBondContact O-N 3.21Å; L155-I157 PolarHBondContact O-N 3.06Å; I157-Q160 PolarHBondContact O-N 3.21Å; I157-T161 VanDerWaalsContact O-CG2 3.27Å; I157-T161 WeakPolarHBondContact O-CG2 3.4Å; I157-T161 PolarHBondContact O-N 3.03Å; I157-T161 PolarHBondContact O-OG1 3.47Å; I157-V190 HydrophobicContact CG1-CG1 4.49Å; I157-V190 HydrophobicContact CG1-CG2 3.91Å; I157-L249 HydrophobicContact CG2-CB 3.86Å; I157-L249 HydrophobicContact CG2-CD1 3.71Å; I157-L249 HydrophobicContact CG2-CG 4.44Å
158A93.1Very high92.7Very high49 Ų4930.9 Ų30.941%0.40517%0.168SC..Hα-helixtrans-62.5-45.9178.400000111.8L154 L155 T161 V162L154-A158 WeakPolarHBondContact O-CB 3.32Å; L154-A158 PolarHBondContact O-N 3.33Å; L155-A158 PolarHBondContact O-N 3.31Å; A158-T161 PolarHBondContact O-N 3.03Å; A158-T161 PolarHBondContact O-OG1 3.05Å; A158-V162 VanDerWaalsContact O-CG2 3.3Å; A158-V162 WeakPolarHBondContact O-CG2 3.22Å; A158-V162 PolarHBondContact O-N 2.95Å; A158-V162 VanDerWaalsContact O-N 3.1Å
159L94.3Very high93.2Very high56 Ų5637.6 Ų37.629%0.29320%0.198SC..Hα-helixtrans-66.1-41.3176.8-67.1175.3000111.6F140 L155 S156 T161 V162 F163 T186F140-L159 HydrophobicContact CZ-CD1 4.14Å; L155-L159 HydrophobicContact CD1-CD1 4.01Å; L155-L159 HydrophobicContact CD1-CG 4.1Å; L155-L159 HydrophobicContact CG-CD1 3.93Å; L155-L159 HydrophobicContact CG-CG 4.38Å; L155-L159 WeakPolarHBondContact O-CB 3.35Å; L155-L159 VanDerWaalsContact O-CG 3.29Å; L155-L159 WeakPolarHBondContact O-CG 3.5Å; L155-L159 PolarHBondContact O-N 3.07Å; S156-L159 PolarHBondContact O-N 3.06Å; L159-T161 VanDerWaalsContact C-N 3.29Å; L159-T161 PolarHBondContact O-N 2.85Å; L159-V162 PolarHBondContact O-N 3.33Å; L159-F163 HydrophobicContact CB-CD2 4.14Å; L159-F163 HydrophobicContact CB-CE2 4.18Å; L159-F163 HydrophobicContact CD2-CE2 3.92Å; L159-F163 WeakPolarHBondContact O-CB 3.34Å; L159-F163 WeakPolarHBondContact O-CD2 3.44Å; L159-F163 PolarHBondContact O-N 2.65Å; L159-T186 HydrophobicContact CB-CG2 3.45Å; L159-T186 VanDerWaalsContact CB-CG2 3.45Å; L159-T186 HydrophobicContact CD1-CG2 4.42Å
160Q94.3Very high93.6Very high9 Ų936 Ų364%0.04219%0.192CC..Hα-helixtrans-59.6-40.7178.6-173.6177.1-38.100111.8H34 S156 I157 G164 T186 I187H34-Q160 PolarHBondContact CD2-NE2 2.95Å; S156-Q160 WeakPolarHBondContact O-CB 3.17Å; S156-Q160 PolarHBondContact O-N 3.49Å; I157-Q160 PolarHBondContact O-N 3.21Å; Q160-G164 VanDerWaalsContact O-CA 3.28Å; Q160-G164 WeakPolarHBondContact O-CA 3.5Å; Q160-G164 PolarHBondContact O-N 3.26Å; Q160-T186 WeakPolarHBondContact CA-OG1 3.45Å; Q160-T186 VanDerWaalsContact CB-OG1 3.27Å; Q160-T186 WeakPolarHBondContact CB-OG1 3.29Å; Q160-I187 HydrophobicContact CG-CG1 4.49Å
161T92.9Very high93.7Very high9 Ų937.1 Ų37.16%0.05521%0.208CC..Hα-helixtrans-73.2-45.3-17949.40000112.2I157 A158 L159 G164 V165 G246I157-T161 VanDerWaalsContact O-CG2 3.27Å; I157-T161 WeakPolarHBondContact O-CG2 3.4Å; I157-T161 PolarHBondContact O-N 3.03Å; I157-T161 PolarHBondContact O-OG1 3.47Å; A158-T161 PolarHBondContact O-N 3.03Å; A158-T161 PolarHBondContact O-OG1 3.05Å; L159-T161 VanDerWaalsContact C-N 3.29Å; L159-T161 PolarHBondContact O-N 2.85Å; T161-G164 PolarHBondContact O-N 3.26Å; T161-V165 WeakPolarHBondContact O-CG2 3.44Å; T161-V165 PolarHBondContact O-N 2.91Å; T161-G246 VanDerWaalsContact CG2-C 3.46Å; T161-G246 VanDerWaalsContact CG2-CA 3.43Å
162V94.7Very high93.9Very high80 Ų8035.8 Ų35.849%0.48520%0.201SC..Hα-helixtrans-61.5-53.3176.4172.30000111.1A158 L159 G164 V165 A166A158-V162 VanDerWaalsContact O-CG2 3.3Å; A158-V162 WeakPolarHBondContact O-CG2 3.22Å; A158-V162 PolarHBondContact O-N 2.95Å; A158-V162 VanDerWaalsContact O-N 3.1Å; L159-V162 PolarHBondContact O-N 3.33Å; V162-G164 VanDerWaalsContact C-N 3.34Å; V162-G164 PolarHBondContact O-N 3.23Å; V162-V165 PolarHBondContact O-N 3.23Å; V162-A166 WeakPolarHBondContact O-CB 3.28Å; V162-A166 PolarHBondContact O-N 2.99Å
163F95.9Very high93.8Very high67 Ų6737 Ų3729%0.29421%0.207SC..Hα-helixtrans-68.3-35.1178.9-68.2-57.9000111.9L159 V165 A166 V167 L179 A182 V183L159-F163 HydrophobicContact CB-CD2 4.14Å; L159-F163 HydrophobicContact CB-CE2 4.18Å; L159-F163 HydrophobicContact CD2-CE2 3.92Å; L159-F163 WeakPolarHBondContact O-CB 3.34Å; L159-F163 WeakPolarHBondContact O-CD2 3.44Å; L159-F163 PolarHBondContact O-N 2.65Å; F163-V165 VanDerWaalsContact C-N 3.35Å; F163-V165 PolarHBondContact O-N 2.86Å; F163-A166 WeakPolarHBondContact O-CB 3.32Å; F163-A166 PolarHBondContact O-N 3.17Å; F163-V167 WeakPolarHBondContact O-CG2 3.32Å; F163-V167 PolarHBondContact O-N 3.21Å; F163-L179 HydrophobicContact CD1-CD2 3.97Å; F163-A182 HydrophobicContact CB-CB 4.48Å; F163-A182 HydrophobicContact CD1-CB 4.24Å; F163-A182 HydrophobicContact CD2-CB 3.96Å; F163-A182 HydrophobicContact CE1-CB 4.48Å; F163-A182 HydrophobicContact CE2-CB 4.21Å; F163-A182 HydrophobicContact CG-CB 3.99Å; F163-A182 HydrophobicContact CZ-CB 4.47Å; F163-V183 HydrophobicContact CB-CG2 3.66Å
164G93.9Very high93.9Very high0 Ų040.9 Ų40.90%023%0.232CC..Hα-helixtrans-59.1-42.8176.300000113Q160 T161 V162 Q239 S243Q160-G164 VanDerWaalsContact O-CA 3.28Å; Q160-G164 WeakPolarHBondContact O-CA 3.5Å; Q160-G164 PolarHBondContact O-N 3.26Å; T161-G164 PolarHBondContact O-N 3.26Å; V162-G164 VanDerWaalsContact C-N 3.34Å; V162-G164 PolarHBondContact O-N 3.23Å; G164-Q239 WeakPolarHBondContact O-CG 3.39Å; G164-Q239 PolarHBondContact O-NE2 3.39Å; G164-S243 VanDerWaalsContact C-OG 3.24Å; G164-S243 PolarHBondContact O-OG 3.29Å
165V95.6Very high94.1Very high27 Ų2742 Ų4216%0.16424%0.24CC..Hα-helixtrans-70.8-41.3173.2170.70000111.3T161 V162 F163 V167 A168 F169 L240 F247T161-V165 WeakPolarHBondContact O-CG2 3.44Å; T161-V165 PolarHBondContact O-N 2.91Å; V162-V165 PolarHBondContact O-N 3.23Å; F163-V165 VanDerWaalsContact C-N 3.35Å; F163-V165 PolarHBondContact O-N 2.86Å; V165-V167 PolarHBondContact O-N 3.01Å; V165-A168 WeakPolarHBondContact O-CB 3.27Å; V165-A168 PolarHBondContact O-N 3.42Å; V165-F169 HydrophobicContact CG1-CD2 4.27Å; V165-F169 HydrophobicContact CG1-CE2 3.81Å; V165-F169 WeakPolarHBondContact O-CD2 3.23Å; V165-L240 HydrophobicContact CG1-CD2 3.86Å; V165-F247 HydrophobicContact CG2-CE2 3.96Å
166A96Very high94.1Very high32 Ų3239.2 Ų39.226%0.26422%0.224SC..Hα-helixtrans-58.3-35.3177.100000112.6V162 F163 A168 F169 A170 L179V162-A166 WeakPolarHBondContact O-CB 3.28Å; V162-A166 PolarHBondContact O-N 2.99Å; F163-A166 WeakPolarHBondContact O-CB 3.32Å; F163-A166 PolarHBondContact O-N 3.17Å; A166-A168 PolarHBondContact O-N 3.28Å; A166-F169 PolarHBondContact O-N 2.89Å; A166-A170 PolarHBondContact O-N 3.09Å; A166-L179 HydrophobicContact CB-CD1 4.18Å; A166-L179 HydrophobicContact CB-CD2 4.02Å
167V95.4Very high94.2Very high0 Ų040 Ų400%023%0.229CC..Hα-helixtrans-55.5-37.5175171.10000111.5F163 V165 F169 A170 Y176 L179 R180 V183 Q239F163-V167 WeakPolarHBondContact O-CG2 3.32Å; F163-V167 PolarHBondContact O-N 3.21Å; V165-V167 PolarHBondContact O-N 3.01Å; V167-F169 PolarHBondContact O-N 3.38Å; V167-A170 WeakPolarHBondContact O-CB 3.34Å; V167-A170 PolarHBondContact O-N 3.02Å; V167-Y176 HydrophobicContact CG1-CD2 3.65Å; V167-Y176 HydrophobicContact CG1-CE2 3.57Å; V167-L179 HydrophobicContact CG2-CB 3.56Å; V167-R180 HydrophobicContact CG1-CG 4.48Å; V167-R180 HydrophobicContact CG2-CG 4.5Å; V167-V183 HydrophobicContact CG2-CG2 4.1Å; V167-Q239 HydrophobicContact CB-CG 4.06Å; V167-Q239 HydrophobicContact CG1-CG 3.91Å
168A94.3Very high94.4Very high3 Ų344.8 Ų44.83%0.02525%0.254CS..Hα-helixtrans-67.6-20.6-179.700000113.3V165 A166 R236 Q239 L240V165-A168 WeakPolarHBondContact O-CB 3.27Å; V165-A168 PolarHBondContact O-N 3.42Å; A166-A168 PolarHBondContact O-N 3.28Å; A168-R236 PolarHBondContact O-NH1 3.2Å; A168-Q239 HydrophobicContact CB-CB 3.95Å; A168-Q239 HydrophobicContact CB-CG 3.9Å; A168-L240 HydrophobicContact CB-CD1 4.44Å; A168-L240 HydrophobicContact CB-CD2 3.73Å; A168-L240 HydrophobicContact CB-CG 3.63Å
169F95.1Very high94.5Very high141 Ų14143.9 Ų43.962%0.61824%0.242SC*.THydrogen-bonded Turntrans-103.510.4179.1-63.3-74.6000113V165 A166 V167 P171 L240V165-F169 HydrophobicContact CG1-CD2 4.27Å; V165-F169 HydrophobicContact CG1-CE2 3.81Å; V165-F169 WeakPolarHBondContact O-CD2 3.23Å; A166-F169 PolarHBondContact O-N 2.89Å; V167-F169 PolarHBondContact O-N 3.38Å; F169-P171 WeakPolarHBondContact O-CD 3.07Å; F169-L240 HydrophobicContact CE2-CD2 3.86Å; F169-L240 HydrophobicContact CZ-CD1 4.44Å; F169-L240 HydrophobicContact CZ-CD2 4.2Å
170A94.8Very high94.5Very high0 Ų041.7 Ų41.70%023%0.23CC..  trans-59.7125.3179.300000110.7A166 V167 V175 Y176 L179 R236A166-A170 PolarHBondContact O-N 3.09Å; V167-A170 WeakPolarHBondContact O-CB 3.34Å; V167-A170 PolarHBondContact O-N 3.02Å; A170-V175 HydrophobicContact CB-CG1 4.37Å; A170-Y176 HydrophobicContact CB-CD2 4.48Å; A170-L179 HydrophobicContact CB-CD1 4.36Å; A170-R236 PolarHBondContact O-NH1 2.95Å; A170-R236 PolarHBondContact O-NH2 2.99Å
171P93Very high94.6Very high94 Ų9444.2 Ų44.261%0.6124%0.241SC*.SBendtrans-82.6-26-177.831.1-34.6000112.6F169F169-P171 WeakPolarHBondContact O-CD 3.07Å
172N93.5Very high94.8Very high70 Ų7044.9 Ų44.937%0.37425%0.247SC..SBendtrans-143163.4-178.66146.2000111.3P174 V175 Y176N172-P174 WeakPolarHBondContact OD1-CD 3.27Å; N172-V175 PolarHBondContact O-N 3.25Å; N172-V175 VanDerWaalsContact OD1-CB 3.28Å; N172-V175 WeakPolarHBondContact OD1-CB 3.39Å; N172-V175 WeakPolarHBondContact OD1-CG2 3.44Å; N172-V175 PolarHBondContact OD1-N 3.02Å; N172-Y176 PolarHBondContact O-N 3.49Å; N172-Y176 VanDerWaalsContact O-N 3.09Å
173F90.8Very high94.8Very high28 Ų2841.2 Ų41.212%0.12323%0.225CC..Hα-helixtrans-61.1-42.7-176.2-175.6-107000114.2W112 L114 L121 V175 Y176 V177W112-F173 HydrophobicContact CB-CB 4.44Å; W112-F173 HydrophobicContact CD2-CB 3.87Å; W112-F173 HydrophobicContact CD2-CD2 4.22Å; W112-F173 HydrophobicContact CE3-CB 3.95Å; W112-F173 AromaticContact CE3-CD2 3.44Å; W112-F173 HydrophobicContact CE3-CD2 3.44Å; W112-F173 VanDerWaalsContact CE3-CD2 3.44Å; W112-F173 HydrophobicContact CE3-CE2 4.4Å; W112-F173 HydrophobicContact CE3-CG 4.18Å; W112-F173 HydrophobicContact CG-CB 4.12Å; W112-F173 HydrophobicContact CZ3-CB 4.49Å; W112-F173 AromaticContact CZ3-CD2 3.73Å; W112-F173 HydrophobicContact CZ3-CD2 3.73Å; L114-F173 HydrophobicContact CD1-CD2 3.64Å; L114-F173 HydrophobicContact CD1-CE2 3.42Å; L114-F173 VanDerWaalsContact CD1-CE2 3.42Å; L114-F173 HydrophobicContact CD1-CG 4.4Å; L114-F173 HydrophobicContact CD1-CZ 4.07Å; L114-F173 HydrophobicContact CD2-CD2 4.42Å; L114-F173 HydrophobicContact CD2-CG 4.39Å; L121-F173 HydrophobicContact CB-CE1 3.74Å; L121-F173 HydrophobicContact CB-CZ 4.07Å; L121-F173 VanDerWaalsContact O-CZ 3.26Å; L121-F173 WeakPolarHBondContact O-CZ 3.49Å; F173-V175 PolarHBondContact O-N 2.98Å; F173-Y176 AromaticContact CD2-CD1 4Å; F173-Y176 HydrophobicContact CD2-CD1 4Å; F173-Y176 AromaticContact CE2-CD1 3.96Å; F173-Y176 HydrophobicContact CE2-CD1 3.96Å; F173-Y176 HydrophobicContact CE2-CE1 4.2Å; F173-Y176 WeakPolarHBondContact O-CB 3.49Å; F173-Y176 PolarHBondContact O-N 2.82Å; F173-V177 HydrophobicContact CD1-CG2 4.14Å; F173-V177 HydrophobicContact CD2-CG2 4.4Å; F173-V177 HydrophobicContact CE1-CG2 3.64Å; F173-V177 HydrophobicContact CE2-CG2 3.98Å; F173-V177 HydrophobicContact CZ-CG2 3.56Å; F173-V177 WeakPolarHBondContact O-CG2 3.35Å; F173-V177 PolarHBondContact O-N 3.26Å
174P93.9Very high94.7Very high83 Ų8338 Ų3854%0.53921%0.211SC..Hα-helixtrans-60.4-43.9177-25.935.5000113.5N172 Y176 V177 I178N172-P174 WeakPolarHBondContact OD1-CD 3.27Å; P174-Y176 VanDerWaalsContact C-N 3.3Å; P174-Y176 PolarHBondContact O-N 3.43Å; P174-V177 PolarHBondContact O-N 2.93Å; P174-I178 WeakPolarHBondContact O-CG1 3.44Å; P174-I178 PolarHBondContact O-N 3.19Å
175V95.4Very high94.7Very high52 Ų5238.7 Ų38.732%0.31522%0.215SC..Hα-helixtrans-62.5-41.2176.3171.30000110.5A170 N172 F173 V177 I178 L179A170-V175 HydrophobicContact CB-CG1 4.37Å; N172-V175 PolarHBondContact O-N 3.25Å; N172-V175 VanDerWaalsContact OD1-CB 3.28Å; N172-V175 WeakPolarHBondContact OD1-CB 3.39Å; N172-V175 WeakPolarHBondContact OD1-CG2 3.44Å; N172-V175 PolarHBondContact OD1-N 3.02Å; F173-V175 PolarHBondContact O-N 2.98Å; V175-V177 VanDerWaalsContact C-N 3.34Å; V175-V177 PolarHBondContact O-N 3.43Å; V175-I178 PolarHBondContact O-N 3.44Å; V175-L179 HydrophobicContact CG1-CD1 3.76Å; V175-L179 HydrophobicContact CG1-CG 4.27Å; V175-L179 WeakPolarHBondContact O-CB 3.33Å; V175-L179 VanDerWaalsContact O-CG 3.27Å; V175-L179 WeakPolarHBondContact O-CG 3.37Å; V175-L179 PolarHBondContact O-N 3.03Å
176Y94.2Very high94.7Very high10 Ų1037.6 Ų37.64%0.03921%0.208CC..Hα-helixtrans-57.5-45173.9167.4-96.7000112.6T108 W112 V167 A170 N172 F173 P174 L179 R180 W235T108-Y176 HydrophobicContact CG2-CE1 4.39Å; T108-Y176 HydrophobicContact CG2-CE2 3.9Å; W112-Y176 HydrophobicContact CH2-CD1 4.17Å; W112-Y176 AromaticContact CH2-CD2 3.82Å; W112-Y176 HydrophobicContact CH2-CD2 3.82Å; W112-Y176 AromaticContact CH2-CG 3.54Å; W112-Y176 HydrophobicContact CH2-CG 3.54Å; W112-Y176 AromaticContact CZ3-CD1 3.79Å; W112-Y176 HydrophobicContact CZ3-CD1 3.79Å; W112-Y176 HydrophobicContact CZ3-CD2 4.08Å; W112-Y176 HydrophobicContact CZ3-CE1 4.32Å; W112-Y176 AromaticContact CZ3-CG 3.65Å; W112-Y176 HydrophobicContact CZ3-CG 3.65Å; V167-Y176 HydrophobicContact CG1-CD2 3.65Å; V167-Y176 HydrophobicContact CG1-CE2 3.57Å; A170-Y176 HydrophobicContact CB-CD2 4.48Å; N172-Y176 PolarHBondContact O-N 3.49Å; N172-Y176 VanDerWaalsContact O-N 3.09Å; F173-Y176 AromaticContact CD2-CD1 4Å; F173-Y176 HydrophobicContact CD2-CD1 4Å; F173-Y176 AromaticContact CE2-CD1 3.96Å; F173-Y176 HydrophobicContact CE2-CD1 3.96Å; F173-Y176 HydrophobicContact CE2-CE1 4.2Å; F173-Y176 WeakPolarHBondContact O-CB 3.49Å; F173-Y176 PolarHBondContact O-N 2.82Å; P174-Y176 VanDerWaalsContact C-N 3.3Å; P174-Y176 PolarHBondContact O-N 3.43Å; Y176-L179 PolarHBondContact O-N 2.93Å; Y176-R180 HydrophobicContact CD1-CG 4.4Å; Y176-R180 HydrophobicContact CD2-CG 4.35Å; Y176-R180 HydrophobicContact CE1-CG 4.05Å; Y176-R180 HydrophobicContact CE2-CG 3.98Å; Y176-R180 WeakPolarHBondContact O-CB 3.37Å; Y176-R180 VanDerWaalsContact O-CG 3.28Å; Y176-R180 WeakPolarHBondContact O-CG 3.47Å; Y176-R180 PolarHBondContact O-N 2.92Å; Y176-R180 PolarHBondContact OH-NE 3.41Å; Y176-R180 PolarHBondContact OH-NH2 3.5Å; Y176-W235 HydrophobicContact CD2-CH2 4.45Å; Y176-W235 HydrophobicContact CD2-CZ3 4.3Å; Y176-W235 HydrophobicContact CE2-CZ3 4.2Å
177V94.8Very high94.5Very high17 Ų1736 Ų3610%0.10320%0.196CC..Hα-helixtrans-65.9-41.4178.4172.50000111.9I128 F173 P174 V175 R180 F181I128-V177 HydrophobicContact CB-CG1 4.03Å; I128-V177 HydrophobicContact CD1-CG1 3.49Å; I128-V177 VanDerWaalsContact CD1-CG1 3.49Å; I128-V177 HydrophobicContact CG1-CG1 4.36Å; I128-V177 HydrophobicContact CG2-CG1 3.7Å; F173-V177 HydrophobicContact CD1-CG2 4.14Å; F173-V177 HydrophobicContact CD2-CG2 4.4Å; F173-V177 HydrophobicContact CE1-CG2 3.64Å; F173-V177 HydrophobicContact CE2-CG2 3.98Å; F173-V177 HydrophobicContact CZ-CG2 3.56Å; F173-V177 WeakPolarHBondContact O-CG2 3.35Å; F173-V177 PolarHBondContact O-N 3.26Å; P174-V177 PolarHBondContact O-N 2.93Å; V175-V177 VanDerWaalsContact C-N 3.34Å; V175-V177 PolarHBondContact O-N 3.43Å; V177-R180 PolarHBondContact O-N 2.93Å; V177-F181 PolarHBondContact O-N 3.47Å
178I96.5Very high94.1Very high114 Ų11436 Ų3659%0.58520%0.196SC*.Hα-helixtrans-63.3-44.5176.7-67.5165.7000110.8P174 V175 F181 A182P174-I178 WeakPolarHBondContact O-CG1 3.44Å; P174-I178 PolarHBondContact O-N 3.19Å; V175-I178 PolarHBondContact O-N 3.44Å; I178-F181 WeakPolarHBondContact O-CB 3.4Å; I178-F181 PolarHBondContact O-N 3.2Å; I178-A182 PolarHBondContact O-N 2.98Å
179L96.1Very high93.8Very high29 Ų2935.9 Ų35.915%0.15219%0.194CC..Hα-helixtrans-66.3-40.3177.5-69170.9000111.4F163 A166 V167 A170 V175 Y176 F181 A182 V183F163-L179 HydrophobicContact CD1-CD2 3.97Å; A166-L179 HydrophobicContact CB-CD1 4.18Å; A166-L179 HydrophobicContact CB-CD2 4.02Å; V167-L179 HydrophobicContact CG2-CB 3.56Å; A170-L179 HydrophobicContact CB-CD1 4.36Å; V175-L179 HydrophobicContact CG1-CD1 3.76Å; V175-L179 HydrophobicContact CG1-CG 4.27Å; V175-L179 WeakPolarHBondContact O-CB 3.33Å; V175-L179 VanDerWaalsContact O-CG 3.27Å; V175-L179 WeakPolarHBondContact O-CG 3.37Å; V175-L179 PolarHBondContact O-N 3.03Å; Y176-L179 PolarHBondContact O-N 2.93Å; L179-F181 PolarHBondContact O-N 3.49Å; L179-A182 PolarHBondContact O-N 2.93Å; L179-V183 WeakPolarHBondContact O-CG2 3.32Å; L179-V183 PolarHBondContact O-N 3.47Å
180R93.8Very high93.6Very high10 Ų1029.3 Ų29.34%0.03817%0.166CC..Hα-helixtrans-59.6-44.2171.9-80.5-84.7-171.8155.91.8111.4T41 Y129 V167 Y176 V177 A182 V183 G184T41-R180 PolarHBondContact OG1-NH2 3.5Å; Y129-R180 HydrophobicContact CD2-CB 4.4Å; Y129-R180 VanDerWaalsContact CD2-O 3.3Å; Y129-R180 WeakPolarHBondContact CD2-O 3.32Å; V167-R180 HydrophobicContact CG1-CG 4.48Å; V167-R180 HydrophobicContact CG2-CG 4.5Å; Y176-R180 HydrophobicContact CD1-CG 4.4Å; Y176-R180 HydrophobicContact CD2-CG 4.35Å; Y176-R180 HydrophobicContact CE1-CG 4.05Å; Y176-R180 HydrophobicContact CE2-CG 3.98Å; Y176-R180 WeakPolarHBondContact O-CB 3.37Å; Y176-R180 VanDerWaalsContact O-CG 3.28Å; Y176-R180 WeakPolarHBondContact O-CG 3.47Å; Y176-R180 PolarHBondContact O-N 2.92Å; Y176-R180 PolarHBondContact OH-NE 3.41Å; Y176-R180 PolarHBondContact OH-NH2 3.5Å; V177-R180 PolarHBondContact O-N 2.93Å; R180-A182 VanDerWaalsContact C-N 3.32Å; R180-A182 PolarHBondContact O-N 2.93Å; R180-V183 PolarHBondContact O-N 3.23Å; R180-G184 PolarHBondContact O-N 3.45Å
181F96.2Very high93.2Very high63 Ų6331 Ų3128%0.27617%0.174SC..Hα-helixtrans-55.5-48.3174.7174-99.1000111.2I128 F131 G132 V135 V177 I178 L179 V183 G184 T185I128-F181 HydrophobicContact CG2-CB 3.88Å; I128-F181 HydrophobicContact CG2-CD2 4.06Å; I128-F181 HydrophobicContact CG2-CG 4.37Å; F131-F181 HydrophobicContact CD1-CD2 4.27Å; F131-F181 AromaticContact CD1-CE2 3.63Å; F131-F181 HydrophobicContact CD1-CE2 3.63Å; F131-F181 HydrophobicContact CE1-CE2 4.03Å; G132-F181 VanDerWaalsContact CA-CE2 3.46Å; V135-F181 HydrophobicContact CB-CZ 4.34Å; V135-F181 HydrophobicContact CG1-CZ 4.37Å; V135-F181 HydrophobicContact CG2-CE2 4.3Å; V135-F181 HydrophobicContact CG2-CZ 4.22Å; V177-F181 PolarHBondContact O-N 3.47Å; I178-F181 WeakPolarHBondContact O-CB 3.4Å; I178-F181 PolarHBondContact O-N 3.2Å; L179-F181 PolarHBondContact O-N 3.49Å; F181-V183 PolarHBondContact O-N 3.14Å; F181-G184 PolarHBondContact O-N 3.11Å; F181-G184 VanDerWaalsContact O-N 3.15Å; F181-T185 PolarHBondContact O-N 3.25Å; F181-T185 PolarHBondContact O-OG1 2.94Å; F181-T185 VanDerWaalsContact O-OG1 3.08Å
182A96.4Very high92.8Very high22 Ų2228.8 Ų28.818%0.18216%0.157CC..Hα-helixtrans-60.3-45.5177.500000112.5F163 I178 L179 R180 G184 T185 T186F163-A182 HydrophobicContact CB-CB 4.48Å; F163-A182 HydrophobicContact CD1-CB 4.24Å; F163-A182 HydrophobicContact CD2-CB 3.96Å; F163-A182 HydrophobicContact CE1-CB 4.48Å; F163-A182 HydrophobicContact CE2-CB 4.21Å; F163-A182 HydrophobicContact CG-CB 3.99Å; F163-A182 HydrophobicContact CZ-CB 4.47Å; I178-A182 PolarHBondContact O-N 2.98Å; L179-A182 PolarHBondContact O-N 2.93Å; R180-A182 VanDerWaalsContact C-N 3.32Å; R180-A182 PolarHBondContact O-N 2.93Å; A182-G184 VanDerWaalsContact C-N 3.31Å; A182-G184 PolarHBondContact O-N 3.26Å; A182-T185 WeakPolarHBondContact O-CB 3.2Å; A182-T185 PolarHBondContact O-N 3.48Å; A182-T186 WeakPolarHBondContact O-CG2 3.19Å; A182-T186 PolarHBondContact O-N 3.42Å; A182-T186 VanDerWaalsContact O-N 3.14Å
183V95Very high92.5Very high3 Ų325.5 Ų25.52%0.01814%0.139CC..Hα-helixtrans-58.7-44.7173.9173.60000110.5H34 Y129 F163 V167 L179 R180 F181 T185 T186 I187H34-V183 HydrophobicContact CB-CG1 4.46Å; Y129-V183 HydrophobicContact CE2-CG1 4.28Å; F163-V183 HydrophobicContact CB-CG2 3.66Å; V167-V183 HydrophobicContact CG2-CG2 4.1Å; L179-V183 WeakPolarHBondContact O-CG2 3.32Å; L179-V183 PolarHBondContact O-N 3.47Å; R180-V183 PolarHBondContact O-N 3.23Å; F181-V183 PolarHBondContact O-N 3.14Å; V183-T185 VanDerWaalsContact C-N 3.32Å; V183-T185 PolarHBondContact O-N 3.48Å; V183-T186 PolarHBondContact O-N 3.46Å; V183-T186 VanDerWaalsContact O-N 3.11Å; V183-T186 PolarHBondContact O-OG1 3.45Å; V183-I187 HydrophobicContact CG1-CD1 3.93Å; V183-I187 HydrophobicContact CG1-CG1 4.49Å; V183-I187 WeakPolarHBondContact O-CG1 3.34Å; V183-I187 PolarHBondContact O-N 3.04Å; V183-I187 VanDerWaalsContact O-N 3.11Å
184G94.3Very high92.4Very high0 Ų024.2 Ų24.20%013%0.134CC..Hα-helixtrans-57.9-42.1177.200000113.1L133 R180 F181 A182 T186 I187L133-G184 WeakPolarHBondContact CA-O 3.13Å; L133-G184 WeakPolarHBondContact CD1-O 3.28Å; L133-G184 VanDerWaalsContact CG-O 3.32Å; L133-G184 WeakPolarHBondContact CG-O 3.35Å; R180-G184 PolarHBondContact O-N 3.45Å; F181-G184 PolarHBondContact O-N 3.11Å; F181-G184 VanDerWaalsContact O-N 3.15Å; A182-G184 VanDerWaalsContact C-N 3.31Å; A182-G184 PolarHBondContact O-N 3.26Å; G184-T186 PolarHBondContact O-N 3.11Å; G184-I187 PolarHBondContact O-N 2.94Å
185T94.1Very high91.8Very high15 Ų1524.2 Ų24.29%0.09213%0.126CC..Hα-helixtrans-60.6-43.2174.6-52.30000111.9G132 G136 L139 F140 F181 A182 V183 I187 S188G132-T185 WeakPolarHBondContact O-CA 3.4Å; G132-T185 PolarHBondContact O-N 2.66Å; G132-T185 PolarHBondContact O-OG1 3.35Å; G136-T185 WeakPolarHBondContact CA-O 3.17Å; L139-T185 HydrophobicContact CD1-CG2 4.46Å; F140-T185 HydrophobicContact CD2-CG2 4.27Å; F140-T185 WeakPolarHBondContact CD2-O 3.35Å; F140-T185 HydrophobicContact CE2-CG2 3.79Å; F140-T185 WeakPolarHBondContact CE2-O 3.35Å; F181-T185 PolarHBondContact O-N 3.25Å; F181-T185 PolarHBondContact O-OG1 2.94Å; F181-T185 VanDerWaalsContact O-OG1 3.08Å; A182-T185 WeakPolarHBondContact O-CB 3.2Å; A182-T185 PolarHBondContact O-N 3.48Å; V183-T185 VanDerWaalsContact C-N 3.32Å; V183-T185 PolarHBondContact O-N 3.48Å; T185-I187 PolarHBondContact O-N 3.28Å; T185-S188 PolarHBondContact O-N 3.04Å
186T94.2Very high91.2Very high3 Ų323.9 Ų23.92%0.01812%0.123CC..Hα-helixtrans-67.9-34.9-178.461.30000113.5F140 L159 Q160 A182 V183 G184 S188 G189 V190F140-T186 HydrophobicContact CE2-CG2 4.48Å; L159-T186 HydrophobicContact CB-CG2 3.45Å; L159-T186 VanDerWaalsContact CB-CG2 3.45Å; L159-T186 HydrophobicContact CD1-CG2 4.42Å; Q160-T186 WeakPolarHBondContact CA-OG1 3.45Å; Q160-T186 VanDerWaalsContact CB-OG1 3.27Å; Q160-T186 WeakPolarHBondContact CB-OG1 3.29Å; A182-T186 WeakPolarHBondContact O-CG2 3.19Å; A182-T186 PolarHBondContact O-N 3.42Å; A182-T186 VanDerWaalsContact O-N 3.14Å; V183-T186 PolarHBondContact O-N 3.46Å; V183-T186 VanDerWaalsContact O-N 3.11Å; V183-T186 PolarHBondContact O-OG1 3.45Å; G184-T186 PolarHBondContact O-N 3.11Å; T186-S188 VanDerWaalsContact C-N 3.3Å; T186-S188 PolarHBondContact O-N 3.48Å; T186-G189 WeakPolarHBondContact O-CA 3.22Å; T186-G189 PolarHBondContact O-N 3.36Å; T186-V190 PolarHBondContact O-N 3.36Å
187I92Very high90.7Very high0 Ų023.4 Ų23.40%012%0.121CC..Hα-helixtrans-59.5-41.8179.5-77.1170.7000111.5L31 H34 M35 Y129 L133 Q160 V183 G184 T185 G189 V190 I191L31-I187 HydrophobicContact CD1-CB 4.06Å; L31-I187 HydrophobicContact CD1-CG1 4.17Å; L31-I187 HydrophobicContact CD1-CG2 3.59Å; L31-I187 HydrophobicContact CG-CG2 4.28Å; H34-I187 HydrophobicContact CB-CD1 3.69Å; H34-I187 HydrophobicContact CB-CG1 4.49Å; M35-I187 HydrophobicContact CG-CG2 3.93Å; M35-I187 HydrophobicContact SD-CG2 4.08Å; Y129-I187 HydrophobicContact CE2-CD1 3.92Å; Y129-I187 WeakPolarHBondContact OH-CD1 3.35Å; L133-I187 HydrophobicContact CD2-CG2 3.88Å; L133-I187 HydrophobicContact CG-CB 4.48Å; L133-I187 HydrophobicContact CG-CG2 4.07Å; Q160-I187 HydrophobicContact CG-CG1 4.49Å; V183-I187 HydrophobicContact CG1-CD1 3.93Å; V183-I187 HydrophobicContact CG1-CG1 4.49Å; V183-I187 WeakPolarHBondContact O-CG1 3.34Å; V183-I187 PolarHBondContact O-N 3.04Å; V183-I187 VanDerWaalsContact O-N 3.11Å; G184-I187 PolarHBondContact O-N 2.94Å; T185-I187 PolarHBondContact O-N 3.28Å; I187-G189 VanDerWaalsContact C-N 3.3Å; I187-G189 PolarHBondContact O-N 3.26Å; I187-V190 PolarHBondContact O-N 3.34Å; I187-I191 HydrophobicContact CG2-CD1 3.83Å; I187-I191 WeakPolarHBondContact O-CG1 3.13Å; I187-I191 PolarHBondContact O-N 2.9Å
188S88.5Confident90.2Very high0 Ų022.6 Ų22.60%012%0.117CC..Hα-helixtrans-63.1-39.8176.2-155.30000111.8L133 S137 T185 T186 V190 I191 I192L133-S188 WeakPolarHBondContact O-CB 3.24Å; L133-S188 PolarHBondContact O-OG 3.08Å; S137-S188 WeakPolarHBondContact CA-OG 3.49Å; S137-S188 VanDerWaalsContact CB-OG 3.22Å; S137-S188 WeakPolarHBondContact CB-OG 3.2Å; S137-S188 PolarHBondContact N-OG 2.96Å; S137-S188 VanDerWaalsContact N-OG 3.11Å; T185-S188 PolarHBondContact O-N 3.04Å; T186-S188 VanDerWaalsContact C-N 3.3Å; T186-S188 PolarHBondContact O-N 3.48Å; S188-V190 VanDerWaalsContact C-N 3.34Å; S188-V190 PolarHBondContact O-N 3.43Å; S188-I191 PolarHBondContact O-N 3.43Å; S188-I192 WeakPolarHBondContact O-CB 3.48Å; S188-I192 VanDerWaalsContact O-CG1 3.32Å; S188-I192 WeakPolarHBondContact O-CG1 3.35Å; S188-I192 PolarHBondContact O-N 3.07Å
189G88Confident89.3Confident0 Ų018.2 Ų18.20%010%0.096CC..Hα-helixtrans-60.6-40.5173.300000112.8T186 I187 N193T186-G189 WeakPolarHBondContact O-CA 3.22Å; T186-G189 PolarHBondContact O-N 3.36Å; I187-G189 VanDerWaalsContact C-N 3.3Å; I187-G189 PolarHBondContact O-N 3.26Å; G189-N193 VanDerWaalsContact O-CB 3.25Å; G189-N193 WeakPolarHBondContact O-CB 3.49Å; G189-N193 PolarHBondContact O-N 3.46Å; G189-N193 PolarHBondContact O-ND2 2.84Å
190V90.5Very high88.6Confident2 Ų217.6 Ų17.61%0.0129%0.092CC..Hα-helixtrans-68.4-49.3175.9179.80000111.5P27 L31 L153 I157 T186 I187 S188 I192 A194P27-V190 HydrophobicContact CB-CG1 4.35Å; L31-V190 HydrophobicContact CD1-CB 4.11Å; L31-V190 HydrophobicContact CD1-CG1 4.23Å; L153-V190 HydrophobicContact CD1-CB 4.34Å; L153-V190 HydrophobicContact CD1-CG1 3.99Å; I157-V190 HydrophobicContact CG1-CG1 4.49Å; I157-V190 HydrophobicContact CG1-CG2 3.91Å; T186-V190 PolarHBondContact O-N 3.36Å; I187-V190 PolarHBondContact O-N 3.34Å; S188-V190 VanDerWaalsContact C-N 3.34Å; S188-V190 PolarHBondContact O-N 3.43Å; V190-I192 PolarHBondContact O-N 3.11Å; V190-A194 WeakPolarHBondContact O-CB 3.29Å; V190-A194 PolarHBondContact O-N 2.64Å
191I87Confident87.9Confident35 Ų3517.3 Ų17.318%0.1799%0.091CC..Hα-helixtrans-55.2-56.7-179.3-69.6162.1000111.1L31 M35 I187 S188 F195L31-I191 HydrophobicContact CD1-CD1 4.11Å; L31-I191 HydrophobicContact CD1-CG1 3.67Å; L31-I191 HydrophobicContact CD2-CD1 3.74Å; L31-I191 HydrophobicContact CD2-CG1 3.26Å; L31-I191 HydrophobicContact CG-CD1 4.37Å; L31-I191 HydrophobicContact CG-CG1 4.04Å; M35-I191 HydrophobicContact SD-CD1 4.36Å; I187-I191 HydrophobicContact CG2-CD1 3.83Å; I187-I191 WeakPolarHBondContact O-CG1 3.13Å; I187-I191 PolarHBondContact O-N 2.9Å; S188-I191 PolarHBondContact O-N 3.43Å; I191-F195 VanDerWaalsContact O-CB 3.23Å; I191-F195 WeakPolarHBondContact O-CB 3.33Å; I191-F195 PolarHBondContact O-N 3.06Å
192I83.9Confident87.2Confident48 Ų4814.4 Ų14.425%0.2468%0.078CC..Hα-helixtrans-65.6-47.9-171.6-64.9167.6000109.8S188 V190 F195 V196S188-I192 WeakPolarHBondContact O-CB 3.48Å; S188-I192 VanDerWaalsContact O-CG1 3.32Å; S188-I192 WeakPolarHBondContact O-CG1 3.35Å; S188-I192 PolarHBondContact O-N 3.07Å; V190-I192 PolarHBondContact O-N 3.11Å; I192-F195 PolarHBondContact O-N 3.34Å; I192-V196 HydrophobicContact CG2-CG2 4.37Å; I192-V196 WeakPolarHBondContact O-CB 3.41Å; I192-V196 WeakPolarHBondContact O-CG2 3.33Å; I192-V196 PolarHBondContact O-N 2.79Å
193N87.5Confident86Confident2 Ų214.3 Ų14.31%0.0118%0.076CC..Hα-helixtrans-73.1-36.1-174.8-71.3-67.9000113.1A144 V152 L153 G189 L197A144-N193 WeakPolarHBondContact CB-OD1 3.34Å; V152-N193 VanDerWaalsContact CG1-ND2 3.35Å; V152-N193 WeakPolarHBondContact CG1-ND2 3.4Å; L153-N193 HydrophobicContact CB-CB 3.94Å; L153-N193 HydrophobicContact CD1-CB 4.33Å; G189-N193 VanDerWaalsContact O-CB 3.25Å; G189-N193 WeakPolarHBondContact O-CB 3.49Å; G189-N193 PolarHBondContact O-N 3.46Å; G189-N193 PolarHBondContact O-ND2 2.84Å; N193-L197 WeakPolarHBondContact O-CB 3.5Å; N193-L197 PolarHBondContact O-N 3.28Å
194A87.3Confident84.7Confident1 Ų117.8 Ų17.81%0.00810%0.097CC..Hα-helixtrans-65.6-45.8174.700000110.9I24 L153 V190 L197 G198I24-A194 HydrophobicContact CG2-CB 4.13Å; I24-A194 VanDerWaalsContact CG2-O 3.29Å; I24-A194 WeakPolarHBondContact CG2-O 3.45Å; L153-A194 HydrophobicContact CD1-CB 4.14Å; L153-A194 HydrophobicContact CD2-CB 4.37Å; V190-A194 WeakPolarHBondContact O-CB 3.29Å; V190-A194 PolarHBondContact O-N 2.64Å; A194-L197 PolarHBondContact O-N 2.93Å; A194-G198 PolarHBondContact O-N 2.95Å
195F82.8Confident83.5Confident83 Ų8327.7 Ų27.736%0.36414%0.141SC..Hα-helixtrans-63.5-47.1178.2-178.6-97.5000112.3I191 I192 G198 T199I191-F195 VanDerWaalsContact O-CB 3.23Å; I191-F195 WeakPolarHBondContact O-CB 3.33Å; I191-F195 PolarHBondContact O-N 3.06Å; I192-F195 PolarHBondContact O-N 3.34Å; F195-G198 PolarHBondContact O-N 3.42Å; F195-T199 HydrophobicContact CD1-CG2 4.29Å; F195-T199 HydrophobicContact CD2-CG2 4.45Å; F195-T199 HydrophobicContact CE1-CG2 3.9Å; F195-T199 HydrophobicContact CE2-CG2 4.08Å; F195-T199 HydrophobicContact CZ-CG2 3.79Å; F195-T199 WeakPolarHBondContact O-CB 2.99Å; F195-T199 WeakPolarHBondContact O-CG2 3.03Å; F195-T199 PolarHBondContact O-N 3.14Å; F195-T199 PolarHBondContact O-OG1 3.33Å
196V81.9Confident82.5Confident44 Ų4433.5 Ų33.527%0.26716%0.161SC..Hα-helixtrans-63.2-46.1178.1172.80000110.7R149 I192 G198 T199 E200R149-V196 HydrophobicContact CG-CG1 4.19Å; I192-V196 HydrophobicContact CG2-CG2 4.37Å; I192-V196 WeakPolarHBondContact O-CB 3.41Å; I192-V196 WeakPolarHBondContact O-CG2 3.33Å; I192-V196 PolarHBondContact O-N 2.79Å; V196-G198 VanDerWaalsContact C-N 3.32Å; V196-G198 PolarHBondContact O-N 3.4Å; V196-T199 WeakPolarHBondContact CA-OG1 3.21Å; V196-T199 PolarHBondContact O-N 3.21Å; V196-T199 PolarHBondContact O-OG1 2.93Å; V196-E200 HydrophobicContact CG1-CG 4.17Å; V196-E200 WeakPolarHBondContact O-CB 3.21Å; V196-E200 VanDerWaalsContact O-CG 3.25Å; V196-E200 WeakPolarHBondContact O-CG 3.45Å; V196-E200 PolarHBondContact O-N 3.03Å
197L84.8Confident81.6Confident0 Ų036.4 Ų36.40%017%0.171CC..Hα-helixtrans-60.6-42.8178.2-172.464.4000111.4I24 L153 N193 A194 E200 W201 L256I24-L197 HydrophobicContact CD1-CB 4.41Å; I24-L197 HydrophobicContact CD1-CD2 4.28Å; I24-L197 HydrophobicContact CD1-CG 4.11Å; L153-L197 HydrophobicContact CD2-CD2 4.26Å; N193-L197 WeakPolarHBondContact O-CB 3.5Å; N193-L197 PolarHBondContact O-N 3.28Å; A194-L197 PolarHBondContact O-N 2.93Å; L197-E200 PolarHBondContact O-N 3.42Å; L197-W201 VanDerWaalsContact O-CD1 3.25Å; L197-W201 PolarHBondContact O-N 3.28Å; L197-L256 HydrophobicContact CD2-CD2 4.12Å
198G82.8Confident80.8Confident1 Ų140.2 Ų40.21%0.0119%0.19CC..Hα-helixtrans-63.6-42.2176.700000113.1A194 F195 V196 W201 T202A194-G198 PolarHBondContact O-N 2.95Å; F195-G198 PolarHBondContact O-N 3.42Å; V196-G198 VanDerWaalsContact C-N 3.32Å; V196-G198 PolarHBondContact O-N 3.4Å; G198-W201 PolarHBondContact O-N 2.98Å; G198-T202 VanDerWaalsContact O-CG2 3.32Å; G198-T202 WeakPolarHBondContact O-CG2 3.22Å; G198-T202 PolarHBondContact O-N 2.84Å; G198-T202 PolarHBondContact O-OG1 3.15Å
199T77.8Confident80.3Confident22 Ų2243.6 Ų43.614%0.13521%0.208CC..Hα-helixtrans-73.2-26.9-179.854.20000113.6F195 V196 W201 T202 R207F195-T199 HydrophobicContact CD1-CG2 4.29Å; F195-T199 HydrophobicContact CD2-CG2 4.45Å; F195-T199 HydrophobicContact CE1-CG2 3.9Å; F195-T199 HydrophobicContact CE2-CG2 4.08Å; F195-T199 HydrophobicContact CZ-CG2 3.79Å; F195-T199 WeakPolarHBondContact O-CB 2.99Å; F195-T199 WeakPolarHBondContact O-CG2 3.03Å; F195-T199 PolarHBondContact O-N 3.14Å; F195-T199 PolarHBondContact O-OG1 3.33Å; V196-T199 WeakPolarHBondContact CA-OG1 3.21Å; V196-T199 PolarHBondContact O-N 3.21Å; V196-T199 PolarHBondContact O-OG1 2.93Å; T199-W201 VanDerWaalsContact C-N 3.35Å; T199-T202 VanDerWaalsContact CA-OG1 3.22Å; T199-T202 WeakPolarHBondContact CA-OG1 3.49Å; T199-T202 PolarHBondContact O-N 2.99Å; T199-T202 PolarHBondContact O-OG1 3.12Å; T199-R207 PolarHBondContact O-NE 2.81Å
200E82.3Confident79.9Confident15 Ų1543.7 Ų43.77%0.0721%0.209CC..Hα-helixtrans-70.7-30.4174.2-74.4-178.9154.100113F3 R149 V196 L197 S259F3-E200 WeakPolarHBondContact CE1-O 3.27Å; R149-E200 IonicContact CZ-OE1 2.76Å; R149-E200 IonicContact NH1-OE1 2.63Å; R149-E200 PolarHBondContact NH1-OE1 3.19Å; R149-E200 VanDerWaalsContact NH1-OE1 3.1Å; V196-E200 HydrophobicContact CG1-CG 4.17Å; V196-E200 WeakPolarHBondContact O-CB 3.21Å; V196-E200 VanDerWaalsContact O-CG 3.25Å; V196-E200 WeakPolarHBondContact O-CG 3.45Å; V196-E200 PolarHBondContact O-N 3.03Å; L197-E200 PolarHBondContact O-N 3.42Å; E200-S259 PolarHBondContact OE1-OG 3.42Å; E200-S259 WeakPolarHBondContact OE2-CB 3.3Å; E200-S259 PolarHBondContact OE2-OG 3.48Å
201W79.4Confident79.5Confident5 Ų544.2 Ų44.22%0.01921%0.214CC..SBendtrans-89.4-3.8177.3-78100.8000113.9Y16 Q17 L20 L197 G198 T199 P257 A260 L275 A279Y16-W201 HydrophobicContact CD1-CE3 4.26Å; Y16-W201 HydrophobicContact CD1-CZ3 4.09Å; Y16-W201 HydrophobicContact CE1-CD2 4.37Å; Y16-W201 AromaticContact CE1-CE3 3.8Å; Y16-W201 HydrophobicContact CE1-CE3 3.8Å; Y16-W201 AromaticContact CE1-CH2 3.77Å; Y16-W201 HydrophobicContact CE1-CH2 3.77Å; Y16-W201 HydrophobicContact CE1-CZ2 4.33Å; Y16-W201 AromaticContact CE1-CZ3 3.48Å; Y16-W201 HydrophobicContact CE1-CZ3 3.48Å; Y16-W201 VanDerWaalsContact CE1-CZ3 3.48Å; Q17-W201 VanDerWaalsContact CG-O 3.24Å; Q17-W201 WeakPolarHBondContact CG-O 3.32Å; L20-W201 HydrophobicContact CD2-CB 3.91Å; L20-W201 HydrophobicContact CD2-CD2 3.8Å; L20-W201 HydrophobicContact CD2-CG 3.47Å; L20-W201 VanDerWaalsContact CD2-CG 3.47Å; L197-W201 VanDerWaalsContact O-CD1 3.25Å; L197-W201 PolarHBondContact O-N 3.28Å; G198-W201 PolarHBondContact O-N 2.98Å; T199-W201 VanDerWaalsContact C-N 3.35Å; W201-P257 HydrophobicContact CZ2-CB 4.15Å; W201-P257 HydrophobicContact CZ2-CG 4.11Å; W201-A260 HydrophobicContact CH2-CB 4.36Å; W201-A260 HydrophobicContact CZ2-CB 4.29Å; W201-L275 HydrophobicContact CH2-CD2 3.65Å; W201-L275 HydrophobicContact CH2-CG 3.88Å; W201-L275 HydrophobicContact CZ2-CD2 3.4Å; W201-L275 VanDerWaalsContact CZ2-CD2 3.4Å; W201-L275 HydrophobicContact CZ2-CG 4.05Å; W201-A279 HydrophobicContact CZ3-CB 4Å
202T80.3Confident79.3Confident1 Ų143 Ų431%0.00621%0.208CC..SBendtrans-107.7137179.5480000111.8F13 Y21 G198 T199 R207 A210F13-T202 HydrophobicContact CD2-CG2 3.81Å; F13-T202 HydrophobicContact CE2-CG2 3.59Å; Y21-T202 HydrophobicContact CD2-CG2 4.23Å; Y21-T202 HydrophobicContact CE2-CG2 4.26Å; G198-T202 VanDerWaalsContact O-CG2 3.32Å; G198-T202 WeakPolarHBondContact O-CG2 3.22Å; G198-T202 PolarHBondContact O-N 2.84Å; G198-T202 PolarHBondContact O-OG1 3.15Å; T199-T202 VanDerWaalsContact CA-OG1 3.22Å; T199-T202 WeakPolarHBondContact CA-OG1 3.49Å; T199-T202 PolarHBondContact O-N 2.99Å; T199-T202 PolarHBondContact O-OG1 3.12Å; T202-R207 PolarHBondContact O-NE 2.81Å; T202-A210 HydrophobicContact CG2-CB 3.97Å
203C71.1Confident79.4Confident21 Ų2143.5 Ų43.514%0.14221%0.21CC..  trans-63.9145.7173.7-62.30000110.8G12 K205 R206 R207G12-C203 VanDerWaalsContact CA-SG 3.6Å; C203-K205 PolarHBondContact O-N 2.9Å; C203-K205 VanDerWaalsContact O-N 3.09Å; C203-R206 PolarHBondContact O-N 3.21Å; C203-R207 PolarHBondContact O-N 3.29Å
204T67.6Low79.3Confident76 Ų7643.7 Ų43.747%0.46621%0.212SC..G310 helixtrans-49.3-41-176.7-46.80000113.5D4 R206 R207D4-T204 PolarHBondContact OD2-OG1 3.2Å; T204-R206 PolarHBondContact O-N 3.41Å; T204-R207 PolarHBondContact O-N 2.7Å; T204-R207 VanDerWaalsContact OG1-CZ 3.28Å; T204-R207 PolarHBondContact OG1-NH1 2.73Å; T204-R207 PolarHBondContact OG1-NH2 3.29Å
205K68.8Low79.3Confident208 Ų20846 Ų4690%0.90422%0.224SC*.G310 helixtrans-61.7-23.5178.5-64.5-170.8177.4-1710114.8C203C203-K205 PolarHBondContact O-N 2.9Å; C203-K205 VanDerWaalsContact O-N 3.09Å
206R73.3Confident79.7Confident136 Ų13644.6 Ų44.651%0.51322%0.217SC..G310 helixtrans-116.25.3-176.3-65.8-176-177.4-96.40.9113.5C203 T204 M208 L209 A210C203-R206 PolarHBondContact O-N 3.21Å; T204-R206 PolarHBondContact O-N 3.41Å; R206-M208 VanDerWaalsContact C-N 3.33Å; R206-M208 PolarHBondContact O-N 3.21Å; R206-L209 PolarHBondContact O-N 3.21Å; R206-A210 PolarHBondContact O-N 3.4Å
207R75.3Confident80.2Confident65 Ų6543.4 Ų43.425%0.24521%0.21CC..Hα-helixtrans-63.6-36.9-179.5-74.7-175.6-169.3144.515.5113D4 T199 T202 C203 T204 A210 G211D4-R207 VanDerWaalsContact CG-NH2 3.34Å; D4-R207 IonicContact OD1-NH2 2.74Å; D4-R207 PolarHBondContact OD1-NH2 3.27Å; D4-R207 IonicContact OD2-NH2 3.14Å; D4-R207 PolarHBondContact OD2-NH2 3.38Å; T199-R207 PolarHBondContact O-NE 2.81Å; T202-R207 PolarHBondContact O-NE 2.81Å; C203-R207 PolarHBondContact O-N 3.29Å; T204-R207 PolarHBondContact O-N 2.7Å; T204-R207 VanDerWaalsContact OG1-CZ 3.28Å; T204-R207 PolarHBondContact OG1-NH1 2.73Å; T204-R207 PolarHBondContact OG1-NH2 3.29Å; R207-A210 WeakPolarHBondContact O-CB 3.37Å; R207-A210 PolarHBondContact O-N 3.4Å; R207-G211 PolarHBondContact O-N 3.12Å
208M75.6Confident80.5Confident79 Ų7944.3 Ų44.339%0.38921%0.214SC..Hα-helixtrans-62.1-49.6176.6-174.2-163.4-68.300110.9R206 A210 G211 I212 L375 L378 V431R206-M208 VanDerWaalsContact C-N 3.33Å; R206-M208 PolarHBondContact O-N 3.21Å; M208-A210 VanDerWaalsContact C-N 3.28Å; M208-A210 PolarHBondContact O-N 2.84Å; M208-G211 PolarHBondContact O-N 3.16Å; M208-I212 HydrophobicContact CG-CD1 4.11Å; M208-I212 PolarHBondContact O-N 2.89Å; M208-I212 VanDerWaalsContact O-N 3.1Å; M208-L375 HydrophobicContact CG-CD2 4.33Å; M208-L375 HydrophobicContact SD-CD2 3.69Å; M208-L378 HydrophobicContact CE-CD1 3.98Å; M208-L378 HydrophobicContact SD-CD1 3.87Å; M208-V431 HydrophobicContact CE-CG1 4.35Å; M208-V431 HydrophobicContact CE-CG2 4.44Å
209L79.3Confident80.9Confident71 Ų7144.3 Ų44.337%0.37221%0.213SC..Hα-helixtrans-59.2-40.5176.8-177.565.6000111.8R206 I212 I213R206-L209 PolarHBondContact O-N 3.21Å; L209-I212 PolarHBondContact O-N 3.33Å; L209-I213 HydrophobicContact CG-CD1 4.09Å; L209-I213 VanDerWaalsContact O-CG1 3.29Å; L209-I213 WeakPolarHBondContact O-CG1 3.47Å; L209-I213 PolarHBondContact O-N 3.29Å
210A79.6Confident81.7Confident3 Ų347.3 Ų47.33%0.02523%0.228CC..Hα-helixtrans-57.8-53.117500000110.8Y21 T202 R206 R207 M208 I212 I213 T214Y21-A210 HydrophobicContact CE1-CB 4.22Å; Y21-A210 WeakPolarHBondContact CE1-O 3.39Å; Y21-A210 HydrophobicContact CE2-CB 3.7Å; Y21-A210 VanDerWaalsContact CZ-O 3.28Å; Y21-A210 WeakPolarHBondContact OH-CA 3.41Å; Y21-A210 WeakPolarHBondContact OH-CB 3.3Å; Y21-A210 PolarHBondContact OH-O 3.19Å; T202-A210 HydrophobicContact CG2-CB 3.97Å; R206-A210 PolarHBondContact O-N 3.4Å; R207-A210 WeakPolarHBondContact O-CB 3.37Å; R207-A210 PolarHBondContact O-N 3.4Å; M208-A210 VanDerWaalsContact C-N 3.28Å; M208-A210 PolarHBondContact O-N 2.84Å; A210-I212 VanDerWaalsContact C-N 3.27Å; A210-I212 PolarHBondContact O-N 3.19Å; A210-I213 PolarHBondContact O-N 3.32Å; A210-I213 VanDerWaalsContact O-N 3.09Å; A210-T214 PolarHBondContact O-N 3.39Å; A210-T214 VanDerWaalsContact O-N 3.14Å; A210-T214 PolarHBondContact O-OG1 3.21Å
211G80.6Confident82.3Confident12 Ų1246.6 Ų46.612%0.12423%0.225CC..Hα-helixtrans-53.7-43.4177.800000113R207 M208 I213 T214 D215R207-G211 PolarHBondContact O-N 3.12Å; M208-G211 PolarHBondContact O-N 3.16Å; G211-I213 PolarHBondContact O-N 3.15Å; G211-T214 WeakPolarHBondContact O-CB 3.3Å; G211-T214 PolarHBondContact O-N 3.07Å; G211-D215 PolarHBondContact O-N 3.16Å
212I83.8Confident82.9Confident11 Ų1146.4 Ų46.46%0.05622%0.224CC..Hα-helixtrans-67.4-34.7179.7-69.9162.7000112.7M208 L209 A210 D215 Y216 R371 L375M208-I212 HydrophobicContact CG-CD1 4.11Å; M208-I212 PolarHBondContact O-N 2.89Å; M208-I212 VanDerWaalsContact O-N 3.1Å; L209-I212 PolarHBondContact O-N 3.33Å; A210-I212 VanDerWaalsContact C-N 3.27Å; A210-I212 PolarHBondContact O-N 3.19Å; I212-D215 WeakPolarHBondContact O-CB 3.49Å; I212-D215 PolarHBondContact O-N 3.26Å; I212-Y216 HydrophobicContact CG2-CD1 4.42Å; I212-Y216 HydrophobicContact CG2-CD2 4.16Å; I212-Y216 HydrophobicContact CG2-CE1 3.84Å; I212-Y216 HydrophobicContact CG2-CE2 3.53Å; I212-Y216 WeakPolarHBondContact O-CD2 3.33Å; I212-Y216 VanDerWaalsContact O-CG 3.31Å; I212-Y216 PolarHBondContact O-N 2.96Å; I212-R371 HydrophobicContact CG2-CB 4.44Å; I212-L375 HydrophobicContact CD1-CD1 3.93Å; I212-L375 HydrophobicContact CD1-CD2 3.19Å; I212-L375 HydrophobicContact CD1-CG 3.49Å; I212-L375 VanDerWaalsContact CD1-CG 3.49Å; I212-L375 HydrophobicContact CG2-CD1 4.46Å
213I86.5Confident83.6Confident57 Ų5747.7 Ų47.729%0.29223%0.23SC..Hα-helixtrans-65.5-40.5174.4-68.5163.9000111.2Y21 L209 A210 G211 D215 Y216 T217Y21-I213 HydrophobicContact CD1-CG2 4.1Å; Y21-I213 HydrophobicContact CE1-CB 3.97Å; Y21-I213 HydrophobicContact CE1-CG2 3.9Å; L209-I213 HydrophobicContact CG-CD1 4.09Å; L209-I213 VanDerWaalsContact O-CG1 3.29Å; L209-I213 WeakPolarHBondContact O-CG1 3.47Å; L209-I213 PolarHBondContact O-N 3.29Å; A210-I213 PolarHBondContact O-N 3.32Å; A210-I213 VanDerWaalsContact O-N 3.09Å; G211-I213 PolarHBondContact O-N 3.15Å; I213-D215 VanDerWaalsContact C-N 3.26Å; I213-D215 PolarHBondContact O-N 3.01Å; I213-Y216 PolarHBondContact O-N 3.22Å; I213-T217 PolarHBondContact O-N 3.27Å; I213-T217 VanDerWaalsContact O-N 3.08Å; I213-T217 PolarHBondContact O-OG1 2.98Å
214T85.3Confident84.8Confident6 Ų651 Ų514%0.03725%0.246CC..Hα-helixtrans-58.9-44.9174.5-56.30000110.5Y21 Q28 A210 G211 T217 F218Y21-T214 PolarHBondContact OH-OG1 2.69Å; Q28-T214 HydrophobicContact CG-CG2 3.61Å; A210-T214 PolarHBondContact O-N 3.39Å; A210-T214 VanDerWaalsContact O-N 3.14Å; A210-T214 PolarHBondContact O-OG1 3.21Å; G211-T214 WeakPolarHBondContact O-CB 3.3Å; G211-T214 PolarHBondContact O-N 3.07Å; T214-T217 VanDerWaalsContact O-CB 3.31Å; T214-T217 WeakPolarHBondContact O-CB 3.36Å; T214-T217 PolarHBondContact O-N 3.49Å; T214-T217 VanDerWaalsContact O-N 3.16Å; T214-F218 PolarHBondContact O-N 2.91Å
215D86.6Confident86.1Confident50 Ų5047.4 Ų47.427%0.26722%0.224SC..Hα-helixtrans-64.3-42.4177.5-89.18000113G211 I212 I213 T217 F218 G219 R371G211-D215 PolarHBondContact O-N 3.16Å; I212-D215 WeakPolarHBondContact O-CB 3.49Å; I212-D215 PolarHBondContact O-N 3.26Å; I213-D215 VanDerWaalsContact C-N 3.26Å; I213-D215 PolarHBondContact O-N 3.01Å; D215-T217 PolarHBondContact O-N 3.34Å; D215-F218 WeakPolarHBondContact O-CB 3.41Å; D215-F218 PolarHBondContact O-N 3.29Å; D215-F218 VanDerWaalsContact O-N 3.09Å; D215-G219 PolarHBondContact O-N 3.24Å; D215-R371 VanDerWaalsContact C-NH1 3.29Å; D215-R371 VanDerWaalsContact CB-CZ 3.44Å; D215-R371 VanDerWaalsContact CB-NE 3.32Å; D215-R371 PolarHBondContact O-NH1 3.4Å; D215-R371 WeakPolarHBondContact OD2-CD 3.12Å; D215-R371 IonicContact OD2-CZ 2.78Å; D215-R371 IonicContact OD2-NE 3.16Å; D215-R371 PolarHBondContact OD2-NE 3.43Å
216Y91.1Very high87.3Confident54 Ų5437.7 Ų37.721%0.21218%0.182CC..Hα-helixtrans-58.7-36.2171.7-66.6-31.1000112.1I212 I213 F218 G219 L220 I368 R371 S372I212-Y216 HydrophobicContact CG2-CD1 4.42Å; I212-Y216 HydrophobicContact CG2-CD2 4.16Å; I212-Y216 HydrophobicContact CG2-CE1 3.84Å; I212-Y216 HydrophobicContact CG2-CE2 3.53Å; I212-Y216 WeakPolarHBondContact O-CD2 3.33Å; I212-Y216 VanDerWaalsContact O-CG 3.31Å; I212-Y216 PolarHBondContact O-N 2.96Å; I213-Y216 PolarHBondContact O-N 3.22Å; Y216-F218 VanDerWaalsContact C-N 3.32Å; Y216-G219 PolarHBondContact O-N 2.6Å; Y216-L220 PolarHBondContact O-N 3.1Å; Y216-I368 HydrophobicContact CD1-CB 4.32Å; Y216-I368 HydrophobicContact CD1-CG1 4.25Å; Y216-I368 HydrophobicContact CD1-CG2 4.06Å; Y216-I368 HydrophobicContact CE1-CB 4.42Å; Y216-I368 HydrophobicContact CE1-CG2 3.93Å; Y216-I368 WeakPolarHBondContact CE1-O 3.37Å; Y216-R371 HydrophobicContact CE1-CB 4.07Å; Y216-S372 PolarHBondContact OH-OG 3.07Å
217T91.8Very high88.2Confident19 Ų1932.9 Ų32.912%0.11718%0.176CC..Hα-helixtrans-68.1-35.6176.9-49.20000111.5C25 Q28 I29 I213 T214 D215 L220 G221C25-T217 HydrophobicContact CB-CG2 4.06Å; C25-T217 WeakPolarHBondContact O-CG2 3.4Å; Q28-T217 HydrophobicContact CB-CG2 4.26Å; I29-T217 HydrophobicContact CD1-CG2 3.98Å; I29-T217 HydrophobicContact CG1-CG2 3.41Å; I29-T217 VanDerWaalsContact CG1-CG2 3.41Å; I213-T217 PolarHBondContact O-N 3.27Å; I213-T217 VanDerWaalsContact O-N 3.08Å; I213-T217 PolarHBondContact O-OG1 2.98Å; T214-T217 VanDerWaalsContact O-CB 3.31Å; T214-T217 WeakPolarHBondContact O-CB 3.36Å; T214-T217 PolarHBondContact O-N 3.49Å; T214-T217 VanDerWaalsContact O-N 3.16Å; D215-T217 PolarHBondContact O-N 3.34Å; T217-L220 PolarHBondContact O-N 3.41Å; T217-G221 PolarHBondContact O-N 3.18Å
218F91.3Very high89.2Confident19 Ų1931.7 Ų31.78%0.08318%0.175CC..Hα-helixtrans-63.3-45.8170.6-177.7-86.1000111.5L31 A32 M35 M36 T214 D215 Y216 L220 G221 Y222 Y342 E367L31-F218 HydrophobicContact CD2-CD2 4.1Å; L31-F218 HydrophobicContact CD2-CE2 4.18Å; A32-F218 HydrophobicContact CB-CD2 3.7Å; A32-F218 HydrophobicContact CB-CE2 3.75Å; A32-F218 HydrophobicContact CB-CG 4.13Å; A32-F218 HydrophobicContact CB-CZ 4.19Å; A32-F218 WeakPolarHBondContact CB-O 3.42Å; M35-F218 HydrophobicContact CB-CE2 4.41Å; M35-F218 HydrophobicContact CB-CZ 4.45Å; M35-F218 HydrophobicContact CG-CE2 4.44Å; M35-F218 HydrophobicContact SD-CE2 4.44Å; M36-F218 HydrophobicContact CE-CE1 4.41Å; M36-F218 HydrophobicContact CE-CZ 3.96Å; T214-F218 PolarHBondContact O-N 2.91Å; D215-F218 WeakPolarHBondContact O-CB 3.41Å; D215-F218 PolarHBondContact O-N 3.29Å; D215-F218 VanDerWaalsContact O-N 3.09Å; Y216-F218 VanDerWaalsContact C-N 3.32Å; F218-L220 VanDerWaalsContact C-N 3.34Å; F218-L220 PolarHBondContact O-N 2.72Å; F218-G221 CarbonylContact O-C 3.49Å; F218-G221 PolarHBondContact O-N 3.01Å; F218-G221 VanDerWaalsContact O-N 3.12Å; F218-Y222 HydrophobicContact CE1-CD1 4.45Å; F218-Y222 PolarHBondContact O-N 3.14Å; F218-Y342 WeakPolarHBondContact CE1-OH 3.4Å; F218-E367 WeakPolarHBondContact CD1-OE2 3.38Å
219G92.5Very high90Very high0 Ų028 Ų280%016%0.157CC..Hα-helixtrans-59-42.3175.400000112.8D215 Y216 Y222 M223D215-G219 PolarHBondContact O-N 3.24Å; Y216-G219 PolarHBondContact O-N 2.6Å; G219-Y222 WeakPolarHBondContact O-CB 3.34Å; G219-Y222 PolarHBondContact O-N 3.35Å; G219-M223 WeakPolarHBondContact O-CG 3.28Å; G219-M223 PolarHBondContact O-N 3.03Å
220L94.3Very high90.6Very high86 Ų8630.6 Ų30.645%0.4516%0.163SC..Hα-helixtrans-60.1-44.3172-84.6165.4000112.2Y216 T217 F218 Y222 M223 L224Y216-L220 PolarHBondContact O-N 3.1Å; T217-L220 PolarHBondContact O-N 3.41Å; F218-L220 VanDerWaalsContact C-N 3.34Å; F218-L220 PolarHBondContact O-N 2.72Å; L220-Y222 VanDerWaalsContact C-N 3.28Å; L220-Y222 PolarHBondContact O-N 3.09Å; L220-M223 PolarHBondContact O-N 3.25Å; L220-L224 WeakPolarHBondContact O-CB 3.33Å; L220-L224 VanDerWaalsContact O-CG 3.3Å; L220-L224 WeakPolarHBondContact O-CG 3.3Å; L220-L224 PolarHBondContact O-N 3.05Å
221G94.1Very high91.3Very high0 Ų037.1 Ų37.10%020%0.197CC..Hα-helixtrans-62.1-36.7174.200000112.7F33 T217 F218 L224 L225F33-G221 WeakPolarHBondContact CD1-O 3.29Å; F33-G221 WeakPolarHBondContact CE1-O 3.38Å; T217-G221 PolarHBondContact O-N 3.18Å; F218-G221 CarbonylContact O-C 3.49Å; F218-G221 PolarHBondContact O-N 3.01Å; F218-G221 VanDerWaalsContact O-N 3.12Å; G221-L224 PolarHBondContact O-N 3.37Å; G221-L225 WeakPolarHBondContact O-CB 3.37Å; G221-L225 PolarHBondContact O-N 3.19Å
222Y92.6Very high91.9Very high0 Ų038.9 Ų38.90%020%0.203CC..Hα-helixtrans-62.9-47.1174.7-158.9166.9000111.3M36 F218 G219 L220 L224 L225 A226 S346 Q360 F363M36-Y222 HydrophobicContact CB-CD2 4.13Å; M36-Y222 HydrophobicContact CB-CE2 3.86Å; M36-Y222 HydrophobicContact CE-CE1 4.41Å; M36-Y222 HydrophobicContact CG-CD1 4.28Å; M36-Y222 HydrophobicContact CG-CD2 3.94Å; M36-Y222 HydrophobicContact CG-CE1 4.06Å; M36-Y222 HydrophobicContact CG-CE2 3.71Å; M36-Y222 HydrophobicContact CG-CG 4.23Å; M36-Y222 HydrophobicContact SD-CE1 4.09Å; M36-Y222 HydrophobicContact SD-CE2 4.29Å; F218-Y222 HydrophobicContact CE1-CD1 4.45Å; F218-Y222 PolarHBondContact O-N 3.14Å; G219-Y222 WeakPolarHBondContact O-CB 3.34Å; G219-Y222 PolarHBondContact O-N 3.35Å; L220-Y222 VanDerWaalsContact C-N 3.28Å; L220-Y222 PolarHBondContact O-N 3.09Å; Y222-L224 PolarHBondContact O-N 3.39Å; Y222-L225 WeakPolarHBondContact O-CB 2.84Å; Y222-L225 PolarHBondContact O-N 3.05Å; Y222-A226 PolarHBondContact O-N 3.24Å; Y222-S346 PolarHBondContact OH-OG 3.35Å; Y222-Q360 PolarHBondContact OH-OE1 3.13Å; Y222-F363 HydrophobicContact CE1-CB 4.41Å
223M95.2Very high92.1Very high29 Ų2942.2 Ų42.214%0.14322%0.215CC..Hα-helixtrans-61.4-44.6176.2-66168.968.900112.3G219 L220 L225 A226 G227 F361 L365 I368G219-M223 WeakPolarHBondContact O-CG 3.28Å; G219-M223 PolarHBondContact O-N 3.03Å; L220-M223 PolarHBondContact O-N 3.25Å; M223-L225 VanDerWaalsContact C-N 3.32Å; M223-L225 PolarHBondContact O-N 2.73Å; M223-A226 PolarHBondContact O-N 3.36Å; M223-G227 PolarHBondContact O-N 3.27Å; M223-F361 HydrophobicContact CB-CD2 3.9Å; M223-F361 HydrophobicContact CB-CE2 3.87Å; M223-F361 HydrophobicContact CE-CD2 4.37Å; M223-F361 HydrophobicContact CE-CE1 3.93Å; M223-F361 HydrophobicContact CE-CE2 3.55Å; M223-F361 HydrophobicContact CE-CZ 3.29Å; M223-F361 HydrophobicContact CG-CD2 4.28Å; M223-F361 HydrophobicContact CG-CE2 4.28Å; M223-L365 HydrophobicContact CE-CB 4.4Å; M223-L365 HydrophobicContact CE-CD1 4.04Å; M223-L365 HydrophobicContact SD-CB 4.31Å; M223-L365 HydrophobicContact SD-CD1 4.34Å; M223-I368 HydrophobicContact SD-CD1 4.47Å
224L95.4Very high92.4Very high90 Ų9041.3 Ų41.347%0.47121%0.21SC..Hα-helixtrans-63-38.3178.1-74.3173.2000111.9I29 F33 L220 G221 Y222 A226 G227 V228I29-L224 HydrophobicContact CG2-CD1 4.06Å; F33-L224 HydrophobicContact CE1-CB 3.76Å; F33-L224 HydrophobicContact CZ-CB 4Å; L220-L224 WeakPolarHBondContact O-CB 3.33Å; L220-L224 VanDerWaalsContact O-CG 3.3Å; L220-L224 WeakPolarHBondContact O-CG 3.3Å; L220-L224 PolarHBondContact O-N 3.05Å; G221-L224 PolarHBondContact O-N 3.37Å; Y222-L224 PolarHBondContact O-N 3.39Å; L224-A226 VanDerWaalsContact C-N 3.32Å; L224-A226 PolarHBondContact O-N 3.44Å; L224-G227 PolarHBondContact O-N 2.98Å; L224-V228 WeakPolarHBondContact O-CG2 3.41Å; L224-V228 PolarHBondContact O-N 3.44Å
225L94.8Very high92.8Very high0 Ų041.1 Ų41.10%021%0.209CC..Hα-helixtrans-59.4-43.8176-179.966.6000111.5F33 M36 F40 G221 Y222 M223 G227 V228 A229 I242F33-L225 HydrophobicContact CB-CD1 4.19Å; F33-L225 HydrophobicContact CD1-CB 3.76Å; F33-L225 HydrophobicContact CD1-CD1 4.24Å; F33-L225 HydrophobicContact CE1-CB 4.12Å; F33-L225 HydrophobicContact CG-CD1 4.32Å; M36-L225 HydrophobicContact CB-CD2 3.52Å; F40-L225 HydrophobicContact CD2-CD2 4.26Å; F40-L225 HydrophobicContact CD2-CG 4.28Å; F40-L225 HydrophobicContact CE2-CD2 3.97Å; F40-L225 HydrophobicContact CE2-CG 3.94Å; G221-L225 WeakPolarHBondContact O-CB 3.37Å; G221-L225 PolarHBondContact O-N 3.19Å; Y222-L225 WeakPolarHBondContact O-CB 2.84Å; Y222-L225 PolarHBondContact O-N 3.05Å; M223-L225 VanDerWaalsContact C-N 3.32Å; M223-L225 PolarHBondContact O-N 2.73Å; L225-G227 VanDerWaalsContact C-N 3.28Å; L225-G227 PolarHBondContact O-N 3.09Å; L225-V228 PolarHBondContact O-N 3.21Å; L225-A229 VanDerWaalsContact O-CB 3.26Å; L225-A229 WeakPolarHBondContact O-CB 3.44Å; L225-A229 PolarHBondContact O-N 3.36Å; L225-I242 HydrophobicContact CD1-CG2 3.87Å
226A93.8Very high93.2Very high4 Ų442 Ų423%0.03321%0.209CC..Hα-helixtrans-60.3-40.5178.100000111.5F40 Y222 M223 L224 Y230 Q360 F361F40-A226 HydrophobicContact CZ-CB 4.23Å; Y222-A226 PolarHBondContact O-N 3.24Å; M223-A226 PolarHBondContact O-N 3.36Å; L224-A226 VanDerWaalsContact C-N 3.32Å; L224-A226 PolarHBondContact O-N 3.44Å; A226-Y230 WeakPolarHBondContact O-CB 3.4Å; A226-Y230 PolarHBondContact O-N 2.84Å; A226-Q360 HydrophobicContact CB-CB 4.24Å; A226-F361 HydrophobicContact CB-CB 4.04Å
227G93.8Very high93.4Very high36 Ų3645.3 Ų45.337%0.37122%0.224SC..Hα-helixtrans-65.1-45.4174.300000113.3M223 L224 L225 A229 Y230 L231M223-G227 PolarHBondContact O-N 3.27Å; L224-G227 PolarHBondContact O-N 2.98Å; L225-G227 VanDerWaalsContact C-N 3.28Å; L225-G227 PolarHBondContact O-N 3.09Å; G227-A229 PolarHBondContact O-N 3.44Å; G227-Y230 WeakPolarHBondContact O-CB 3.42Å; G227-Y230 PolarHBondContact O-N 2.89Å; G227-L231 WeakPolarHBondContact O-CG 3.38Å; G227-L231 PolarHBondContact O-N 3.28Å
228V94.6Very high93.5Very high40 Ų4044.6 Ų44.624%0.24222%0.22CC..Hα-helixtrans-64.5-40.8177.4176.20000111.2L224 L225 Y230 L231 I232 L238 A241L224-V228 WeakPolarHBondContact O-CG2 3.41Å; L224-V228 PolarHBondContact O-N 3.44Å; L225-V228 PolarHBondContact O-N 3.21Å; V228-Y230 VanDerWaalsContact C-N 3.31Å; V228-Y230 PolarHBondContact O-N 3.09Å; V228-L231 PolarHBondContact O-N 2.87Å; V228-I232 HydrophobicContact CG1-CD1 4.23Å; V228-I232 PolarHBondContact O-N 3.15Å; V228-L238 HydrophobicContact CG1-CD1 3.88Å; V228-A241 HydrophobicContact CG1-CB 4.42Å
229A92.9Very high93.7Very high1 Ų143.8 Ų43.81%0.00822%0.216CC..Hα-helixtrans-66.2-32.6177.400000112.5F40 L225 G227 L231 I232 L238 Y357F40-A229 HydrophobicContact CB-CB 4.27Å; F40-A229 HydrophobicContact CD1-CB 3.69Å; F40-A229 HydrophobicContact CD2-CB 3.73Å; F40-A229 HydrophobicContact CE1-CB 3.9Å; F40-A229 HydrophobicContact CE2-CB 3.93Å; F40-A229 HydrophobicContact CG-CB 3.61Å; F40-A229 HydrophobicContact CZ-CB 4.01Å; L225-A229 VanDerWaalsContact O-CB 3.26Å; L225-A229 WeakPolarHBondContact O-CB 3.44Å; L225-A229 PolarHBondContact O-N 3.36Å; G227-A229 PolarHBondContact O-N 3.44Å; A229-L231 VanDerWaalsContact C-N 3.34Å; A229-I232 CarbonylContact O-C 3.48Å; A229-L238 HydrophobicContact CB-CD1 4.25Å; A229-L238 HydrophobicContact CB-CD2 4.07Å; A229-Y357 VanDerWaalsContact C-CE1 3.4Å; A229-Y357 HydrophobicContact CB-CD1 4.22Å; A229-Y357 HydrophobicContact CB-CE1 3.88Å; A229-Y357 WeakPolarHBondContact O-CE1 3.1Å
230Y92.4Very high93.8Very high126 Ų12646.5 Ų46.549%0.49423%0.23SC..Hα-helixtrans-65-38.4174.5179.6-100.2000112.3A226 G227 V228 Y357A226-Y230 WeakPolarHBondContact O-CB 3.4Å; A226-Y230 PolarHBondContact O-N 2.84Å; G227-Y230 WeakPolarHBondContact O-CB 3.42Å; G227-Y230 PolarHBondContact O-N 2.89Å; V228-Y230 VanDerWaalsContact C-N 3.31Å; V228-Y230 PolarHBondContact O-N 3.09Å; Y230-Y357 AromaticContact CD2-CD2 3.98Å; Y230-Y357 HydrophobicContact CD2-CD2 3.98Å; Y230-Y357 HydrophobicContact CD2-CE2 4.38Å; Y230-Y357 HydrophobicContact CD2-CG 4.05Å
231L93.3Very high93.7Very high140 Ų14044 Ų4473%0.73322%0.222SC*.Hα-helixtrans-76.8-37178.4-63.5174.5000112.6G227 V228 A229G227-L231 WeakPolarHBondContact O-CG 3.38Å; G227-L231 PolarHBondContact O-N 3.28Å; V228-L231 PolarHBondContact O-N 2.87Å; A229-L231 VanDerWaalsContact C-N 3.34Å
232I93.1Very high93.7Very high49 Ų4944 Ų4425%0.25122%0.222SC..  trans-116.296-175.7-53.4176000109.7V228 A229 K237 L238 A241V228-I232 HydrophobicContact CG1-CD1 4.23Å; V228-I232 PolarHBondContact O-N 3.15Å; A229-I232 CarbonylContact O-C 3.48Å; I232-K237 HydrophobicContact CG2-CB 3.56Å; I232-L238 HydrophobicContact CB-CD1 4.43Å; I232-L238 HydrophobicContact CG2-CB 4.09Å; I232-A241 HydrophobicContact CD1-CB 3.45Å; I232-A241 VanDerWaalsContact CD1-CB 3.45Å
233R89.8Confident93.7Very high80 Ų8044 Ų4430%0.30222%0.222SC..  trans-89.2-0.4-175.6-57.1179.3-174.7-176.21.3114.9E102 H105E102-R233 PolarHBondContact O-NH1 3Å; H105-R233 PolarHBondContact N-O 3.42Å
234D92.9Very high93.4Very high38 Ų3844.9 Ų44.920%0.20323%0.234CC..BIsolated β-bridgetrans-95.3121.8173.6-76.8-49.2000110.2H105 R236 K237 L238H105-D234 WeakPolarHBondContact CB-OD1 3.39Å; D234-R236 VanDerWaalsContact C-N 3.33Å; D234-R236 PolarHBondContact O-N 3.33Å; D234-K237 HydrophobicContact CB-CB 4.02Å; D234-K237 HydrophobicContact CB-CD 3.93Å; D234-K237 HydrophobicContact CB-CG 3.98Å; D234-K237 PolarHBondContact O-N 3.5Å; D234-K237 WeakPolarHBondContact OD2-CD 3.4Å; D234-K237 WeakPolarHBondContact OD2-CE 3.3Å; D234-K237 IonicContact OD2-NZ 3.1Å; D234-K237 PolarHBondContact OD2-NZ 2.89Å; D234-L238 WeakPolarHBondContact O-CB 3.44Å; D234-L238 PolarHBondContact O-N 3.12Å
235W93.4Very high93.1Very high3 Ų343 Ų431%0.01123%0.227CC..Hα-helixtrans-60.6-37.4-175.178.9-91.8000113.9T41 S106 T107 T108 E111 W112 Y176 L238 Q239T41-W235 HydrophobicContact CG2-CB 3.94Å; S106-W235 WeakPolarHBondContact O-CB 3.36Å; S106-W235 PolarHBondContact O-N 3.4Å; T107-W235 VanDerWaalsContact C-CD1 3.41Å; T108-W235 HydrophobicContact CG2-CD2 3.72Å; T108-W235 HydrophobicContact CG2-CE3 3.82Å; T108-W235 HydrophobicContact CG2-CG 4.17Å; T108-W235 HydrophobicContact CG2-CH2 4.46Å; T108-W235 HydrophobicContact CG2-CZ2 4.36Å; T108-W235 HydrophobicContact CG2-CZ3 4.2Å; E111-W235 WeakPolarHBondContact OE2-CZ2 3.5Å; E111-W235 PolarHBondContact OE2-NE1 2.82Å; W112-W235 AromaticContact CH2-CH2 3.92Å; W112-W235 HydrophobicContact CH2-CH2 3.92Å; W112-W235 HydrophobicContact CH2-CZ2 4.02Å; W112-W235 HydrophobicContact CZ2-CH2 4.45Å; W112-W235 HydrophobicContact CZ2-CZ2 4.34Å; Y176-W235 HydrophobicContact CD2-CH2 4.45Å; Y176-W235 HydrophobicContact CD2-CZ3 4.3Å; Y176-W235 HydrophobicContact CE2-CZ3 4.2Å; W235-L238 PolarHBondContact O-N 3.3Å; W235-Q239 VanDerWaalsContact O-CB 3.31Å; W235-Q239 WeakPolarHBondContact O-CB 3.38Å; W235-Q239 PolarHBondContact O-N 3.34Å
236R94.7Very high92.7Very high67 Ų6743.1 Ų43.125%0.25323%0.228SC..Hα-helixtrans-66-45.8178-65.5-175.6175.9-89.85.8111.4E111 A168 A170 D234 Q239 L240E111-R236 VanDerWaalsContact CD-NH2 3.32Å; E111-R236 IonicContact OE1-CZ 2.68Å; E111-R236 IonicContact OE1-NE 3.18Å; E111-R236 PolarHBondContact OE1-NE 3.45Å; E111-R236 IonicContact OE1-NH2 2.82Å; E111-R236 PolarHBondContact OE1-NH2 2.85Å; E111-R236 IonicContact OE2-CZ 3.67Å; E111-R236 IonicContact OE2-NE 2.84Å; E111-R236 PolarHBondContact OE2-NE 2.97Å; E111-R236 VanDerWaalsContact OE2-NE 3.07Å; E111-R236 IonicContact OE2-NH2 3.88Å; E111-R236 PolarHBondContact OE2-NH2 3.42Å; A168-R236 PolarHBondContact O-NH1 3.2Å; A170-R236 PolarHBondContact O-NH1 2.95Å; A170-R236 PolarHBondContact O-NH2 2.99Å; D234-R236 VanDerWaalsContact C-N 3.33Å; D234-R236 PolarHBondContact O-N 3.33Å; R236-Q239 PolarHBondContact O-N 3.44Å; R236-L240 WeakPolarHBondContact O-CG 3.42Å; R236-L240 PolarHBondContact O-N 3.12Å; R236-L240 VanDerWaalsContact O-N 3.07Å
237K95Very high92.4Very high124 Ų12447.5 Ų47.554%0.53925%0.247SC..Hα-helixtrans-67.3-39.1177.5-62.6179.6-169.81540111I232 D234 L240 A241I232-K237 HydrophobicContact CG2-CB 3.56Å; D234-K237 HydrophobicContact CB-CB 4.02Å; D234-K237 HydrophobicContact CB-CD 3.93Å; D234-K237 HydrophobicContact CB-CG 3.98Å; D234-K237 PolarHBondContact O-N 3.5Å; D234-K237 WeakPolarHBondContact OD2-CD 3.4Å; D234-K237 WeakPolarHBondContact OD2-CE 3.3Å; D234-K237 IonicContact OD2-NZ 3.1Å; D234-K237 PolarHBondContact OD2-NZ 2.89Å; K237-L240 PolarHBondContact O-N 3.22Å; K237-A241 WeakPolarHBondContact O-CB 3.34Å; K237-A241 PolarHBondContact O-N 3.29Å
238L94.3Very high92.1Very high5 Ų551.9 Ų51.93%0.02626%0.261CS..Hα-helixtrans-61.8-45.8175.8-179.459.5000110.8V37 F40 T41 V228 A229 I232 D234 W235 L240 A241 I242V37-L238 HydrophobicContact CG2-CD2 4.1Å; V37-L238 HydrophobicContact CG2-CG 4.2Å; F40-L238 HydrophobicContact CB-CD2 3.98Å; T41-L238 HydrophobicContact CG2-CD2 4.22Å; V228-L238 HydrophobicContact CG1-CD1 3.88Å; A229-L238 HydrophobicContact CB-CD1 4.25Å; A229-L238 HydrophobicContact CB-CD2 4.07Å; I232-L238 HydrophobicContact CB-CD1 4.43Å; I232-L238 HydrophobicContact CG2-CB 4.09Å; D234-L238 WeakPolarHBondContact O-CB 3.44Å; D234-L238 PolarHBondContact O-N 3.12Å; W235-L238 PolarHBondContact O-N 3.3Å; L238-L240 VanDerWaalsContact C-N 3.31Å; L238-L240 PolarHBondContact O-N 3.43Å; L238-A241 PolarHBondContact O-N 3.42Å; L238-I242 HydrophobicContact CD1-CG2 4.35Å; L238-I242 WeakPolarHBondContact O-CG1 3.44Å; L238-I242 WeakPolarHBondContact O-CG2 3.44Å; L238-I242 PolarHBondContact O-N 3.07Å
239Q94.4Very high91.6Very high2 Ų251 Ų511%0.00925%0.254CS..Hα-helixtrans-60.9-38.3176.6-173.566.726.700112.1G164 V167 A168 W235 R236 I242 S243G164-Q239 WeakPolarHBondContact O-CG 3.39Å; G164-Q239 PolarHBondContact O-NE2 3.39Å; V167-Q239 HydrophobicContact CB-CG 4.06Å; V167-Q239 HydrophobicContact CG1-CG 3.91Å; A168-Q239 HydrophobicContact CB-CB 3.95Å; A168-Q239 HydrophobicContact CB-CG 3.9Å; W235-Q239 VanDerWaalsContact O-CB 3.31Å; W235-Q239 WeakPolarHBondContact O-CB 3.38Å; W235-Q239 PolarHBondContact O-N 3.34Å; R236-Q239 PolarHBondContact O-N 3.44Å; Q239-I242 VanDerWaalsContact O-CG1 3.22Å; Q239-I242 WeakPolarHBondContact O-CG1 3.29Å; Q239-S243 VanDerWaalsContact O-CB 3.27Å; Q239-S243 WeakPolarHBondContact O-CB 3.48Å; Q239-S243 PolarHBondContact O-N 3.07Å; Q239-S243 PolarHBondContact O-OG 3.3Å
240L94.3Very high91Very high57 Ų5756 Ų5630%0.29828%0.28SS..Hα-helixtrans-67.5-45.7173-71.1172.1000111.8V165 A168 F169 R236 K237 L238 I242 S243 A244V165-L240 HydrophobicContact CG1-CD2 3.86Å; A168-L240 HydrophobicContact CB-CD1 4.44Å; A168-L240 HydrophobicContact CB-CD2 3.73Å; A168-L240 HydrophobicContact CB-CG 3.63Å; F169-L240 HydrophobicContact CE2-CD2 3.86Å; F169-L240 HydrophobicContact CZ-CD1 4.44Å; F169-L240 HydrophobicContact CZ-CD2 4.2Å; R236-L240 WeakPolarHBondContact O-CG 3.42Å; R236-L240 PolarHBondContact O-N 3.12Å; R236-L240 VanDerWaalsContact O-N 3.07Å; K237-L240 PolarHBondContact O-N 3.22Å; L238-L240 VanDerWaalsContact C-N 3.31Å; L238-L240 PolarHBondContact O-N 3.43Å; L240-I242 VanDerWaalsContact C-N 3.28Å; L240-I242 PolarHBondContact O-N 3.15Å; L240-S243 PolarHBondContact O-N 3.27Å; L240-A244 WeakPolarHBondContact O-CB 3.47Å; L240-A244 PolarHBondContact O-N 3.18Å
241A93.9Very high90.7Very high34 Ų3454.2 Ų54.228%0.28128%0.275SS..Hα-helixtrans-61.5-34.7-178.200000112.7V228 I232 K237 L238 P245V228-A241 HydrophobicContact CG1-CB 4.42Å; I232-A241 HydrophobicContact CD1-CB 3.45Å; I232-A241 VanDerWaalsContact CD1-CB 3.45Å; K237-A241 WeakPolarHBondContact O-CB 3.34Å; K237-A241 PolarHBondContact O-N 3.29Å; L238-A241 PolarHBondContact O-N 3.42Å; A241-P245 WeakPolarHBondContact O-CD 3.33Å; A241-P245 WeakPolarHBondContact O-CG 3.4Å
242I93.1Very high90.4Very high0 Ų047.6 Ų47.60%024%0.241CC..Hα-helixtrans-79.3-32.7175.966.9175.6000113.2F33 V37 L225 L238 Q239 L240F33-I242 HydrophobicContact CB-CB 3.96Å; F33-I242 HydrophobicContact CB-CG2 4.04Å; F33-I242 HydrophobicContact CD2-CB 3.96Å; F33-I242 HydrophobicContact CD2-CG2 4Å; F33-I242 HydrophobicContact CG-CB 4.36Å; F33-I242 HydrophobicContact CG-CG2 4.21Å; V37-I242 HydrophobicContact CB-CD1 3.81Å; V37-I242 HydrophobicContact CG1-CD1 3.89Å; V37-I242 HydrophobicContact CG2-CD1 3.64Å; L225-I242 HydrophobicContact CD1-CG2 3.87Å; L238-I242 HydrophobicContact CD1-CG2 4.35Å; L238-I242 WeakPolarHBondContact O-CG1 3.44Å; L238-I242 WeakPolarHBondContact O-CG2 3.44Å; L238-I242 PolarHBondContact O-N 3.07Å; Q239-I242 VanDerWaalsContact O-CG1 3.22Å; Q239-I242 WeakPolarHBondContact O-CG1 3.29Å; L240-I242 VanDerWaalsContact C-N 3.28Å; L240-I242 PolarHBondContact O-N 3.15Å
243S92.7Very high90Very high0 Ų049.7 Ų49.70%025%0.251CS..Hα-helixtrans-91.3-36.9-170.7-51.50000112.6H34 G164 Q239 L240 G246H34-S243 PolarHBondContact CE1-OG 2.82Å; G164-S243 VanDerWaalsContact C-OG 3.24Å; G164-S243 PolarHBondContact O-OG 3.29Å; Q239-S243 VanDerWaalsContact O-CB 3.27Å; Q239-S243 WeakPolarHBondContact O-CB 3.48Å; Q239-S243 PolarHBondContact O-N 3.07Å; Q239-S243 PolarHBondContact O-OG 3.3Å; L240-S243 PolarHBondContact O-N 3.27Å; S243-G246 PolarHBondContact O-N 3.41Å
244A89.6Confident89.9Confident46 Ų4657 Ų5738%0.3828%0.279SS..G310 helixtrans-62.2-39.2-176.500000114L240 G246 F247L240-A244 WeakPolarHBondContact O-CB 3.47Å; L240-A244 PolarHBondContact O-N 3.18Å; A244-G246 PolarHBondContact O-N 3.05Å; A244-F247 WeakPolarHBondContact O-CD2 3.28Å; A244-F247 PolarHBondContact O-N 3.12Å
245P89.1Confident89.6Confident51 Ų5157.5 Ų57.533%0.33128%0.283SS..G310 helixtrans-58.3-22.5173.8-25.835.8000113.3L30 A241 F247 L248L30-P245 HydrophobicContact CD2-CB 4.44Å; A241-P245 WeakPolarHBondContact O-CD 3.33Å; A241-P245 WeakPolarHBondContact O-CG 3.4Å; P245-F247 PolarHBondContact O-N 3.43Å; P245-L248 VanDerWaalsContact O-CB 3.24Å; P245-L248 WeakPolarHBondContact O-CB 3.3Å; P245-L248 PolarHBondContact O-N 3.15Å
246G86.4Confident89.3Confident2 Ų257.5 Ų57.52%0.02128%0.283CS..G310 helixtrans-66-21.6176.200000114.2T161 S243 A244 L248 L249T161-G246 VanDerWaalsContact CG2-C 3.46Å; T161-G246 VanDerWaalsContact CG2-CA 3.43Å; S243-G246 PolarHBondContact O-N 3.41Å; A244-G246 PolarHBondContact O-N 3.05Å; G246-L248 PolarHBondContact O-N 2.92Å; G246-L249 VanDerWaalsContact O-CB 3.22Å; G246-L249 WeakPolarHBondContact O-CB 3.37Å; G246-L249 PolarHBondContact O-N 2.99Å
247F87.4Confident88.9Confident97 Ų9754.9 Ų54.943%0.42528%0.275SS..G310 helixtrans-64.8-27.5170.5-74.5-68.5000112.5V165 A244 P245 L249 I250V165-F247 HydrophobicContact CG2-CE2 3.96Å; A244-F247 WeakPolarHBondContact O-CD2 3.28Å; A244-F247 PolarHBondContact O-N 3.12Å; P245-F247 PolarHBondContact O-N 3.43Å; F247-L249 PolarHBondContact O-N 3.03Å; F247-I250 HydrophobicContact CD1-CD1 4.43Å; F247-I250 WeakPolarHBondContact O-CB 3.43Å; F247-I250 WeakPolarHBondContact O-CD1 3.17Å; F247-I250 WeakPolarHBondContact O-CG1 3.23Å; F247-I250 PolarHBondContact O-N 3.1Å; F247-I250 VanDerWaalsContact O-N 3.15Å
248L87.1Confident88.5Confident127 Ų12750.6 Ų50.667%0.66526%0.257SS*.G310 helixtrans-61.9-27.9172.6-58.4174000110.4P245 G246 I250 F251P245-L248 VanDerWaalsContact O-CB 3.24Å; P245-L248 WeakPolarHBondContact O-CB 3.3Å; P245-L248 PolarHBondContact O-N 3.15Å; G246-L248 PolarHBondContact O-N 2.92Å; L248-I250 PolarHBondContact O-N 3.2Å; L248-F251 WeakPolarHBondContact O-CD1 3.34Å; L248-F251 WeakPolarHBondContact O-CE1 3.27Å; L248-F251 PolarHBondContact O-N 2.91Å
249L82.9Confident88Confident21 Ų2150.4 Ų50.411%0.1126%0.256CS..G310 helixtrans-67-2.4178-55-177.5000114P27 L30 I157 G246 F247 F251 Y252P27-L249 HydrophobicContact CB-CD1 4.47Å; L30-L249 HydrophobicContact CD1-CD1 3.44Å; L30-L249 VanDerWaalsContact CD1-CD1 3.44Å; L30-L249 HydrophobicContact CD1-CG 4.07Å; I157-L249 HydrophobicContact CG2-CB 3.86Å; I157-L249 HydrophobicContact CG2-CD1 3.71Å; I157-L249 HydrophobicContact CG2-CG 4.44Å; G246-L249 VanDerWaalsContact O-CB 3.22Å; G246-L249 WeakPolarHBondContact O-CB 3.37Å; G246-L249 PolarHBondContact O-N 2.99Å; F247-L249 PolarHBondContact O-N 3.03Å; L249-F251 PolarHBondContact O-N 3.18Å; L249-F251 VanDerWaalsContact O-N 3.15Å; L249-Y252 HydrophobicContact CB-CD2 3.93Å; L249-Y252 HydrophobicContact CB-CE2 4.35Å; L249-Y252 HydrophobicContact CD2-CD2 3.82Å; L249-Y252 HydrophobicContact CD2-CE2 3.33Å; L249-Y252 HydrophobicContact CG-CD2 4.46Å; L249-Y252 HydrophobicContact CG-CE2 4.38Å; L249-Y252 WeakPolarHBondContact O-CB 3.26Å; L249-Y252 WeakPolarHBondContact O-CD2 3.4Å; L249-Y252 PolarHBondContact O-N 3.33Å
250I81.7Confident87.5Confident108 Ų10850.3 Ų50.355%0.55426%0.256SS*.G310 helixtrans-54.7-31.5170-69.8167.8000111.5F247 L248 Y252 I253F247-I250 HydrophobicContact CD1-CD1 4.43Å; F247-I250 WeakPolarHBondContact O-CB 3.43Å; F247-I250 WeakPolarHBondContact O-CD1 3.17Å; F247-I250 WeakPolarHBondContact O-CG1 3.23Å; F247-I250 PolarHBondContact O-N 3.1Å; F247-I250 VanDerWaalsContact O-N 3.15Å; L248-I250 PolarHBondContact O-N 3.2Å; I250-Y252 PolarHBondContact O-N 2.9Å; I250-Y252 VanDerWaalsContact O-N 3.09Å; I250-I253 HydrophobicContact CG2-CD1 4.2Å; I250-I253 WeakPolarHBondContact O-CB 3.22Å; I250-I253 VanDerWaalsContact O-CG1 3.31Å; I250-I253 WeakPolarHBondContact O-CG1 3.34Å; I250-I253 PolarHBondContact O-N 3.04Å
251F86.4Confident86.8Confident88 Ų8850.4 Ų50.439%0.38625%0.252SS..G310 helixtrans-62.3-19.4176.677.1-106000113W23 L248 L249 I253 R254 V255W23-F251 AromaticContact CE3-CE2 3.63Å; W23-F251 HydrophobicContact CE3-CE2 3.63Å; W23-F251 AromaticContact CE3-CZ 3.94Å; W23-F251 HydrophobicContact CE3-CZ 3.94Å; W23-F251 AromaticContact CH2-CE2 3.76Å; W23-F251 HydrophobicContact CH2-CE2 3.76Å; W23-F251 HydrophobicContact CH2-CZ 4.06Å; W23-F251 HydrophobicContact CZ3-CD2 4.43Å; W23-F251 AromaticContact CZ3-CE2 3.21Å; W23-F251 HydrophobicContact CZ3-CE2 3.21Å; W23-F251 AromaticContact CZ3-CZ 3.3Å; W23-F251 HydrophobicContact CZ3-CZ 3.3Å; L248-F251 WeakPolarHBondContact O-CD1 3.34Å; L248-F251 WeakPolarHBondContact O-CE1 3.27Å; L248-F251 PolarHBondContact O-N 2.91Å; L249-F251 PolarHBondContact O-N 3.18Å; L249-F251 VanDerWaalsContact O-N 3.15Å; F251-I253 PolarHBondContact O-N 2.98Å; F251-I253 VanDerWaalsContact O-N 3.1Å; F251-R254 PolarHBondContact O-N 3.16Å; F251-V255 HydrophobicContact CD2-CG2 3.74Å; F251-V255 HydrophobicContact CE2-CG2 4.1Å; F251-V255 PolarHBondContact O-N 2.93Å
252Y85.6Confident86.3Confident1 Ų149.6 Ų49.60%0.00424%0.242CC..Hα-helixtrans-58.8-24.4177.2-85.6-117.8000112.8W23 L26 P27 L249 I250 R254 V255 L256W23-Y252 HydrophobicContact CE3-CE2 4.26Å; W23-Y252 WeakPolarHBondContact O-CE1 3.17Å; W23-Y252 VanDerWaalsContact O-CZ 3.31Å; W23-Y252 PolarHBondContact O-OH 3.25Å; L26-Y252 WeakPolarHBondContact CB-OH 2.96Å; P27-Y252 WeakPolarHBondContact CD-OH 3.39Å; P27-Y252 HydrophobicContact CG-CD1 4.34Å; P27-Y252 HydrophobicContact CG-CE1 3.53Å; L249-Y252 HydrophobicContact CB-CD2 3.93Å; L249-Y252 HydrophobicContact CB-CE2 4.35Å; L249-Y252 HydrophobicContact CD2-CD2 3.82Å; L249-Y252 HydrophobicContact CD2-CE2 3.33Å; L249-Y252 HydrophobicContact CG-CD2 4.46Å; L249-Y252 HydrophobicContact CG-CE2 4.38Å; L249-Y252 WeakPolarHBondContact O-CB 3.26Å; L249-Y252 WeakPolarHBondContact O-CD2 3.4Å; L249-Y252 PolarHBondContact O-N 3.33Å; I250-Y252 PolarHBondContact O-N 2.9Å; I250-Y252 VanDerWaalsContact O-N 3.09Å; Y252-R254 PolarHBondContact O-N 3.26Å; Y252-V255 PolarHBondContact O-N 2.82Å; Y252-V255 VanDerWaalsContact O-N 3.16Å; Y252-L256 HydrophobicContact CD1-CD1 3.69Å; Y252-L256 HydrophobicContact CD1-CD2 4.2Å; Y252-L256 HydrophobicContact CD1-CG 3.73Å; Y252-L256 HydrophobicContact CE1-CD2 4.49Å; Y252-L256 HydrophobicContact CE1-CG 4.48Å; Y252-L256 HydrophobicContact CG-CD1 4.5Å; Y252-L256 PolarHBondContact O-N 3.3Å
253I85.6Confident85.9Confident92 Ų9249.8 Ų49.847%0.47224%0.242SC..Hα-helixtrans-54-36.3174.4-62.7171.8000110.2R150 L154 I250 F251R150-I253 PolarHBondContact NH2-O 3.17Å; L154-I253 HydrophobicContact CD1-CG1 4.18Å; L154-I253 HydrophobicContact CD2-CG1 4.05Å; I250-I253 HydrophobicContact CG2-CD1 4.2Å; I250-I253 WeakPolarHBondContact O-CB 3.22Å; I250-I253 VanDerWaalsContact O-CG1 3.31Å; I250-I253 WeakPolarHBondContact O-CG1 3.34Å; I250-I253 PolarHBondContact O-N 3.04Å; F251-I253 PolarHBondContact O-N 2.98Å; F251-I253 VanDerWaalsContact O-N 3.1Å
254R86.8Confident85.3Confident235 Ų23551.2 Ų51.289%0.88725%0.25SC*.Hα-helixtrans-88.8-27.8178.9-64.3-161.6-179.8132.20.2114.1F251 Y252F251-R254 PolarHBondContact O-N 3.16Å; Y252-R254 PolarHBondContact O-N 3.26Å
255V86.6Confident84.7Confident48 Ų4851.7 Ų51.729%0.29125%0.254SS..Hα-helixtrans-85.7-41.3-171.9177.10000112.4W23 F251 Y252 P257W23-V255 HydrophobicContact CB-CG1 4Å; W23-V255 VanDerWaalsContact CD1-CG1 3.47Å; W23-V255 HydrophobicContact CD2-CG1 3.7Å; W23-V255 HydrophobicContact CE3-CG1 4.46Å; W23-V255 HydrophobicContact CG-CG1 3.46Å; W23-V255 VanDerWaalsContact CG-CG1 3.46Å; F251-V255 HydrophobicContact CD2-CG2 3.74Å; F251-V255 HydrophobicContact CE2-CG2 4.1Å; F251-V255 PolarHBondContact O-N 2.93Å; Y252-V255 PolarHBondContact O-N 2.82Å; Y252-V255 VanDerWaalsContact O-N 3.16Å; V255-P257 WeakPolarHBondContact O-CD 3.47Å
256L86.8Confident84.2Confident3 Ų353 Ų532%0.01626%0.258CS..PPolyproline II helixtrans-74.3121.6-174.9-73.4178.9000111.5L20 I24 R150 L153 L154 L197 Y252L20-L256 HydrophobicContact CD1-CD2 4.35Å; I24-L256 HydrophobicContact CG1-CD2 4.12Å; R150-L256 VanDerWaalsContact CD-O 3.24Å; R150-L256 WeakPolarHBondContact CD-O 3.35Å; R150-L256 HydrophobicContact CG-CB 4.29Å; R150-L256 VanDerWaalsContact CZ-O 3.27Å; R150-L256 PolarHBondContact NE-O 3.04Å; L153-L256 HydrophobicContact CD2-CD1 3.6Å; L153-L256 HydrophobicContact CG-CD1 4.19Å; L154-L256 HydrophobicContact CD2-CD1 4.17Å; L197-L256 HydrophobicContact CD2-CD2 4.12Å; Y252-L256 HydrophobicContact CD1-CD1 3.69Å; Y252-L256 HydrophobicContact CD1-CD2 4.2Å; Y252-L256 HydrophobicContact CD1-CG 3.73Å; Y252-L256 HydrophobicContact CE1-CD2 4.49Å; Y252-L256 HydrophobicContact CE1-CG 4.48Å; Y252-L256 HydrophobicContact CG-CD1 4.5Å; Y252-L256 PolarHBondContact O-N 3.3Å
257P86.3Confident83.8Confident12 Ų1256.8 Ų56.88%0.07828%0.278CS..PPolyproline II helixtrans-75.6160.817233.4-34.4000110.6Y16 L20 W201 V255 L275Y16-P257 WeakPolarHBondContact OH-CB 3.38Å; L20-P257 HydrophobicContact CD1-CG 3.71Å; L20-P257 HydrophobicContact CD2-CG 3.75Å; L20-P257 HydrophobicContact CG-CG 4.39Å; W201-P257 HydrophobicContact CZ2-CB 4.15Å; W201-P257 HydrophobicContact CZ2-CG 4.11Å; V255-P257 WeakPolarHBondContact O-CD 3.47Å; P257-L275 HydrophobicContact CB-CD1 4.01Å; P257-L275 HydrophobicContact CB-CD2 4.46Å
258Q86.8Confident83.6Confident34 Ų3456.9 Ų56.916%0.15928%0.276CS..PPolyproline II helixtrans-73.4159.2168.6-158.6143.917.200110.4A260 W262 L263 L275Q258-A260 PolarHBondContact O-N 3.24Å; Q258-W262 HydrophobicContact CG-CE3 4.2Å; Q258-W262 HydrophobicContact CG-CZ3 4.42Å; Q258-L263 HydrophobicContact CB-CD1 4.13Å; Q258-L263 HydrophobicContact CB-CG 4.48Å; Q258-L263 HydrophobicContact CG-CD1 4.34Å; Q258-L263 HydrophobicContact CG-CD2 4.19Å; Q258-L263 HydrophobicContact CG-CG 4.14Å; Q258-L275 VanDerWaalsContact O-CD2 3.24Å; Q258-L275 WeakPolarHBondContact O-CD2 3.4Å
259S85.4Confident83.2Confident0 Ų056.1 Ų56.10%026%0.264CS..PPolyproline II helixtrans-68.9117.7174.6165.90000110.3E200 R261 W262 L263E200-S259 PolarHBondContact OE1-OG 3.42Å; E200-S259 WeakPolarHBondContact OE2-CB 3.3Å; E200-S259 PolarHBondContact OE2-OG 3.48Å; S259-R261 PolarHBondContact O-N 2.82Å; S259-R261 PolarHBondContact OG-N 2.92Å; S259-W262 PolarHBondContact O-N 3.39Å; S259-W262 WeakPolarHBondContact OG-CB 3.31Å; S259-W262 PolarHBondContact OG-N 2.8Å; S259-L263 WeakPolarHBondContact O-CG 3.29Å; S259-L263 PolarHBondContact O-N 3.37Å
260A82.4Confident83.3Confident1 Ų163.1 Ų63.11%0.00830%0.296CS..Hα-helixtrans-60.9-34.9174.700000111.8F3 W201 Q258 L264 L275 L276F3-A260 HydrophobicContact CE2-CB 3.93Å; F3-A260 HydrophobicContact CZ-CB 3.87Å; W201-A260 HydrophobicContact CH2-CB 4.36Å; W201-A260 HydrophobicContact CZ2-CB 4.29Å; Q258-A260 PolarHBondContact O-N 3.24Å; A260-L264 VanDerWaalsContact O-CG 3.3Å; A260-L264 WeakPolarHBondContact O-CG 3.14Å; A260-L264 PolarHBondContact O-N 3.22Å; A260-L264 VanDerWaalsContact O-N 3.12Å; A260-L275 HydrophobicContact CB-CD2 4.15Å; A260-L276 HydrophobicContact CB-CD2 4.31Å
261R80.4Confident83.4Confident59 Ų5962 Ų6222%0.22329%0.288CS..Hα-helixtrans-67.5-43.3176.4-71-170.6-179153.6-1.9112.2F3 D4 S259 L264 A265F3-R261 HydrophobicContact CD1-CG 3.76Å; F3-R261 HydrophobicContact CD2-CG 3.84Å; F3-R261 HydrophobicContact CE1-CG 3.51Å; F3-R261 HydrophobicContact CE2-CG 3.65Å; F3-R261 HydrophobicContact CG-CG 3.88Å; F3-R261 HydrophobicContact CZ-CG 3.48Å; F3-R261 VanDerWaalsContact CZ-CG 3.48Å; D4-R261 IonicContact OD1-NH2 3.27Å; D4-R261 PolarHBondContact OD1-NH2 2.71Å; S259-R261 PolarHBondContact O-N 2.82Å; S259-R261 PolarHBondContact OG-N 2.92Å; R261-L264 PolarHBondContact O-N 3.4Å; R261-A265 WeakPolarHBondContact O-CB 3.31Å; R261-A265 PolarHBondContact O-N 2.91Å
262W83.9Confident83.3Confident17 Ų1757.8 Ų57.86%0.06427%0.27CS..Hα-helixtrans-63.2-43.8176.8-174.784.1000111.7D145 G148 Q258 S259 L264 A265 N266D145-W262 PolarHBondContact O-NE1 3.28Å; G148-W262 VanDerWaalsContact CA-CE2 3.42Å; Q258-W262 HydrophobicContact CG-CE3 4.2Å; Q258-W262 HydrophobicContact CG-CZ3 4.42Å; S259-W262 PolarHBondContact O-N 3.39Å; S259-W262 WeakPolarHBondContact OG-CB 3.31Å; S259-W262 PolarHBondContact OG-N 2.8Å; W262-L264 VanDerWaalsContact C-N 3.33Å; W262-L264 PolarHBondContact O-N 3.27Å; W262-A265 WeakPolarHBondContact O-CB 3.48Å; W262-A265 PolarHBondContact O-N 3.48Å; W262-A265 VanDerWaalsContact O-N 3.1Å; W262-N266 WeakPolarHBondContact CZ2-ND2 3.48Å; W262-N266 PolarHBondContact NE1-ND2 3.13Å; W262-N266 PolarHBondContact O-N 2.84Å
263L83.3Confident83.2Confident3 Ų358.3 Ų58.32%0.01627%0.273CS..Hα-helixtrans-60-43.3177-71.7171000111.8Q258 S259 A265 N266 D267 R268 E271 A272 L275Q258-L263 HydrophobicContact CB-CD1 4.13Å; Q258-L263 HydrophobicContact CB-CG 4.48Å; Q258-L263 HydrophobicContact CG-CD1 4.34Å; Q258-L263 HydrophobicContact CG-CD2 4.19Å; Q258-L263 HydrophobicContact CG-CG 4.14Å; S259-L263 WeakPolarHBondContact O-CG 3.29Å; S259-L263 PolarHBondContact O-N 3.37Å; L263-A265 VanDerWaalsContact C-N 3.33Å; L263-A265 PolarHBondContact O-N 3.12Å; L263-N266 PolarHBondContact O-N 2.98Å; L263-D267 PolarHBondContact O-N 3.26Å; L263-R268 HydrophobicContact CB-CB 4.45Å; L263-R268 HydrophobicContact CD2-CB 3.92Å; L263-R268 PolarHBondContact O-N 3.48Å; L263-E271 HydrophobicContact CD1-CB 4.2Å; L263-E271 HydrophobicContact CD2-CB 4.36Å; L263-A272 HydrophobicContact CB-CB 3.84Å; L263-A272 HydrophobicContact CD1-CB 4.45Å; L263-L275 HydrophobicContact CD1-CD2 4.33Å
264L80.6Confident83.3Confident30 Ų3056.7 Ų56.716%0.15727%0.273CS..Hα-helixtrans-66-33.9174.8-70.2171.9000112.8F3 A260 R261 W262 A272 I294F3-L264 HydrophobicContact CD2-CD1 3.88Å; F3-L264 HydrophobicContact CE2-CD1 4Å; A260-L264 VanDerWaalsContact O-CG 3.3Å; A260-L264 WeakPolarHBondContact O-CG 3.14Å; A260-L264 PolarHBondContact O-N 3.22Å; A260-L264 VanDerWaalsContact O-N 3.12Å; R261-L264 PolarHBondContact O-N 3.4Å; W262-L264 VanDerWaalsContact C-N 3.33Å; W262-L264 PolarHBondContact O-N 3.27Å; L264-A272 HydrophobicContact CD2-CB 3.72Å; L264-A272 HydrophobicContact CG-CB 3.81Å; L264-I294 HydrophobicContact CD2-CG2 3.98Å
265A76.4Confident83.3Confident57 Ų5746.9 Ų46.947%0.47124%0.238SC..Hα-helixtrans-70.2-35.1177.300000112.4R261 W262 L263 D267R261-A265 WeakPolarHBondContact O-CB 3.31Å; R261-A265 PolarHBondContact O-N 2.91Å; W262-A265 WeakPolarHBondContact O-CB 3.48Å; W262-A265 PolarHBondContact O-N 3.48Å; W262-A265 VanDerWaalsContact O-N 3.1Å; L263-A265 VanDerWaalsContact C-N 3.33Å; L263-A265 PolarHBondContact O-N 3.12Å; A265-D267 VanDerWaalsContact C-N 3.33Å; A265-D267 PolarHBondContact O-N 3.36Å
266N78.9Confident83.2Confident79 Ų7944.6 Ų44.642%0.42222%0.224SC..THydrogen-bonded Turntrans-92.620.4179.1-76.5-12.8000114.1W262 L263 R268W262-N266 WeakPolarHBondContact CZ2-ND2 3.48Å; W262-N266 PolarHBondContact NE1-ND2 3.13Å; W262-N266 PolarHBondContact O-N 2.84Å; L263-N266 PolarHBondContact O-N 2.98Å; N266-R268 PolarHBondContact O-N 3.29Å
267D78.9Confident83.1Confident81 Ų8150 Ų5043%0.43324%0.244SC..THydrogen-bonded Turntrans58.315.2178.9-144.68.1000116.5L263 A265 R269 K298L263-D267 PolarHBondContact O-N 3.26Å; A265-D267 VanDerWaalsContact C-N 3.33Å; A265-D267 PolarHBondContact O-N 3.36Å; D267-R269 VanDerWaalsContact C-N 3.26Å; D267-R269 PolarHBondContact O-N 3.18Å; D267-R269 IonicContact OD1-CZ 3.92Å; D267-R269 IonicContact OD1-NE 3.2Å; D267-R269 PolarHBondContact OD1-NE 2.95Å; D267-K298 IonicContact OD1-NZ 3.45Å; D267-K298 PolarHBondContact OD1-NZ 2.87Å; D267-K298 IonicContact OD2-NZ 3.32Å; D267-K298 PolarHBondContact OD2-NZ 3.43Å
268R82.8Confident83.1Confident99 Ų9955.5 Ų55.537%0.37427%0.267SS..  trans-83.366.9174.3-67.5177.171.71796.9110.9L263 N266 E271 A272L263-R268 HydrophobicContact CB-CB 4.45Å; L263-R268 HydrophobicContact CD2-CB 3.92Å; L263-R268 PolarHBondContact O-N 3.48Å; N266-R268 PolarHBondContact O-N 3.29Å; R268-E271 IonicContact CZ-OE1 3.01Å; R268-E271 IonicContact CZ-OE2 2.64Å; R268-E271 VanDerWaalsContact NE-CD 3.35Å; R268-E271 IonicContact NE-OE1 3.69Å; R268-E271 PolarHBondContact NE-OE1 3.04Å; R268-E271 IonicContact NE-OE2 3.07Å; R268-E271 PolarHBondContact NE-OE2 3.16Å; R268-E271 IonicContact NH2-OE1 2.99Å; R268-E271 PolarHBondContact NH2-OE1 3.29Å; R268-E271 IonicContact NH2-OE2 3.23Å; R268-E271 PolarHBondContact NH2-OE2 3.08Å; R268-A272 PolarHBondContact O-N 2.91Å
269R78.8Confident83.1Confident111 Ų11153.9 Ų53.942%0.41926%0.259SS..Hα-helixtrans-68.3-44.2-169.4-70.2178.9-77.5166.71.8114D267 E271 A272 I273D267-R269 VanDerWaalsContact C-N 3.26Å; D267-R269 PolarHBondContact O-N 3.18Å; D267-R269 IonicContact OD1-CZ 3.92Å; D267-R269 IonicContact OD1-NE 3.2Å; D267-R269 PolarHBondContact OD1-NE 2.95Å; R269-E271 VanDerWaalsContact C-N 3.32Å; R269-E271 PolarHBondContact O-N 3.09Å; R269-A272 PolarHBondContact O-N 2.88Å; R269-I273 VanDerWaalsContact O-CG1 3.29Å; R269-I273 WeakPolarHBondContact O-CG1 3.32Å; R269-I273 PolarHBondContact O-N 3.34Å
270E84Confident83.1Confident168 Ų16854 Ų5479%0.78526%0.26SS*.Hα-helixtrans-62.4-42.6-175.7-63.6-173.6173.200111.5I273 A274E270-I273 PolarHBondContact O-N 2.85Å; E270-A274 WeakPolarHBondContact O-CB 3.37Å; E270-A274 PolarHBondContact O-N 3.1Å
271E85Confident83.3Confident83 Ų8360.1 Ų60.139%0.38829%0.292SS..Hα-helixtrans-65.2-42.3175.6-65.9178.2-136.300112.3L263 R268 R269 I273 A274 L275L263-E271 HydrophobicContact CD1-CB 4.2Å; L263-E271 HydrophobicContact CD2-CB 4.36Å; R268-E271 IonicContact CZ-OE1 3.01Å; R268-E271 IonicContact CZ-OE2 2.64Å; R268-E271 VanDerWaalsContact NE-CD 3.35Å; R268-E271 IonicContact NE-OE1 3.69Å; R268-E271 PolarHBondContact NE-OE1 3.04Å; R268-E271 IonicContact NE-OE2 3.07Å; R268-E271 PolarHBondContact NE-OE2 3.16Å; R268-E271 IonicContact NH2-OE1 2.99Å; R268-E271 PolarHBondContact NH2-OE1 3.29Å; R268-E271 IonicContact NH2-OE2 3.23Å; R268-E271 PolarHBondContact NH2-OE2 3.08Å; R269-E271 VanDerWaalsContact C-N 3.32Å; R269-E271 PolarHBondContact O-N 3.09Å; E271-I273 VanDerWaalsContact C-N 3.31Å; E271-I273 PolarHBondContact O-N 3.45Å; E271-A274 PolarHBondContact O-N 3.31Å; E271-L275 WeakPolarHBondContact O-CB 3.44Å; E271-L275 PolarHBondContact O-N 2.64Å
272A84.4Confident83.6Confident0 Ų060.3 Ų60.30%030%0.3CS..Hα-helixtrans-60.8-42175.600000111.5L263 L264 R268 R269 L275 L276L263-A272 HydrophobicContact CB-CB 3.84Å; L263-A272 HydrophobicContact CD1-CB 4.45Å; L264-A272 HydrophobicContact CD2-CB 3.72Å; L264-A272 HydrophobicContact CG-CB 3.81Å; R268-A272 PolarHBondContact O-N 2.91Å; R269-A272 PolarHBondContact O-N 2.88Å; A272-L275 PolarHBondContact O-N 2.86Å; A272-L276 WeakPolarHBondContact O-CB 3.34Å; A272-L276 VanDerWaalsContact O-CG 3.25Å; A272-L276 WeakPolarHBondContact O-CG 3.33Å; A272-L276 PolarHBondContact O-N 3.07Å
273I83.2Confident83.7Confident13 Ų1360.8 Ų60.87%0.06730%0.303CS..Hα-helixtrans-65.7-46.7177.5-69.4165000110.7R269 E270 E271 L275 L276 R277 I294R269-I273 VanDerWaalsContact O-CG1 3.29Å; R269-I273 WeakPolarHBondContact O-CG1 3.32Å; R269-I273 PolarHBondContact O-N 3.34Å; E270-I273 PolarHBondContact O-N 2.85Å; E271-I273 VanDerWaalsContact C-N 3.31Å; E271-I273 PolarHBondContact O-N 3.45Å; I273-L275 VanDerWaalsContact C-N 3.26Å; I273-L275 PolarHBondContact O-N 3.31Å; I273-L276 PolarHBondContact O-N 3.07Å; I273-R277 HydrophobicContact CG2-CG 4.28Å; I273-R277 WeakPolarHBondContact O-CB 3.46Å; I273-R277 VanDerWaalsContact O-CG 3.3Å; I273-R277 WeakPolarHBondContact O-CG 3.34Å; I273-R277 PolarHBondContact O-N 3.45Å; I273-I294 HydrophobicContact CD1-CD1 3.87Å; I273-I294 HydrophobicContact CG1-CD1 3.35Å
274A86.9Confident83.6Confident57 Ų5763.7 Ų63.747%0.47134%0.335SS..Hα-helixtrans-57.8-41.9177.600000111.4E270 E271 R277 K278E270-A274 WeakPolarHBondContact O-CB 3.37Å; E270-A274 PolarHBondContact O-N 3.1Å; E271-A274 PolarHBondContact O-N 3.31Å; A274-R277 PolarHBondContact O-N 3.45Å; A274-K278 PolarHBondContact O-N 2.97Å
275L86.4Confident83.4Confident29 Ų2969.1 Ų69.115%0.15235%0.353CS..Hα-helixtrans-67.1-44.1178.1-158.881000112.5W201 P257 Q258 A260 L263 E271 A272 I273 K278 A279W201-L275 HydrophobicContact CH2-CD2 3.65Å; W201-L275 HydrophobicContact CH2-CG 3.88Å; W201-L275 HydrophobicContact CZ2-CD2 3.4Å; W201-L275 VanDerWaalsContact CZ2-CD2 3.4Å; W201-L275 HydrophobicContact CZ2-CG 4.05Å; P257-L275 HydrophobicContact CB-CD1 4.01Å; P257-L275 HydrophobicContact CB-CD2 4.46Å; Q258-L275 VanDerWaalsContact O-CD2 3.24Å; Q258-L275 WeakPolarHBondContact O-CD2 3.4Å; A260-L275 HydrophobicContact CB-CD2 4.15Å; L263-L275 HydrophobicContact CD1-CD2 4.33Å; E271-L275 WeakPolarHBondContact O-CB 3.44Å; E271-L275 PolarHBondContact O-N 2.64Å; A272-L275 PolarHBondContact O-N 2.86Å; I273-L275 VanDerWaalsContact C-N 3.26Å; I273-L275 PolarHBondContact O-N 3.31Å; L275-K278 PolarHBondContact O-N 3.37Å; L275-A279 PolarHBondContact O-N 3.38Å
276L86.3Confident82.5Confident0 Ų071.9 Ų71.90%037%0.369CS..Hα-helixtrans-66.2-36.8176.4-71.5169.7000111.9I6 I10 A260 A272 I273 A279 A280I6-L276 HydrophobicContact CG2-CD1 4.18Å; I6-L276 HydrophobicContact CG2-CD2 4.4Å; I10-L276 HydrophobicContact CD1-CD2 3.96Å; A260-L276 HydrophobicContact CB-CD2 4.31Å; A272-L276 WeakPolarHBondContact O-CB 3.34Å; A272-L276 VanDerWaalsContact O-CG 3.25Å; A272-L276 WeakPolarHBondContact O-CG 3.33Å; A272-L276 PolarHBondContact O-N 3.07Å; I273-L276 PolarHBondContact O-N 3.07Å; L276-A279 PolarHBondContact O-N 3.37Å; L276-A280 WeakPolarHBondContact O-CB 3.5Å; L276-A280 PolarHBondContact O-N 3.1Å
277R84.5Confident81.4Confident117 Ų11772.7 Ų72.744%0.44238%0.377SS..Hα-helixtrans-63.2-46.2172.9-76.3179-178.9161.31.4111.4I273 A274 A279 A280 L281I273-R277 HydrophobicContact CG2-CG 4.28Å; I273-R277 WeakPolarHBondContact O-CB 3.46Å; I273-R277 VanDerWaalsContact O-CG 3.3Å; I273-R277 WeakPolarHBondContact O-CG 3.34Å; I273-R277 PolarHBondContact O-N 3.45Å; A274-R277 PolarHBondContact O-N 3.45Å; R277-A279 VanDerWaalsContact C-N 3.29Å; R277-A279 PolarHBondContact O-N 3.23Å; R277-A280 PolarHBondContact O-N 2.71Å; R277-L281 VanDerWaalsContact O-CG 3.32Å; R277-L281 WeakPolarHBondContact O-CG 3.25Å; R277-L281 PolarHBondContact O-N 2.93Å
278K86.3Confident80.1Confident127 Ų12771.9 Ų71.955%0.55238%0.377SS*.Hα-helixtrans-56.9-44.7174.7-174.5-179.9-179.21800111.3A274 L275 L281 V282A274-K278 PolarHBondContact O-N 2.97Å; L275-K278 PolarHBondContact O-N 3.37Å; K278-L281 PolarHBondContact O-N 3.02Å; K278-V282 WeakPolarHBondContact O-CG2 3.36Å; K278-V282 PolarHBondContact O-N 3.01Å; K278-V282 VanDerWaalsContact O-N 3.13Å
279A86Confident78.8Confident0 Ų067.9 Ų67.90%036%0.364CS..Hα-helixtrans-64-4217700000112.6I10 Y16 W201 L275 L276 R277 V282 N283I10-A279 HydrophobicContact CD1-CB 4.13Å; Y16-A279 HydrophobicContact CD1-CB 3.64Å; Y16-A279 HydrophobicContact CD2-CB 4.44Å; Y16-A279 HydrophobicContact CE1-CB 3.87Å; Y16-A279 HydrophobicContact CG-CB 3.94Å; W201-A279 HydrophobicContact CZ3-CB 4Å; L275-A279 PolarHBondContact O-N 3.38Å; L276-A279 PolarHBondContact O-N 3.37Å; R277-A279 VanDerWaalsContact C-N 3.29Å; R277-A279 PolarHBondContact O-N 3.23Å; A279-V282 PolarHBondContact O-N 3.11Å; A279-N283 WeakPolarHBondContact O-CB 3.09Å; A279-N283 VanDerWaalsContact O-CG 3.25Å; A279-N283 PolarHBondContact O-N 3.47Å; A279-N283 VanDerWaalsContact O-N 3.07Å; A279-N283 PolarHBondContact O-ND2 3.01Å
280A85.3Confident77.7Confident2 Ų267 Ų672%0.01737%0.371CS..Hα-helixtrans-63.3-43.5177.100000112.3I10 L276 R277 N283 G284 R285I10-A280 HydrophobicContact CB-CB 4.02Å; I10-A280 HydrophobicContact CG2-CB 3.95Å; L276-A280 WeakPolarHBondContact O-CB 3.5Å; L276-A280 PolarHBondContact O-N 3.1Å; R277-A280 PolarHBondContact O-N 2.71Å; A280-N283 CarbonylContact O-C 3.45Å; A280-N283 PolarHBondContact O-N 3.28Å; A280-N283 VanDerWaalsContact O-N 3.17Å; A280-G284 PolarHBondContact O-N 2.74Å; A280-R285 CarbonylContact C-O 3.45Å; A280-R285 PolarHBondContact O-N 3.31Å
281L86.4Confident76.3Confident131 Ų13164.5 Ų64.569%0.68636%0.363SS*.Hα-helixtrans-60.1-48177-73167.7000111.9R277 K278 N283 G284R277-L281 VanDerWaalsContact O-CG 3.32Å; R277-L281 WeakPolarHBondContact O-CG 3.25Å; R277-L281 PolarHBondContact O-N 2.93Å; K278-L281 PolarHBondContact O-N 3.02Å; L281-N283 PolarHBondContact O-N 2.78Å; L281-G284 PolarHBondContact O-N 3.22Å
282V86.8Confident74.8Confident63 Ų6364.1 Ų64.138%0.38237%0.367SS..Hα-helixtrans-64.9-28.3177.7174.50000111.9K15 Y16 K278 A279 G284K15-V282 HydrophobicContact CB-CG1 4.46Å; Y16-V282 HydrophobicContact CD2-CB 4.16Å; Y16-V282 HydrophobicContact CD2-CG1 4.2Å; Y16-V282 HydrophobicContact CD2-CG2 4.24Å; K278-V282 WeakPolarHBondContact O-CG2 3.36Å; K278-V282 PolarHBondContact O-N 3.01Å; K278-V282 VanDerWaalsContact O-N 3.13Å; A279-V282 PolarHBondContact O-N 3.11Å; V282-G284 VanDerWaalsContact C-N 3.26Å; V282-G284 PolarHBondContact O-N 3.37Å
283N85.7Confident73.5Confident26 Ų2665 Ų6514%0.13937%0.374CS..THydrogen-bonded Turntrans-82.11.3174-72.6-14.9000113.9I10 G14 K15 Y16 Q17 A279 A280 L281 R285I10-N283 WeakPolarHBondContact O-CB 3.28Å; I10-N283 PolarHBondContact O-ND2 2.92Å; G14-N283 WeakPolarHBondContact CA-OD1 3.43Å; K15-N283 PolarHBondContact N-OD1 2.63Å; Y16-N283 WeakPolarHBondContact CB-OD1 3.36Å; Y16-N283 PolarHBondContact N-OD1 3.38Å; Q17-N283 PolarHBondContact NE2-ND2 2.86Å; Q17-N283 PolarHBondContact OE1-ND2 2.76Å; Q17-N283 PolarHBondContact OE1-OD1 3.07Å; A279-N283 WeakPolarHBondContact O-CB 3.09Å; A279-N283 VanDerWaalsContact O-CG 3.25Å; A279-N283 PolarHBondContact O-N 3.47Å; A279-N283 VanDerWaalsContact O-N 3.07Å; A279-N283 PolarHBondContact O-ND2 3.01Å; A280-N283 CarbonylContact O-C 3.45Å; A280-N283 PolarHBondContact O-N 3.28Å; A280-N283 VanDerWaalsContact O-N 3.17Å; L281-N283 PolarHBondContact O-N 2.78Å; N283-R285 VanDerWaalsContact C-N 3.31Å; N283-R285 PolarHBondContact O-N 2.86Å
284G81.4Confident72.3Confident65 Ų6564.9 Ų64.967%0.6737%0.373SS*.THydrogen-bonded Turntrans70.523.8-179.700000113.8A280 L281 V282A280-G284 PolarHBondContact O-N 2.74Å; L281-G284 PolarHBondContact O-N 3.22Å; V282-G284 VanDerWaalsContact C-N 3.26Å; V282-G284 PolarHBondContact O-N 3.37Å
285R76.4Confident70.8Confident143 Ų14367.7 Ų67.754%0.5438%0.376SS..  trans-106.7118.3177.3-67.4-68.4-173.7170.5-0.2110.2A280 N283A280-R285 CarbonylContact C-O 3.45Å; A280-R285 PolarHBondContact O-N 3.31Å; N283-R285 VanDerWaalsContact C-N 3.31Å; N283-R285 PolarHBondContact O-N 2.86Å
286S58.8Low69.3Low115 Ų11574.5 Ų74.580%0.80440%0.4SS*.  trans-80.7-17177-38.60000113.3C288S286-C288 PolarHBondContact O-N 3.42Å; S286-C288 VanDerWaalsContact O-N 3.1Å
287T54.4Low67.9Low96 Ų9675.5 Ų75.559%0.58941%0.405SS*.  trans-7797.8-178.146.70000111
288C51.9Low66.4Low64 Ų6473.4 Ų73.443%0.43240%0.399SS..  trans-66.2141.5171.5-73.30000111.1S286 T290S286-C288 PolarHBondContact O-N 3.42Å; S286-C288 VanDerWaalsContact O-N 3.1Å; C288-T290 PolarHBondContact O-N 2.93Å
289P56.3Low64.8Low16 Ų1670.1 Ų70.110%0.10439%0.389CS..  trans-63.7107.5156.724.7-27.9000108.2I6I6-P289 HydrophobicContact CG2-CB 4.29Å; I6-P289 HydrophobicContact CG2-CG 4.21Å
290T55.2Low63.2Low93 Ų9373.4 Ų73.457%0.57141%0.407SS*.  trans-62.9148.9176.7-19.20000110.3C288 P292 S293C288-T290 PolarHBondContact O-N 2.93Å; T290-P292 HydrophobicContact CG2-CG 4.15Å; T290-P292 WeakPolarHBondContact O-CD 3.37Å; T290-S293 PolarHBondContact O-N 3.19Å; T290-S293 PolarHBondContact O-OG 3.04Å
291N55.7Low61.5Low115 Ų11578.6 Ų78.662%0.61543%0.426SS*.Hα-helixtrans-36.8-41.8172.8-99.9-19.2000115.7S293 I294 H295N291-S293 PolarHBondContact O-N 3.15Å; N291-I294 PolarHBondContact O-N 3.42Å; N291-H295 PolarHBondContact O-N 3.13Å
292P52.9Low59.6Low74 Ų7481.4 Ų81.448%0.48143%0.428SS..Hα-helixtrans-62-32.2177.618.9-33.6000116T290 I294 H295 R296T290-P292 HydrophobicContact CG2-CG 4.15Å; T290-P292 WeakPolarHBondContact O-CD 3.37Å; P292-I294 VanDerWaalsContact C-N 3.35Å; P292-H295 PolarHBondContact O-N 2.87Å; P292-R296 WeakPolarHBondContact O-CG 3.24Å; P292-R296 PolarHBondContact O-N 2.91Å
293S57.6Low57.3Low19 Ų1985.4 Ų85.413%0.13344%0.44CS..Hα-helixtrans-73-29.8-18052.40000112.4T290 N291 L297T290-S293 PolarHBondContact O-N 3.19Å; T290-S293 PolarHBondContact O-OG 3.04Å; N291-S293 PolarHBondContact O-N 3.15Å; S293-L297 PolarHBondContact O-N 3.34Å
294I58.3Low55.2Low10 Ų1090.9 Ų90.95%0.05147%0.465CS..Hα-helixtrans-79.4-34.2172.6-62.8170.8000111.3I6 L264 I273 N291 P292 R296 L297 K298I6-I294 HydrophobicContact CD1-CG1 4.22Å; L264-I294 HydrophobicContact CD2-CG2 3.98Å; I273-I294 HydrophobicContact CD1-CD1 3.87Å; I273-I294 HydrophobicContact CG1-CD1 3.35Å; N291-I294 PolarHBondContact O-N 3.42Å; P292-I294 VanDerWaalsContact C-N 3.35Å; I294-R296 VanDerWaalsContact C-N 3.29Å; I294-R296 PolarHBondContact O-N 3.47Å; I294-L297 VanDerWaalsContact O-CB 3.28Å; I294-L297 WeakPolarHBondContact O-CB 3.38Å; I294-L297 PolarHBondContact O-N 3.22Å; I294-L297 VanDerWaalsContact O-N 3.14Å; I294-K298 PolarHBondContact O-N 2.62Å
295H55.4Low53.5Low117 Ų11792.4 Ų92.454%0.54246%0.457SS..Hα-helixtrans-61.9-40171-153.8-83.4000111.2N291 P292 L297 K298 V299N291-H295 PolarHBondContact O-N 3.13Å; P292-H295 PolarHBondContact O-N 2.87Å; H295-L297 VanDerWaalsContact C-N 3.32Å; H295-L297 PolarHBondContact O-N 3.47Å; H295-K298 PolarHBondContact O-N 3.36Å; H295-K298 VanDerWaalsContact O-N 3.16Å; H295-V299 WeakPolarHBondContact O-CG2 2.94Å; H295-V299 PolarHBondContact O-N 3.02Å
296R53.9Low51.3Low172 Ų17288.7 Ų88.765%0.64946%0.462SS*.Hα-helixtrans-62.9-32.6172.5-73.3-179.7-175.4-158.42.5113.2P292 I294 V299 N300P292-R296 WeakPolarHBondContact O-CG 3.24Å; P292-R296 PolarHBondContact O-N 2.91Å; I294-R296 VanDerWaalsContact C-N 3.29Å; I294-R296 PolarHBondContact O-N 3.47Å; R296-V299 PolarHBondContact O-N 2.82Å; R296-N300 WeakPolarHBondContact O-CB 3.43Å; R296-N300 PolarHBondContact O-N 3.44Å
297L57.8Low49.9Very low21 Ų2189.1 Ų89.111%0.1146%0.464CS..Hα-helixtrans-62-44170.8-93164.9000111.7M1 I6 S293 I294 H295 R301M1-L297 WeakPolarHBondContact O-CD2 3.26Å; M1-L297 WeakPolarHBondContact O-CG 3.42Å; I6-L297 HydrophobicContact CD1-CD1 3.28Å; I6-L297 HydrophobicContact CD1-CG 4.4Å; I6-L297 HydrophobicContact CG1-CD1 4.36Å; S293-L297 PolarHBondContact O-N 3.34Å; I294-L297 VanDerWaalsContact O-CB 3.28Å; I294-L297 WeakPolarHBondContact O-CB 3.38Å; I294-L297 PolarHBondContact O-N 3.22Å; I294-L297 VanDerWaalsContact O-N 3.14Å; H295-L297 VanDerWaalsContact C-N 3.32Å; H295-L297 PolarHBondContact O-N 3.47Å; L297-R301 VanDerWaalsContact O-CB 3.3Å; L297-R301 WeakPolarHBondContact O-CB 3.3Å; L297-R301 PolarHBondContact O-N 2.99Å
298K51.7Low48.8Very low73 Ų7386.9 Ų86.932%0.31746%0.46SS..Hα-helixtrans-70.3-35.2178.7-147.5177.6-175.5177.60111.5D267 I294 H295 R302D267-K298 IonicContact OD1-NZ 3.45Å; D267-K298 PolarHBondContact OD1-NZ 2.87Å; D267-K298 IonicContact OD2-NZ 3.32Å; D267-K298 PolarHBondContact OD2-NZ 3.43Å; I294-K298 PolarHBondContact O-N 2.62Å; H295-K298 PolarHBondContact O-N 3.36Å; H295-K298 VanDerWaalsContact O-N 3.16Å; K298-R302 VanDerWaalsContact O-CB 3.3Å; K298-R302 WeakPolarHBondContact O-CB 3.41Å; K298-R302 PolarHBondContact O-N 3.45Å
299V53.1Low47.8Very low57 Ų5789.3 Ų89.335%0.34548%0.478SS..Hα-helixtrans-68.8-44.5174.7173.40000111.6H295 R296 R301 R302 K303H295-V299 WeakPolarHBondContact O-CG2 2.94Å; H295-V299 PolarHBondContact O-N 3.02Å; R296-V299 PolarHBondContact O-N 2.82Å; V299-R301 VanDerWaalsContact C-N 3.34Å; V299-R302 PolarHBondContact O-N 3.01Å; V299-K303 HydrophobicContact CG1-CD 4.28Å; V299-K303 WeakPolarHBondContact O-CB 3.47Å; V299-K303 WeakPolarHBondContact O-CG 3.16Å; V299-K303 PolarHBondContact O-N 3.08Å
300N52Low47Very low69 Ų6997.3 Ų97.337%0.36951%0.511SS..Hα-helixtrans-61.9-44173.7-8113.9000110.9R296 K303 E304R296-N300 WeakPolarHBondContact O-CB 3.43Å; R296-N300 PolarHBondContact O-N 3.44Å; N300-K303 PolarHBondContact O-N 3.2Å; N300-E304 WeakPolarHBondContact O-CB 3.19Å; N300-E304 WeakPolarHBondContact O-CG 3.41Å; N300-E304 PolarHBondContact O-N 3.43Å
301R50.3Low46.2Very low112 Ų112101 Ų10142%0.42352%0.515SS..Hα-helixtrans-67.2-37.4176.6-159.3-170-69.2-140.6-1.8112.7L297 V299 K303 E304 I305L297-R301 VanDerWaalsContact O-CB 3.3Å; L297-R301 WeakPolarHBondContact O-CB 3.3Å; L297-R301 PolarHBondContact O-N 2.99Å; V299-R301 VanDerWaalsContact C-N 3.34Å; R301-K303 VanDerWaalsContact C-N 3.35Å; R301-E304 PolarHBondContact O-N 3.08Å; R301-I305 HydrophobicContact CG-CD1 3.73Å; R301-I305 HydrophobicContact CG-CG1 4.4Å; R301-I305 VanDerWaalsContact O-CB 3.25Å; R301-I305 WeakPolarHBondContact O-CB 3.47Å; R301-I305 WeakPolarHBondContact O-CD1 3.24Å; R301-I305 WeakPolarHBondContact O-CG1 3.07Å; R301-I305 PolarHBondContact O-N 3.18Å
302R46.2Very low45.8Very low189 Ų189100.7 Ų100.771%0.71352%0.521SS*.Hα-helixtrans-69.6-30.2173.7-100.6-173-178.5-166.80.5112.5K298 V299 G306K298-R302 VanDerWaalsContact O-CB 3.3Å; K298-R302 WeakPolarHBondContact O-CB 3.41Å; K298-R302 PolarHBondContact O-N 3.45Å; V299-R302 PolarHBondContact O-N 3.01Å; R302-G306 WeakPolarHBondContact O-CA 3.42Å; R302-G306 PolarHBondContact O-N 3.43Å
303K38.2Very low46Very low148 Ų148100.5 Ų100.564%0.64351%0.514SS*.Hα-helixtrans-72.8-39.1171.8-75.9-176.6175.5-170.10111.3V299 N300 R301 I305 G306 C307V299-K303 HydrophobicContact CG1-CD 4.28Å; V299-K303 WeakPolarHBondContact O-CB 3.47Å; V299-K303 WeakPolarHBondContact O-CG 3.16Å; V299-K303 PolarHBondContact O-N 3.08Å; N300-K303 PolarHBondContact O-N 3.2Å; R301-K303 VanDerWaalsContact C-N 3.35Å; K303-I305 VanDerWaalsContact C-N 3.35Å; K303-G306 PolarHBondContact O-N 3.19Å; K303-C307 PolarHBondContact O-N 3.1Å
304E42.6Very low46.5Very low141 Ų141102.6 Ų102.666%0.65953%0.529SS*.Hα-helixtrans-63.8-36.6169.5-74.7171178.200112.4N300 R301N300-E304 WeakPolarHBondContact O-CB 3.19Å; N300-E304 WeakPolarHBondContact O-CG 3.41Å; N300-E304 PolarHBondContact O-N 3.43Å; R301-E304 PolarHBondContact O-N 3.08Å
305I45.3Very low47.2Very low97 Ų97104.2 Ų104.250%0.49754%0.543SS..Hα-helixtrans-83.2-19177.3-66.1164.8000112.2R301 K303R301-I305 HydrophobicContact CG-CD1 3.73Å; R301-I305 HydrophobicContact CG-CG1 4.4Å; R301-I305 VanDerWaalsContact O-CB 3.25Å; R301-I305 WeakPolarHBondContact O-CB 3.47Å; R301-I305 WeakPolarHBondContact O-CD1 3.24Å; R301-I305 WeakPolarHBondContact O-CG1 3.07Å; R301-I305 PolarHBondContact O-N 3.18Å; K303-I305 VanDerWaalsContact C-N 3.35Å
306G29.1Very low48.2Very low64 Ų64104.7 Ų104.766%0.6655%0.547SS*.Hα-helixtrans-103.6-9.2-16800000115.6R302 K303R302-G306 WeakPolarHBondContact O-CA 3.42Å; R302-G306 PolarHBondContact O-N 3.43Å; K303-G306 PolarHBondContact O-N 3.19Å
307C30.7Very low49.2Very low124 Ų12497.1 Ų97.184%0.83852%0.52SS*.SBendtrans-120.516.6-177.5-147.40000114.7K303K303-C307 PolarHBondContact O-N 3.1Å
308G31.4Very low50.3Low49 Ų4996.2 Ų96.251%0.50552%0.515SS..SBendtrans-152.8124.1172.200000109.9K310G308-K310 PolarHBondContact O-N 3.23Å
309S31.1Very low51.9Low116 Ų11696 Ų9681%0.81152%0.517SS*.  trans-39.8126.4170.4174.70000110.6R311S309-R311 PolarHBondContact O-N 3.38Å
310K38Very low53.4Low184 Ų184100.2 Ų100.280%0.853%0.526SS*.  trans-60.584.2170.6-77.7179.6176.4177.30109.3G308 S312G308-K310 PolarHBondContact O-N 3.23Å; K310-S312 PolarHBondContact O-N 3.46Å
311R39.5Very low54.9Low171 Ų17198 Ų9865%0.64552%0.515SS*.  trans-71.4105.3147.9-76.9-174.6176.7171.72.2105.1S309 H313S309-R311 PolarHBondContact O-N 3.38Å; R311-H313 PolarHBondContact O-N 3.16Å
312S47.4Very low56.6Low107 Ų10797 Ų9775%0.74852%0.523SS*.  trans-59.193.6161.9167.80000106.3K310 S314K310-S312 PolarHBondContact O-N 3.46Å; S312-S314 PolarHBondContact O-N 2.89Å
313H55.5Low58.5Low70 Ų7091.4 Ų91.432%0.32451%0.505SS..  trans-61.6108.1178-75.9-63000108.3R311 D317 V441R311-H313 PolarHBondContact O-N 3.16Å; H313-D317 VanDerWaalsContact CA-OD2 3.3Å; H313-D317 WeakPolarHBondContact CA-OD2 2.97Å; H313-D317 IonicContact CE1-OD2 2.84Å; H313-D317 IonicContact CG-OD2 3.83Å; H313-D317 IonicContact ND1-OD2 2.69Å; H313-D317 PolarHBondContact ND1-OD2 3.31Å; H313-V441 HydrophobicContact CB-CG1 3.75Å
314S69.5Low60.8Low64 Ų6484.4 Ų84.445%0.44848%0.475SS..  trans-91.9164.2-174.3-177.40000109.5S312 M316 D317S312-S314 PolarHBondContact O-N 2.89Å; S314-M316 PolarHBondContact O-N 3.31Å; S314-D317 PolarHBondContact N-OD2 3.37Å; S314-D317 WeakPolarHBondContact O-CB 3.19Å; S314-D317 PolarHBondContact O-N 3.35Å
315A72Confident63.1Low44 Ų4483.4 Ų83.436%0.36447%0.465SS..G310 helixtrans-54.4-24.2172.200000112.5D317 L318 T444 V448A315-D317 PolarHBondContact O-N 2.77Å; A315-L318 HydrophobicContact CB-CD1 4.42Å; A315-L318 WeakPolarHBondContact O-CB 3.21Å; A315-L318 PolarHBondContact O-N 2.87Å; A315-T444 HydrophobicContact CB-CG2 4.01Å; A315-V448 HydrophobicContact CB-CG2 4.17Å
316M76Confident65.3Low127 Ų12784 Ų8463%0.62646%0.464SS*.G310 helixtrans-61.9-28.3173.8-166.661.667.200113.4S314 L318 I319 R320S314-M316 PolarHBondContact O-N 3.31Å; M316-L318 PolarHBondContact O-N 3.01Å; M316-I319 VanDerWaalsContact O-CG1 3.29Å; M316-I319 WeakPolarHBondContact O-CG1 3.46Å; M316-I319 PolarHBondContact O-N 3.47Å; M316-I319 HydrophobicContact SD-CD1 3.75Å; M316-I319 HydrophobicContact SD-CG1 4.03Å; M316-R320 PolarHBondContact O-N 3.49Å
317D76.9Confident68.2Low13 Ų1381.5 Ų81.57%0.0743%0.434CS..G310 helixtrans-70.8-16.5179.2-72.4-29.2000112.5H313 S314 A315 I319 R320 V441 L504H313-D317 VanDerWaalsContact CA-OD2 3.3Å; H313-D317 WeakPolarHBondContact CA-OD2 2.97Å; H313-D317 IonicContact CE1-OD2 2.84Å; H313-D317 IonicContact CG-OD2 3.83Å; H313-D317 IonicContact ND1-OD2 2.69Å; H313-D317 PolarHBondContact ND1-OD2 3.31Å; S314-D317 PolarHBondContact N-OD2 3.37Å; S314-D317 WeakPolarHBondContact O-CB 3.19Å; S314-D317 PolarHBondContact O-N 3.35Å; A315-D317 PolarHBondContact O-N 2.77Å; D317-I319 VanDerWaalsContact C-N 3.27Å; D317-I319 PolarHBondContact O-N 3.42Å; D317-R320 WeakPolarHBondContact OD1-CD 3.43Å; D317-R320 IonicContact OD1-NH1 2.75Å; D317-R320 PolarHBondContact OD1-NH1 3.35Å; D317-V441 HydrophobicContact CB-CG1 4.41Å; D317-L504 HydrophobicContact CB-CD1 4.24Å
318L79.4Confident71.2Confident2 Ų275.6 Ų75.61%0.0139%0.394CS..G310 helixtrans-68.6-24.5175-72153.9000113.3A315 M316 T328 F437 V441 T444 V448A315-L318 HydrophobicContact CB-CD1 4.42Å; A315-L318 WeakPolarHBondContact O-CB 3.21Å; A315-L318 PolarHBondContact O-N 2.87Å; M316-L318 PolarHBondContact O-N 3.01Å; L318-T328 HydrophobicContact CB-CG2 4.09Å; L318-T328 PolarHBondContact O-OG1 3.35Å; L318-F437 HydrophobicContact CD2-CD1 3.86Å; L318-F437 HydrophobicContact CD2-CE1 3.57Å; L318-F437 HydrophobicContact CD2-CG 4.49Å; L318-F437 HydrophobicContact CD2-CZ 3.95Å; L318-V441 HydrophobicContact CD2-CG2 4.37Å; L318-T444 HydrophobicContact CD1-CG2 4.25Å; L318-V448 HydrophobicContact CD1-CG2 4.34Å
319I86.6Confident74.2Confident68 Ų6878 Ų7835%0.34940%0.395SS..THydrogen-bonded Turntrans-113.61.8-177.460.3170.4000112.7M316 D317 R325 T328M316-I319 VanDerWaalsContact O-CG1 3.29Å; M316-I319 WeakPolarHBondContact O-CG1 3.46Å; M316-I319 PolarHBondContact O-N 3.47Å; M316-I319 HydrophobicContact SD-CD1 3.75Å; M316-I319 HydrophobicContact SD-CG1 4.03Å; D317-I319 VanDerWaalsContact C-N 3.27Å; D317-I319 PolarHBondContact O-N 3.42Å; I319-R325 HydrophobicContact CB-CG 4.37Å; I319-R325 VanDerWaalsContact O-CZ 3.29Å; I319-R325 PolarHBondContact O-NE 3.47Å; I319-R325 PolarHBondContact O-NH2 2.96Å; I319-T328 HydrophobicContact CG2-CG2 4.44Å
320R82.9Confident77.2Confident146 Ų14673 Ų7355%0.55136%0.359SS*.THydrogen-bonded Turntrans-69.9-50.1-173.2-173175-176.61612.4112.3M316 D317M316-R320 PolarHBondContact O-N 3.49Å; D317-R320 WeakPolarHBondContact OD1-CD 3.43Å; D317-R320 IonicContact OD1-NH1 2.75Å; D317-R320 PolarHBondContact OD1-NH1 3.35Å
321T84.9Confident79.9Confident22 Ų2264.3 Ų64.314%0.13532%0.321CS..SBendtrans-91.9144.5-178.243.70000111.8Q323 M324 R325 E508T321-Q323 PolarHBondContact O-N 3.27Å; T321-M324 PolarHBondContact O-N 2.98Å; T321-M324 WeakPolarHBondContact OG1-CB 3.48Å; T321-M324 WeakPolarHBondContact OG1-CG 3.49Å; T321-R325 VanDerWaalsContact O-CB 3.27Å; T321-R325 WeakPolarHBondContact O-CB 3.41Å; T321-R325 PolarHBondContact O-N 3.43Å; T321-E508 WeakPolarHBondContact CB-OE1 3.32Å; T321-E508 HydrophobicContact CG2-CG 4.3Å; T321-E508 WeakPolarHBondContact CG2-OE1 3.33Å
322P85.8Confident82.6Confident90 Ų9057.3 Ų57.358%0.58430%0.295SS*.Hα-helixtrans-62.4-44.5-171.322.6-34.4000113.7R325 K326 E508P322-R325 PolarHBondContact O-N 3.18Å; P322-K326 PolarHBondContact O-N 3.45Å; P322-E508 WeakPolarHBondContact CD-OE1 3.34Å
323Q85.4Confident84.9Confident73 Ų7355 Ų5534%0.34127%0.271SS..Hα-helixtrans-69.3-41.4179.3-69.2-64.6-4.800111.9T321 K326 R327T321-Q323 PolarHBondContact O-N 3.27Å; Q323-K326 PolarHBondContact O-N 2.77Å; Q323-R327 VanDerWaalsContact O-CG 3.32Å; Q323-R327 WeakPolarHBondContact O-CG 3.46Å; Q323-R327 PolarHBondContact O-N 3.04Å
324M86.7Confident86.9Confident0 Ų051.7 Ų51.70%026%0.255CS..Hα-helixtrans-61.5-45.2172.8-75.6-67.3-60.200111.2T321 K326 R327 T328 F437 P438 V441 L504 V507T321-M324 PolarHBondContact O-N 2.98Å; T321-M324 WeakPolarHBondContact OG1-CB 3.48Å; T321-M324 WeakPolarHBondContact OG1-CG 3.49Å; M324-K326 VanDerWaalsContact C-N 3.33Å; M324-K326 PolarHBondContact O-N 3.47Å; M324-R327 PolarHBondContact O-N 3.21Å; M324-T328 VanDerWaalsContact O-CB 3.22Å; M324-T328 WeakPolarHBondContact O-CB 3.29Å; M324-T328 PolarHBondContact O-N 3.45Å; M324-T328 PolarHBondContact O-OG1 3.41Å; M324-F437 HydrophobicContact CE-CD1 3.86Å; M324-F437 HydrophobicContact CE-CE1 4.26Å; M324-P438 HydrophobicContact CE-CG 4.24Å; M324-P438 HydrophobicContact SD-CG 4.38Å; M324-V441 HydrophobicContact CE-CG2 4.46Å; M324-L504 HydrophobicContact CE-CD2 3.96Å; M324-L504 HydrophobicContact CG-CD2 3.9Å; M324-L504 HydrophobicContact SD-CD2 4.24Å; M324-V507 HydrophobicContact CG-CB 4.13Å; M324-V507 HydrophobicContact CG-CG1 3.8Å; M324-V507 HydrophobicContact SD-CB 3.63Å; M324-V507 HydrophobicContact SD-CG1 3.23Å; M324-V507 WeakPolarHBondContact SD-CG1 3.45Å; M324-V507 HydrophobicContact SD-CG2 3.69Å
325R90.7Very high88.1Confident121 Ų12148.7 Ų48.746%0.45723%0.234SC..Hα-helixtrans-56.7-47.3178.1-174.8-174.6-57.7172.15.6111.3I319 T321 P322 T328 I329I319-R325 HydrophobicContact CB-CG 4.37Å; I319-R325 VanDerWaalsContact O-CZ 3.29Å; I319-R325 PolarHBondContact O-NE 3.47Å; I319-R325 PolarHBondContact O-NH2 2.96Å; T321-R325 VanDerWaalsContact O-CB 3.27Å; T321-R325 WeakPolarHBondContact O-CB 3.41Å; T321-R325 PolarHBondContact O-N 3.43Å; P322-R325 PolarHBondContact O-N 3.18Å; R325-T328 PolarHBondContact O-N 3.49Å; R325-I329 HydrophobicContact CG-CD1 3.77Å; R325-I329 HydrophobicContact CG-CG1 4.47Å; R325-I329 WeakPolarHBondContact O-CB 3.33Å; R325-I329 VanDerWaalsContact O-CG1 3.27Å; R325-I329 WeakPolarHBondContact O-CG1 3.47Å; R325-I329 PolarHBondContact O-N 3.04Å
326K91.4Very high89.3Confident109 Ų10948.7 Ų48.747%0.47423%0.226SC..Hα-helixtrans-57.7-51.8176.4-178.3-177.3175.1-1740111.2P322 Q323 M324 I329 I330P322-K326 PolarHBondContact O-N 3.45Å; Q323-K326 PolarHBondContact O-N 2.77Å; M324-K326 VanDerWaalsContact C-N 3.33Å; M324-K326 PolarHBondContact O-N 3.47Å; K326-I329 PolarHBondContact O-N 2.93Å; K326-I330 HydrophobicContact CG-CD1 4.03Å; K326-I330 VanDerWaalsContact O-CG1 3.31Å; K326-I330 WeakPolarHBondContact O-CG1 3.42Å; K326-I330 PolarHBondContact O-N 3.46Å
327R91.3Very high90.3Very high11 Ų1142.7 Ų42.74%0.04220%0.196CC..Hα-helixtrans-61.6-45.2-179.9-67.8174.1-173.7-160.12.1111.7Q323 M324 I330 L331 I436 L492Q323-R327 VanDerWaalsContact O-CG 3.32Å; Q323-R327 WeakPolarHBondContact O-CG 3.46Å; Q323-R327 PolarHBondContact O-N 3.04Å; M324-R327 PolarHBondContact O-N 3.21Å; R327-I330 PolarHBondContact O-N 3.27Å; R327-L331 VanDerWaalsContact O-CG 3.29Å; R327-L331 WeakPolarHBondContact O-CG 3.49Å; R327-L331 PolarHBondContact O-N 2.92Å; R327-I436 HydrophobicContact CB-CG2 3.99Å; R327-I436 HydrophobicContact CG-CG2 4.4Å; R327-L492 HydrophobicContact CB-CD2 4.18Å; R327-L492 HydrophobicContact CG-CD2 4.16Å
328T92.1Very high91.2Very high0 Ų042 Ų420%019%0.193CC..Hα-helixtrans-60.1-48.5178.5-61.90000111.9L318 I319 M324 R325 I330 L331 F332 F437L318-T328 HydrophobicContact CB-CG2 4.09Å; L318-T328 PolarHBondContact O-OG1 3.35Å; I319-T328 HydrophobicContact CG2-CG2 4.44Å; M324-T328 VanDerWaalsContact O-CB 3.22Å; M324-T328 WeakPolarHBondContact O-CB 3.29Å; M324-T328 PolarHBondContact O-N 3.45Å; M324-T328 PolarHBondContact O-OG1 3.41Å; R325-T328 PolarHBondContact O-N 3.49Å; T328-I330 PolarHBondContact O-N 3.28Å; T328-L331 PolarHBondContact O-N 3.3Å; T328-F332 HydrophobicContact CG2-CD1 4.18Å; T328-F332 HydrophobicContact CG2-CD2 3.98Å; T328-F332 HydrophobicContact CG2-CE1 3.61Å; T328-F332 HydrophobicContact CG2-CE2 3.39Å; T328-F332 HydrophobicContact CG2-CG 4.36Å; T328-F332 HydrophobicContact CG2-CZ 3.17Å; T328-F332 WeakPolarHBondContact O-CD1 3.32Å; T328-F332 VanDerWaalsContact O-CG 3.24Å; T328-F332 WeakPolarHBondContact O-CG 3.24Å; T328-F332 PolarHBondContact O-N 3.4Å; T328-F437 HydrophobicContact CG2-CE1 4.49Å; T328-F437 HydrophobicContact CG2-CZ 4.39Å; T328-F437 WeakPolarHBondContact OG1-CE1 3.31Å
329I94.6Very high91.9Very high99 Ų9942.3 Ų42.351%0.50820%0.195SC..Hα-helixtrans-63-43.4-179.4-70169000111R325 K326 L331 F332 Y333R325-I329 HydrophobicContact CG-CD1 3.77Å; R325-I329 HydrophobicContact CG-CG1 4.47Å; R325-I329 WeakPolarHBondContact O-CB 3.33Å; R325-I329 VanDerWaalsContact O-CG1 3.27Å; R325-I329 WeakPolarHBondContact O-CG1 3.47Å; R325-I329 PolarHBondContact O-N 3.04Å; K326-I329 PolarHBondContact O-N 2.93Å; I329-L331 VanDerWaalsContact C-N 3.35Å; I329-L331 PolarHBondContact O-N 3.5Å; I329-F332 PolarHBondContact O-N 3.45Å; I329-Y333 PolarHBondContact O-N 2.83Å
330I95.3Very high92.3Very high13 Ų1339.2 Ų39.27%0.06718%0.179CC..Hα-helixtrans-61.5-45.7176.8-66.6166.3000110.3K326 R327 T328 Y333 I334 L488 A491 L492K326-I330 HydrophobicContact CG-CD1 4.03Å; K326-I330 VanDerWaalsContact O-CG1 3.31Å; K326-I330 WeakPolarHBondContact O-CG1 3.42Å; K326-I330 PolarHBondContact O-N 3.46Å; R327-I330 PolarHBondContact O-N 3.27Å; T328-I330 PolarHBondContact O-N 3.28Å; I330-Y333 PolarHBondContact O-N 3.3Å; I330-I334 HydrophobicContact CG2-CD1 3.69Å; I330-I334 HydrophobicContact CG2-CG1 4.37Å; I330-I334 WeakPolarHBondContact O-CG1 3.27Å; I330-I334 PolarHBondContact O-N 2.93Å; I330-L488 HydrophobicContact CG1-CB 4.48Å; I330-L488 HydrophobicContact CG2-CB 3.99Å; I330-A491 HydrophobicContact CD1-CB 4.18Å; I330-L492 HydrophobicContact CB-CD2 4.11Å; I330-L492 HydrophobicContact CB-CG 4.47Å; I330-L492 HydrophobicContact CD1-CD2 4.18Å; I330-L492 HydrophobicContact CG2-CD1 3.81Å; I330-L492 HydrophobicContact CG2-CD2 3.98Å; I330-L492 HydrophobicContact CG2-CG 3.8Å
331L94.3Very high92.9Very high0 Ų032.3 Ų32.30%015%0.153CC..Hα-helixtrans-61.5-46.5177.1-71.1174.2000111.4R327 T328 I329 Y333 I334 W335 I429 T433 I436 F437 L492R327-L331 VanDerWaalsContact O-CG 3.29Å; R327-L331 WeakPolarHBondContact O-CG 3.49Å; R327-L331 PolarHBondContact O-N 2.92Å; T328-L331 PolarHBondContact O-N 3.3Å; I329-L331 VanDerWaalsContact C-N 3.35Å; I329-L331 PolarHBondContact O-N 3.5Å; L331-Y333 VanDerWaalsContact C-N 3.27Å; L331-Y333 PolarHBondContact O-N 3.29Å; L331-I334 PolarHBondContact O-N 3.2Å; L331-I334 VanDerWaalsContact O-N 3.16Å; L331-W335 WeakPolarHBondContact O-CB 3.48Å; L331-W335 PolarHBondContact O-N 3.29Å; L331-I429 HydrophobicContact CD2-CD1 3.63Å; L331-T433 HydrophobicContact CD1-CG2 4.01Å; L331-I436 HydrophobicContact CD1-CB 4.13Å; L331-I436 HydrophobicContact CD1-CD1 4.11Å; L331-I436 HydrophobicContact CD1-CG2 3.85Å; L331-I436 HydrophobicContact CD2-CD1 3.94Å; L331-I436 HydrophobicContact CG-CD1 4.38Å; L331-F437 HydrophobicContact CD1-CE1 4.06Å; L331-F437 HydrophobicContact CD1-CE2 3.97Å; L331-F437 HydrophobicContact CD1-CZ 3.7Å; L331-L492 HydrophobicContact CD2-CD1 3.97Å
332F95.3Very high93.4Very high24 Ų2431.8 Ų31.811%0.10515%0.148CC..Hα-helixtrans-56.2-43177.2-68.7-7.9000112T328 I329 F336 V448 S449 F452T328-F332 HydrophobicContact CG2-CD1 4.18Å; T328-F332 HydrophobicContact CG2-CD2 3.98Å; T328-F332 HydrophobicContact CG2-CE1 3.61Å; T328-F332 HydrophobicContact CG2-CE2 3.39Å; T328-F332 HydrophobicContact CG2-CG 4.36Å; T328-F332 HydrophobicContact CG2-CZ 3.17Å; T328-F332 WeakPolarHBondContact O-CD1 3.32Å; T328-F332 VanDerWaalsContact O-CG 3.24Å; T328-F332 WeakPolarHBondContact O-CG 3.24Å; T328-F332 PolarHBondContact O-N 3.4Å; I329-F332 PolarHBondContact O-N 3.45Å; F332-F336 VanDerWaalsContact O-CB 3.32Å; F332-F336 WeakPolarHBondContact O-CB 3.49Å; F332-F336 PolarHBondContact O-N 3.48Å; F332-V448 HydrophobicContact CE1-CB 4.17Å; F332-V448 HydrophobicContact CE1-CG1 3.84Å; F332-V448 HydrophobicContact CE2-CG1 4Å; F332-V448 HydrophobicContact CZ-CB 4.03Å; F332-V448 HydrophobicContact CZ-CG1 3.37Å; F332-S449 VanDerWaalsContact CD1-OG 3.28Å; F332-S449 WeakPolarHBondContact CD1-OG 3.26Å; F332-S449 WeakPolarHBondContact CE1-OG 3.46Å; F332-F452 HydrophobicContact CB-CB 4.39Å; F332-F452 HydrophobicContact CB-CD2 3.94Å; F332-F452 HydrophobicContact CB-CE2 4.37Å; F332-F452 HydrophobicContact CB-CG 4.04Å; F332-F452 AromaticContact CD1-CD2 3.96Å; F332-F452 HydrophobicContact CD1-CD2 3.96Å; F332-F452 HydrophobicContact CD1-CE2 4.4Å; F332-F452 AromaticContact CD2-CD2 3.68Å; F332-F452 HydrophobicContact CD2-CD2 3.68Å; F332-F452 AromaticContact CD2-CE2 3.36Å; F332-F452 HydrophobicContact CD2-CE2 3.36Å; F332-F452 HydrophobicContact CD2-CG 4.5Å; F332-F452 AromaticContact CD2-CZ 3.95Å; F332-F452 HydrophobicContact CD2-CZ 3.95Å; F332-F452 HydrophobicContact CE1-CD2 4.36Å; F332-F452 HydrophobicContact CE2-CD2 4.1Å; F332-F452 AromaticContact CE2-CE2 3.56Å; F332-F452 HydrophobicContact CE2-CE2 3.56Å; F332-F452 HydrophobicContact CE2-CZ 4.34Å; F332-F452 AromaticContact CG-CD2 3.6Å; F332-F452 HydrophobicContact CG-CD2 3.6Å; F332-F452 AromaticContact CG-CE2 3.82Å; F332-F452 HydrophobicContact CG-CE2 3.82Å; F332-F452 HydrophobicContact CG-CG 4.22Å; F332-F452 HydrophobicContact CZ-CD2 4.42Å; F332-F452 HydrophobicContact CZ-CE2 4.17Å
333Y96.6Very high93.7Very high60 Ų6028.4 Ų28.424%0.23512%0.124CC..Hα-helixtrans-63.9-46.8175.8-179.6-98.2000112.4I329 I330 L331 W335 F336 V337 S481 L484 L488I329-Y333 PolarHBondContact O-N 2.83Å; I330-Y333 PolarHBondContact O-N 3.3Å; L331-Y333 VanDerWaalsContact C-N 3.27Å; L331-Y333 PolarHBondContact O-N 3.29Å; Y333-W335 VanDerWaalsContact C-N 3.35Å; Y333-W335 PolarHBondContact O-N 3.43Å; Y333-F336 WeakPolarHBondContact O-CB 3.49Å; Y333-F336 PolarHBondContact O-N 3.44Å; Y333-V337 HydrophobicContact CD1-CG2 4.16Å; Y333-V337 HydrophobicContact CD2-CG2 4.31Å; Y333-V337 HydrophobicContact CE1-CG2 3.65Å; Y333-V337 HydrophobicContact CE2-CG2 3.82Å; Y333-V337 HydrophobicContact CG-CG2 4.46Å; Y333-V337 VanDerWaalsContact CZ-CG2 3.45Å; Y333-V337 WeakPolarHBondContact O-CG2 3.25Å; Y333-V337 PolarHBondContact O-N 2.91Å; Y333-S481 WeakPolarHBondContact OH-CA 2.97Å; Y333-S481 PolarHBondContact OH-O 2.88Å; Y333-L484 HydrophobicContact CE1-CB 4.42Å; Y333-L484 HydrophobicContact CE1-CD2 4.47Å; Y333-L484 HydrophobicContact CE1-CG 4.2Å; Y333-L488 HydrophobicContact CD1-CD1 3.71Å; Y333-L488 HydrophobicContact CE1-CD1 4Å; Y333-L488 HydrophobicContact CG-CD1 4.33Å
334I96.4Very high94Very high0 Ų025 Ų250%011%0.109CC..Hα-helixtrans-63.3-41.3179.5-67.6168.1000111.4I330 L331 V337 N338 Q386 L390 I429 A489 L492I330-I334 HydrophobicContact CG2-CD1 3.69Å; I330-I334 HydrophobicContact CG2-CG1 4.37Å; I330-I334 WeakPolarHBondContact O-CG1 3.27Å; I330-I334 PolarHBondContact O-N 2.93Å; L331-I334 PolarHBondContact O-N 3.2Å; L331-I334 VanDerWaalsContact O-N 3.16Å; I334-V337 PolarHBondContact O-N 3.27Å; I334-N338 WeakPolarHBondContact CG2-ND2 3.2Å; I334-N338 WeakPolarHBondContact O-CB 3.42Å; I334-N338 PolarHBondContact O-N 3.3Å; I334-N338 PolarHBondContact O-ND2 2.99Å; I334-N338 VanDerWaalsContact O-ND2 3.15Å; I334-Q386 VanDerWaalsContact CG2-NE2 3.35Å; I334-L390 HydrophobicContact CG1-CD1 4.35Å; I334-L390 HydrophobicContact CG2-CD1 4.05Å; I334-I429 HydrophobicContact CB-CD1 4.23Å; I334-I429 HydrophobicContact CG2-CD1 3.61Å; I334-I429 HydrophobicContact CG2-CG1 3.9Å; I334-A489 HydrophobicContact CD1-CB 3.86Å; I334-L492 HydrophobicContact CD1-CD1 4.09Å
335W95.9Very high94.2Very high1 Ų125.6 Ų25.60%0.00411%0.112CC..Hα-helixtrans-60.7-46.6174.7-87.897.2000112.2L331 Y333 V339 F426 I429 Y430 T433 S449 A453L331-W335 WeakPolarHBondContact O-CB 3.48Å; L331-W335 PolarHBondContact O-N 3.29Å; Y333-W335 VanDerWaalsContact C-N 3.35Å; Y333-W335 PolarHBondContact O-N 3.43Å; W335-V339 PolarHBondContact O-N 2.99Å; W335-F426 AromaticContact CE3-CE2 3.93Å; W335-F426 HydrophobicContact CE3-CE2 3.93Å; W335-F426 HydrophobicContact CZ3-CD2 4.41Å; W335-F426 AromaticContact CZ3-CE2 3.61Å; W335-F426 HydrophobicContact CZ3-CE2 3.61Å; W335-F426 HydrophobicContact CZ3-CZ 4.14Å; W335-I429 HydrophobicContact CD2-CG1 4.28Å; W335-I429 HydrophobicContact CD2-CG2 4.31Å; W335-I429 HydrophobicContact CE3-CG2 4.45Å; W335-I429 HydrophobicContact CG-CG1 4.29Å; W335-I429 HydrophobicContact CH2-CG2 4.17Å; W335-I429 HydrophobicContact CZ2-CG1 4.3Å; W335-I429 HydrophobicContact CZ2-CG2 4.03Å; W335-I429 HydrophobicContact CZ3-CG2 4.39Å; W335-Y430 AromaticContact CH2-CD1 3.53Å; W335-Y430 HydrophobicContact CH2-CD1 3.53Å; W335-Y430 AromaticContact CH2-CD2 3.6Å; W335-Y430 HydrophobicContact CH2-CD2 3.6Å; W335-Y430 AromaticContact CH2-CE1 3.42Å; W335-Y430 HydrophobicContact CH2-CE1 3.42Å; W335-Y430 VanDerWaalsContact CH2-CE1 3.42Å; W335-Y430 AromaticContact CH2-CE2 3.47Å; W335-Y430 HydrophobicContact CH2-CE2 3.47Å; W335-Y430 VanDerWaalsContact CH2-CE2 3.47Å; W335-Y430 AromaticContact CH2-CG 3.61Å; W335-Y430 HydrophobicContact CH2-CG 3.61Å; W335-Y430 AromaticContact CH2-CZ 3.36Å; W335-Y430 HydrophobicContact CZ2-CD1 4.19Å; W335-Y430 HydrophobicContact CZ2-CD2 4.48Å; W335-Y430 HydrophobicContact CZ2-CE1 4.41Å; W335-Y430 HydrophobicContact CZ2-CG 4.21Å; W335-Y430 HydrophobicContact CZ3-CD2 4.23Å; W335-Y430 HydrophobicContact CZ3-CE1 4.09Å; W335-Y430 AromaticContact CZ3-CE2 3.7Å; W335-Y430 HydrophobicContact CZ3-CE2 3.7Å; W335-Y430 AromaticContact CZ3-CZ 3.61Å; W335-T433 PolarHBondContact NE1-OG1 3.49Å; W335-S449 WeakPolarHBondContact CB-O 3.39Å; W335-S449 VanDerWaalsContact CD1-CB 3.45Å; W335-A453 HydrophobicContact CB-CB 4.05Å; W335-A453 HydrophobicContact CD2-CB 4.44Å; W335-A453 HydrophobicContact CE3-CB 3.66Å
336F96.3Very high94.2Very high44 Ų4419.8 Ų19.819%0.1939%0.09CC..Hα-helixtrans-57-52.6175.2171.9-92.7000111.5F332 Y333 V339 L340 F452 M455 L459F332-F336 VanDerWaalsContact O-CB 3.32Å; F332-F336 WeakPolarHBondContact O-CB 3.49Å; F332-F336 PolarHBondContact O-N 3.48Å; Y333-F336 WeakPolarHBondContact O-CB 3.49Å; Y333-F336 PolarHBondContact O-N 3.44Å; F336-V339 PolarHBondContact O-N 3.18Å; F336-L340 HydrophobicContact CE1-CD2 3.83Å; F336-L340 HydrophobicContact CZ-CD2 4.22Å; F336-L340 VanDerWaalsContact O-CB 3.28Å; F336-L340 WeakPolarHBondContact O-CB 3.31Å; F336-L340 PolarHBondContact O-N 2.67Å; F336-F452 WeakPolarHBondContact CD2-O 3.29Å; F336-M455 HydrophobicContact CD2-CB 4.31Å; F336-M455 HydrophobicContact CE2-CB 4.39Å; F336-L459 HydrophobicContact CE2-CD1 3.75Å; F336-L459 HydrophobicContact CZ-CD1 3.7Å
337V96.7Very high94Very high0 Ų016 Ų160%08%0.075CC..Hα-helixtrans-65.5-42.3-176.6171.40000112.5Y333 I334 V339 L340 V341 P482Y333-V337 HydrophobicContact CD1-CG2 4.16Å; Y333-V337 HydrophobicContact CD2-CG2 4.31Å; Y333-V337 HydrophobicContact CE1-CG2 3.65Å; Y333-V337 HydrophobicContact CE2-CG2 3.82Å; Y333-V337 HydrophobicContact CG-CG2 4.46Å; Y333-V337 VanDerWaalsContact CZ-CG2 3.45Å; Y333-V337 WeakPolarHBondContact O-CG2 3.25Å; Y333-V337 PolarHBondContact O-N 2.91Å; I334-V337 PolarHBondContact O-N 3.27Å; V337-V339 VanDerWaalsContact C-N 3.3Å; V337-V339 PolarHBondContact O-N 3.22Å; V337-L340 WeakPolarHBondContact O-CB 3.49Å; V337-L340 PolarHBondContact O-N 3.27Å; V337-V341 HydrophobicContact CG1-CG2 4.11Å; V337-V341 WeakPolarHBondContact O-CG2 3.48Å; V337-V341 PolarHBondContact O-N 3.02Å; V337-P482 HydrophobicContact CG1-CB 3.78Å; V337-P482 HydrophobicContact CG1-CG 4.46Å
338N95.8Very high93.6Very high0 Ų016 Ų160%08%0.078CC..Hα-helixtrans-56.2-47.7178.3-87.4-44000111.4I334 Y342 L390 I422 S425 F426I334-N338 WeakPolarHBondContact CG2-ND2 3.2Å; I334-N338 WeakPolarHBondContact O-CB 3.42Å; I334-N338 PolarHBondContact O-N 3.3Å; I334-N338 PolarHBondContact O-ND2 2.99Å; I334-N338 VanDerWaalsContact O-ND2 3.15Å; N338-Y342 WeakPolarHBondContact O-CB 3.43Å; N338-Y342 PolarHBondContact O-N 3.44Å; N338-L390 WeakPolarHBondContact OD1-CD2 3.26Å; N338-I422 WeakPolarHBondContact O-CG2 3.39Å; N338-S425 VanDerWaalsContact CG-OG 3.29Å; N338-S425 PolarHBondContact ND2-OG 3.28Å; N338-S425 WeakPolarHBondContact OD1-CB 3.49Å; N338-S425 PolarHBondContact OD1-OG 3.29Å; N338-F426 HydrophobicContact CB-CD2 3.81Å
339V94.8Very high93.3Very high7 Ų716.1 Ų16.14%0.0428%0.079CC..Hα-helixtrans-72.9-37.3-178.9177.10000111.8W335 F336 V337 Y342 Y343 F426 A453W335-V339 PolarHBondContact O-N 2.99Å; F336-V339 PolarHBondContact O-N 3.18Å; V337-V339 VanDerWaalsContact C-N 3.3Å; V337-V339 PolarHBondContact O-N 3.22Å; V339-Y342 PolarHBondContact O-N 2.71Å; V339-Y343 HydrophobicContact CG1-CD2 3.43Å; V339-Y343 VanDerWaalsContact CG1-CD2 3.43Å; V339-Y343 HydrophobicContact CG1-CE2 3.48Å; V339-Y343 VanDerWaalsContact CG1-CE2 3.48Å; V339-Y343 WeakPolarHBondContact O-CD2 3.47Å; V339-Y343 PolarHBondContact O-N 2.83Å; V339-F426 HydrophobicContact CG2-CD2 4.38Å; V339-F426 HydrophobicContact CG2-CE2 3.53Å; V339-F426 HydrophobicContact CG2-CZ 3.88Å; V339-A453 HydrophobicContact CB-CB 4.24Å; V339-A453 WeakPolarHBondContact CB-O 3.34Å; V339-A453 WeakPolarHBondContact CG1-O 3.45Å; V339-A453 HydrophobicContact CG2-CB 3.55Å
340L95.4Very high92.4Very high4 Ų414.5 Ų14.52%0.0218%0.076CC..Hα-helixtrans-55.8-53.6174.8-173.969.2000111.3F336 V337 G344 G456 L459 A460 I463 I477 F478F336-L340 HydrophobicContact CE1-CD2 3.83Å; F336-L340 HydrophobicContact CZ-CD2 4.22Å; F336-L340 VanDerWaalsContact O-CB 3.28Å; F336-L340 WeakPolarHBondContact O-CB 3.31Å; F336-L340 PolarHBondContact O-N 2.67Å; V337-L340 WeakPolarHBondContact O-CB 3.49Å; V337-L340 PolarHBondContact O-N 3.27Å; L340-G344 WeakPolarHBondContact O-CA 3.38Å; L340-G344 PolarHBondContact O-N 3.04Å; L340-G456 WeakPolarHBondContact CD1-O 3.28Å; L340-L459 HydrophobicContact CD1-CB 3.94Å; L340-A460 HydrophobicContact CD1-CB 4.15Å; L340-I463 HydrophobicContact CD1-CD1 3.69Å; L340-I463 HydrophobicContact CD2-CD1 4.05Å; L340-I463 HydrophobicContact CG-CD1 4.24Å; L340-I477 HydrophobicContact CD2-CG2 4.49Å; L340-F478 HydrophobicContact CG-CD1 4.48Å; L340-F478 HydrophobicContact CG-CE1 4.22Å
341V95.7Very high91.4Very high0 Ų018.4 Ų18.40%09%0.09CC..Hα-helixtrans-73.5-36.6-177.9-174.60000111V337 Y343 G344 L345 I422 F478 P482V337-V341 HydrophobicContact CG1-CG2 4.11Å; V337-V341 WeakPolarHBondContact O-CG2 3.48Å; V337-V341 PolarHBondContact O-N 3.02Å; V341-Y343 PolarHBondContact O-N 3.18Å; V341-G344 PolarHBondContact O-N 3.07Å; V341-L345 HydrophobicContact CG1-CD1 3.88Å; V341-L345 HydrophobicContact CG1-CG 4.07Å; V341-L345 WeakPolarHBondContact O-CB 3.36Å; V341-L345 WeakPolarHBondContact O-CG 3.49Å; V341-L345 PolarHBondContact O-N 2.85Å; V341-I422 HydrophobicContact CB-CD1 4Å; V341-I422 HydrophobicContact CB-CG1 4.03Å; V341-I422 HydrophobicContact CB-CG2 4.44Å; V341-I422 HydrophobicContact CG1-CD1 4Å; V341-I422 HydrophobicContact CG1-CG1 3.66Å; V341-I422 HydrophobicContact CG2-CD1 4.46Å; V341-F478 HydrophobicContact CG1-CB 4.23Å; V341-F478 HydrophobicContact CG2-CB 4.28Å; V341-F478 HydrophobicContact CG2-CD1 4.27Å; V341-P482 HydrophobicContact CG2-CG 4.28Å
342Y94.5Very high90.5Very high11 Ų1119.3 Ų19.34%0.04310%0.095CC..Hα-helixtrans-58.7-49178.6178.1-86.3000112M36 F218 N338 V339 S346 E367 K419M36-Y342 HydrophobicContact CE-CE1 3.84Å; F218-Y342 WeakPolarHBondContact CE1-OH 3.4Å; N338-Y342 WeakPolarHBondContact O-CB 3.43Å; N338-Y342 PolarHBondContact O-N 3.44Å; V339-Y342 PolarHBondContact O-N 2.71Å; Y342-S346 WeakPolarHBondContact O-CB 3.46Å; Y342-S346 PolarHBondContact O-N 2.97Å; Y342-S346 PolarHBondContact O-OG 2.93Å; Y342-E367 PolarHBondContact OH-OE1 2.79Å; Y342-K419 PolarHBondContact O-NZ 3.49Å
343Y92.5Very high89.2Confident20 Ų2021 Ų218%0.07812%0.119CC..Hα-helixtrans-79.5-30.4176.1-71-64000112.5M35 M36 M130 V339 V341 S346 L347M35-Y343 HydrophobicContact CE-CE1 3.72Å; M35-Y343 WeakPolarHBondContact CE-OH 3.48Å; M36-Y343 HydrophobicContact CE-CD1 4.24Å; M36-Y343 HydrophobicContact CE-CE1 3.64Å; M130-Y343 HydrophobicContact CE-CD1 3.43Å; M130-Y343 VanDerWaalsContact CE-CD1 3.43Å; M130-Y343 HydrophobicContact CE-CD2 4.12Å; M130-Y343 HydrophobicContact CE-CE1 3.51Å; M130-Y343 HydrophobicContact CE-CE2 4.19Å; M130-Y343 HydrophobicContact CE-CG 3.78Å; M130-Y343 HydrophobicContact SD-CD2 4.5Å; M130-Y343 HydrophobicContact SD-CE2 4.33Å; V339-Y343 HydrophobicContact CG1-CD2 3.43Å; V339-Y343 VanDerWaalsContact CG1-CD2 3.43Å; V339-Y343 HydrophobicContact CG1-CE2 3.48Å; V339-Y343 VanDerWaalsContact CG1-CE2 3.48Å; V339-Y343 WeakPolarHBondContact O-CD2 3.47Å; V339-Y343 PolarHBondContact O-N 2.83Å; V341-Y343 PolarHBondContact O-N 3.18Å; Y343-S346 PolarHBondContact O-N 2.91Å; Y343-L347 VanDerWaalsContact O-CB 3.23Å; Y343-L347 WeakPolarHBondContact O-CB 3.33Å; Y343-L347 VanDerWaalsContact O-CG 3.25Å; Y343-L347 WeakPolarHBondContact O-CG 3.35Å; Y343-L347 PolarHBondContact O-N 3.34Å
344G91.9Very high88.5Confident1 Ų120 Ų201%0.0112%0.12CC..Hα-helixtrans-55.4-53.5173.800000111.8L340 V341 G348 N464 F478L340-G344 WeakPolarHBondContact O-CA 3.38Å; L340-G344 PolarHBondContact O-N 3.04Å; V341-G344 PolarHBondContact O-N 3.07Å; G344-G348 PolarHBondContact O-N 3.42Å; G344-N464 PolarHBondContact O-ND2 3Å; G344-N464 PolarHBondContact O-OD1 3.04Å; G344-F478 VanDerWaalsContact CA-CZ 3.41Å
345L91.6Very high88Confident12 Ų1225.8 Ų25.86%0.06315%0.15CC..Hα-helixtrans-66.6-42.8176.9-67.3176.5000112.5V341 G348 V349 M400V341-L345 HydrophobicContact CG1-CD1 3.88Å; V341-L345 HydrophobicContact CG1-CG 4.07Å; V341-L345 WeakPolarHBondContact O-CB 3.36Å; V341-L345 WeakPolarHBondContact O-CG 3.49Å; V341-L345 PolarHBondContact O-N 2.85Å; L345-G348 PolarHBondContact O-N 3.19Å; L345-V349 PolarHBondContact O-N 2.72Å; L345-M400 HydrophobicContact CD2-CE 3.84Å
346S90.8Very high87.7Confident0 Ų026.7 Ų26.70%016%0.155CC..Hα-helixtrans-67.8-41.5-178.6-77.20000113.5I39 Y222 Y342 Y343 V349 Q360 K419I39-S346 VanDerWaalsContact CD1-O 3.27Å; I39-S346 WeakPolarHBondContact CD1-O 3.44Å; Y222-S346 PolarHBondContact OH-OG 3.35Å; Y342-S346 WeakPolarHBondContact O-CB 3.46Å; Y342-S346 PolarHBondContact O-N 2.97Å; Y342-S346 PolarHBondContact O-OG 2.93Å; Y343-S346 PolarHBondContact O-N 2.91Å; S346-V349 WeakPolarHBondContact O-CG1 3.27Å; S346-Q360 PolarHBondContact O-NE2 3.43Å; S346-K419 WeakPolarHBondContact OG-CE 3.35Å; S346-K419 PolarHBondContact OG-NZ 2.9Å
347L86.6Confident87.4Confident30 Ų3025.9 Ų25.916%0.15715%0.151CC..Hα-helixtrans-78.8-21.7178.4-61.9176.3000112.5S38 I39 Y343 V349 P461S38-L347 WeakPolarHBondContact OG-CD2 3.31Å; I39-L347 HydrophobicContact CD1-CD2 4.39Å; I39-L347 HydrophobicContact CG1-CD2 3.75Å; Y343-L347 VanDerWaalsContact O-CB 3.23Å; Y343-L347 WeakPolarHBondContact O-CB 3.33Å; Y343-L347 VanDerWaalsContact O-CG 3.25Å; Y343-L347 WeakPolarHBondContact O-CG 3.35Å; Y343-L347 PolarHBondContact O-N 3.34Å; L347-V349 VanDerWaalsContact C-N 3.33Å; L347-P461 HydrophobicContact CD1-CB 4.35Å; L347-P461 HydrophobicContact CD1-CG 3.7Å
348G83.3Confident87.2Confident11 Ų1131 Ų3111%0.11318%0.177CC..THydrogen-bonded Turntrans-85.63.2178.500000114.9G344 L345 S350 R351 N464G344-G348 PolarHBondContact O-N 3.42Å; L345-G348 PolarHBondContact O-N 3.19Å; G348-S350 PolarHBondContact O-N 3.06Å; G348-S350 VanDerWaalsContact O-N 3.16Å; G348-R351 PolarHBondContact O-N 3.1Å; G348-N464 PolarHBondContact N-ND2 3.48Å
349V84.4Confident87Confident2 Ų231.1 Ų31.11%0.01218%0.178CC..G310 helixtrans-61.2-27.7-171.1690000114.1I39 L345 S346 L347 R351 L352 L356 T359 Q360 F363I39-V349 HydrophobicContact CG2-CG1 3.42Å; I39-V349 VanDerWaalsContact CG2-CG1 3.42Å; L345-V349 PolarHBondContact O-N 2.72Å; S346-V349 WeakPolarHBondContact O-CG1 3.27Å; L347-V349 VanDerWaalsContact C-N 3.33Å; V349-R351 PolarHBondContact O-N 2.56Å; V349-L352 HydrophobicContact CB-CD1 4.47Å; V349-L352 HydrophobicContact CG2-CD1 3.94Å; V349-L352 PolarHBondContact O-N 3.17Å; V349-L352 VanDerWaalsContact O-N 3.13Å; V349-L356 HydrophobicContact CB-CD1 4.34Å; V349-L356 HydrophobicContact CG1-CD1 3.28Å; V349-L356 HydrophobicContact CG1-CG 4.47Å; V349-L356 HydrophobicContact CG2-CD1 4.49Å; V349-T359 HydrophobicContact CG2-CG2 3.29Å; V349-Q360 VanDerWaalsContact CB-NE2 3.26Å; V349-Q360 HydrophobicContact CG1-CG 3.96Å; V349-Q360 HydrophobicContact CG2-CG 4.36Å; V349-F363 HydrophobicContact CB-CE2 4.21Å; V349-F363 HydrophobicContact CG2-CD2 4.47Å; V349-F363 HydrophobicContact CG2-CE2 3.94Å; V349-F363 HydrophobicContact CG2-CZ 4.38Å
350S75.4Confident86.8Confident65 Ų6530.8 Ų30.846%0.45518%0.176SC..G310 helixtrans-65.4-11.6-177.560.60000112.9G348G348-S350 PolarHBondContact O-N 3.06Å; G348-S350 VanDerWaalsContact O-N 3.16Å
351R74.2Confident86.8Confident95 Ų9534.5 Ų34.536%0.35819%0.193SC..G310 helixtrans-99.9-2.2-178.2-53.2178.8-171-110.59.3113.2G348 V349 G353 N464 H467 N468G348-R351 PolarHBondContact O-N 3.1Å; V349-R351 PolarHBondContact O-N 2.56Å; R351-G353 VanDerWaalsContact C-N 3.25Å; R351-G353 PolarHBondContact O-N 3.27Å; R351-N464 PolarHBondContact NH2-O 3.45Å; R351-N464 VanDerWaalsContact NH2-O 3.11Å; R351-H467 PolarHBondContact NH1-CD2 2.78Å; R351-N468 PolarHBondContact NH1-OD1 2.7Å; R351-N468 PolarHBondContact NH2-OD1 2.98Å
352L76.3Confident86.6Confident18 Ų1836 Ų369%0.09420%0.201CC..SBendtrans-81.11.7-175.3-64.3173.9000114.1V349 T354 T359 F363 M400 L411 T412 A415V349-L352 HydrophobicContact CB-CD1 4.47Å; V349-L352 HydrophobicContact CG2-CD1 3.94Å; V349-L352 PolarHBondContact O-N 3.17Å; V349-L352 VanDerWaalsContact O-N 3.13Å; L352-T354 PolarHBondContact O-N 2.94Å; L352-T359 HydrophobicContact CD1-CG2 4.07Å; L352-F363 HydrophobicContact CD1-CZ 4Å; L352-M400 HydrophobicContact CD2-SD 4.47Å; L352-L411 HydrophobicContact CD2-CD2 4.22Å; L352-L411 HydrophobicContact CD2-CG 4.01Å; L352-T412 PolarHBondContact O-OG1 3Å; L352-A415 HydrophobicContact CD1-CB 3.73Å; L352-A415 HydrophobicContact CD2-CB 3.87Å; L352-A415 HydrophobicContact CG-CB 4.5Å
353G68.6Low86.5Confident61 Ų6135.4 Ų35.463%0.62920%0.199SC*.SBendtrans72.72.4173.100000115.7R351R351-G353 VanDerWaalsContact C-N 3.25Å; R351-G353 PolarHBondContact O-N 3.27Å
354T80.5Confident86.5Confident39 Ų3934.5 Ų34.524%0.23920%0.196CC..SBendtrans-111169.3176.349.90000111.4L352 L356 T359 P408 T412L352-T354 PolarHBondContact O-N 2.94Å; T354-L356 PolarHBondContact O-N 3.45Å; T354-L356 VanDerWaalsContact O-N 3.1Å; T354-T359 PolarHBondContact OG1-OG1 3.01Å; T354-P408 HydrophobicContact CG2-CB 4.29Å; T354-T412 HydrophobicContact CG2-CG2 4.45Å; T354-T412 WeakPolarHBondContact CG2-OG1 3.27Å; T354-T412 WeakPolarHBondContact OG1-CG2 3.43Å; T354-T412 PolarHBondContact OG1-OG1 2.83Å
355D87.5Confident86.6Confident121 Ų12138.1 Ų38.165%0.64722%0.215SC*.  trans-54.4116.2177-75.4-45.2000111.9Y357 L358 T359D355-Y357 VanDerWaalsContact C-N 3.26Å; D355-Y357 PolarHBondContact O-N 3.06Å; D355-L358 HydrophobicContact CB-CB 4.05Å; D355-L358 PolarHBondContact O-N 3.23Å; D355-L358 VanDerWaalsContact O-N 3.16Å; D355-T359 PolarHBondContact O-N 3.35Å; D355-T359 PolarHBondContact O-OG1 3.48Å
356L88.2Confident86.8Confident19 Ų1938.5 Ų38.510%0.09922%0.217CC..Hα-helixtrans-51.8-45.5-177.8-175.877.9000112.1I39 F40 F104 V349 T354 Q360I39-L356 HydrophobicContact CG2-CD1 4.15Å; F40-L356 HydrophobicContact CD1-CD2 3.74Å; F40-L356 HydrophobicContact CD1-CG 4.47Å; F40-L356 HydrophobicContact CE1-CD2 3.98Å; F40-L356 HydrophobicContact CE1-CG 4.22Å; F104-L356 HydrophobicContact CE1-CD2 4.47Å; F104-L356 HydrophobicContact CE2-CD2 4.5Å; F104-L356 HydrophobicContact CZ-CD2 3.62Å; V349-L356 HydrophobicContact CB-CD1 4.34Å; V349-L356 HydrophobicContact CG1-CD1 3.28Å; V349-L356 HydrophobicContact CG1-CG 4.47Å; V349-L356 HydrophobicContact CG2-CD1 4.49Å; T354-L356 PolarHBondContact O-N 3.45Å; T354-L356 VanDerWaalsContact O-N 3.1Å; L356-Q360 HydrophobicContact CG-CG 4.5Å; L356-Q360 WeakPolarHBondContact O-CB 3.14Å; L356-Q360 WeakPolarHBondContact O-CG 3.5Å; L356-Q360 PolarHBondContact O-N 2.94Å
357Y91.3Very high86.8Confident28 Ų2838.5 Ų38.511%0.1122%0.217CC..Hα-helixtrans-64.8-44.6-177.2-58.8-77000112F40 V103 F104 A229 Y230 D355 F361F40-Y357 HydrophobicContact CD1-CD1 4.01Å; F40-Y357 AromaticContact CD1-CE1 3.74Å; F40-Y357 HydrophobicContact CD1-CE1 3.74Å; F40-Y357 AromaticContact CE1-CD1 3.51Å; F40-Y357 HydrophobicContact CE1-CD1 3.51Å; F40-Y357 AromaticContact CE1-CE1 3.76Å; F40-Y357 HydrophobicContact CE1-CE1 3.76Å; F40-Y357 HydrophobicContact CE1-CG 4.4Å; F40-Y357 HydrophobicContact CZ-CD1 4.39Å; V103-Y357 HydrophobicContact CG1-CE2 4.16Å; V103-Y357 PolarHBondContact O-OH 3.1Å; F104-Y357 AromaticContact CE1-CZ 3.99Å; F104-Y357 WeakPolarHBondContact CE1-OH 3.38Å; A229-Y357 VanDerWaalsContact C-CE1 3.4Å; A229-Y357 HydrophobicContact CB-CD1 4.22Å; A229-Y357 HydrophobicContact CB-CE1 3.88Å; A229-Y357 WeakPolarHBondContact O-CE1 3.1Å; Y230-Y357 AromaticContact CD2-CD2 3.98Å; Y230-Y357 HydrophobicContact CD2-CD2 3.98Å; Y230-Y357 HydrophobicContact CD2-CE2 4.38Å; Y230-Y357 HydrophobicContact CD2-CG 4.05Å; D355-Y357 VanDerWaalsContact C-N 3.26Å; D355-Y357 PolarHBondContact O-N 3.06Å; Y357-F361 WeakPolarHBondContact O-CB 3.37Å; Y357-F361 PolarHBondContact O-N 3.36Å
358L91.3Very high87.1Confident106 Ų10639.5 Ų39.556%0.55522%0.222SC*.Hα-helixtrans-66.3-46.3179.7-177.565000110.5D355 Q360 F361 V362D355-L358 HydrophobicContact CB-CB 4.05Å; D355-L358 PolarHBondContact O-N 3.23Å; D355-L358 VanDerWaalsContact O-N 3.16Å; L358-Q360 VanDerWaalsContact C-N 3.3Å; L358-Q360 PolarHBondContact O-N 3.2Å; L358-F361 WeakPolarHBondContact O-CB 3.36Å; L358-F361 PolarHBondContact O-N 2.85Å; L358-V362 WeakPolarHBondContact O-CG2 3.42Å; L358-V362 PolarHBondContact O-N 3.35Å
359T91.7Very high87.6Confident3 Ų342 Ų422%0.01824%0.237CC..Hα-helixtrans-63.4-38.1-179.3-58.40000111.7V349 L352 T354 D355 V362 F363 T412V349-T359 HydrophobicContact CG2-CG2 3.29Å; L352-T359 HydrophobicContact CD1-CG2 4.07Å; T354-T359 PolarHBondContact OG1-OG1 3.01Å; D355-T359 PolarHBondContact O-N 3.35Å; D355-T359 PolarHBondContact O-OG1 3.48Å; T359-V362 PolarHBondContact O-N 3.07Å; T359-F363 HydrophobicContact CG2-CD1 4.41Å; T359-F363 HydrophobicContact CG2-CE1 4.03Å; T359-F363 HydrophobicContact CG2-CZ 4.11Å; T359-F363 WeakPolarHBondContact O-CD1 3.41Å; T359-F363 WeakPolarHBondContact O-CG 3.31Å; T359-F363 PolarHBondContact O-N 3.33Å; T359-T412 HydrophobicContact CG2-CG2 3.6Å
360Q91.6Very high88Confident0 Ų042 Ų420%024%0.236CC..Hα-helixtrans-67.8-40.2174.3-71.8-69.8-63.100113I39 F40 Y222 A226 S346 V349 L356 L358 V362 F363 G364I39-Q360 HydrophobicContact CG2-CG 4.09Å; F40-Q360 HydrophobicContact CE1-CG 4.36Å; F40-Q360 HydrophobicContact CZ-CB 3.88Å; F40-Q360 HydrophobicContact CZ-CG 3.93Å; Y222-Q360 PolarHBondContact OH-OE1 3.13Å; A226-Q360 HydrophobicContact CB-CB 4.24Å; S346-Q360 PolarHBondContact O-NE2 3.43Å; V349-Q360 VanDerWaalsContact CB-NE2 3.26Å; V349-Q360 HydrophobicContact CG1-CG 3.96Å; V349-Q360 HydrophobicContact CG2-CG 4.36Å; L356-Q360 HydrophobicContact CG-CG 4.5Å; L356-Q360 WeakPolarHBondContact O-CB 3.14Å; L356-Q360 WeakPolarHBondContact O-CG 3.5Å; L356-Q360 PolarHBondContact O-N 2.94Å; L358-Q360 VanDerWaalsContact C-N 3.3Å; L358-Q360 PolarHBondContact O-N 3.2Å; Q360-V362 VanDerWaalsContact C-N 3.33Å; Q360-V362 PolarHBondContact O-N 3.32Å; Q360-F363 PolarHBondContact O-N 2.89Å; Q360-G364 PolarHBondContact O-N 3.3Å
361F94.1Very high88.7Confident83 Ų8339.3 Ų39.336%0.36422%0.216SC..Hα-helixtrans-60-44.9173.1-179.8-91.5000111.3M223 A226 Y357 L358 G364 L365M223-F361 HydrophobicContact CB-CD2 3.9Å; M223-F361 HydrophobicContact CB-CE2 3.87Å; M223-F361 HydrophobicContact CE-CD2 4.37Å; M223-F361 HydrophobicContact CE-CE1 3.93Å; M223-F361 HydrophobicContact CE-CE2 3.55Å; M223-F361 HydrophobicContact CE-CZ 3.29Å; M223-F361 HydrophobicContact CG-CD2 4.28Å; M223-F361 HydrophobicContact CG-CE2 4.28Å; A226-F361 HydrophobicContact CB-CB 4.04Å; Y357-F361 WeakPolarHBondContact O-CB 3.37Å; Y357-F361 PolarHBondContact O-N 3.36Å; L358-F361 WeakPolarHBondContact O-CB 3.36Å; L358-F361 PolarHBondContact O-N 2.85Å; F361-G364 PolarHBondContact O-N 3.43Å; F361-L365 PolarHBondContact O-N 3.33Å
362V93.1Very high89.6Confident30 Ų3036.8 Ų36.818%0.18221%0.213CC..Hα-helixtrans-67.4-37177.7-1800000111.5L358 T359 Q360 G364 L365 V366 M416L358-V362 WeakPolarHBondContact O-CG2 3.42Å; L358-V362 PolarHBondContact O-N 3.35Å; T359-V362 PolarHBondContact O-N 3.07Å; Q360-V362 VanDerWaalsContact C-N 3.33Å; Q360-V362 PolarHBondContact O-N 3.32Å; V362-G364 VanDerWaalsContact C-N 3.3Å; V362-G364 PolarHBondContact O-N 3.4Å; V362-L365 WeakPolarHBondContact O-CB 3.4Å; V362-L365 PolarHBondContact O-N 3.45Å; V362-L365 VanDerWaalsContact O-N 3.14Å; V362-V366 HydrophobicContact CG1-CG2 4.09Å; V362-V366 WeakPolarHBondContact O-CB 3.48Å; V362-V366 VanDerWaalsContact O-CG2 3.24Å; V362-V366 WeakPolarHBondContact O-CG2 3.25Å; V362-V366 PolarHBondContact O-N 3.38Å; V362-M416 HydrophobicContact CB-CE 3.74Å; V362-M416 HydrophobicContact CB-SD 4.45Å; V362-M416 HydrophobicContact CG1-CE 3.46Å; V362-M416 VanDerWaalsContact CG1-CE 3.46Å; V362-M416 HydrophobicContact CG1-CG 4.16Å; V362-M416 HydrophobicContact CG1-SD 3.52Å; V362-M416 VanDerWaalsContact CG1-SD 3.52Å; V362-M416 HydrophobicContact CG2-CE 4.12Å
363F92.6Very high90.3Very high0 Ų039.1 Ų39.10%023%0.225CC..Hα-helixtrans-59.6-39.5172.3-80.15.4000112.6Y222 V349 L352 T359 Q360 E367 A415 M416 K419Y222-F363 HydrophobicContact CE1-CB 4.41Å; V349-F363 HydrophobicContact CB-CE2 4.21Å; V349-F363 HydrophobicContact CG2-CD2 4.47Å; V349-F363 HydrophobicContact CG2-CE2 3.94Å; V349-F363 HydrophobicContact CG2-CZ 4.38Å; L352-F363 HydrophobicContact CD1-CZ 4Å; T359-F363 HydrophobicContact CG2-CD1 4.41Å; T359-F363 HydrophobicContact CG2-CE1 4.03Å; T359-F363 HydrophobicContact CG2-CZ 4.11Å; T359-F363 WeakPolarHBondContact O-CD1 3.41Å; T359-F363 WeakPolarHBondContact O-CG 3.31Å; T359-F363 PolarHBondContact O-N 3.33Å; Q360-F363 PolarHBondContact O-N 2.89Å; F363-E367 WeakPolarHBondContact O-CG 3.32Å; F363-A415 HydrophobicContact CZ-CB 4.3Å; F363-M416 HydrophobicContact CD1-CG 4.25Å; F363-M416 HydrophobicContact CE1-CG 3.95Å; F363-K419 HydrophobicContact CD1-CB 4.38Å; F363-K419 HydrophobicContact CD1-CG 4.21Å; F363-K419 HydrophobicContact CE1-CB 4.32Å; F363-K419 HydrophobicContact CG-CG 4.22Å
364G92.6Very high91.2Very high0 Ų036.3 Ų36.30%020%0.196CC..Hα-helixtrans-65-42.9171.600000112.6Q360 F361 V362 V366 E367Q360-G364 PolarHBondContact O-N 3.3Å; F361-G364 PolarHBondContact O-N 3.43Å; V362-G364 VanDerWaalsContact C-N 3.3Å; V362-G364 PolarHBondContact O-N 3.4Å; G364-V366 PolarHBondContact O-N 3.46Å; G364-E367 WeakPolarHBondContact O-CB 3.12Å; G364-E367 PolarHBondContact O-N 3.46Å
365L94.1Very high91.5Very high78 Ų7837.1 Ų37.141%0.40820%0.199SC..Hα-helixtrans-62.5-42.5178-178.165.3000112.1M223 F361 V362 E367 I368 P369M223-L365 HydrophobicContact CE-CB 4.4Å; M223-L365 HydrophobicContact CE-CD1 4.04Å; M223-L365 HydrophobicContact SD-CB 4.31Å; M223-L365 HydrophobicContact SD-CD1 4.34Å; F361-L365 PolarHBondContact O-N 3.33Å; V362-L365 WeakPolarHBondContact O-CB 3.4Å; V362-L365 PolarHBondContact O-N 3.45Å; V362-L365 VanDerWaalsContact O-N 3.14Å; L365-E367 PolarHBondContact O-N 3.36Å; L365-I368 PolarHBondContact O-N 3.06Å; L365-I368 VanDerWaalsContact O-N 3.15Å; L365-P369 WeakPolarHBondContact O-CD 3.06Å
366V94.4Very high91.5Very high19 Ų1935.7 Ų35.712%0.11519%0.194CC..Hα-helixtrans-59.4-25.1179.5163.10000112.4V362 G364 I368 P369 A370 K419 F420V362-V366 HydrophobicContact CG1-CG2 4.09Å; V362-V366 WeakPolarHBondContact O-CB 3.48Å; V362-V366 VanDerWaalsContact O-CG2 3.24Å; V362-V366 WeakPolarHBondContact O-CG2 3.25Å; V362-V366 PolarHBondContact O-N 3.38Å; G364-V366 PolarHBondContact O-N 3.46Å; V366-I368 VanDerWaalsContact C-N 3.28Å; V366-I368 PolarHBondContact O-N 3.28Å; V366-P369 VanDerWaalsContact O-CD 3.31Å; V366-P369 WeakPolarHBondContact O-CD 3.46Å; V366-P369 WeakPolarHBondContact O-CG 3.34Å; V366-A370 VanDerWaalsContact O-CB 3.23Å; V366-A370 WeakPolarHBondContact O-CB 3.46Å; V366-A370 PolarHBondContact O-N 2.92Å; V366-K419 HydrophobicContact CG1-CG 4.46Å; V366-F420 HydrophobicContact CG1-CB 3.69Å; V366-F420 HydrophobicContact CG1-CD2 4.13Å; V366-F420 HydrophobicContact CG1-CG 4.42Å
367E91.6Very high91.5Very high0 Ų036.9 Ų36.90%020%0.202CC..Hα-helixtrans-65.3-31.1177.8-58-151.8159.700113.6F218 Y342 F363 G364 L365 R371 T423F218-E367 WeakPolarHBondContact CD1-OE2 3.38Å; Y342-E367 PolarHBondContact OH-OE1 2.79Å; F363-E367 WeakPolarHBondContact O-CG 3.32Å; G364-E367 WeakPolarHBondContact O-CB 3.12Å; G364-E367 PolarHBondContact O-N 3.46Å; L365-E367 PolarHBondContact O-N 3.36Å; E367-R371 WeakPolarHBondContact O-CB 3.38Å; E367-R371 VanDerWaalsContact O-CG 3.31Å; E367-R371 WeakPolarHBondContact O-CG 3.19Å; E367-R371 PolarHBondContact O-N 3.4Å; E367-R371 IonicContact OE1-NH2 2.73Å; E367-R371 IonicContact OE2-CZ 3.03Å; E367-R371 IonicContact OE2-NH1 2.71Å; E367-R371 PolarHBondContact OE2-NH1 2.63Å; E367-R371 IonicContact OE2-NH2 2.7Å; E367-R371 PolarHBondContact OE2-NH2 3.17Å; E367-T423 HydrophobicContact CB-CG2 4.21Å; E367-T423 HydrophobicContact CG-CG2 4.2Å
368I92.3Very high91.1Very high52 Ų5235.9 Ų35.927%0.26720%0.198SC..Hα-helixtrans-68.7-57.2-178.8-57174.8000111.5Y216 M223 L365 V366 A370 R371 S372Y216-I368 HydrophobicContact CD1-CB 4.32Å; Y216-I368 HydrophobicContact CD1-CG1 4.25Å; Y216-I368 HydrophobicContact CD1-CG2 4.06Å; Y216-I368 HydrophobicContact CE1-CB 4.42Å; Y216-I368 HydrophobicContact CE1-CG2 3.93Å; Y216-I368 WeakPolarHBondContact CE1-O 3.37Å; M223-I368 HydrophobicContact SD-CD1 4.47Å; L365-I368 PolarHBondContact O-N 3.06Å; L365-I368 VanDerWaalsContact O-N 3.15Å; V366-I368 VanDerWaalsContact C-N 3.28Å; V366-I368 PolarHBondContact O-N 3.28Å; I368-A370 VanDerWaalsContact C-N 3.34Å; I368-A370 PolarHBondContact O-N 2.99Å; I368-R371 PolarHBondContact O-N 3.35Å; I368-S372 WeakPolarHBondContact O-CB 3.35Å; I368-S372 PolarHBondContact O-N 3.15Å; I368-S372 PolarHBondContact O-OG 2.93Å
369P94Very high90.7Very high64 Ų6434.7 Ų34.742%0.41620%0.197SC..Hα-helixtrans-65.8-35.8178.927.1-33.8000111.9L365 V366 R371 S372 L373 F420L365-P369 WeakPolarHBondContact O-CD 3.06Å; V366-P369 VanDerWaalsContact O-CD 3.31Å; V366-P369 WeakPolarHBondContact O-CD 3.46Å; V366-P369 WeakPolarHBondContact O-CG 3.34Å; P369-R371 PolarHBondContact O-N 2.93Å; P369-S372 PolarHBondContact O-N 2.84Å; P369-L373 WeakPolarHBondContact O-CB 3.48Å; P369-L373 PolarHBondContact O-N 3.49Å; P369-F420 HydrophobicContact CB-CE2 4.36Å
370A93.3Very high90.4Very high0 Ų042.5 Ų42.50%023%0.231CC..Hα-helixtrans-57.5-48.1177.800000111.8V366 I368 V374 F420 T423 A424V366-A370 VanDerWaalsContact O-CB 3.23Å; V366-A370 WeakPolarHBondContact O-CB 3.46Å; V366-A370 PolarHBondContact O-N 2.92Å; I368-A370 VanDerWaalsContact C-N 3.34Å; I368-A370 PolarHBondContact O-N 2.99Å; A370-V374 WeakPolarHBondContact O-CG2 3.4Å; A370-V374 PolarHBondContact O-N 3.04Å; A370-F420 HydrophobicContact CB-CD2 3.67Å; A370-F420 HydrophobicContact CB-CE2 3.82Å; A370-F420 HydrophobicContact CB-CG 4.26Å; A370-F420 HydrophobicContact CB-CZ 4.5Å; A370-T423 HydrophobicContact CB-CG2 4.08Å; A370-A424 HydrophobicContact CB-CB 4.32Å
371R90.6Very high90.2Very high10 Ų1043.1 Ų43.14%0.03824%0.235CC..Hα-helixtrans-75.3-28.7179.4-65.2-177.6-176.7121-1113.4I212 D215 Y216 E367 I368 P369 V374 T423 A427I212-R371 HydrophobicContact CG2-CB 4.44Å; D215-R371 VanDerWaalsContact C-NH1 3.29Å; D215-R371 VanDerWaalsContact CB-CZ 3.44Å; D215-R371 VanDerWaalsContact CB-NE 3.32Å; D215-R371 PolarHBondContact O-NH1 3.4Å; D215-R371 WeakPolarHBondContact OD2-CD 3.12Å; D215-R371 IonicContact OD2-CZ 2.78Å; D215-R371 IonicContact OD2-NE 3.16Å; D215-R371 PolarHBondContact OD2-NE 3.43Å; Y216-R371 HydrophobicContact CE1-CB 4.07Å; E367-R371 WeakPolarHBondContact O-CB 3.38Å; E367-R371 VanDerWaalsContact O-CG 3.31Å; E367-R371 WeakPolarHBondContact O-CG 3.19Å; E367-R371 PolarHBondContact O-N 3.4Å; E367-R371 IonicContact OE1-NH2 2.73Å; E367-R371 IonicContact OE2-CZ 3.03Å; E367-R371 IonicContact OE2-NH1 2.71Å; E367-R371 PolarHBondContact OE2-NH1 2.63Å; E367-R371 IonicContact OE2-NH2 2.7Å; E367-R371 PolarHBondContact OE2-NH2 3.17Å; I368-R371 PolarHBondContact O-N 3.35Å; P369-R371 PolarHBondContact O-N 2.93Å; R371-V374 PolarHBondContact O-N 3.29Å; R371-T423 HydrophobicContact CG-CG2 4.36Å; R371-A427 HydrophobicContact CG-CB 4.31Å
372S91.7Very high89.9Confident42 Ų4240.8 Ų40.829%0.29422%0.224SC..Hα-helixtrans-67.3-41.3174.4-53.70000111.5Y216 I368 P369 V374 L375Y216-S372 PolarHBondContact OH-OG 3.07Å; I368-S372 WeakPolarHBondContact O-CB 3.35Å; I368-S372 PolarHBondContact O-N 3.15Å; I368-S372 PolarHBondContact O-OG 2.93Å; P369-S372 PolarHBondContact O-N 2.84Å; S372-V374 VanDerWaalsContact C-N 3.29Å; S372-V374 PolarHBondContact O-N 3.34Å; S372-L375 WeakPolarHBondContact O-CB 3.4Å; S372-L375 PolarHBondContact O-N 3.05Å
373L91.6Very high89.9Confident66 Ų6643.7 Ų43.735%0.34623%0.232SC..Hα-helixtrans-61.8-39.2176.4-177.362.5000111.3P369 L375 V376 V377 F389 F420P369-L373 WeakPolarHBondContact O-CB 3.48Å; P369-L373 PolarHBondContact O-N 3.49Å; L373-L375 PolarHBondContact O-N 3.21Å; L373-V376 WeakPolarHBondContact O-CB 3.42Å; L373-V376 PolarHBondContact O-N 3.35Å; L373-V377 HydrophobicContact CD1-CG2 3.92Å; L373-V377 HydrophobicContact CG-CG2 3.95Å; L373-V377 WeakPolarHBondContact O-CG2 3.46Å; L373-V377 PolarHBondContact O-N 3.38Å; L373-F389 HydrophobicContact CD2-CE1 3.85Å; L373-F389 HydrophobicContact CD2-CZ 3.99Å; L373-F389 HydrophobicContact CG-CZ 4.23Å; L373-F420 HydrophobicContact CB-CZ 4.5Å; L373-F420 HydrophobicContact CD2-CE1 4.04Å; L373-F420 HydrophobicContact CD2-CZ 3.65Å
374V87.9Confident89.8Confident2 Ų248.5 Ų48.51%0.01226%0.257CS..Hα-helixtrans-56.3-37.5177.91690000112.2A370 R371 S372 V376 V377 L378 F389 A424 A427 V428A370-V374 WeakPolarHBondContact O-CG2 3.4Å; A370-V374 PolarHBondContact O-N 3.04Å; R371-V374 PolarHBondContact O-N 3.29Å; S372-V374 VanDerWaalsContact C-N 3.29Å; S372-V374 PolarHBondContact O-N 3.34Å; V374-V376 PolarHBondContact O-N 2.91Å; V374-V377 PolarHBondContact O-N 3.23Å; V374-L378 HydrophobicContact CG1-CD1 3.53Å; V374-L378 HydrophobicContact CG1-CD2 4.44Å; V374-L378 HydrophobicContact CG1-CG 3.74Å; V374-L378 VanDerWaalsContact O-CB 3.31Å; V374-L378 WeakPolarHBondContact O-CB 3.42Å; V374-L378 WeakPolarHBondContact O-CG 3.46Å; V374-L378 PolarHBondContact O-N 3.11Å; V374-F389 HydrophobicContact CG2-CE2 3.98Å; V374-F389 HydrophobicContact CG2-CZ 4.4Å; V374-A424 HydrophobicContact CG2-CB 3.8Å; V374-A424 WeakPolarHBondContact CG2-O 3.38Å; V374-A427 HydrophobicContact CB-CB 4.46Å; V374-A427 HydrophobicContact CG1-CB 4.11Å; V374-A427 HydrophobicContact CG2-CB 4.22Å; V374-V428 HydrophobicContact CB-CG2 4.39Å; V374-V428 HydrophobicContact CG1-CG2 3.67Å; V374-V428 HydrophobicContact CG2-CG2 3.87Å
375L86.3Confident89.9Confident57 Ų5748.8 Ų48.830%0.29826%0.259SS..Hα-helixtrans-60.3-32.9175.4-73.2173.4000113.5M208 I212 S372 L373 P379M208-L375 HydrophobicContact CG-CD2 4.33Å; M208-L375 HydrophobicContact SD-CD2 3.69Å; I212-L375 HydrophobicContact CD1-CD1 3.93Å; I212-L375 HydrophobicContact CD1-CD2 3.19Å; I212-L375 HydrophobicContact CD1-CG 3.49Å; I212-L375 VanDerWaalsContact CD1-CG 3.49Å; I212-L375 HydrophobicContact CG2-CD1 4.46Å; S372-L375 WeakPolarHBondContact O-CB 3.4Å; S372-L375 PolarHBondContact O-N 3.05Å; L373-L375 PolarHBondContact O-N 3.21Å; L375-P379 WeakPolarHBondContact O-CD 3.32Å
376V87.4Confident89.9Confident90 Ų9045 Ų4555%0.54524%0.239SC..Hα-helixtrans-83.1-35.9-178.1-177.90000111L373 V374 P379 F380L373-V376 WeakPolarHBondContact O-CB 3.42Å; L373-V376 PolarHBondContact O-N 3.35Å; V374-V376 PolarHBondContact O-N 2.91Å; V376-P379 WeakPolarHBondContact O-CD 3.11Å; V376-F380 WeakPolarHBondContact O-CD2 3.49Å; V376-F380 WeakPolarHBondContact O-CE2 3.28Å
377V87.5Confident90Very high45 Ų4544.9 Ų44.927%0.27324%0.239SC..Hα-helixtrans-87-28.9-174.5-165.60000112.6L373 V374 P379 F380 S385 F389L373-V377 HydrophobicContact CD1-CG2 3.92Å; L373-V377 HydrophobicContact CG-CG2 3.95Å; L373-V377 WeakPolarHBondContact O-CG2 3.46Å; L373-V377 PolarHBondContact O-N 3.38Å; V374-V377 PolarHBondContact O-N 3.23Å; V377-P379 VanDerWaalsContact C-CD 3.44Å; V377-F380 PolarHBondContact O-N 2.7Å; V377-F380 VanDerWaalsContact O-N 3.07Å; V377-S385 WeakPolarHBondContact CG1-OG 3.33Å; V377-F389 HydrophobicContact CG2-CZ 4.38Å
378L83.8Confident90.1Very high7 Ų746.3 Ų46.34%0.03725%0.254CS..THydrogen-bonded Turntrans-53.9-39.6-179.7-82.3173.5000115.4M208 V374 F380 R382 V428 V431M208-L378 HydrophobicContact CE-CD1 3.98Å; M208-L378 HydrophobicContact SD-CD1 3.87Å; V374-L378 HydrophobicContact CG1-CD1 3.53Å; V374-L378 HydrophobicContact CG1-CD2 4.44Å; V374-L378 HydrophobicContact CG1-CG 3.74Å; V374-L378 VanDerWaalsContact O-CB 3.31Å; V374-L378 WeakPolarHBondContact O-CB 3.42Å; V374-L378 WeakPolarHBondContact O-CG 3.46Å; V374-L378 PolarHBondContact O-N 3.11Å; L378-F380 VanDerWaalsContact C-N 3.27Å; L378-F380 PolarHBondContact O-N 3.42Å; L378-R382 HydrophobicContact CD2-CG 4.06Å; L378-V428 HydrophobicContact CD2-CB 4.49Å; L378-V428 HydrophobicContact CD2-CG1 4.05Å; L378-V428 HydrophobicContact CD2-CG2 4.18Å; L378-V431 HydrophobicContact CD1-CG2 4.32Å
379P83.2Confident90.3Very high80 Ų8044.5 Ų44.552%0.51924%0.244SC..THydrogen-bonded Turntrans-63-28.6177.1-23.934.8000114.1L375 V376 V377L375-P379 WeakPolarHBondContact O-CD 3.32Å; V376-P379 WeakPolarHBondContact O-CD 3.11Å; V377-P379 VanDerWaalsContact C-CD 3.44Å
380F84.4Confident90.4Very high167 Ų16741.5 Ų41.573%0.73222%0.224SC*.THydrogen-bonded Turntrans-82-49.5-174.4-64.7-80.8000112.7V376 V377 L378V376-F380 WeakPolarHBondContact O-CD2 3.49Å; V376-F380 WeakPolarHBondContact O-CE2 3.28Å; V377-F380 PolarHBondContact O-N 2.7Å; V377-F380 VanDerWaalsContact O-N 3.07Å; L378-F380 VanDerWaalsContact C-N 3.27Å; L378-F380 PolarHBondContact O-N 3.42Å
381S87.9Confident90.6Very high14 Ų1443 Ų4310%0.09824%0.237CC..  trans-165.1126.5178.2169.40000110L384 S385 E494S381-L384 VanDerWaalsContact OG-CB 3.31Å; S381-L384 WeakPolarHBondContact OG-CB 3.32Å; S381-L384 WeakPolarHBondContact OG-CG 3.42Å; S381-L384 PolarHBondContact OG-N 3.27Å; S381-S385 VanDerWaalsContact O-CB 3.22Å; S381-S385 WeakPolarHBondContact O-CB 3.37Å; S381-S385 PolarHBondContact O-N 2.99Å; S381-S385 PolarHBondContact O-OG 3.31Å; S381-E494 WeakPolarHBondContact CB-OE2 3.23Å; S381-E494 PolarHBondContact OG-OE2 2.85Å
382R88.4Confident90.9Very high34 Ų3446.1 Ų46.113%0.12825%0.254CS..Hα-helixtrans-84.5-34.1178.5-63.5156.2-164.2-11437.3110.7L378 Q386 V431 Y432 E435 E494 T495L378-R382 HydrophobicContact CD2-CG 4.06Å; R382-Q386 WeakPolarHBondContact O-CB 3.09Å; R382-Q386 PolarHBondContact O-N 3.26Å; R382-V431 VanDerWaalsContact NH1-CG1 3.25Å; R382-Y432 HydrophobicContact CB-CD2 4.12Å; R382-Y432 HydrophobicContact CB-CE2 4.32Å; R382-E435 WeakPolarHBondContact CD-OE2 3.29Å; R382-E435 IonicContact CZ-OE1 3.88Å; R382-E435 IonicContact CZ-OE2 4Å; R382-E435 IonicContact NE-OE2 3.26Å; R382-E435 PolarHBondContact NE-OE2 2.95Å; R382-E435 IonicContact NH1-OE1 3.82Å; R382-E435 PolarHBondContact NH1-OE1 3.11Å; R382-E435 IonicContact NH1-OE2 3.67Å; R382-E435 PolarHBondContact NH1-OE2 3.45Å; R382-E435 VanDerWaalsContact NH2-CD 3.25Å; R382-E435 IonicContact NH2-OE1 2.7Å; R382-E435 PolarHBondContact NH2-OE1 3.27Å; R382-E435 IonicContact NH2-OE2 2.9Å; R382-E435 PolarHBondContact NH2-OE2 2.9Å; R382-E435 VanDerWaalsContact NH2-OE2 3.07Å; R382-E494 PolarHBondContact N-OE1 3.48Å; R382-E494 PolarHBondContact N-OE2 2.91Å; R382-T495 WeakPolarHBondContact CD-OG1 3.47Å
383R91.6Very high91.1Very high91 Ų9144.1 Ų44.134%0.34324%0.24SC..Hα-helixtrans-63.8-52.1176.2-175.2-179.367.4172.4-1.3111.8Q386 S387 L492 E494R383-Q386 PolarHBondContact O-N 3.46Å; R383-S387 PolarHBondContact O-N 2.97Å; R383-S387 VanDerWaalsContact O-N 3.09Å; R383-L492 WeakPolarHBondContact CD-O 3.24Å; R383-E494 VanDerWaalsContact CB-OE2 3.29Å; R383-E494 WeakPolarHBondContact CB-OE2 3.02Å; R383-E494 PolarHBondContact N-OE2 3.01Å
384L92Very high91.3Very high100 Ų10041 Ų4152%0.52422%0.223SC..Hα-helixtrans-70.4-36.5-179-64.2176.2000111.6S381 Q386 S387 G388 L490S381-L384 VanDerWaalsContact OG-CB 3.31Å; S381-L384 WeakPolarHBondContact OG-CB 3.32Å; S381-L384 WeakPolarHBondContact OG-CG 3.42Å; S381-L384 PolarHBondContact OG-N 3.27Å; L384-Q386 PolarHBondContact O-N 3.03Å; L384-S387 PolarHBondContact O-N 3.19Å; L384-G388 PolarHBondContact O-N 3.44Å; L384-L490 HydrophobicContact CD2-CD2 4.1Å
385S93.2Very high91.7Very high6 Ų645.4 Ų45.44%0.04225%0.246CC..Hα-helixtrans-57-50.4172.5-66.90000111.7V377 S381 S387 G388 F389V377-S385 WeakPolarHBondContact CG1-OG 3.33Å; S381-S385 VanDerWaalsContact O-CB 3.22Å; S381-S385 WeakPolarHBondContact O-CB 3.37Å; S381-S385 PolarHBondContact O-N 2.99Å; S381-S385 PolarHBondContact O-OG 3.31Å; S385-S387 PolarHBondContact O-N 3.37Å; S385-G388 PolarHBondContact O-N 2.95Å; S385-F389 WeakPolarHBondContact O-CB 3.08Å; S385-F389 WeakPolarHBondContact O-CD2 3.36Å; S385-F389 WeakPolarHBondContact O-CG 3.31Å; S385-F389 PolarHBondContact O-N 2.62Å
386Q94.6Very high92.1Very high0 Ų042.9 Ų42.90%023%0.233CC..Hα-helixtrans-62.1-46.4-178.5-17361.936.700111.5I334 R382 R383 L384 L390 S425 V428 Y432 A489I334-Q386 VanDerWaalsContact CG2-NE2 3.35Å; R382-Q386 WeakPolarHBondContact O-CB 3.09Å; R382-Q386 PolarHBondContact O-N 3.26Å; R383-Q386 PolarHBondContact O-N 3.46Å; L384-Q386 PolarHBondContact O-N 3.03Å; Q386-L390 HydrophobicContact CG-CD1 4.34Å; Q386-L390 WeakPolarHBondContact O-CB 3.49Å; Q386-L390 WeakPolarHBondContact O-CG 3.45Å; Q386-L390 PolarHBondContact O-N 3.03Å; Q386-S425 PolarHBondContact NE2-OG 3.38Å; Q386-S425 PolarHBondContact OE1-O 3.43Å; Q386-V428 HydrophobicContact CB-CG1 4.04Å; Q386-V428 VanDerWaalsContact OE1-CB 3.25Å; Q386-Y432 HydrophobicContact CB-CD1 4.19Å; Q386-Y432 HydrophobicContact CB-CE1 4.33Å; Q386-Y432 HydrophobicContact CG-CD1 4.23Å; Q386-A489 HydrophobicContact CB-CB 4.48Å; Q386-A489 HydrophobicContact CG-CB 4.07Å
387S95.9Very high92.3Very high15 Ų1538.6 Ų38.611%0.10521%0.207CC..Hα-helixtrans-65-46.4177.9-1790000112R383 L384 S385 L390 A391 A486R383-S387 PolarHBondContact O-N 2.97Å; R383-S387 VanDerWaalsContact O-N 3.09Å; L384-S387 PolarHBondContact O-N 3.19Å; S385-S387 PolarHBondContact O-N 3.37Å; S387-L390 PolarHBondContact O-N 3.14Å; S387-A391 WeakPolarHBondContact O-CB 3.44Å; S387-A391 PolarHBondContact O-N 2.94Å; S387-A486 WeakPolarHBondContact O-CB 3.37Å; S387-A486 PolarHBondContact OG-O 2.78Å; S387-A486 VanDerWaalsContact OG-O 3.11Å
388G95.5Very high92.6Very high30 Ų3038.8 Ų38.831%0.30921%0.207SC..Hα-helixtrans-62.8-46.7-17700000112.4L384 S385 A391 I392L384-G388 PolarHBondContact O-N 3.44Å; S385-G388 PolarHBondContact O-N 2.95Å; G388-A391 PolarHBondContact O-N 3.4Å; G388-I392 VanDerWaalsContact O-CG1 3.27Å; G388-I392 WeakPolarHBondContact O-CG1 3.18Å; G388-I392 PolarHBondContact O-N 3.06Å
389F96.3Very high93.1Very high14 Ų1442.5 Ų42.56%0.06123%0.226CC..Hα-helixtrans-67-37.7179-70.3-47.5000113.2L373 V374 V377 S385 I392 G393 F420 G421 A424 V428L373-F389 HydrophobicContact CD2-CE1 3.85Å; L373-F389 HydrophobicContact CD2-CZ 3.99Å; L373-F389 HydrophobicContact CG-CZ 4.23Å; V374-F389 HydrophobicContact CG2-CE2 3.98Å; V374-F389 HydrophobicContact CG2-CZ 4.4Å; V377-F389 HydrophobicContact CG2-CZ 4.38Å; S385-F389 WeakPolarHBondContact O-CB 3.08Å; S385-F389 WeakPolarHBondContact O-CD2 3.36Å; S385-F389 WeakPolarHBondContact O-CG 3.31Å; S385-F389 PolarHBondContact O-N 2.62Å; F389-I392 HydrophobicContact CD1-CD1 4.42Å; F389-G393 PolarHBondContact O-N 2.89Å; F389-F420 HydrophobicContact CE1-CE1 4.49Å; F389-G421 WeakPolarHBondContact CB-O 3.33Å; F389-G421 CarbonylContact O-C 3.43Å; F389-A424 HydrophobicContact CB-CB 4.26Å; F389-A424 HydrophobicContact CD1-CB 3.61Å; F389-A424 HydrophobicContact CD2-CB 3.81Å; F389-A424 HydrophobicContact CE1-CB 3.82Å; F389-A424 HydrophobicContact CE2-CB 4.01Å; F389-A424 HydrophobicContact CG-CB 3.63Å; F389-A424 HydrophobicContact CZ-CB 4.01Å; F389-V428 HydrophobicContact CD2-CG2 4.02Å; F389-V428 HydrophobicContact CE2-CG2 4.09Å
390L96.4Very high93.4Very high1 Ų139 Ų391%0.00520%0.203CC..Hα-helixtrans-64.2-41.4171.8-77172.8000111.8I334 N338 Q386 S387 G393 G394 I422 S425 P482 A486I334-L390 HydrophobicContact CG1-CD1 4.35Å; I334-L390 HydrophobicContact CG2-CD1 4.05Å; N338-L390 WeakPolarHBondContact OD1-CD2 3.26Å; Q386-L390 HydrophobicContact CG-CD1 4.34Å; Q386-L390 WeakPolarHBondContact O-CB 3.49Å; Q386-L390 WeakPolarHBondContact O-CG 3.45Å; Q386-L390 PolarHBondContact O-N 3.03Å; S387-L390 PolarHBondContact O-N 3.14Å; L390-G393 PolarHBondContact O-N 2.83Å; L390-G394 PolarHBondContact O-N 2.91Å; L390-I422 HydrophobicContact CD2-CD1 4.25Å; L390-S425 VanDerWaalsContact CD2-OG 3.3Å; L390-S425 WeakPolarHBondContact CD2-OG 3.06Å; L390-S425 WeakPolarHBondContact CG-OG 3.47Å; L390-P482 HydrophobicContact CD2-CB 4.05Å; L390-A486 HydrophobicContact CB-CB 3.88Å
391A97.2Very high93.6Very high32 Ų3234 Ų3426%0.26418%0.183SC..Hα-helixtrans-65.1-44.5178.200000112S387 G388 G393 G394 L395 L483 A486S387-A391 WeakPolarHBondContact O-CB 3.44Å; S387-A391 PolarHBondContact O-N 2.94Å; G388-A391 PolarHBondContact O-N 3.4Å; A391-G393 VanDerWaalsContact C-N 3.34Å; A391-G393 PolarHBondContact O-N 3.49Å; A391-G394 PolarHBondContact O-N 3.18Å; A391-L395 WeakPolarHBondContact O-CB 3.29Å; A391-L395 PolarHBondContact O-N 3.24Å; A391-L483 HydrophobicContact CB-CD2 4.4Å; A391-A486 HydrophobicContact CB-CB 4.07Å
392I96.6Very high93.6Very high76 Ų7637.1 Ų37.139%0.3921%0.21SC..Hα-helixtrans-58.7-47.4174.2-68.4163.7000110.2G388 F389 G394 A396 V417G388-I392 VanDerWaalsContact O-CG1 3.27Å; G388-I392 WeakPolarHBondContact O-CG1 3.18Å; G388-I392 PolarHBondContact O-N 3.06Å; F389-I392 HydrophobicContact CD1-CD1 4.42Å; I392-G394 PolarHBondContact O-N 3.28Å; I392-A396 VanDerWaalsContact O-CB 3.23Å; I392-A396 WeakPolarHBondContact O-CB 3.23Å; I392-A396 PolarHBondContact O-N 3.31Å; I392-V417 HydrophobicContact CG2-CG1 3.84Å
393G94.9Very high93.5Very high0 Ų037.1 Ų37.10%021%0.214CC..Hα-helixtrans-59.2-47.3178.600000113F389 L390 A391 C397F389-G393 PolarHBondContact O-N 2.89Å; L390-G393 PolarHBondContact O-N 2.83Å; A391-G393 VanDerWaalsContact C-N 3.34Å; A391-G393 PolarHBondContact O-N 3.49Å; G393-C397 PolarHBondContact O-N 3.42Å; G393-C397 PolarHBondContact O-SG 2.91Å
394G95.5Very high92.9Very high0 Ų036.4 Ų36.40%022%0.221CC..Hα-helixtrans-71.6-44.2-178.400000114.2L390 A391 I392 A396 C397 L398 G479 P482L390-G394 PolarHBondContact O-N 2.91Å; A391-G394 PolarHBondContact O-N 3.18Å; I392-G394 PolarHBondContact O-N 3.28Å; G394-A396 VanDerWaalsContact C-N 3.33Å; G394-A396 PolarHBondContact O-N 3.35Å; G394-C397 PolarHBondContact O-N 3.45Å; G394-C397 VanDerWaalsContact O-N 3.15Å; G394-L398 PolarHBondContact O-N 3.41Å; G394-G479 WeakPolarHBondContact CA-O 3.32Å; G394-G479 WeakPolarHBondContact O-CA 3.24Å; G394-P482 VanDerWaalsContact CA-CG 3.41Å
395L96.4Very high91.9Very high95 Ų9536.2 Ų36.250%0.49723%0.234SC..Hα-helixtrans-64.1-41.2178-173.863.8000110.8A391 C397 L398 L399A391-L395 WeakPolarHBondContact O-CB 3.29Å; A391-L395 PolarHBondContact O-N 3.24Å; L395-C397 VanDerWaalsContact C-N 3.3Å; L395-C397 PolarHBondContact O-N 3.45Å; L395-L398 PolarHBondContact O-N 3.25Å; L395-L399 HydrophobicContact CD1-CG 4.46Å; L395-L399 HydrophobicContact CG-CD1 4.1Å; L395-L399 HydrophobicContact CG-CG 4.32Å; L395-L399 WeakPolarHBondContact O-CB 3.41Å; L395-L399 VanDerWaalsContact O-CG 3.28Å; L395-L399 WeakPolarHBondContact O-CG 3.47Å; L395-L399 PolarHBondContact O-N 3.2Å
396A95.2Very high91.1Very high3 Ų342.3 Ų42.33%0.02527%0.266CS..Hα-helixtrans-58.3-43.6172.900000111.5I392 G394 L398 L399 M400 L414 V417I392-A396 VanDerWaalsContact O-CB 3.23Å; I392-A396 WeakPolarHBondContact O-CB 3.23Å; I392-A396 PolarHBondContact O-N 3.31Å; G394-A396 VanDerWaalsContact C-N 3.33Å; G394-A396 PolarHBondContact O-N 3.35Å; A396-L398 PolarHBondContact O-N 3.42Å; A396-L399 PolarHBondContact O-N 3.49Å; A396-M400 WeakPolarHBondContact O-CG 2.97Å; A396-M400 PolarHBondContact O-N 3.15Å; A396-L414 HydrophobicContact CB-CD1 3.83Å; A396-L414 HydrophobicContact CB-CG 4.24Å; A396-L414 WeakPolarHBondContact O-CD2 3.16Å; A396-L414 VanDerWaalsContact O-CG 3.24Å; A396-L414 WeakPolarHBondContact O-CG 3.41Å; A396-V417 HydrophobicContact CB-CB 4.17Å; A396-V417 HydrophobicContact CB-CG1 3.94Å
397C92.7Very high90.6Very high0 Ų047.6 Ų47.60%029%0.29CS..Hα-helixtrans-64.6-36177.4-64.90000113.9G393 G394 L395 M400 F478G393-C397 PolarHBondContact O-N 3.42Å; G393-C397 PolarHBondContact O-SG 2.91Å; G394-C397 PolarHBondContact O-N 3.45Å; G394-C397 VanDerWaalsContact O-N 3.15Å; L395-C397 VanDerWaalsContact C-N 3.3Å; L395-C397 PolarHBondContact O-N 3.45Å; C397-M400 HydrophobicContact CB-CE 4.03Å; C397-M400 WeakPolarHBondContact O-CB 3.47Å; C397-F478 HydrophobicContact CB-CB 4.44Å
398L93.8Very high90Very high49 Ų4948.9 Ų48.926%0.25730%0.298SS..Hα-helixtrans-73.3-39175-69.5-174.9000112.6G394 L395 A396 M400 L401 T480 L483G394-L398 PolarHBondContact O-N 3.41Å; L395-L398 PolarHBondContact O-N 3.25Å; A396-L398 PolarHBondContact O-N 3.42Å; L398-M400 PolarHBondContact O-N 2.95Å; L398-L401 HydrophobicContact CD2-CD1 4.29Å; L398-L401 VanDerWaalsContact O-CB 3.25Å; L398-L401 WeakPolarHBondContact O-CB 3.41Å; L398-L401 PolarHBondContact O-N 3.35Å; L398-T480 HydrophobicContact CD2-CG2 4.28Å; L398-L483 HydrophobicContact CD1-CD1 3.45Å; L398-L483 VanDerWaalsContact CD1-CD1 3.45Å; L398-L483 HydrophobicContact CG-CD1 4.34Å
399L93.5Very high89.7Confident85 Ų8553.5 Ų53.545%0.44532%0.316SS..Hα-helixtrans-61.1-25.3176.8-76174.7000111.5L395 A396 L401 A402 L414L395-L399 HydrophobicContact CD1-CG 4.46Å; L395-L399 HydrophobicContact CG-CD1 4.1Å; L395-L399 HydrophobicContact CG-CG 4.32Å; L395-L399 WeakPolarHBondContact O-CB 3.41Å; L395-L399 VanDerWaalsContact O-CG 3.28Å; L395-L399 WeakPolarHBondContact O-CG 3.47Å; L395-L399 PolarHBondContact O-N 3.2Å; A396-L399 PolarHBondContact O-N 3.49Å; L399-L401 PolarHBondContact O-N 3.3Å; L399-A402 WeakPolarHBondContact O-CB 3.31Å; L399-A402 PolarHBondContact O-N 2.96Å; L399-L414 HydrophobicContact CB-CD1 4.14Å; L399-L414 HydrophobicContact CB-CD2 3.43Å; L399-L414 VanDerWaalsContact CB-CD2 3.43Å; L399-L414 HydrophobicContact CB-CG 4.31Å; L399-L414 HydrophobicContact CD1-CD1 4.34Å
400M89.8Confident89.3Confident6 Ų656.7 Ų56.73%0.0334%0.337CS..THydrogen-bonded Turntrans-61.4-25.9174.9-72.8-165.7-83.500112L345 L352 A396 C397 L398 A402 L411 L414 A415 L475L345-M400 HydrophobicContact CD2-CE 3.84Å; L352-M400 HydrophobicContact CD2-SD 4.47Å; A396-M400 WeakPolarHBondContact O-CG 2.97Å; A396-M400 PolarHBondContact O-N 3.15Å; C397-M400 HydrophobicContact CB-CE 4.03Å; C397-M400 WeakPolarHBondContact O-CB 3.47Å; L398-M400 PolarHBondContact O-N 2.95Å; M400-A402 VanDerWaalsContact C-N 3.33Å; M400-L411 HydrophobicContact CB-CD1 3.67Å; M400-L411 HydrophobicContact CG-CD1 3.74Å; M400-L411 HydrophobicContact SD-CD1 3.87Å; M400-L414 HydrophobicContact CB-CD2 4.17Å; M400-L414 HydrophobicContact CG-CB 4.01Å; M400-L414 HydrophobicContact CG-CD2 3.56Å; M400-L414 HydrophobicContact CG-CG 3.78Å; M400-A415 HydrophobicContact CE-CB 4.46Å; M400-A415 HydrophobicContact SD-CB 3.82Å; M400-L475 HydrophobicContact CB-CD1 4.35Å; M400-L475 HydrophobicContact CB-CD2 4.4Å; M400-L475 HydrophobicContact CE-CD2 3.6Å; M400-L475 HydrophobicContact SD-CD2 4.26Å
401L88.9Confident89Confident63 Ų6358.5 Ų58.533%0.3335%0.346SS..THydrogen-bonded Turntrans-73.1-25.6176-62.9174.1000113.2L398 L399 V403 V472 L475 I476L398-L401 HydrophobicContact CD2-CD1 4.29Å; L398-L401 VanDerWaalsContact O-CB 3.25Å; L398-L401 WeakPolarHBondContact O-CB 3.41Å; L398-L401 PolarHBondContact O-N 3.35Å; L399-L401 PolarHBondContact O-N 3.3Å; L401-V403 VanDerWaalsContact C-N 3.33Å; L401-V472 HydrophobicContact CD1-CG1 4.13Å; L401-V472 HydrophobicContact CD2-CB 4.24Å; L401-V472 HydrophobicContact CD2-CG1 3.63Å; L401-V472 HydrophobicContact CG-CG1 4.5Å; L401-L475 HydrophobicContact CD1-CB 4.47Å; L401-L475 HydrophobicContact CD2-CB 3.62Å; L401-L475 HydrophobicContact CD2-CD1 3.62Å; L401-L475 HydrophobicContact CD2-CG 4.26Å; L401-L475 HydrophobicContact CG-CB 4.04Å; L401-L475 HydrophobicContact CG-CD1 4.42Å; L401-I476 HydrophobicContact CD1-CG1 3.68Å
402A88.2Confident88.6Confident79 Ų7957.1 Ų57.165%0.65333%0.334SS*.THydrogen-bonded Turntrans-83.8-13-179.800000112.5L399 M400L399-A402 WeakPolarHBondContact O-CB 3.31Å; L399-A402 PolarHBondContact O-N 2.96Å; M400-A402 VanDerWaalsContact C-N 3.33Å
403V86.3Confident88.4Confident35 Ų3555 Ų5521%0.21233%0.331CS..SBendtrans-87.5121-178.7-178.70000109.2L401 H407 V410 L414L401-V403 VanDerWaalsContact C-N 3.33Å; V403-H407 HydrophobicContact CG1-CB 4.43Å; V403-V410 HydrophobicContact CG1-CB 4.19Å; V403-V410 HydrophobicContact CG1-CG1 4.1Å; V403-V410 HydrophobicContact CG2-CG1 4.04Å; V403-L414 HydrophobicContact CG2-CD2 4.43Å
404P77.4Confident88.2Confident75 Ų7556.3 Ų56.349%0.48734%0.338SS..  trans-65.5153.4174.325.2-31000111.5D406 H407P404-D406 PolarHBondContact O-N 3.17Å; P404-H407 PolarHBondContact O-N 2.68Å
405A71.1Confident88.1Confident96 Ų9656.3 Ų56.379%0.79334%0.338SS*.THydrogen-bonded Turntrans-60.5-16.1-174.300000114.4H407A405-H407 PolarHBondContact O-N 3.43Å
406D76.8Confident87.9Confident135 Ų13554.1 Ų54.172%0.72233%0.326SS*.THydrogen-bonded Turntrans-74.6-6.8-175.6-54.4-39.9000114P404 P408P404-D406 PolarHBondContact O-N 3.17Å; D406-P408 WeakPolarHBondContact O-CD 3.46Å
407H84.8Confident87.9Confident110 Ų11057.2 Ų57.251%0.50934%0.344SS..  trans-125.569.7-177.9-63.6-42.5000113.2V403 P404 A405 N409 V410 L411V403-H407 HydrophobicContact CG1-CB 4.43Å; P404-H407 PolarHBondContact O-N 2.68Å; A405-H407 PolarHBondContact O-N 3.43Å; H407-N409 PolarHBondContact O-N 3.38Å; H407-V410 HydrophobicContact CB-CB 4.23Å; H407-V410 HydrophobicContact CB-CG2 4.05Å; H407-V410 PolarHBondContact O-N 3.38Å; H407-V410 VanDerWaalsContact O-N 3.11Å; H407-L411 PolarHBondContact O-N 3.05Å
408P83.4Confident88Confident42 Ų4257.2 Ų57.227%0.27334%0.344SS..Hα-helixtrans-63-27.6-176.125.8-35.4000113.6T354 D406 L411 T412T354-P408 HydrophobicContact CG2-CB 4.29Å; D406-P408 WeakPolarHBondContact O-CD 3.46Å; P408-L411 PolarHBondContact O-N 2.98Å; P408-T412 WeakPolarHBondContact O-CB 3.27Å; P408-T412 PolarHBondContact O-N 2.86Å; P408-T412 PolarHBondContact O-OG1 3.45Å
409N87.9Confident88Confident127 Ų12754.9 Ų54.968%0.67933%0.332SS*.Hα-helixtrans-66.4-39.5176.1-67-18.3000112.2H407 G413H407-N409 PolarHBondContact O-N 3.38Å; N409-G413 PolarHBondContact O-N 2.74Å
410V89.4Confident88.2Confident82 Ų8253.3 Ų53.350%0.49732%0.321SS..Hα-helixtrans-69.8-43.4178.1179.80000109.8V403 H407 T412 G413 L414V403-V410 HydrophobicContact CG1-CB 4.19Å; V403-V410 HydrophobicContact CG1-CG1 4.1Å; V403-V410 HydrophobicContact CG2-CG1 4.04Å; H407-V410 HydrophobicContact CB-CB 4.23Å; H407-V410 HydrophobicContact CB-CG2 4.05Å; H407-V410 PolarHBondContact O-N 3.38Å; H407-V410 VanDerWaalsContact O-N 3.11Å; V410-T412 VanDerWaalsContact C-N 3.34Å; V410-T412 PolarHBondContact O-N 3.45Å; V410-G413 PolarHBondContact O-N 3.18Å; V410-L414 WeakPolarHBondContact O-CB 3.49Å; V410-L414 PolarHBondContact O-N 3.3Å
411L88.6Confident88.4Confident38 Ų3853 Ų5320%0.19932%0.32CS..Hα-helixtrans-57.7-47.3174.9-177.766.7000111.5L352 M400 H407 P408 L414 A415L352-L411 HydrophobicContact CD2-CD2 4.22Å; L352-L411 HydrophobicContact CD2-CG 4.01Å; M400-L411 HydrophobicContact CB-CD1 3.67Å; M400-L411 HydrophobicContact CG-CD1 3.74Å; M400-L411 HydrophobicContact SD-CD1 3.87Å; H407-L411 PolarHBondContact O-N 3.05Å; P408-L411 PolarHBondContact O-N 2.98Å; L411-L414 PolarHBondContact O-N 3.26Å; L411-A415 PolarHBondContact O-N 2.96Å
412T89.3Confident88.8Confident4 Ų450 Ų503%0.02530%0.304CS..Hα-helixtrans-65.7-43.7178.8-53.80000111.4L352 T354 T359 P408 V410 L414 A415 M416L352-T412 PolarHBondContact O-OG1 3Å; T354-T412 HydrophobicContact CG2-CG2 4.45Å; T354-T412 WeakPolarHBondContact CG2-OG1 3.27Å; T354-T412 WeakPolarHBondContact OG1-CG2 3.43Å; T354-T412 PolarHBondContact OG1-OG1 2.83Å; T359-T412 HydrophobicContact CG2-CG2 3.6Å; P408-T412 WeakPolarHBondContact O-CB 3.27Å; P408-T412 PolarHBondContact O-N 2.86Å; P408-T412 PolarHBondContact O-OG1 3.45Å; V410-T412 VanDerWaalsContact C-N 3.34Å; V410-T412 PolarHBondContact O-N 3.45Å; T412-L414 VanDerWaalsContact C-N 3.26Å; T412-L414 PolarHBondContact O-N 3.4Å; T412-A415 WeakPolarHBondContact O-CB 3.45Å; T412-A415 PolarHBondContact O-N 3.46Å; T412-M416 HydrophobicContact CG2-CE 3.65Å; T412-M416 VanDerWaalsContact O-CG 3.29Å; T412-M416 WeakPolarHBondContact O-CG 3.2Å; T412-M416 PolarHBondContact O-N 3.4Å
413G91.8Very high89.1Confident31 Ų3146.3 Ų46.332%0.3227%0.274SS..Hα-helixtrans-59-38.9176.300000112.3N409 V410 M416 V417N409-G413 PolarHBondContact O-N 2.74Å; V410-G413 PolarHBondContact O-N 3.18Å; G413-M416 WeakPolarHBondContact O-CB 3.21Å; G413-M416 PolarHBondContact O-N 2.94Å; G413-V417 WeakPolarHBondContact O-CG2 3.23Å; G413-V417 PolarHBondContact O-N 3.45Å
414L92.5Very high89.5Confident27 Ų2744.6 Ų44.614%0.14126%0.263CS..Hα-helixtrans-72.2-36.9176.9-166.661.3000112.7A396 L399 M400 V403 V410 L411 T412 M416 V417 G418A396-L414 HydrophobicContact CB-CD1 3.83Å; A396-L414 HydrophobicContact CB-CG 4.24Å; A396-L414 WeakPolarHBondContact O-CD2 3.16Å; A396-L414 VanDerWaalsContact O-CG 3.24Å; A396-L414 WeakPolarHBondContact O-CG 3.41Å; L399-L414 HydrophobicContact CB-CD1 4.14Å; L399-L414 HydrophobicContact CB-CD2 3.43Å; L399-L414 VanDerWaalsContact CB-CD2 3.43Å; L399-L414 HydrophobicContact CB-CG 4.31Å; L399-L414 HydrophobicContact CD1-CD1 4.34Å; M400-L414 HydrophobicContact CB-CD2 4.17Å; M400-L414 HydrophobicContact CG-CB 4.01Å; M400-L414 HydrophobicContact CG-CD2 3.56Å; M400-L414 HydrophobicContact CG-CG 3.78Å; V403-L414 HydrophobicContact CG2-CD2 4.43Å; V410-L414 WeakPolarHBondContact O-CB 3.49Å; V410-L414 PolarHBondContact O-N 3.3Å; L411-L414 PolarHBondContact O-N 3.26Å; T412-L414 VanDerWaalsContact C-N 3.26Å; T412-L414 PolarHBondContact O-N 3.4Å; L414-M416 VanDerWaalsContact C-N 3.27Å; L414-M416 PolarHBondContact O-N 3.47Å; L414-V417 PolarHBondContact O-N 3.06Å; L414-G418 PolarHBondContact O-N 3.29Å
415A92.1Very high90.3Very high0 Ų041 Ų410%024%0.24CC..Hα-helixtrans-61.1-36.1169.500000111.9L352 F363 M400 L411 T412 G418 K419L352-A415 HydrophobicContact CD1-CB 3.73Å; L352-A415 HydrophobicContact CD2-CB 3.87Å; L352-A415 HydrophobicContact CG-CB 4.5Å; F363-A415 HydrophobicContact CZ-CB 4.3Å; M400-A415 HydrophobicContact CE-CB 4.46Å; M400-A415 HydrophobicContact SD-CB 3.82Å; L411-A415 PolarHBondContact O-N 2.96Å; T412-A415 WeakPolarHBondContact O-CB 3.45Å; T412-A415 PolarHBondContact O-N 3.46Å; A415-G418 PolarHBondContact O-N 3.42Å; A415-K419 WeakPolarHBondContact O-CB 3.49Å; A415-K419 PolarHBondContact O-N 2.91Å
416M93.1Very high91.3Very high50 Ų5038.5 Ų38.525%0.24621%0.211CC..Hα-helixtrans-65.7-41.8174-66172-176.100111.9V362 F363 T412 G413 L414 G418 K419 F420V362-M416 HydrophobicContact CB-CE 3.74Å; V362-M416 HydrophobicContact CB-SD 4.45Å; V362-M416 HydrophobicContact CG1-CE 3.46Å; V362-M416 VanDerWaalsContact CG1-CE 3.46Å; V362-M416 HydrophobicContact CG1-CG 4.16Å; V362-M416 HydrophobicContact CG1-SD 3.52Å; V362-M416 VanDerWaalsContact CG1-SD 3.52Å; V362-M416 HydrophobicContact CG2-CE 4.12Å; F363-M416 HydrophobicContact CD1-CG 4.25Å; F363-M416 HydrophobicContact CE1-CG 3.95Å; T412-M416 HydrophobicContact CG2-CE 3.65Å; T412-M416 VanDerWaalsContact O-CG 3.29Å; T412-M416 WeakPolarHBondContact O-CG 3.2Å; T412-M416 PolarHBondContact O-N 3.4Å; G413-M416 WeakPolarHBondContact O-CB 3.21Å; G413-M416 PolarHBondContact O-N 2.94Å; L414-M416 VanDerWaalsContact C-N 3.27Å; L414-M416 PolarHBondContact O-N 3.47Å; M416-G418 VanDerWaalsContact C-N 3.33Å; M416-K419 PolarHBondContact O-N 3.26Å; M416-F420 WeakPolarHBondContact O-CB 3.44Å; M416-F420 PolarHBondContact O-N 2.93Å
417V95.6Very high91.9Very high68 Ų6832.8 Ų32.841%0.41218%0.183SC..Hα-helixtrans-62.2-42.8173.4176.20000110.6I392 A396 G413 L414 F420 G421I392-V417 HydrophobicContact CG2-CG1 3.84Å; A396-V417 HydrophobicContact CB-CB 4.17Å; A396-V417 HydrophobicContact CB-CG1 3.94Å; G413-V417 WeakPolarHBondContact O-CG2 3.23Å; G413-V417 PolarHBondContact O-N 3.45Å; L414-V417 PolarHBondContact O-N 3.06Å; V417-F420 WeakPolarHBondContact O-CB 3.47Å; V417-F420 PolarHBondContact O-N 3.31Å; V417-G421 PolarHBondContact O-N 2.61Å
418G94.8Very high92.2Very high0 Ų027.5 Ų27.50%016%0.158CC..Hα-helixtrans-57.8-48.8173.700000112.2L414 A415 M416 F420 G421 I422L414-G418 PolarHBondContact O-N 3.29Å; A415-G418 PolarHBondContact O-N 3.42Å; M416-G418 VanDerWaalsContact C-N 3.33Å; G418-F420 VanDerWaalsContact C-N 3.35Å; G418-F420 PolarHBondContact O-N 2.84Å; G418-G421 PolarHBondContact O-N 3.07Å; G418-I422 WeakPolarHBondContact O-CG1 3.42Å; G418-I422 PolarHBondContact O-N 2.93Å
419K93.9Very high92.6Very high0 Ų025.5 Ų25.50%015%0.145CC..Hα-helixtrans-62.1-40.9177.7-17464.6178-179.80111.9Y342 S346 F363 V366 A415 M416 T423Y342-K419 PolarHBondContact O-NZ 3.49Å; S346-K419 WeakPolarHBondContact OG-CE 3.35Å; S346-K419 PolarHBondContact OG-NZ 2.9Å; F363-K419 HydrophobicContact CD1-CB 4.38Å; F363-K419 HydrophobicContact CD1-CG 4.21Å; F363-K419 HydrophobicContact CE1-CB 4.32Å; F363-K419 HydrophobicContact CG-CG 4.22Å; V366-K419 HydrophobicContact CG1-CG 4.46Å; A415-K419 WeakPolarHBondContact O-CB 3.49Å; A415-K419 PolarHBondContact O-N 2.91Å; M416-K419 PolarHBondContact O-N 3.26Å; K419-T423 VanDerWaalsContact O-CB 3.27Å; K419-T423 WeakPolarHBondContact O-CB 3.06Å; K419-T423 PolarHBondContact O-N 2.95Å; K419-T423 PolarHBondContact O-OG1 3.45Å
420F95.9Very high92.6Very high51 Ų5123.5 Ų23.522%0.22413%0.129CC..Hα-helixtrans-59.9-52.8175.7177.1-88.8000111.3V366 P369 A370 L373 F389 M416 V417 G418 I422 T423 A424V366-F420 HydrophobicContact CG1-CB 3.69Å; V366-F420 HydrophobicContact CG1-CD2 4.13Å; V366-F420 HydrophobicContact CG1-CG 4.42Å; P369-F420 HydrophobicContact CB-CE2 4.36Å; A370-F420 HydrophobicContact CB-CD2 3.67Å; A370-F420 HydrophobicContact CB-CE2 3.82Å; A370-F420 HydrophobicContact CB-CG 4.26Å; A370-F420 HydrophobicContact CB-CZ 4.5Å; L373-F420 HydrophobicContact CB-CZ 4.5Å; L373-F420 HydrophobicContact CD2-CE1 4.04Å; L373-F420 HydrophobicContact CD2-CZ 3.65Å; F389-F420 HydrophobicContact CE1-CE1 4.49Å; M416-F420 WeakPolarHBondContact O-CB 3.44Å; M416-F420 PolarHBondContact O-N 2.93Å; V417-F420 WeakPolarHBondContact O-CB 3.47Å; V417-F420 PolarHBondContact O-N 3.31Å; G418-F420 VanDerWaalsContact C-N 3.35Å; G418-F420 PolarHBondContact O-N 2.84Å; F420-I422 PolarHBondContact O-N 3.26Å; F420-T423 PolarHBondContact O-N 3.44Å; F420-A424 WeakPolarHBondContact O-CB 3.45Å; F420-A424 PolarHBondContact O-N 3.09Å
421G95.9Very high92.4Very high0 Ų021 Ų210%011%0.113CC..Hα-helixtrans-59.6-46.9-179.100000112.4F389 V417 G418 T423 A424 S425F389-G421 WeakPolarHBondContact CB-O 3.33Å; F389-G421 CarbonylContact O-C 3.43Å; V417-G421 PolarHBondContact O-N 2.61Å; G418-G421 PolarHBondContact O-N 3.07Å; G421-T423 PolarHBondContact O-N 3.49Å; G421-A424 PolarHBondContact O-N 3.02Å; G421-S425 WeakPolarHBondContact O-CB 3.48Å; G421-S425 PolarHBondContact O-N 3.43Å
422I95.7Very high92.4Very high0 Ų019.1 Ų19.10%010%0.104CC..Hα-helixtrans-67.2-37.7178.7-64.1-64.6000112N338 V341 L390 G418 F420 S425 F426 P482N338-I422 WeakPolarHBondContact O-CG2 3.39Å; V341-I422 HydrophobicContact CB-CD1 4Å; V341-I422 HydrophobicContact CB-CG1 4.03Å; V341-I422 HydrophobicContact CB-CG2 4.44Å; V341-I422 HydrophobicContact CG1-CD1 4Å; V341-I422 HydrophobicContact CG1-CG1 3.66Å; V341-I422 HydrophobicContact CG2-CD1 4.46Å; L390-I422 HydrophobicContact CD2-CD1 4.25Å; G418-I422 WeakPolarHBondContact O-CG1 3.42Å; G418-I422 PolarHBondContact O-N 2.93Å; F420-I422 PolarHBondContact O-N 3.26Å; I422-S425 PolarHBondContact O-N 3.49Å; I422-F426 WeakPolarHBondContact O-CB 3.22Å; I422-F426 PolarHBondContact O-N 3.01Å; I422-P482 HydrophobicContact CD1-CB 4.14Å
423T94.3Very high92.3Very high1 Ų119 Ų191%0.00610%0.103CC..Hα-helixtrans-66.5-41.1177.7-55.90000111.6E367 A370 R371 K419 F420 G421 F426 A427E367-T423 HydrophobicContact CB-CG2 4.21Å; E367-T423 HydrophobicContact CG-CG2 4.2Å; A370-T423 HydrophobicContact CB-CG2 4.08Å; R371-T423 HydrophobicContact CG-CG2 4.36Å; K419-T423 VanDerWaalsContact O-CB 3.27Å; K419-T423 WeakPolarHBondContact O-CB 3.06Å; K419-T423 PolarHBondContact O-N 2.95Å; K419-T423 PolarHBondContact O-OG1 3.45Å; F420-T423 PolarHBondContact O-N 3.44Å; G421-T423 PolarHBondContact O-N 3.49Å; T423-F426 PolarHBondContact O-N 2.55Å; T423-A427 PolarHBondContact O-N 3.01Å
424A94.4Very high91.9Very high0 Ų018.6 Ų18.60%010%0.097CC..Hα-helixtrans-64.3-46.5174.300000111.6A370 V374 F389 F420 G421 F426 A427 V428A370-A424 HydrophobicContact CB-CB 4.32Å; V374-A424 HydrophobicContact CG2-CB 3.8Å; V374-A424 WeakPolarHBondContact CG2-O 3.38Å; F389-A424 HydrophobicContact CB-CB 4.26Å; F389-A424 HydrophobicContact CD1-CB 3.61Å; F389-A424 HydrophobicContact CD2-CB 3.81Å; F389-A424 HydrophobicContact CE1-CB 3.82Å; F389-A424 HydrophobicContact CE2-CB 4.01Å; F389-A424 HydrophobicContact CG-CB 3.63Å; F389-A424 HydrophobicContact CZ-CB 4.01Å; F420-A424 WeakPolarHBondContact O-CB 3.45Å; F420-A424 PolarHBondContact O-N 3.09Å; G421-A424 PolarHBondContact O-N 3.02Å; A424-F426 VanDerWaalsContact C-N 3.28Å; A424-F426 PolarHBondContact O-N 3.21Å; A424-A427 PolarHBondContact O-N 2.9Å; A424-A427 VanDerWaalsContact O-N 3.13Å; A424-V428 WeakPolarHBondContact O-CG2 3.46Å; A424-V428 PolarHBondContact O-N 3.43Å; A424-V428 VanDerWaalsContact O-N 3.07Å
425S95.5Very high91.6Very high0 Ų018.7 Ų18.70%010%0.096CC..Hα-helixtrans-57.5-40174167.50000112.3N338 Q386 L390 G421 I422 A427 V428 I429N338-S425 VanDerWaalsContact CG-OG 3.29Å; N338-S425 PolarHBondContact ND2-OG 3.28Å; N338-S425 WeakPolarHBondContact OD1-CB 3.49Å; N338-S425 PolarHBondContact OD1-OG 3.29Å; Q386-S425 PolarHBondContact NE2-OG 3.38Å; Q386-S425 PolarHBondContact OE1-O 3.43Å; L390-S425 VanDerWaalsContact CD2-OG 3.3Å; L390-S425 WeakPolarHBondContact CD2-OG 3.06Å; L390-S425 WeakPolarHBondContact CG-OG 3.47Å; G421-S425 WeakPolarHBondContact O-CB 3.48Å; G421-S425 PolarHBondContact O-N 3.43Å; I422-S425 PolarHBondContact O-N 3.49Å; S425-A427 VanDerWaalsContact C-N 3.31Å; S425-A427 PolarHBondContact O-N 3Å; S425-V428 PolarHBondContact O-N 3.04Å; S425-I429 PolarHBondContact O-N 2.79Å
426F91.8Very high91.3Very high43 Ų4318.7 Ų18.719%0.18910%0.096CC..Hα-helixtrans-66-32.6178.3-164.1-126.1000112.4W335 N338 V339 I422 T423 A424 I429 Y430W335-F426 AromaticContact CE3-CE2 3.93Å; W335-F426 HydrophobicContact CE3-CE2 3.93Å; W335-F426 HydrophobicContact CZ3-CD2 4.41Å; W335-F426 AromaticContact CZ3-CE2 3.61Å; W335-F426 HydrophobicContact CZ3-CE2 3.61Å; W335-F426 HydrophobicContact CZ3-CZ 4.14Å; N338-F426 HydrophobicContact CB-CD2 3.81Å; V339-F426 HydrophobicContact CG2-CD2 4.38Å; V339-F426 HydrophobicContact CG2-CE2 3.53Å; V339-F426 HydrophobicContact CG2-CZ 3.88Å; I422-F426 WeakPolarHBondContact O-CB 3.22Å; I422-F426 PolarHBondContact O-N 3.01Å; T423-F426 PolarHBondContact O-N 2.55Å; A424-F426 VanDerWaalsContact C-N 3.28Å; A424-F426 PolarHBondContact O-N 3.21Å; F426-I429 HydrophobicContact CD2-CG2 4.21Å; F426-I429 VanDerWaalsContact O-CG2 3.3Å; F426-I429 WeakPolarHBondContact O-CG2 3.4Å; F426-Y430 HydrophobicContact CD1-CE2 4.26Å; F426-Y430 HydrophobicContact CD2-CE2 4.49Å; F426-Y430 AromaticContact CE1-CE2 3.84Å; F426-Y430 HydrophobicContact CE1-CE2 3.84Å; F426-Y430 HydrophobicContact CE2-CE2 4.1Å; F426-Y430 AromaticContact CZ-CE2 3.76Å; F426-Y430 HydrophobicContact CZ-CE2 3.76Å; F426-Y430 VanDerWaalsContact O-CD2 3.24Å; F426-Y430 WeakPolarHBondContact O-CD2 3.4Å
427A89.9Confident91Very high14 Ų1416.3 Ų16.312%0.1169%0.085CC..Hα-helixtrans-72.9-41.1173.400000112.5R371 V374 T423 A424 S425R371-A427 HydrophobicContact CG-CB 4.31Å; V374-A427 HydrophobicContact CB-CB 4.46Å; V374-A427 HydrophobicContact CG1-CB 4.11Å; V374-A427 HydrophobicContact CG2-CB 4.22Å; T423-A427 PolarHBondContact O-N 3.01Å; A424-A427 PolarHBondContact O-N 2.9Å; A424-A427 VanDerWaalsContact O-N 3.13Å; S425-A427 VanDerWaalsContact C-N 3.31Å; S425-A427 PolarHBondContact O-N 3Å
428V91.3Very high90.2Very high0 Ų013 Ų130%07%0.065CC..Hα-helixtrans-63.8-43178.9176.30000111.1V374 L378 Q386 F389 A424 S425 Y430 V431 Y432V374-V428 HydrophobicContact CB-CG2 4.39Å; V374-V428 HydrophobicContact CG1-CG2 3.67Å; V374-V428 HydrophobicContact CG2-CG2 3.87Å; L378-V428 HydrophobicContact CD2-CB 4.49Å; L378-V428 HydrophobicContact CD2-CG1 4.05Å; L378-V428 HydrophobicContact CD2-CG2 4.18Å; Q386-V428 HydrophobicContact CB-CG1 4.04Å; Q386-V428 VanDerWaalsContact OE1-CB 3.25Å; F389-V428 HydrophobicContact CD2-CG2 4.02Å; F389-V428 HydrophobicContact CE2-CG2 4.09Å; A424-V428 WeakPolarHBondContact O-CG2 3.46Å; A424-V428 PolarHBondContact O-N 3.43Å; A424-V428 VanDerWaalsContact O-N 3.07Å; S425-V428 PolarHBondContact O-N 3.04Å; V428-Y430 VanDerWaalsContact C-N 3.31Å; V428-Y430 PolarHBondContact O-N 3.06Å; V428-V431 PolarHBondContact O-N 3.42Å; V428-V431 VanDerWaalsContact O-N 3.11Å; V428-Y432 WeakPolarHBondContact O-CB 3.24Å; V428-Y432 PolarHBondContact O-N 3.1Å
429I91.9Very high89.2Confident0 Ų016.1 Ų16.10%08%0.084CC..Hα-helixtrans-63.8-32.2-175-16563.3000113.1L331 I334 W335 S425 F426 V431 Y432 T433L331-I429 HydrophobicContact CD2-CD1 3.63Å; I334-I429 HydrophobicContact CB-CD1 4.23Å; I334-I429 HydrophobicContact CG2-CD1 3.61Å; I334-I429 HydrophobicContact CG2-CG1 3.9Å; W335-I429 HydrophobicContact CD2-CG1 4.28Å; W335-I429 HydrophobicContact CD2-CG2 4.31Å; W335-I429 HydrophobicContact CE3-CG2 4.45Å; W335-I429 HydrophobicContact CG-CG1 4.29Å; W335-I429 HydrophobicContact CH2-CG2 4.17Å; W335-I429 HydrophobicContact CZ2-CG1 4.3Å; W335-I429 HydrophobicContact CZ2-CG2 4.03Å; W335-I429 HydrophobicContact CZ3-CG2 4.39Å; S425-I429 PolarHBondContact O-N 2.79Å; F426-I429 HydrophobicContact CD2-CG2 4.21Å; F426-I429 VanDerWaalsContact O-CG2 3.3Å; F426-I429 WeakPolarHBondContact O-CG2 3.4Å; I429-V431 VanDerWaalsContact C-N 3.34Å; I429-V431 PolarHBondContact O-N 2.97Å; I429-Y432 PolarHBondContact O-N 3.24Å; I429-T433 WeakPolarHBondContact O-CB 3.35Å; I429-T433 PolarHBondContact O-N 3.14Å; I429-T433 PolarHBondContact O-OG1 2.99Å
430Y86.3Confident88.2Confident84 Ų8419.2 Ų19.233%0.32910%0.103SC..Hα-helixtrans-60.1-44.6174.1-89.1-83.6000111.6W335 F426 V428 A434W335-Y430 AromaticContact CH2-CD1 3.53Å; W335-Y430 HydrophobicContact CH2-CD1 3.53Å; W335-Y430 AromaticContact CH2-CD2 3.6Å; W335-Y430 HydrophobicContact CH2-CD2 3.6Å; W335-Y430 AromaticContact CH2-CE1 3.42Å; W335-Y430 HydrophobicContact CH2-CE1 3.42Å; W335-Y430 VanDerWaalsContact CH2-CE1 3.42Å; W335-Y430 AromaticContact CH2-CE2 3.47Å; W335-Y430 HydrophobicContact CH2-CE2 3.47Å; W335-Y430 VanDerWaalsContact CH2-CE2 3.47Å; W335-Y430 AromaticContact CH2-CG 3.61Å; W335-Y430 HydrophobicContact CH2-CG 3.61Å; W335-Y430 AromaticContact CH2-CZ 3.36Å; W335-Y430 HydrophobicContact CZ2-CD1 4.19Å; W335-Y430 HydrophobicContact CZ2-CD2 4.48Å; W335-Y430 HydrophobicContact CZ2-CE1 4.41Å; W335-Y430 HydrophobicContact CZ2-CG 4.21Å; W335-Y430 HydrophobicContact CZ3-CD2 4.23Å; W335-Y430 HydrophobicContact CZ3-CE1 4.09Å; W335-Y430 AromaticContact CZ3-CE2 3.7Å; W335-Y430 HydrophobicContact CZ3-CE2 3.7Å; W335-Y430 AromaticContact CZ3-CZ 3.61Å; F426-Y430 HydrophobicContact CD1-CE2 4.26Å; F426-Y430 HydrophobicContact CD2-CE2 4.49Å; F426-Y430 AromaticContact CE1-CE2 3.84Å; F426-Y430 HydrophobicContact CE1-CE2 3.84Å; F426-Y430 HydrophobicContact CE2-CE2 4.1Å; F426-Y430 AromaticContact CZ-CE2 3.76Å; F426-Y430 HydrophobicContact CZ-CE2 3.76Å; F426-Y430 VanDerWaalsContact O-CD2 3.24Å; F426-Y430 WeakPolarHBondContact O-CD2 3.4Å; V428-Y430 VanDerWaalsContact C-N 3.31Å; V428-Y430 PolarHBondContact O-N 3.06Å; Y430-A434 PolarHBondContact O-N 3.45Å
431V85.9Confident87.3Confident29 Ų2916.8 Ų16.818%0.1769%0.092CC..Hα-helixtrans-70.7-50.1178.5-179.60000109.5M208 L378 R382 V428 I429 T433 A434 E435M208-V431 HydrophobicContact CE-CG1 4.35Å; M208-V431 HydrophobicContact CE-CG2 4.44Å; L378-V431 HydrophobicContact CD1-CG2 4.32Å; R382-V431 VanDerWaalsContact NH1-CG1 3.25Å; V428-V431 PolarHBondContact O-N 3.42Å; V428-V431 VanDerWaalsContact O-N 3.11Å; I429-V431 VanDerWaalsContact C-N 3.34Å; I429-V431 PolarHBondContact O-N 2.97Å; V431-T433 VanDerWaalsContact C-N 3.34Å; V431-T433 PolarHBondContact O-N 2.77Å; V431-A434 WeakPolarHBondContact O-CB 3.46Å; V431-A434 PolarHBondContact O-N 2.78Å; V431-A434 VanDerWaalsContact O-N 3.07Å; V431-E435 WeakPolarHBondContact O-CG 3.41Å; V431-E435 PolarHBondContact O-N 2.85Å
432Y88.7Confident86.5Confident0 Ų019.3 Ų19.30%010%0.101CC..Hα-helixtrans-62.9-40.3-173.7-166.9-158.7000112.5R382 Q386 V428 I429 A434 E435 I436 L492 P493 T495R382-Y432 HydrophobicContact CB-CD2 4.12Å; R382-Y432 HydrophobicContact CB-CE2 4.32Å; Q386-Y432 HydrophobicContact CB-CD1 4.19Å; Q386-Y432 HydrophobicContact CB-CE1 4.33Å; Q386-Y432 HydrophobicContact CG-CD1 4.23Å; V428-Y432 WeakPolarHBondContact O-CB 3.24Å; V428-Y432 PolarHBondContact O-N 3.1Å; I429-Y432 PolarHBondContact O-N 3.24Å; Y432-A434 VanDerWaalsContact C-N 3.32Å; Y432-A434 PolarHBondContact O-N 3.18Å; Y432-E435 PolarHBondContact O-N 3.43Å; Y432-E435 VanDerWaalsContact O-N 3.15Å; Y432-I436 HydrophobicContact CD1-CD1 4.08Å; Y432-I436 HydrophobicContact CD2-CD1 3.58Å; Y432-I436 HydrophobicContact CD2-CG1 3.91Å; Y432-I436 HydrophobicContact CE1-CD1 3.97Å; Y432-I436 HydrophobicContact CE2-CD1 3.44Å; Y432-I436 VanDerWaalsContact CE2-CD1 3.44Å; Y432-I436 HydrophobicContact CE2-CG1 3.8Å; Y432-I436 HydrophobicContact CG-CD1 3.91Å; Y432-I436 WeakPolarHBondContact O-CG1 3.4Å; Y432-I436 PolarHBondContact O-N 3.29Å; Y432-L492 HydrophobicContact CD1-CD1 4.31Å; Y432-L492 HydrophobicContact CE1-CB 4.07Å; Y432-L492 HydrophobicContact CE1-CD1 3.6Å; Y432-L492 WeakPolarHBondContact OH-CB 3.44Å; Y432-P493 WeakPolarHBondContact CE2-O 3.39Å; Y432-P493 PolarHBondContact OH-O 2.95Å; Y432-T495 HydrophobicContact CD2-CG2 4.23Å; Y432-T495 VanDerWaalsContact CD2-OG1 3.24Å; Y432-T495 WeakPolarHBondContact CD2-OG1 3.3Å; Y432-T495 HydrophobicContact CE2-CG2 3.87Å; Y432-T495 WeakPolarHBondContact CE2-OG1 3.48Å
433T88.1Confident85.3Confident0 Ų027.7 Ų27.70%014%0.141CC..Hα-helixtrans-63.8-37.9175.8-52.70000111.8L331 W335 I429 V431 E435 F437 I446L331-T433 HydrophobicContact CD1-CG2 4.01Å; W335-T433 PolarHBondContact NE1-OG1 3.49Å; I429-T433 WeakPolarHBondContact O-CB 3.35Å; I429-T433 PolarHBondContact O-N 3.14Å; I429-T433 PolarHBondContact O-OG1 2.99Å; V431-T433 VanDerWaalsContact C-N 3.34Å; V431-T433 PolarHBondContact O-N 2.77Å; T433-E435 PolarHBondContact O-N 3.45Å; T433-F437 HydrophobicContact CG2-CD2 3.46Å; T433-F437 VanDerWaalsContact CG2-CD2 3.46Å; T433-F437 HydrophobicContact CG2-CE2 3.27Å; T433-F437 HydrophobicContact CG2-CZ 4.34Å; T433-F437 WeakPolarHBondContact O-CD2 3.39Å; T433-F437 PolarHBondContact O-N 3.45Å; T433-I446 HydrophobicContact CG2-CG1 3.96Å
434A83Confident84.6Confident23 Ų2330.1 Ų30.119%0.1916%0.155CC..Hα-helixtrans-68.6-17.8177.800000113.2Y430 V431 Y432 R442 I446Y430-A434 PolarHBondContact O-N 3.45Å; V431-A434 WeakPolarHBondContact O-CB 3.46Å; V431-A434 PolarHBondContact O-N 2.78Å; V431-A434 VanDerWaalsContact O-N 3.07Å; Y432-A434 VanDerWaalsContact C-N 3.32Å; Y432-A434 PolarHBondContact O-N 3.18Å; A434-R442 WeakPolarHBondContact O-CD 3.38Å; A434-R442 PolarHBondContact O-NE 2.95Å; A434-I446 HydrophobicContact CB-CD1 3.83Å
435E85Confident84.1Confident29 Ų2930.1 Ų30.114%0.13616%0.155CC..Hα-helixtrans-101.4-30.8-179.2-63-173.2164.900113.3R382 V431 Y432 T433 T495 L500 P501R382-E435 WeakPolarHBondContact CD-OE2 3.29Å; R382-E435 IonicContact CZ-OE1 3.88Å; R382-E435 IonicContact CZ-OE2 4Å; R382-E435 IonicContact NE-OE2 3.26Å; R382-E435 PolarHBondContact NE-OE2 2.95Å; R382-E435 IonicContact NH1-OE1 3.82Å; R382-E435 PolarHBondContact NH1-OE1 3.11Å; R382-E435 IonicContact NH1-OE2 3.67Å; R382-E435 PolarHBondContact NH1-OE2 3.45Å; R382-E435 VanDerWaalsContact NH2-CD 3.25Å; R382-E435 IonicContact NH2-OE1 2.7Å; R382-E435 PolarHBondContact NH2-OE1 3.27Å; R382-E435 IonicContact NH2-OE2 2.9Å; R382-E435 PolarHBondContact NH2-OE2 2.9Å; R382-E435 VanDerWaalsContact NH2-OE2 3.07Å; V431-E435 WeakPolarHBondContact O-CG 3.41Å; V431-E435 PolarHBondContact O-N 2.85Å; Y432-E435 PolarHBondContact O-N 3.43Å; Y432-E435 VanDerWaalsContact O-N 3.15Å; T433-E435 PolarHBondContact O-N 3.45Å; E435-T495 HydrophobicContact CB-CG2 4.17Å; E435-T495 WeakPolarHBondContact OE2-CB 3.43Å; E435-T495 PolarHBondContact OE2-OG1 2.8Å; E435-L500 HydrophobicContact CB-CD2 3.74Å; E435-L500 HydrophobicContact CG-CD2 3.64Å; E435-P501 VanDerWaalsContact O-CD 3.26Å; E435-P501 WeakPolarHBondContact O-CD 3.3Å
436I87.3Confident83.6Confident0 Ų032.2 Ų32.20%017%0.166CC..Hα-helixtrans-69-40.7172.8-71.6165.9000110.7R327 L331 Y432 L492 T495R327-I436 HydrophobicContact CB-CG2 3.99Å; R327-I436 HydrophobicContact CG-CG2 4.4Å; L331-I436 HydrophobicContact CD1-CB 4.13Å; L331-I436 HydrophobicContact CD1-CD1 4.11Å; L331-I436 HydrophobicContact CD1-CG2 3.85Å; L331-I436 HydrophobicContact CD2-CD1 3.94Å; L331-I436 HydrophobicContact CG-CD1 4.38Å; Y432-I436 HydrophobicContact CD1-CD1 4.08Å; Y432-I436 HydrophobicContact CD2-CD1 3.58Å; Y432-I436 HydrophobicContact CD2-CG1 3.91Å; Y432-I436 HydrophobicContact CE1-CD1 3.97Å; Y432-I436 HydrophobicContact CE2-CD1 3.44Å; Y432-I436 VanDerWaalsContact CE2-CD1 3.44Å; Y432-I436 HydrophobicContact CE2-CG1 3.8Å; Y432-I436 HydrophobicContact CG-CD1 3.91Å; Y432-I436 WeakPolarHBondContact O-CG1 3.4Å; Y432-I436 PolarHBondContact O-N 3.29Å; I436-L492 HydrophobicContact CD1-CB 4.42Å; I436-L492 HydrophobicContact CD1-CD1 4Å; I436-L492 HydrophobicContact CD1-CD2 4.19Å; I436-L492 HydrophobicContact CD1-CG 4.45Å; I436-T495 HydrophobicContact CG1-CG2 4.18Å
437F85.1Confident83.2Confident0 Ų032 Ų320%018%0.176CC..SBendtrans-79.9130.6-178.6-69.8-44000112.4L318 M324 T328 L331 T433 R442 G445L318-F437 HydrophobicContact CD2-CD1 3.86Å; L318-F437 HydrophobicContact CD2-CE1 3.57Å; L318-F437 HydrophobicContact CD2-CG 4.49Å; L318-F437 HydrophobicContact CD2-CZ 3.95Å; M324-F437 HydrophobicContact CE-CD1 3.86Å; M324-F437 HydrophobicContact CE-CE1 4.26Å; T328-F437 HydrophobicContact CG2-CE1 4.49Å; T328-F437 HydrophobicContact CG2-CZ 4.39Å; T328-F437 WeakPolarHBondContact OG1-CE1 3.31Å; L331-F437 HydrophobicContact CD1-CE1 4.06Å; L331-F437 HydrophobicContact CD1-CE2 3.97Å; L331-F437 HydrophobicContact CD1-CZ 3.7Å; T433-F437 HydrophobicContact CG2-CD2 3.46Å; T433-F437 VanDerWaalsContact CG2-CD2 3.46Å; T433-F437 HydrophobicContact CG2-CE2 3.27Å; T433-F437 HydrophobicContact CG2-CZ 4.34Å; T433-F437 WeakPolarHBondContact O-CD2 3.39Å; T433-F437 PolarHBondContact O-N 3.45Å; F437-R442 HydrophobicContact CB-CB 4.28Å; F437-R442 HydrophobicContact CB-CG 4.35Å; F437-R442 PolarHBondContact O-NE 3.1Å; F437-G445 VanDerWaalsContact CE2-CA 3.49Å
438P80.5Confident83.1Confident0 Ų032.8 Ų32.80%018%0.179CC..  trans-66.8150.3-179.223.3-26.9000111.2M324 V440 V441 R442 P501 L504 V507M324-P438 HydrophobicContact CE-CG 4.24Å; M324-P438 HydrophobicContact SD-CG 4.38Å; P438-V440 HydrophobicContact CB-CG2 4.3Å; P438-V440 HydrophobicContact CG-CG2 4.38Å; P438-V440 PolarHBondContact O-N 3.37Å; P438-V441 HydrophobicContact CG-CG2 3.64Å; P438-V441 PolarHBondContact O-N 3.23Å; P438-R442 WeakPolarHBondContact O-CA 3.21Å; P438-R442 WeakPolarHBondContact O-CB 3.41Å; P438-R442 PolarHBondContact O-N 3.34Å; P438-P501 WeakPolarHBondContact CA-O 3.35Å; P438-P501 HydrophobicContact CB-CB 4.07Å; P438-P501 HydrophobicContact CB-CG 4.3Å; P438-L504 HydrophobicContact CG-CD2 4.06Å; P438-V507 HydrophobicContact CB-CG2 4.25Å; P438-V507 HydrophobicContact CG-CG2 4.01Å
439T73.6Confident83.1Confident64 Ų6432.8 Ų32.839%0.39318%0.179SC..THydrogen-bonded Turntrans-52-35.6-172.351.30000113.1V441 R442 P501 D502T439-V441 PolarHBondContact O-N 3.18Å; T439-R442 VanDerWaalsContact CG2-NH2 3.3Å; T439-P501 PolarHBondContact N-O 3.02Å; T439-P501 VanDerWaalsContact N-O 3.12Å; T439-D502 VanDerWaalsContact CG2-OD1 3.24Å; T439-D502 WeakPolarHBondContact CG2-OD1 3.34Å; T439-D502 WeakPolarHBondContact OG1-CA 3.22Å; T439-D502 PolarHBondContact OG1-O 3.47Å; T439-D502 PolarHBondContact OG1-OD1 3.27Å
440V71.9Confident82.8Confident66 Ų6633.9 Ų33.940%0.419%0.187SC..THydrogen-bonded Turntrans-62.8-31.7178.3-66.20000115.4P438 D502P438-V440 HydrophobicContact CB-CG2 4.3Å; P438-V440 HydrophobicContact CG-CG2 4.38Å; P438-V440 PolarHBondContact O-N 3.37Å; V440-D502 WeakPolarHBondContact CG1-O 3.2Å
441V76.8Confident82.9Confident0 Ų033.2 Ų33.20%019%0.187CC..THydrogen-bonded Turntrans-122.44.1-178.9-69.40000113.5H313 D317 L318 M324 P438 T439 Q443 T444 G445 L504H313-V441 HydrophobicContact CB-CG1 3.75Å; D317-V441 HydrophobicContact CB-CG1 4.41Å; L318-V441 HydrophobicContact CD2-CG2 4.37Å; M324-V441 HydrophobicContact CE-CG2 4.46Å; P438-V441 HydrophobicContact CG-CG2 3.64Å; P438-V441 PolarHBondContact O-N 3.23Å; T439-V441 PolarHBondContact O-N 3.18Å; V441-Q443 PolarHBondContact O-N 3.26Å; V441-T444 PolarHBondContact O-N 3.47Å; V441-G445 PolarHBondContact O-N 3.2Å; V441-L504 HydrophobicContact CG2-CD2 4.21Å
442R79.3Confident83.2Confident52 Ų5235.3 Ų35.320%0.19620%0.195CC..Hα-helixtrans-53.9-49.3-174-174.8-179.1-61.7-175.7-4.8113.8A434 F437 P438 T439 G445 I446A434-R442 WeakPolarHBondContact O-CD 3.38Å; A434-R442 PolarHBondContact O-NE 2.95Å; F437-R442 HydrophobicContact CB-CB 4.28Å; F437-R442 HydrophobicContact CB-CG 4.35Å; F437-R442 PolarHBondContact O-NE 3.1Å; P438-R442 WeakPolarHBondContact O-CA 3.21Å; P438-R442 WeakPolarHBondContact O-CB 3.41Å; P438-R442 PolarHBondContact O-N 3.34Å; T439-R442 VanDerWaalsContact CG2-NH2 3.3Å; R442-G445 PolarHBondContact O-N 3.1Å; R442-I446 HydrophobicContact CG-CD1 3.94Å; R442-I446 VanDerWaalsContact O-CG1 3.3Å; R442-I446 WeakPolarHBondContact O-CG1 3.43Å; R442-I446 PolarHBondContact O-N 3.14Å
443Q71.8Confident83.4Confident176 Ų17635.4 Ų35.482%0.82220%0.195SC*.Hα-helixtrans-66.7-41.8-178.5-67.1-176.15.600111.5V441 G447V441-Q443 PolarHBondContact O-N 3.26Å; Q443-G447 PolarHBondContact O-N 3.24Å
444T79.5Confident83.5Confident52 Ų5236.8 Ų36.832%0.31920%0.2SC..Hα-helixtrans-62.3-44.8175.2-48.80000111.2A315 L318 V441 G447 V448A315-T444 HydrophobicContact CB-CG2 4.01Å; L318-T444 HydrophobicContact CD1-CG2 4.25Å; V441-T444 PolarHBondContact O-N 3.47Å; T444-G447 PolarHBondContact O-N 3Å; T444-V448 WeakPolarHBondContact O-CG2 3.41Å; T444-V448 PolarHBondContact O-N 2.88Å
445G83.8Confident84Confident0 Ų039.8 Ų39.80%021%0.212CC..Hα-helixtrans-61.7-48.8177.900000112.8F437 V441 R442 G447 V448 S449F437-G445 VanDerWaalsContact CE2-CA 3.49Å; V441-G445 PolarHBondContact O-N 3.2Å; R442-G445 PolarHBondContact O-N 3.1Å; G445-G447 VanDerWaalsContact C-N 3.3Å; G445-G447 PolarHBondContact O-N 3.16Å; G445-V448 PolarHBondContact O-N 2.9Å; G445-S449 VanDerWaalsContact O-CB 3.3Å; G445-S449 WeakPolarHBondContact O-CB 3.44Å; G445-S449 PolarHBondContact O-N 3.41Å; G445-S449 PolarHBondContact O-OG 3.46Å
446I84.3Confident84.4Confident45 Ų4538.4 Ų38.423%0.23121%0.205CC..Hα-helixtrans-60.4-41.5175-65.6165.5000110.8T433 A434 R442 S450T433-I446 HydrophobicContact CG2-CG1 3.96Å; A434-I446 HydrophobicContact CB-CD1 3.83Å; R442-I446 HydrophobicContact CG-CD1 3.94Å; R442-I446 VanDerWaalsContact O-CG1 3.3Å; R442-I446 WeakPolarHBondContact O-CG1 3.43Å; R442-I446 PolarHBondContact O-N 3.14Å; I446-S450 WeakPolarHBondContact O-CB 3.38Å; I446-S450 PolarHBondContact O-N 3.32Å
447G83.5Confident84.6Confident37 Ų3738.5 Ų38.538%0.38121%0.206SC..Hα-helixtrans-60.1-51.3177.700000112.8Q443 T444 G445 S450 M451Q443-G447 PolarHBondContact O-N 3.24Å; T444-G447 PolarHBondContact O-N 3Å; G445-G447 VanDerWaalsContact C-N 3.3Å; G445-G447 PolarHBondContact O-N 3.16Å; G447-S450 WeakPolarHBondContact O-CB 3.12Å; G447-S450 PolarHBondContact O-N 2.87Å; G447-M451 WeakPolarHBondContact O-CG 3.41Å; G447-M451 PolarHBondContact O-N 3.31Å; G447-M451 VanDerWaalsContact O-N 3.1Å
448V87.4Confident85.1Confident32 Ų3239.9 Ų39.919%0.19421%0.214CC..Hα-helixtrans-65.6-42.4178.7179.40000111.1A315 L318 F332 T444 G445 S450 M451 F452A315-V448 HydrophobicContact CB-CG2 4.17Å; L318-V448 HydrophobicContact CD1-CG2 4.34Å; F332-V448 HydrophobicContact CE1-CB 4.17Å; F332-V448 HydrophobicContact CE1-CG1 3.84Å; F332-V448 HydrophobicContact CE2-CG1 4Å; F332-V448 HydrophobicContact CZ-CB 4.03Å; F332-V448 HydrophobicContact CZ-CG1 3.37Å; T444-V448 WeakPolarHBondContact O-CG2 3.41Å; T444-V448 PolarHBondContact O-N 2.88Å; G445-V448 PolarHBondContact O-N 2.9Å; V448-S450 VanDerWaalsContact C-N 3.26Å; V448-S450 PolarHBondContact O-N 3.27Å; V448-M451 WeakPolarHBondContact O-CB 3.47Å; V448-M451 PolarHBondContact O-N 3.35Å; V448-F452 HydrophobicContact CG1-CD2 4.12Å; V448-F452 HydrophobicContact CG1-CE2 3.89Å; V448-F452 WeakPolarHBondContact O-CD2 3.29Å; V448-F452 PolarHBondContact O-N 3.01Å
449S90.6Very high85.7Confident0 Ų043.3 Ų43.30%023%0.232CC..Hα-helixtrans-55.6-42.2172.6-71.80000112.1F332 W335 G445 M451 F452 A453F332-S449 VanDerWaalsContact CD1-OG 3.28Å; F332-S449 WeakPolarHBondContact CD1-OG 3.26Å; F332-S449 WeakPolarHBondContact CE1-OG 3.46Å; W335-S449 WeakPolarHBondContact CB-O 3.39Å; W335-S449 VanDerWaalsContact CD1-CB 3.45Å; G445-S449 VanDerWaalsContact O-CB 3.3Å; G445-S449 WeakPolarHBondContact O-CB 3.44Å; G445-S449 PolarHBondContact O-N 3.41Å; G445-S449 PolarHBondContact O-OG 3.46Å; S449-M451 VanDerWaalsContact C-N 3.31Å; S449-M451 PolarHBondContact O-N 2.84Å; S449-F452 PolarHBondContact O-N 3.21Å; S449-A453 PolarHBondContact O-N 2.84Å
450S87Confident86.7Confident22 Ų2240.2 Ų40.215%0.15421%0.213CC..Hα-helixtrans-63-36.6175.9-163.90000112I446 G447 V448 A453 R454I446-S450 WeakPolarHBondContact O-CB 3.38Å; I446-S450 PolarHBondContact O-N 3.32Å; G447-S450 WeakPolarHBondContact O-CB 3.12Å; G447-S450 PolarHBondContact O-N 2.87Å; V448-S450 VanDerWaalsContact C-N 3.26Å; V448-S450 PolarHBondContact O-N 3.27Å; S450-A453 WeakPolarHBondContact O-CA 3.36Å; S450-A453 WeakPolarHBondContact O-CB 3.38Å; S450-A453 PolarHBondContact O-N 3.05Å; S450-A453 VanDerWaalsContact O-N 3.15Å; S450-R454 WeakPolarHBondContact O-CG 3.42Å; S450-R454 PolarHBondContact O-N 3.23Å
451M88.9Confident87.5Confident70 Ų7037.3 Ų37.335%0.34520%0.196SC..Hα-helixtrans-61.2-45.3174.9-63.3177.574.400111.8L134 V138 G447 V448 S449 A453 R454 M455L134-M451 HydrophobicContact CD1-CB 3.92Å; L134-M451 HydrophobicContact CD1-CE 4.24Å; L134-M451 HydrophobicContact CD1-CG 4.16Å; V138-M451 HydrophobicContact CG2-CE 3.68Å; V138-M451 HydrophobicContact CG2-SD 4.37Å; G447-M451 WeakPolarHBondContact O-CG 3.41Å; G447-M451 PolarHBondContact O-N 3.31Å; G447-M451 VanDerWaalsContact O-N 3.1Å; V448-M451 WeakPolarHBondContact O-CB 3.47Å; V448-M451 PolarHBondContact O-N 3.35Å; S449-M451 VanDerWaalsContact C-N 3.31Å; S449-M451 PolarHBondContact O-N 2.84Å; M451-A453 VanDerWaalsContact C-N 3.27Å; M451-A453 PolarHBondContact O-N 2.96Å; M451-R454 PolarHBondContact O-N 2.9Å; M451-R454 VanDerWaalsContact O-N 3.12Å; M451-M455 PolarHBondContact O-N 3.43Å
452F92Very high88.2Confident74 Ų7440.3 Ų40.333%0.32521%0.211SC..Hα-helixtrans-61.7-37.1173.1-79.3-79.9000111.9F332 F336 V448 S449 R454 M455 G456F332-F452 HydrophobicContact CB-CB 4.39Å; F332-F452 HydrophobicContact CB-CD2 3.94Å; F332-F452 HydrophobicContact CB-CE2 4.37Å; F332-F452 HydrophobicContact CB-CG 4.04Å; F332-F452 AromaticContact CD1-CD2 3.96Å; F332-F452 HydrophobicContact CD1-CD2 3.96Å; F332-F452 HydrophobicContact CD1-CE2 4.4Å; F332-F452 AromaticContact CD2-CD2 3.68Å; F332-F452 HydrophobicContact CD2-CD2 3.68Å; F332-F452 AromaticContact CD2-CE2 3.36Å; F332-F452 HydrophobicContact CD2-CE2 3.36Å; F332-F452 HydrophobicContact CD2-CG 4.5Å; F332-F452 AromaticContact CD2-CZ 3.95Å; F332-F452 HydrophobicContact CD2-CZ 3.95Å; F332-F452 HydrophobicContact CE1-CD2 4.36Å; F332-F452 HydrophobicContact CE2-CD2 4.1Å; F332-F452 AromaticContact CE2-CE2 3.56Å; F332-F452 HydrophobicContact CE2-CE2 3.56Å; F332-F452 HydrophobicContact CE2-CZ 4.34Å; F332-F452 AromaticContact CG-CD2 3.6Å; F332-F452 HydrophobicContact CG-CD2 3.6Å; F332-F452 AromaticContact CG-CE2 3.82Å; F332-F452 HydrophobicContact CG-CE2 3.82Å; F332-F452 HydrophobicContact CG-CG 4.22Å; F332-F452 HydrophobicContact CZ-CD2 4.42Å; F332-F452 HydrophobicContact CZ-CE2 4.17Å; F336-F452 WeakPolarHBondContact CD2-O 3.29Å; V448-F452 HydrophobicContact CG1-CD2 4.12Å; V448-F452 HydrophobicContact CG1-CE2 3.89Å; V448-F452 WeakPolarHBondContact O-CD2 3.29Å; V448-F452 PolarHBondContact O-N 3.01Å; S449-F452 PolarHBondContact O-N 3.21Å; F452-R454 PolarHBondContact O-N 3.16Å; F452-M455 HydrophobicContact CD1-SD 3.97Å; F452-M455 HydrophobicContact CE1-SD 4.28Å; F452-M455 WeakPolarHBondContact O-CB 3.36Å; F452-M455 PolarHBondContact O-N 3.13Å; F452-G456 PolarHBondContact O-N 3.37Å
453A91.8Very high88.8Confident2 Ų238.9 Ų38.92%0.01721%0.207CC..Hα-helixtrans-58-46.4171.800000111.6W335 V339 S449 S450 M451 M455 G456 G457W335-A453 HydrophobicContact CB-CB 4.05Å; W335-A453 HydrophobicContact CD2-CB 4.44Å; W335-A453 HydrophobicContact CE3-CB 3.66Å; V339-A453 HydrophobicContact CB-CB 4.24Å; V339-A453 WeakPolarHBondContact CB-O 3.34Å; V339-A453 WeakPolarHBondContact CG1-O 3.45Å; V339-A453 HydrophobicContact CG2-CB 3.55Å; S449-A453 PolarHBondContact O-N 2.84Å; S450-A453 WeakPolarHBondContact O-CA 3.36Å; S450-A453 WeakPolarHBondContact O-CB 3.38Å; S450-A453 PolarHBondContact O-N 3.05Å; S450-A453 VanDerWaalsContact O-N 3.15Å; M451-A453 VanDerWaalsContact C-N 3.27Å; M451-A453 PolarHBondContact O-N 2.96Å; A453-M455 VanDerWaalsContact C-N 3.31Å; A453-M455 PolarHBondContact O-N 2.84Å; A453-G456 WeakPolarHBondContact O-CA 3.46Å; A453-G456 PolarHBondContact O-N 2.9Å; A453-G456 VanDerWaalsContact O-N 3.08Å; A453-G457 PolarHBondContact O-N 2.01Å
454R90.9Very high89.6Confident28 Ų2831.3 Ų31.311%0.10617%0.172CC..Hα-helixtrans-63.7-34.3177.2-58.5-55.2177.9157.21.1112.6L134 S450 M451 F452 G456 G457 V458L134-R454 HydrophobicContact CB-CB 3.9Å; L134-R454 HydrophobicContact CB-CG 4.48Å; L134-R454 HydrophobicContact CD1-CB 3.93Å; L134-R454 HydrophobicContact CD1-CG 4.41Å; L134-R454 HydrophobicContact CG-CB 4.47Å; S450-R454 WeakPolarHBondContact O-CG 3.42Å; S450-R454 PolarHBondContact O-N 3.23Å; M451-R454 PolarHBondContact O-N 2.9Å; M451-R454 VanDerWaalsContact O-N 3.12Å; F452-R454 PolarHBondContact O-N 3.16Å; R454-G456 VanDerWaalsContact C-N 3.28Å; R454-G456 PolarHBondContact O-N 2.99Å; R454-G457 WeakPolarHBondContact O-CA 3.36Å; R454-G457 PolarHBondContact O-N 3.42Å; R454-G457 VanDerWaalsContact O-N 3.08Å; R454-V458 WeakPolarHBondContact O-CG2 3.44Å; R454-V458 PolarHBondContact O-N 3.29Å
455M92.9Very high89.8Confident87 Ų8731.4 Ų31.443%0.42917%0.17SC..Hα-helixtrans-59.7-39.7172.1-66.3174.862.800111.7F336 M451 F452 A453 G457 V458 L459F336-M455 HydrophobicContact CD2-CB 4.31Å; F336-M455 HydrophobicContact CE2-CB 4.39Å; M451-M455 PolarHBondContact O-N 3.43Å; F452-M455 HydrophobicContact CD1-SD 3.97Å; F452-M455 HydrophobicContact CE1-SD 4.28Å; F452-M455 WeakPolarHBondContact O-CB 3.36Å; F452-M455 PolarHBondContact O-N 3.13Å; A453-M455 VanDerWaalsContact C-N 3.31Å; A453-M455 PolarHBondContact O-N 2.84Å; M455-G457 VanDerWaalsContact C-N 3.3Å; M455-G457 PolarHBondContact O-N 3.49Å; M455-V458 PolarHBondContact O-N 3.11Å; M455-L459 PolarHBondContact O-N 3.36Å; M455-L459 VanDerWaalsContact O-N 3.1Å
456G93.4Very high89.9Confident0 Ų034.3 Ų34.30%019%0.185CC..Hα-helixtrans-58.8-41.717200000112.2L340 F452 A453 R454 V458 L459 A460L340-G456 WeakPolarHBondContact CD1-O 3.28Å; F452-G456 PolarHBondContact O-N 3.37Å; A453-G456 WeakPolarHBondContact O-CA 3.46Å; A453-G456 PolarHBondContact O-N 2.9Å; A453-G456 VanDerWaalsContact O-N 3.08Å; R454-G456 VanDerWaalsContact C-N 3.28Å; R454-G456 PolarHBondContact O-N 2.99Å; G456-V458 VanDerWaalsContact C-N 3.35Å; G456-V458 PolarHBondContact O-N 3.02Å; G456-L459 PolarHBondContact O-N 2.86Å; G456-A460 PolarHBondContact O-N 3.18Å
457G92.5Very high89.7Confident1 Ų134.2 Ų34.21%0.0118%0.183CC..Hα-helixtrans-62.8-37174.700000113.7M130 A453 R454 M455 P461M130-G457 WeakPolarHBondContact CG-O 3.31Å; A453-G457 PolarHBondContact O-N 2.01Å; R454-G457 WeakPolarHBondContact O-CA 3.36Å; R454-G457 PolarHBondContact O-N 3.42Å; R454-G457 VanDerWaalsContact O-N 3.08Å; M455-G457 VanDerWaalsContact C-N 3.3Å; M455-G457 PolarHBondContact O-N 3.49Å; G457-P461 WeakPolarHBondContact O-CD 3.42Å
458V94.6Very high89.4Confident29 Ų2936.8 Ų36.818%0.17619%0.189CC..Hα-helixtrans-66.3-38.4175.8175.80000111.6S127 M130 F131 R454 M455 G456S127-V458 WeakPolarHBondContact CB-O 3.3Å; S127-V458 PolarHBondContact OG-O 2.84Å; M130-V458 HydrophobicContact CB-CG2 3.95Å; F131-V458 HydrophobicContact CB-CG2 3.97Å; R454-V458 WeakPolarHBondContact O-CG2 3.44Å; R454-V458 PolarHBondContact O-N 3.29Å; M455-V458 PolarHBondContact O-N 3.11Å; G456-V458 VanDerWaalsContact C-N 3.35Å; G456-V458 PolarHBondContact O-N 3.02Å
459L94.1Very high89Confident72 Ų7243.3 Ų43.338%0.37722%0.216SC..Hα-helixtrans-79.4-26.3-179-68.3176.9000113.4F336 L340 M455 G456 I462 I463F336-L459 HydrophobicContact CE2-CD1 3.75Å; F336-L459 HydrophobicContact CZ-CD1 3.7Å; L340-L459 HydrophobicContact CD1-CB 3.94Å; M455-L459 PolarHBondContact O-N 3.36Å; M455-L459 VanDerWaalsContact O-N 3.1Å; G456-L459 PolarHBondContact O-N 2.86Å; L459-I462 HydrophobicContact CD2-CD1 4.39Å; L459-I462 WeakPolarHBondContact O-CB 3.27Å; L459-I462 PolarHBondContact O-N 3.49Å; L459-I462 VanDerWaalsContact O-N 3.11Å; L459-I463 WeakPolarHBondContact O-CG1 3.45Å; L459-I463 PolarHBondContact O-N 2.96Å
460A92.8Very high88.6Confident0 Ų046.8 Ų46.80%024%0.235CC..Hα-helixtrans-54-50.7-176.800000114.5L340 G456 I462 I463 N464L340-A460 HydrophobicContact CD1-CB 4.15Å; G456-A460 PolarHBondContact O-N 3.18Å; A460-I462 VanDerWaalsContact C-N 3.29Å; A460-I462 PolarHBondContact O-N 3.38Å; A460-I463 PolarHBondContact O-N 3.48Å; A460-N464 PolarHBondContact O-N 3.36Å
461P90.6Very high88.2Confident4 Ų449.1 Ų49.13%0.02625%0.25CC..Hα-helixtrans-63.1-33.7177.1-17.526.9000113.3L347 G457 N464 M465L347-P461 HydrophobicContact CD1-CB 4.35Å; L347-P461 HydrophobicContact CD1-CG 3.7Å; G457-P461 WeakPolarHBondContact O-CD 3.42Å; P461-N464 PolarHBondContact O-N 3.2Å; P461-M465 PolarHBondContact O-N 2.9Å; P461-M465 VanDerWaalsContact O-N 3.1Å
462I90.8Very high88.2Confident63 Ų6348.5 Ų48.532%0.32325%0.25SC..Hα-helixtrans-68-44.2177.1-64.1164.8000109.7S127 L459 A460 N464 M465 L466S127-I462 WeakPolarHBondContact OG-CG1 3Å; L459-I462 HydrophobicContact CD2-CD1 4.39Å; L459-I462 WeakPolarHBondContact O-CB 3.27Å; L459-I462 PolarHBondContact O-N 3.49Å; L459-I462 VanDerWaalsContact O-N 3.11Å; A460-I462 VanDerWaalsContact C-N 3.29Å; A460-I462 PolarHBondContact O-N 3.38Å; I462-N464 VanDerWaalsContact C-N 3.32Å; I462-N464 PolarHBondContact O-N 2.9Å; I462-M465 WeakPolarHBondContact O-CB 3.2Å; I462-M465 PolarHBondContact O-N 2.84Å; I462-L466 WeakPolarHBondContact O-CD1 3.06Å; I462-L466 PolarHBondContact O-N 2.9Å
463I91.6Very high88Confident22 Ų2247 Ų4711%0.11325%0.246CC..Hα-helixtrans-62.9-40.7175.6-65.3175.7000110.7L340 L459 A460 M465 L466 P474 I477 F478L340-I463 HydrophobicContact CD1-CD1 3.69Å; L340-I463 HydrophobicContact CD2-CD1 4.05Å; L340-I463 HydrophobicContact CG-CD1 4.24Å; L459-I463 WeakPolarHBondContact O-CG1 3.45Å; L459-I463 PolarHBondContact O-N 2.96Å; A460-I463 PolarHBondContact O-N 3.48Å; I463-M465 PolarHBondContact O-N 3.25Å; I463-L466 WeakPolarHBondContact O-CB 3.4Å; I463-L466 PolarHBondContact O-N 2.84Å; I463-P474 HydrophobicContact CG2-CB 4.02Å; I463-P474 WeakPolarHBondContact O-CG 3.08Å; I463-I477 HydrophobicContact CD1-CG2 3.97Å; I463-I477 HydrophobicContact CG2-CB 4.37Å; I463-I477 HydrophobicContact CG2-CD1 3.91Å; I463-I477 HydrophobicContact CG2-CG2 4.47Å; I463-F478 HydrophobicContact CB-CE1 4.26Å; I463-F478 HydrophobicContact CB-CZ 4.18Å; I463-F478 HydrophobicContact CD1-CE1 4.4Å; I463-F478 HydrophobicContact CG2-CE1 3.77Å; I463-F478 HydrophobicContact CG2-CE2 4.45Å; I463-F478 HydrophobicContact CG2-CZ 3.69Å
464N88.1Confident87.9Confident17 Ų1747 Ų479%0.09125%0.247CC..Hα-helixtrans-61.5-27.6174-82.2-20000113.3G344 G348 R351 A460 P461 I462 L466 H467 F478G344-N464 PolarHBondContact O-ND2 3Å; G344-N464 PolarHBondContact O-OD1 3.04Å; G348-N464 PolarHBondContact N-ND2 3.48Å; R351-N464 PolarHBondContact NH2-O 3.45Å; R351-N464 VanDerWaalsContact NH2-O 3.11Å; A460-N464 PolarHBondContact O-N 3.36Å; P461-N464 PolarHBondContact O-N 3.2Å; I462-N464 VanDerWaalsContact C-N 3.32Å; I462-N464 PolarHBondContact O-N 2.9Å; N464-L466 VanDerWaalsContact C-N 3.32Å; N464-H467 VanDerWaalsContact O-CB 3.3Å; N464-H467 WeakPolarHBondContact O-CB 3.47Å; N464-H467 PolarHBondContact O-N 2.04Å; N464-F478 VanDerWaalsContact OD1-CE2 3.24Å; N464-F478 WeakPolarHBondContact OD1-CE2 3.16Å; N464-F478 WeakPolarHBondContact OD1-CZ 3.41Å
465M85.1Confident87.9Confident54 Ų5447.4 Ų47.427%0.26625%0.251SS..Hα-helixtrans-67.8-31.2174.3-170.6-167.272.200112.2G120 P461 I462 I463 H467 N468G120-M465 VanDerWaalsContact CA-SD 3.56Å; P461-M465 PolarHBondContact O-N 2.9Å; P461-M465 VanDerWaalsContact O-N 3.1Å; I462-M465 WeakPolarHBondContact O-CB 3.2Å; I462-M465 PolarHBondContact O-N 2.84Å; I463-M465 PolarHBondContact O-N 3.25Å; M465-H467 PolarHBondContact O-N 3.07Å; M465-H467 VanDerWaalsContact O-N 3.13Å; M465-N468 WeakPolarHBondContact O-CB 3.33Å; M465-N468 PolarHBondContact O-N 3.28Å; M465-N468 VanDerWaalsContact O-N 3.07Å
466L85.3Confident87.9Confident61 Ų6146.7 Ų46.732%0.31925%0.248SC..Hα-helixtrans-62-21.6179.1-8765.8000112.3I462 I463 N464 N468 H469 N470 T473I462-L466 WeakPolarHBondContact O-CD1 3.06Å; I462-L466 PolarHBondContact O-N 2.9Å; I463-L466 WeakPolarHBondContact O-CB 3.4Å; I463-L466 PolarHBondContact O-N 2.84Å; N464-L466 VanDerWaalsContact C-N 3.32Å; L466-N468 PolarHBondContact O-N 3.4Å; L466-H469 PolarHBondContact O-N 3.5Å; L466-N470 PolarHBondContact O-N 2.91Å; L466-T473 HydrophobicContact CB-CG2 4.43Å; L466-T473 HydrophobicContact CD2-CG2 3.87Å
467H79.9Confident88Confident43 Ų4349.1 Ų49.120%0.19926%0.26CS..THydrogen-bonded Turntrans-53.1-35.9173-168.296.1000112.6R351 N464 M465 H469 N470 P471 P474R351-H467 PolarHBondContact NH1-CD2 2.78Å; N464-H467 VanDerWaalsContact O-CB 3.3Å; N464-H467 WeakPolarHBondContact O-CB 3.47Å; N464-H467 PolarHBondContact O-N 2.04Å; M465-H467 PolarHBondContact O-N 3.07Å; M465-H467 VanDerWaalsContact O-N 3.13Å; H467-H469 PolarHBondContact O-N 3.17Å; H467-N470 WeakPolarHBondContact CA-O 3.17Å; H467-N470 CarbonylContact O-C 3.33Å; H467-N470 PolarHBondContact O-N 3.13Å; H467-P471 VanDerWaalsContact CE1-CB 3.43Å; H467-P471 WeakPolarHBondContact CE1-CB 3.33Å; H467-P471 WeakPolarHBondContact ND1-CA 3.2Å; H467-P471 PolarHBondContact ND1-O 3.42Å; H467-P474 HydrophobicContact CB-CG 3.81Å
468N76.2Confident88Confident92 Ų9249.2 Ų49.249%0.49226%0.261SS..THydrogen-bonded Turntrans-67.4-20.6-178.1-62.40.9000112.5R351 M465 L466R351-N468 PolarHBondContact NH1-OD1 2.7Å; R351-N468 PolarHBondContact NH2-OD1 2.98Å; M465-N468 WeakPolarHBondContact O-CB 3.33Å; M465-N468 PolarHBondContact O-N 3.28Å; M465-N468 VanDerWaalsContact O-N 3.07Å; L466-N468 PolarHBondContact O-N 3.4Å
469H79.1Confident88Confident168 Ų16847.9 Ų47.978%0.77825%0.252SS*.THydrogen-bonded Turntrans-95-47.1174-68.274.9000110.8L466 H467L466-H469 PolarHBondContact O-N 3.5Å; H467-H469 PolarHBondContact O-N 3.17Å
470N82.3Confident88.2Confident74 Ų7447.6 Ų47.640%0.39625%0.253SS..  trans-142.6115.4176.3-175.9-20.2000109.9L466 H467 V472 T473L466-N470 PolarHBondContact O-N 2.91Å; H467-N470 WeakPolarHBondContact CA-O 3.17Å; H467-N470 CarbonylContact O-C 3.33Å; H467-N470 PolarHBondContact O-N 3.13Å; N470-V472 PolarHBondContact O-N 2.85Å; N470-V472 VanDerWaalsContact O-N 3.15Å; N470-V472 WeakPolarHBondContact OD1-CB 2.99Å; N470-V472 WeakPolarHBondContact OD1-CG2 3.16Å; N470-V472 PolarHBondContact OD1-N 3.29Å; N470-T473 WeakPolarHBondContact CB-OG1 3.15Å; N470-T473 PolarHBondContact O-N 2.85Å
471P80.1Confident88.3Confident70 Ų7048.2 Ų48.246%0.45526%0.258SS..THydrogen-bonded Turntrans-64.6-22.2-174.425.7-34.6000113.4H467H467-P471 VanDerWaalsContact CE1-CB 3.43Å; H467-P471 WeakPolarHBondContact CE1-CB 3.33Å; H467-P471 WeakPolarHBondContact ND1-CA 3.2Å; H467-P471 PolarHBondContact ND1-O 3.42Å
472V87.3Confident88.6Confident58 Ų5848 Ų4835%0.35226%0.257SS..Hα-helixtrans-78.9-31.5-176.7-173.30000111.7L401 N470 L475 I476L401-V472 HydrophobicContact CD1-CG1 4.13Å; L401-V472 HydrophobicContact CD2-CB 4.24Å; L401-V472 HydrophobicContact CD2-CG1 3.63Å; L401-V472 HydrophobicContact CG-CG1 4.5Å; N470-V472 PolarHBondContact O-N 2.85Å; N470-V472 VanDerWaalsContact O-N 3.15Å; N470-V472 WeakPolarHBondContact OD1-CB 2.99Å; N470-V472 WeakPolarHBondContact OD1-CG2 3.16Å; N470-V472 PolarHBondContact OD1-N 3.29Å; V472-L475 PolarHBondContact O-N 3.35Å; V472-I476 HydrophobicContact CG1-CD1 3.48Å; V472-I476 VanDerWaalsContact CG1-CD1 3.48Å; V472-I476 HydrophobicContact CG1-CG1 3.88Å; V472-I476 PolarHBondContact O-N 2.83Å
473T89.2Confident88.9Confident41 Ų4147.3 Ų47.325%0.25225%0.253SS..Hα-helixtrans-59.8-47.6-169.6-55.40000114.4L466 N470 L475 I476 I477L466-T473 HydrophobicContact CB-CG2 4.43Å; L466-T473 HydrophobicContact CD2-CG2 3.87Å; N470-T473 WeakPolarHBondContact CB-OG1 3.15Å; N470-T473 PolarHBondContact O-N 2.85Å; T473-L475 VanDerWaalsContact C-N 3.32Å; T473-L475 PolarHBondContact O-N 3.03Å; T473-I476 PolarHBondContact O-N 3.09Å; T473-I477 HydrophobicContact CG2-CD1 3.89Å; T473-I477 WeakPolarHBondContact O-CG1 2.94Å; T473-I477 PolarHBondContact O-N 3.44Å; T473-I477 VanDerWaalsContact O-N 3.08Å
474P89.7Confident89.2Confident4 Ų450.4 Ų50.43%0.02627%0.269CS..Hα-helixtrans-62.8-39.4179.7-20.132.4000112.4I463 H467 I477 F478I463-P474 HydrophobicContact CG2-CB 4.02Å; I463-P474 WeakPolarHBondContact O-CG 3.08Å; H467-P474 HydrophobicContact CB-CG 3.81Å; P474-I477 PolarHBondContact O-N 3.27Å; P474-F478 HydrophobicContact CB-CD2 4.39Å; P474-F478 HydrophobicContact CB-CE2 4Å; P474-F478 WeakPolarHBondContact O-CB 3.47Å; P474-F478 WeakPolarHBondContact O-CD2 3.42Å; P474-F478 WeakPolarHBondContact O-CG 3.3Å; P474-F478 PolarHBondContact O-N 3Å
475L89.8Confident89.6Confident35 Ų3549.6 Ų49.618%0.18327%0.265CS..Hα-helixtrans-68.9-39-179.7-67.7174.6000112M400 L401 V472 T473 I477 F478 G479M400-L475 HydrophobicContact CB-CD1 4.35Å; M400-L475 HydrophobicContact CB-CD2 4.4Å; M400-L475 HydrophobicContact CE-CD2 3.6Å; M400-L475 HydrophobicContact SD-CD2 4.26Å; L401-L475 HydrophobicContact CD1-CB 4.47Å; L401-L475 HydrophobicContact CD2-CB 3.62Å; L401-L475 HydrophobicContact CD2-CD1 3.62Å; L401-L475 HydrophobicContact CD2-CG 4.26Å; L401-L475 HydrophobicContact CG-CB 4.04Å; L401-L475 HydrophobicContact CG-CD1 4.42Å; V472-L475 PolarHBondContact O-N 3.35Å; T473-L475 VanDerWaalsContact C-N 3.32Å; T473-L475 PolarHBondContact O-N 3.03Å; L475-I477 VanDerWaalsContact C-N 3.34Å; L475-F478 PolarHBondContact O-N 2.95Å; L475-G479 PolarHBondContact O-N 3.4Å
476I93.6Very high90.1Very high73 Ų7347.2 Ų47.237%0.37425%0.254SS..Hα-helixtrans-60-46.6171.1-70.5173.4000110.2L401 V472 T473 G479 T480L401-I476 HydrophobicContact CD1-CG1 3.68Å; V472-I476 HydrophobicContact CG1-CD1 3.48Å; V472-I476 VanDerWaalsContact CG1-CD1 3.48Å; V472-I476 HydrophobicContact CG1-CG1 3.88Å; V472-I476 PolarHBondContact O-N 2.83Å; T473-I476 PolarHBondContact O-N 3.09Å; I476-G479 PolarHBondContact O-N 3.08Å; I476-T480 HydrophobicContact CG2-CG2 4.03Å; I476-T480 WeakPolarHBondContact O-CB 3.26Å; I476-T480 WeakPolarHBondContact O-CG2 3.24Å; I476-T480 PolarHBondContact O-N 3.17Å; I476-T480 PolarHBondContact O-OG1 3.3Å
477I95.1Very high90.6Very high50 Ų5049.8 Ų49.826%0.25627%0.267SS..Hα-helixtrans-64.3-50-178.9-64.5164.1000110L340 I463 T473 P474 L475 G479 S481L340-I477 HydrophobicContact CD2-CG2 4.49Å; I463-I477 HydrophobicContact CD1-CG2 3.97Å; I463-I477 HydrophobicContact CG2-CB 4.37Å; I463-I477 HydrophobicContact CG2-CD1 3.91Å; I463-I477 HydrophobicContact CG2-CG2 4.47Å; T473-I477 HydrophobicContact CG2-CD1 3.89Å; T473-I477 WeakPolarHBondContact O-CG1 2.94Å; T473-I477 PolarHBondContact O-N 3.44Å; T473-I477 VanDerWaalsContact O-N 3.08Å; P474-I477 PolarHBondContact O-N 3.27Å; L475-I477 VanDerWaalsContact C-N 3.34Å; I477-G479 PolarHBondContact O-N 2.67Å; I477-S481 VanDerWaalsContact O-CB 3.29Å; I477-S481 WeakPolarHBondContact O-CB 3.1Å; I477-S481 PolarHBondContact O-N 3.36Å; I477-S481 PolarHBondContact O-OG 3.33Å
478F93.9Very high91.3Very high4 Ų450.3 Ų50.32%0.01827%0.271CS..Hα-helixtrans-66-22.4179.3-62.1-29.6000114L340 V341 G344 C397 I463 N464 P474 L475 P482L340-F478 HydrophobicContact CG-CD1 4.48Å; L340-F478 HydrophobicContact CG-CE1 4.22Å; V341-F478 HydrophobicContact CG1-CB 4.23Å; V341-F478 HydrophobicContact CG2-CB 4.28Å; V341-F478 HydrophobicContact CG2-CD1 4.27Å; G344-F478 VanDerWaalsContact CA-CZ 3.41Å; C397-F478 HydrophobicContact CB-CB 4.44Å; I463-F478 HydrophobicContact CB-CE1 4.26Å; I463-F478 HydrophobicContact CB-CZ 4.18Å; I463-F478 HydrophobicContact CD1-CE1 4.4Å; I463-F478 HydrophobicContact CG2-CE1 3.77Å; I463-F478 HydrophobicContact CG2-CE2 4.45Å; I463-F478 HydrophobicContact CG2-CZ 3.69Å; N464-F478 VanDerWaalsContact OD1-CE2 3.24Å; N464-F478 WeakPolarHBondContact OD1-CE2 3.16Å; N464-F478 WeakPolarHBondContact OD1-CZ 3.41Å; P474-F478 HydrophobicContact CB-CD2 4.39Å; P474-F478 HydrophobicContact CB-CE2 4Å; P474-F478 WeakPolarHBondContact O-CB 3.47Å; P474-F478 WeakPolarHBondContact O-CD2 3.42Å; P474-F478 WeakPolarHBondContact O-CG 3.3Å; P474-F478 PolarHBondContact O-N 3Å; L475-F478 PolarHBondContact O-N 2.95Å; F478-P482 WeakPolarHBondContact O-CD 3.45Å; F478-P482 WeakPolarHBondContact O-CG 3.38Å
479G94.4Very high92.1Very high0 Ų046 Ų460%025%0.248CC..Hα-helixtrans-87.5-48.2175.100000113.9G394 L475 I476 I477 P482 L483G394-G479 WeakPolarHBondContact CA-O 3.32Å; G394-G479 WeakPolarHBondContact O-CA 3.24Å; L475-G479 PolarHBondContact O-N 3.4Å; I476-G479 PolarHBondContact O-N 3.08Å; I477-G479 PolarHBondContact O-N 2.67Å; G479-P482 WeakPolarHBondContact O-CD 3.31Å; G479-P482 WeakPolarHBondContact O-CG 3Å; G479-L483 WeakPolarHBondContact O-CD1 3.36Å; G479-L483 VanDerWaalsContact O-CG 3.31Å; G479-L483 WeakPolarHBondContact O-CG 3.39Å; G479-L483 PolarHBondContact O-N 2.96Å
480T96.4Very high92.8Very high66 Ų6641.7 Ų41.741%0.40523%0.23SC..Hα-helixtrans-72.9-37.2-176.956.80000112.8L398 I476 L483 L484L398-T480 HydrophobicContact CD2-CG2 4.28Å; I476-T480 HydrophobicContact CG2-CG2 4.03Å; I476-T480 WeakPolarHBondContact O-CB 3.26Å; I476-T480 WeakPolarHBondContact O-CG2 3.24Å; I476-T480 PolarHBondContact O-N 3.17Å; I476-T480 PolarHBondContact O-OG1 3.3Å; T480-L483 PolarHBondContact O-N 3.33Å; T480-L484 PolarHBondContact O-N 3.35Å
481S96.4Very high93.2Very high13 Ų1340.6 Ų40.69%0.09123%0.232CC..Hα-helixtrans-63.3-45.9-178.471.80000113.9Y333 I477 L484 G485Y333-S481 WeakPolarHBondContact OH-CA 2.97Å; Y333-S481 PolarHBondContact OH-O 2.88Å; I477-S481 VanDerWaalsContact O-CB 3.29Å; I477-S481 WeakPolarHBondContact O-CB 3.1Å; I477-S481 PolarHBondContact O-N 3.36Å; I477-S481 PolarHBondContact O-OG 3.33Å; S481-L484 PolarHBondContact O-N 3.22Å; S481-G485 PolarHBondContact O-N 2.79Å
482P96.7Very high93.7Very high0 Ų037.4 Ų37.40%021%0.211CC..Hα-helixtrans-71.2-28.317430.2-37.8000113.6V337 V341 L390 G394 I422 F478 G479 G485 A486V337-P482 HydrophobicContact CG1-CB 3.78Å; V337-P482 HydrophobicContact CG1-CG 4.46Å; V341-P482 HydrophobicContact CG2-CG 4.28Å; L390-P482 HydrophobicContact CD2-CB 4.05Å; G394-P482 VanDerWaalsContact CA-CG 3.41Å; I422-P482 HydrophobicContact CD1-CB 4.14Å; F478-P482 WeakPolarHBondContact O-CD 3.45Å; F478-P482 WeakPolarHBondContact O-CG 3.38Å; G479-P482 WeakPolarHBondContact O-CD 3.31Å; G479-P482 WeakPolarHBondContact O-CG 3Å; P482-G485 CarbonylContact O-C 3.31Å; P482-G485 WeakPolarHBondContact O-CA 3.43Å; P482-G485 PolarHBondContact O-N 2.97Å; P482-G485 VanDerWaalsContact O-N 3.14Å; P482-A486 PolarHBondContact O-N 3.34Å
483L97.2Very high93.7Very high49 Ų4935.5 Ų35.526%0.25720%0.2SC..Hα-helixtrans-65.2-43.6172.4-73.9170.8000111.7A391 L398 G479 T480 G485 A486 I487A391-L483 HydrophobicContact CB-CD2 4.4Å; L398-L483 HydrophobicContact CD1-CD1 3.45Å; L398-L483 VanDerWaalsContact CD1-CD1 3.45Å; L398-L483 HydrophobicContact CG-CD1 4.34Å; G479-L483 WeakPolarHBondContact O-CD1 3.36Å; G479-L483 VanDerWaalsContact O-CG 3.31Å; G479-L483 WeakPolarHBondContact O-CG 3.39Å; G479-L483 PolarHBondContact O-N 2.96Å; T480-L483 PolarHBondContact O-N 3.33Å; L483-G485 PolarHBondContact O-N 2.92Å; L483-A486 WeakPolarHBondContact O-CB 3.29Å; L483-A486 PolarHBondContact O-N 2.91Å; L483-I487 WeakPolarHBondContact O-CG1 3.46Å; L483-I487 PolarHBondContact O-N 3.18Å; L483-I487 VanDerWaalsContact O-N 3.09Å
484L97.3Very high93.6Very high86 Ų8634.9 Ų34.945%0.4519%0.194SC..Hα-helixtrans-59.7-40.1170179.359.1000110.7Y333 T480 S481 A486 I487 L488Y333-L484 HydrophobicContact CE1-CB 4.42Å; Y333-L484 HydrophobicContact CE1-CD2 4.47Å; Y333-L484 HydrophobicContact CE1-CG 4.2Å; T480-L484 PolarHBondContact O-N 3.35Å; S481-L484 PolarHBondContact O-N 3.22Å; L484-A486 VanDerWaalsContact C-N 3.33Å; L484-A486 PolarHBondContact O-N 3.04Å; L484-I487 PolarHBondContact O-N 2.88Å; L484-L488 HydrophobicContact CD1-CD1 4.29Å; L484-L488 HydrophobicContact CD1-CG 4.27Å; L484-L488 HydrophobicContact CG-CD1 4.07Å; L484-L488 HydrophobicContact CG-CG 4.48Å; L484-L488 WeakPolarHBondContact O-CB 3.35Å; L484-L488 VanDerWaalsContact O-CG 3.26Å; L484-L488 WeakPolarHBondContact O-CG 3.33Å; L484-L488 PolarHBondContact O-N 3.42Å
485G95.6Very high93.3Very high0 Ų034.9 Ų34.90%019%0.194CC..Hα-helixtrans-62-37.7175.400000113.4S481 P482 L483 L488 A489S481-G485 PolarHBondContact O-N 2.79Å; P482-G485 CarbonylContact O-C 3.31Å; P482-G485 WeakPolarHBondContact O-CA 3.43Å; P482-G485 PolarHBondContact O-N 2.97Å; P482-G485 VanDerWaalsContact O-N 3.14Å; L483-G485 PolarHBondContact O-N 2.92Å; G485-L488 PolarHBondContact O-N 3.45Å; G485-A489 VanDerWaalsContact O-CB 3.29Å; G485-A489 WeakPolarHBondContact O-CB 3.33Å; G485-A489 PolarHBondContact O-N 3.45Å
486A96.5Very high92.8Very high4 Ų434 Ų343%0.03319%0.191CC..Hα-helixtrans-64.6-47.5176.400000111S387 L390 A391 P482 L483 L484 L488 A489 L490S387-A486 WeakPolarHBondContact O-CB 3.37Å; S387-A486 PolarHBondContact OG-O 2.78Å; S387-A486 VanDerWaalsContact OG-O 3.11Å; L390-A486 HydrophobicContact CB-CB 3.88Å; A391-A486 HydrophobicContact CB-CB 4.07Å; P482-A486 PolarHBondContact O-N 3.34Å; L483-A486 WeakPolarHBondContact O-CB 3.29Å; L483-A486 PolarHBondContact O-N 2.91Å; L484-A486 VanDerWaalsContact C-N 3.33Å; L484-A486 PolarHBondContact O-N 3.04Å; A486-L488 VanDerWaalsContact C-N 3.35Å; A486-L488 PolarHBondContact O-N 3.41Å; A486-A489 WeakPolarHBondContact O-CB 3.17Å; A486-A489 PolarHBondContact O-N 3.26Å; A486-L490 PolarHBondContact O-N 2.94Å
487I96.5Very high91.8Very high115 Ų11537.9 Ų37.959%0.5921%0.213SC*.Hα-helixtrans-60.6-45.8176.6-63.1166.7000110.6L483 L484 A489 L490L483-I487 WeakPolarHBondContact O-CG1 3.46Å; L483-I487 PolarHBondContact O-N 3.18Å; L483-I487 VanDerWaalsContact O-N 3.09Å; L484-I487 PolarHBondContact O-N 2.88Å; I487-A489 VanDerWaalsContact C-N 3.31Å; I487-A489 PolarHBondContact O-N 3.43Å; I487-L490 WeakPolarHBondContact O-CB 3.49Å; I487-L490 PolarHBondContact O-N 3.41Å
488L94.9Very high90.8Very high55 Ų5539.6 Ų39.629%0.28822%0.216SC..Hα-helixtrans-65.5-33.6177.8-68.5174.6000112.4I330 Y333 L484 G485 A486 L490 A491I330-L488 HydrophobicContact CG1-CB 4.48Å; I330-L488 HydrophobicContact CG2-CB 3.99Å; Y333-L488 HydrophobicContact CD1-CD1 3.71Å; Y333-L488 HydrophobicContact CE1-CD1 4Å; Y333-L488 HydrophobicContact CG-CD1 4.33Å; L484-L488 HydrophobicContact CD1-CD1 4.29Å; L484-L488 HydrophobicContact CD1-CG 4.27Å; L484-L488 HydrophobicContact CG-CD1 4.07Å; L484-L488 HydrophobicContact CG-CG 4.48Å; L484-L488 WeakPolarHBondContact O-CB 3.35Å; L484-L488 VanDerWaalsContact O-CG 3.26Å; L484-L488 WeakPolarHBondContact O-CG 3.33Å; L484-L488 PolarHBondContact O-N 3.42Å; G485-L488 PolarHBondContact O-N 3.45Å; A486-L488 VanDerWaalsContact C-N 3.35Å; A486-L488 PolarHBondContact O-N 3.41Å; L488-L490 VanDerWaalsContact C-N 3.26Å; L488-L490 PolarHBondContact O-N 3.15Å; L488-A491 WeakPolarHBondContact O-CB 3.39Å; L488-A491 PolarHBondContact O-N 3.35Å; L488-A491 VanDerWaalsContact O-N 3.1Å
489A92.9Very high89.7Confident0 Ų043.9 Ų43.90%024%0.244CC..Hα-helixtrans-63.8-30.1176.100000112.4I334 Q386 G485 A486 I487 A491 L492I334-A489 HydrophobicContact CD1-CB 3.86Å; Q386-A489 HydrophobicContact CB-CB 4.48Å; Q386-A489 HydrophobicContact CG-CB 4.07Å; G485-A489 VanDerWaalsContact O-CB 3.29Å; G485-A489 WeakPolarHBondContact O-CB 3.33Å; G485-A489 PolarHBondContact O-N 3.45Å; A486-A489 WeakPolarHBondContact O-CB 3.17Å; A486-A489 PolarHBondContact O-N 3.26Å; I487-A489 VanDerWaalsContact C-N 3.31Å; I487-A489 PolarHBondContact O-N 3.43Å; A489-A491 PolarHBondContact O-N 3.23Å; A489-L492 WeakPolarHBondContact O-CB 3.41Å; A489-L492 PolarHBondContact O-N 3Å; A489-L492 VanDerWaalsContact O-N 3.14Å
490L92.7Very high88.8Confident79 Ų7947.6 Ų47.641%0.41426%0.264SS..Hα-helixtrans-66.3-24.2174.4-63.5174.7000113L384 A486 I487 L488 L492L384-L490 HydrophobicContact CD2-CD2 4.1Å; A486-L490 PolarHBondContact O-N 2.94Å; I487-L490 WeakPolarHBondContact O-CB 3.49Å; I487-L490 PolarHBondContact O-N 3.41Å; L488-L490 VanDerWaalsContact C-N 3.26Å; L488-L490 PolarHBondContact O-N 3.15Å; L490-L492 PolarHBondContact O-N 3.21Å
491A90.5Very high87.8Confident51 Ų5144.6 Ų44.642%0.42125%0.245SC..THydrogen-bonded Turntrans-79.1-5.6175.800000113.4I330 L488 A489I330-A491 HydrophobicContact CD1-CB 4.18Å; L488-A491 WeakPolarHBondContact O-CB 3.39Å; L488-A491 PolarHBondContact O-N 3.35Å; L488-A491 VanDerWaalsContact O-N 3.1Å; A489-A491 PolarHBondContact O-N 3.23Å
492L90.4Very high86.6Confident3 Ų348.2 Ų48.22%0.01626%0.263CS..SBendtrans-83.6151.8172.8-66.5173.7000111R327 I330 L331 I334 R383 Y432 I436 A489 L490R327-L492 HydrophobicContact CB-CD2 4.18Å; R327-L492 HydrophobicContact CG-CD2 4.16Å; I330-L492 HydrophobicContact CB-CD2 4.11Å; I330-L492 HydrophobicContact CB-CG 4.47Å; I330-L492 HydrophobicContact CD1-CD2 4.18Å; I330-L492 HydrophobicContact CG2-CD1 3.81Å; I330-L492 HydrophobicContact CG2-CD2 3.98Å; I330-L492 HydrophobicContact CG2-CG 3.8Å; L331-L492 HydrophobicContact CD2-CD1 3.97Å; I334-L492 HydrophobicContact CD1-CD1 4.09Å; R383-L492 WeakPolarHBondContact CD-O 3.24Å; Y432-L492 HydrophobicContact CD1-CD1 4.31Å; Y432-L492 HydrophobicContact CE1-CB 4.07Å; Y432-L492 HydrophobicContact CE1-CD1 3.6Å; Y432-L492 WeakPolarHBondContact OH-CB 3.44Å; I436-L492 HydrophobicContact CD1-CB 4.42Å; I436-L492 HydrophobicContact CD1-CD1 4Å; I436-L492 HydrophobicContact CD1-CD2 4.19Å; I436-L492 HydrophobicContact CD1-CG 4.45Å; A489-L492 WeakPolarHBondContact O-CB 3.41Å; A489-L492 PolarHBondContact O-N 3Å; A489-L492 VanDerWaalsContact O-N 3.14Å; L490-L492 PolarHBondContact O-N 3.21Å
493P87.6Confident85.7Confident18 Ų1851 Ų5112%0.11728%0.28CS..PPolyproline II helixtrans-71.5150.4179.431.9-38.6000111.9Y432Y432-P493 WeakPolarHBondContact CE2-O 3.39Å; Y432-P493 PolarHBondContact OH-O 2.95Å
494E87.4Confident84.7Confident28 Ų2849.8 Ų49.813%0.13127%0.274CS..PPolyproline II helixtrans-68.2140.7167.1-172.953.9-100.800110.2S381 R382 R383 A496 R498S381-E494 WeakPolarHBondContact CB-OE2 3.23Å; S381-E494 PolarHBondContact OG-OE2 2.85Å; R382-E494 PolarHBondContact N-OE1 3.48Å; R382-E494 PolarHBondContact N-OE2 2.91Å; R383-E494 VanDerWaalsContact CB-OE2 3.29Å; R383-E494 WeakPolarHBondContact CB-OE2 3.02Å; R383-E494 PolarHBondContact N-OE2 3.01Å; E494-A496 HydrophobicContact CG-CB 4.38Å; E494-A496 PolarHBondContact OE1-N 3.35Å; E494-R498 WeakPolarHBondContact O-CD 3.28Å
495T84.2Confident83.6Confident4 Ų452.1 Ų52.13%0.02528%0.283CS..  trans-126.4-6.6-176.244.90000112.7R382 Y432 E435 I436 D497 R498 W510R382-T495 WeakPolarHBondContact CD-OG1 3.47Å; Y432-T495 HydrophobicContact CD2-CG2 4.23Å; Y432-T495 VanDerWaalsContact CD2-OG1 3.24Å; Y432-T495 WeakPolarHBondContact CD2-OG1 3.3Å; Y432-T495 HydrophobicContact CE2-CG2 3.87Å; Y432-T495 WeakPolarHBondContact CE2-OG1 3.48Å; E435-T495 HydrophobicContact CB-CG2 4.17Å; E435-T495 WeakPolarHBondContact OE2-CB 3.43Å; E435-T495 PolarHBondContact OE2-OG1 2.8Å; I436-T495 HydrophobicContact CG1-CG2 4.18Å; T495-D497 PolarHBondContact O-N 3.41Å; T495-R498 PolarHBondContact O-N 2.87Å; T495-W510 HydrophobicContact CG2-CZ2 4.49Å
496A77.6Confident82.6Confident15 Ų1553.1 Ų53.112%0.12429%0.288CS..THydrogen-bonded Turntrans-59.8128.3171.200000110.9E494 R498E494-A496 HydrophobicContact CG-CB 4.38Å; E494-A496 PolarHBondContact OE1-N 3.35Å; A496-R498 WeakPolarHBondContact O-CG 3.47Å; A496-R498 PolarHBondContact O-N 3.42Å
497D73.1Confident81.7Confident155 Ų15553 Ų5383%0.82929%0.287SS*.THydrogen-bonded Turntrans52.422.4-179.7-57.2-38.7000116.5T495T495-D497 PolarHBondContact O-N 3.41Å
498R74.7Confident80.9Confident86 Ų8650.8 Ų50.833%0.32527%0.274SS..PPolyproline II helixtrans-101147.2175.4-63.3-164.6-173.4-167.1-0.8112.2E494 T495 A496 W510 M514E494-R498 WeakPolarHBondContact O-CD 3.28Å; T495-R498 PolarHBondContact O-N 2.87Å; A496-R498 WeakPolarHBondContact O-CG 3.47Å; A496-R498 PolarHBondContact O-N 3.42Å; R498-W510 HydrophobicContact CB-CZ2 4.48Å; R498-M514 HydrophobicContact CG-SD 4.36Å; R498-M514 VanDerWaalsContact CZ-SD 3.53Å; R498-M514 PolarHBondContact NH1-SD 2.99Å; R498-M514 VanDerWaalsContact NH1-SD 3.37Å
499P70.4Confident80Confident95 Ų9551.5 Ų51.562%0.61728%0.278SS*.PPolyproline II helixtrans-62.5140.5173.227.2-33.7000110.4W510P499-W510 WeakPolarHBondContact O-CH2 3.37Å
500L76.3Confident78.9Confident78 Ų7852.5 Ų52.541%0.40828%0.282SS..PPolyproline II helixtrans-71.7141.2179.4-64.8164.9000110E435E435-L500 HydrophobicContact CB-CD2 3.74Å; E435-L500 HydrophobicContact CG-CD2 3.64Å
501P74.7Confident77.6Confident2 Ų253.9 Ų53.91%0.01329%0.29CS..PPolyproline II helixtrans-70.9137.1174.623.9-22000109.7E435 P438 T439 D506 V507 W510E435-P501 VanDerWaalsContact O-CD 3.26Å; E435-P501 WeakPolarHBondContact O-CD 3.3Å; P438-P501 WeakPolarHBondContact CA-O 3.35Å; P438-P501 HydrophobicContact CB-CB 4.07Å; P438-P501 HydrophobicContact CB-CG 4.3Å; T439-P501 PolarHBondContact N-O 3.02Å; T439-P501 VanDerWaalsContact N-O 3.12Å; P501-D506 HydrophobicContact CB-CB 4.09Å; P501-V507 HydrophobicContact CB-CG2 3.65Å; P501-V507 HydrophobicContact CG-CG2 3.94Å; P501-W510 HydrophobicContact CB-CE3 4.19Å; P501-W510 HydrophobicContact CB-CZ3 3.59Å; P501-W510 VanDerWaalsContact CD-CZ3 3.48Å; P501-W510 HydrophobicContact CG-CE3 4.33Å; P501-W510 HydrophobicContact CG-CH2 4.12Å; P501-W510 HydrophobicContact CG-CZ3 3.49Å; P501-W510 VanDerWaalsContact CG-CZ3 3.49Å
502D70.6Confident76.1Confident89 Ų8957.3 Ų57.348%0.47630%0.3SS..  trans-98.6-36.8175.8-78-40.3000111.6T439 V440 D506T439-D502 VanDerWaalsContact CG2-OD1 3.24Å; T439-D502 WeakPolarHBondContact CG2-OD1 3.34Å; T439-D502 WeakPolarHBondContact OG1-CA 3.22Å; T439-D502 PolarHBondContact OG1-O 3.47Å; T439-D502 PolarHBondContact OG1-OD1 3.27Å; V440-D502 WeakPolarHBondContact CG1-O 3.2Å; D502-D506 PolarHBondContact N-OD2 3Å; D502-D506 VanDerWaalsContact N-OD2 3.15Å
503T77.7Confident74.4Confident58 Ų5863.5 Ų63.536%0.35632%0.323SS..SBendtrans-118.1165.8-177.570.90000112.9E505 D506T503-E505 VanDerWaalsContact C-N 3.29Å; T503-D506 PolarHBondContact N-OD2 3.15Å; T503-D506 WeakPolarHBondContact O-CB 3.43Å; T503-D506 PolarHBondContact O-N 3.44Å; T503-D506 PolarHBondContact OG1-N 3.2Å; T503-D506 PolarHBondContact OG1-OD1 3.23Å; T503-D506 PolarHBondContact OG1-OD2 2.74Å
504L77.2Confident72.7Confident25 Ų2564.1 Ų64.113%0.13133%0.325CS..Hα-helixtrans-66.2-33.1175.2-69.6165000111.9D317 M324 P438 V441 D506 V507 E508D317-L504 HydrophobicContact CB-CD1 4.24Å; M324-L504 HydrophobicContact CE-CD2 3.96Å; M324-L504 HydrophobicContact CG-CD2 3.9Å; M324-L504 HydrophobicContact SD-CD2 4.24Å; P438-L504 HydrophobicContact CG-CD2 4.06Å; V441-L504 HydrophobicContact CG2-CD2 4.21Å; L504-D506 VanDerWaalsContact C-N 3.33Å; L504-V507 WeakPolarHBondContact O-CB 3.45Å; L504-V507 PolarHBondContact O-N 3.24Å; L504-E508 PolarHBondContact O-N 3.03Å
505E73.9Confident70.8Confident135 Ų13565.7 Ų65.763%0.63134%0.343SS*.Hα-helixtrans-68.2-34.1178-64.6173.9-167.900111.4T503 V507 E508 N509T503-E505 VanDerWaalsContact C-N 3.29Å; E505-V507 PolarHBondContact O-N 3.47Å; E505-E508 PolarHBondContact O-N 3.05Å; E505-N509 PolarHBondContact O-N 3.39Å
506D73.9Confident68.8Low21 Ų2168.5 Ų68.511%0.11236%0.361CS..Hα-helixtrans-61.4-31.7173.6-58.4-31.8000112P501 D502 T503 L504 W510 R513P501-D506 HydrophobicContact CB-CB 4.09Å; D502-D506 PolarHBondContact N-OD2 3Å; D502-D506 VanDerWaalsContact N-OD2 3.15Å; T503-D506 PolarHBondContact N-OD2 3.15Å; T503-D506 WeakPolarHBondContact O-CB 3.43Å; T503-D506 PolarHBondContact O-N 3.44Å; T503-D506 PolarHBondContact OG1-N 3.2Å; T503-D506 PolarHBondContact OG1-OD1 3.23Å; T503-D506 PolarHBondContact OG1-OD2 2.74Å; L504-D506 VanDerWaalsContact C-N 3.33Å; D506-W510 PolarHBondContact O-N 3.48Å; D506-R513 IonicContact OD1-CZ 3.07Å; D506-R513 IonicContact OD1-NH1 3.22Å; D506-R513 PolarHBondContact OD1-NH1 3.11Å; D506-R513 IonicContact OD1-NH2 2.74Å; D506-R513 PolarHBondContact OD1-NH2 3.25Å
507V78.3Confident67.4Low0 Ų071.8 Ų71.80%038%0.376CS..Hα-helixtrans-76.8-35.4178.7177.30000111.6M324 P438 P501 L504 E505 W510M324-V507 HydrophobicContact CG-CB 4.13Å; M324-V507 HydrophobicContact CG-CG1 3.8Å; M324-V507 HydrophobicContact SD-CB 3.63Å; M324-V507 HydrophobicContact SD-CG1 3.23Å; M324-V507 WeakPolarHBondContact SD-CG1 3.45Å; M324-V507 HydrophobicContact SD-CG2 3.69Å; P438-V507 HydrophobicContact CB-CG2 4.25Å; P438-V507 HydrophobicContact CG-CG2 4.01Å; P501-V507 HydrophobicContact CB-CG2 3.65Å; P501-V507 HydrophobicContact CG-CG2 3.94Å; L504-V507 WeakPolarHBondContact O-CB 3.45Å; L504-V507 PolarHBondContact O-N 3.24Å; E505-V507 PolarHBondContact O-N 3.47Å; V507-W510 WeakPolarHBondContact O-CB 3.38Å
508E80.1Confident66.1Low70 Ų7070.3 Ų70.333%0.32737%0.367SS..Hα-helixtrans-68.9-38.6175.6-67.4-170.2136.900111.9T321 P322 L504 E505 W510T321-E508 WeakPolarHBondContact CB-OE1 3.32Å; T321-E508 HydrophobicContact CG2-CG 4.3Å; T321-E508 WeakPolarHBondContact CG2-OE1 3.33Å; P322-E508 WeakPolarHBondContact CD-OE1 3.34Å; L504-E508 PolarHBondContact O-N 3.03Å; E505-E508 PolarHBondContact O-N 3.05Å; E508-W510 VanDerWaalsContact C-N 3.3Å; E508-W510 PolarHBondContact O-N 2.62Å
509N75.6Confident64.6Low69 Ų6973.7 Ų73.737%0.36939%0.386SS..THydrogen-bonded Turntrans-91.716-179.7-65.9-28.2000113.8E505 D511 I512 R513E505-N509 PolarHBondContact O-N 3.39Å; N509-D511 VanDerWaalsContact C-N 3.29Å; N509-D511 PolarHBondContact O-N 3.22Å; N509-I512 PolarHBondContact O-N 3.12Å; N509-I512 VanDerWaalsContact O-N 3.16Å; N509-R513 PolarHBondContact O-N 2.66Å
510W70.5Confident63Low22 Ų2275.7 Ų75.78%0.08339%0.392CS..THydrogen-bonded Turntrans-57.8-38.6-172.2-169.9-86.5000113.3T495 R498 P499 P501 D506 V507 E508 M514T495-W510 HydrophobicContact CG2-CZ2 4.49Å; R498-W510 HydrophobicContact CB-CZ2 4.48Å; P499-W510 WeakPolarHBondContact O-CH2 3.37Å; P501-W510 HydrophobicContact CB-CE3 4.19Å; P501-W510 HydrophobicContact CB-CZ3 3.59Å; P501-W510 VanDerWaalsContact CD-CZ3 3.48Å; P501-W510 HydrophobicContact CG-CE3 4.33Å; P501-W510 HydrophobicContact CG-CH2 4.12Å; P501-W510 HydrophobicContact CG-CZ3 3.49Å; P501-W510 VanDerWaalsContact CG-CZ3 3.49Å; D506-W510 PolarHBondContact O-N 3.48Å; V507-W510 WeakPolarHBondContact O-CB 3.38Å; E508-W510 VanDerWaalsContact C-N 3.3Å; E508-W510 PolarHBondContact O-N 2.62Å; W510-M514 WeakPolarHBondContact O-CG 3.49Å
511D65.1Low61.3Low108 Ų10878.1 Ų78.158%0.57841%0.405SS*.THydrogen-bonded Turntrans-80.5-30.9-179.2-60.1-32.1000111.9N509N509-D511 VanDerWaalsContact C-N 3.29Å; N509-D511 PolarHBondContact O-N 3.22Å
512I59.5Low59.4Low123 Ų12386 Ų8663%0.63144%0.441SS*.THydrogen-bonded Turntrans-76.1-38-179-58.8173.2000111.2N509 M514 A515 P516N509-I512 PolarHBondContact O-N 3.12Å; N509-I512 VanDerWaalsContact O-N 3.16Å; I512-M514 VanDerWaalsContact C-N 3.25Å; I512-M514 PolarHBondContact O-N 3.28Å; I512-A515 PolarHBondContact O-N 3.19Å; I512-P516 VanDerWaalsContact O-CD 3.25Å; I512-P516 WeakPolarHBondContact O-CD 3.49Å
513R54.6Low57.8Low132 Ų13287.3 Ų87.350%0.49846%0.455SS..THydrogen-bonded Turntrans-69.6-19.8177.2-76.4-167.6-178.3174.711.7114.1D506 N509 P516 I517D506-R513 IonicContact OD1-CZ 3.07Å; D506-R513 IonicContact OD1-NH1 3.22Å; D506-R513 PolarHBondContact OD1-NH1 3.11Å; D506-R513 IonicContact OD1-NH2 2.74Å; D506-R513 PolarHBondContact OD1-NH2 3.25Å; N509-R513 PolarHBondContact O-N 2.66Å; R513-P516 WeakPolarHBondContact O-CD 3.5Å; R513-I517 WeakPolarHBondContact O-CD1 3.25Å
514M51.9Low55.7Low31 Ų3194.7 Ų94.715%0.15348%0.478CS..THydrogen-bonded Turntrans-85.6-22.8-179.6-76.4-98.888.900113.2R498 W510 I512 I517 L518R498-M514 HydrophobicContact CG-SD 4.36Å; R498-M514 VanDerWaalsContact CZ-SD 3.53Å; R498-M514 PolarHBondContact NH1-SD 2.99Å; R498-M514 VanDerWaalsContact NH1-SD 3.37Å; W510-M514 WeakPolarHBondContact O-CG 3.49Å; I512-M514 VanDerWaalsContact C-N 3.25Å; I512-M514 PolarHBondContact O-N 3.28Å; M514-I517 HydrophobicContact CE-CB 4.09Å; M514-I517 HydrophobicContact CE-CD1 3.71Å; M514-I517 HydrophobicContact CE-CG1 4.47Å; M514-I517 HydrophobicContact CE-CG2 4.12Å; M514-I517 PolarHBondContact O-N 3.02Å; M514-L518 PolarHBondContact O-N 3.2Å
515A46.1Very low53.6Low62 Ų62102 Ų10251%0.51251%0.511SS..Hα-helixtrans-56.6-48.3175.500000113.1I512 I517I512-A515 PolarHBondContact O-N 3.19Å; A515-I517 PolarHBondContact O-N 3.33Å
516P42.9Very low51.7Low63 Ų63102.9 Ų102.941%0.40952%0.52SS..Hα-helixtrans-78.6-15.1179.628.6-34.5000114.7I512 R513 N520I512-P516 VanDerWaalsContact O-CD 3.25Å; I512-P516 WeakPolarHBondContact O-CD 3.49Å; R513-P516 WeakPolarHBondContact O-CD 3.5Å; P516-N520 PolarHBondContact O-N 3.4Å; P516-N520 PolarHBondContact O-ND2 2.96Å
517I49Very low49.6Very low84 Ų84110.9 Ų110.943%0.43155%0.554SS.*Hα-helixtrans-81.2-31.8178.5-64.4171.1000111R513 M514 A515 E519R513-I517 WeakPolarHBondContact O-CD1 3.25Å; M514-I517 HydrophobicContact CE-CB 4.09Å; M514-I517 HydrophobicContact CE-CD1 3.71Å; M514-I517 HydrophobicContact CE-CG1 4.47Å; M514-I517 HydrophobicContact CE-CG2 4.12Å; M514-I517 PolarHBondContact O-N 3.02Å; A515-I517 PolarHBondContact O-N 3.33Å; I517-E519 VanDerWaalsContact C-N 3.33Å
518L45.6Very low47.4Very low124 Ų124117.7 Ų117.765%0.64959%0.591SS**Hα-helixtrans-74.5-25.9173.8-72.3166.2000112.4M514M514-L518 PolarHBondContact O-N 3.2Å
519E42.3Very low45.1Very low156 Ų156119.5 Ų119.573%0.72961%0.608SS**Hα-helixtrans-79.2-22.9177.4-151.4166.3-154.400112.7I517I517-E519 VanDerWaalsContact C-N 3.33Å
520N38.1Very low43Very low137 Ų137122 Ų12273%0.73363%0.629SS**THydrogen-bonded Turntrans-94.18.8176.5-73.2-59.4000114.1P516P516-N520 PolarHBondContact O-N 3.4Å; P516-N520 PolarHBondContact O-ND2 2.96Å
521L40.8Very low41.3Very low129 Ų129130.4 Ų130.468%0.67567%0.669SS**  trans-10053170.8-73.5165.5000109.7
522E34.7Very low39.9Very low167 Ų167130.7 Ų130.778%0.7868%0.68SS**  trans-72.1147.5157-75.9-174.615900109Y524E522-Y524 PolarHBondContact O-N 2.91Å
523P37Very low38.6Very low118 Ų118130 Ų13077%0.76669%0.685SS**  trans-61.8132.9-179.1-0.812.3000109.2E525P523-E525 PolarHBondContact O-N 3.38Å
524Y32.7Very low37.5Very low213 Ų213130.1 Ų130.184%0.83571%0.705SS**  trans-53.1101.2168.3-158-90.6000108.2E522 D526E522-Y524 PolarHBondContact O-N 2.91Å; Y524-D526 PolarHBondContact O-N 2.99Å
525E33.5Very low36.5Very low177 Ų177135.7 Ų135.783%0.82774%0.735SS**  trans-60.2133.5168.3-81.4-171.5151.500108.4P523 F527P523-E525 PolarHBondContact O-N 3.38Å; E525-F527 PolarHBondContact O-N 3Å; E525-F527 VanDerWaalsContact O-N 3.1Å
526D32.7Very low36Very low155 Ų155144.4 Ų144.483%0.82977%0.771SS**  trans-53.1113177.1-79.3-47000110.1Y524 D528Y524-D526 PolarHBondContact O-N 2.99Å; D526-D528 PolarHBondContact O-N 2.71Å
527F31.2Very low35.7Very low189 Ų189148.5 Ų148.583%0.82979%0.789SS**  trans-80.5101.9167.2-124-90.8000107.5E525E525-F527 PolarHBondContact O-N 3Å; E525-F527 VanDerWaalsContact O-N 3.1Å
528D30.7Very low35Very low142 Ų142151.9 Ų151.976%0.75981%0.808SS**PPolyproline II helixtrans-54.7135.8169.1-84.9-37.7000110.4D526D526-D528 PolarHBondContact O-N 2.71Å
529P32.8Very low34.4Very low108 Ų108153.4 Ų153.470%0.70182%0.817SS**PPolyproline II helixtrans-73.7139.617629.9-31.3000110E531P529-E531 PolarHBondContact O-N 3.28Å
530P31.8Very low33.9Very low123 Ų123153.3 Ų153.380%0.79982%0.822SS**PPolyproline II helixtrans-71.4120173.528-30.3000109.8S532P530-S532 PolarHBondContact O-N 3.21Å; P530-S532 VanDerWaalsContact O-N 3.15Å
531E34.7Very low33.6Very low197 Ų197154.3 Ų154.392%0.92183%0.827SS**  trans-56.6113.3162.5-74.3-175.1153.300109P529P529-E531 PolarHBondContact O-N 3.28Å
532S35.1Very low33.2Very low115 Ų115156 Ų15680%0.80484%0.838SS**  trans-103.6101.9165.843.30000108.6P530 C534P530-S532 PolarHBondContact O-N 3.21Å; P530-S532 VanDerWaalsContact O-N 3.15Å; S532-C534 PolarHBondContact O-N 3.2Å
533S33.4Very low33.1Very low108 Ų108155.2 Ų155.276%0.75584%0.842SS**  trans-68.8110.1166.539.60000109.8
534C29.7Very low32.8Very low134 Ų134158.1 Ų158.191%0.90585%0.848SS**  trans-88.2101.7160.6-92.70000108.4S532S532-C534 PolarHBondContact O-N 3.2Å
535N31.7Very low32.8Very low148 Ų148153.5 Ų153.579%0.79185%0.849SS**  trans-99.1138.1160.3-92.8-22.1000109.1
536I35.8Very low32.7Very low246 Ų246151.4 Ų151.4100%1.26285%0.851SS**  trans83.80169.6-48.1175.6000116.1

Retrieved 536 of 536 residues in 166.4 ms (Link to these results)

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