A0A075BLW8_DROME Loading...

Innexin

Structural component of the gap junctions.

AlphaFold DB , UniProt , Accession A0A075BLW8, Species DROME (Drosophila melanogaster, Fruit fly), Gene zpg, Length 356 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M43.7Very low60.4Low213 Ų213118.3 Ų118.3100%1.04962%0.624SS**  0-43.80-132.9169.5169.600113.6A3M1-A3 PolarHBondContact O-N 2.87Å
2Y50.7Low60.7Low221 Ų221114.3 Ų114.387%0.86760%0.603SS**Hα-helixtrans-62.8-28.2-179.8-75.2-83.2000116.4K6Y2-K6 PolarHBondContact O-N 3.46Å
3A56.8Low61.2Low86 Ų86114.1 Ų114.171%0.71160%0.596SS**Hα-helixtrans-70.2-35.4-178.200000113.7M1 P7M1-A3 PolarHBondContact O-N 2.87Å; A3-P7 WeakPolarHBondContact O-CD 3.39Å
4A55Low61Low83 Ų83118.8 Ų118.869%0.68661%0.61SS**Hα-helixtrans-73.7-28.7-178.500000113P7A4-P7 WeakPolarHBondContact O-CD 3.42Å; A4-P7 WeakPolarHBondContact O-CG 3.28Å
5V59.5Low61.1Low80 Ų80120.1 Ų120.149%0.48561%0.61SS.*Hα-helixtrans-88.8-19.3-178.2-169.40000112.1L8 S9V5-L8 WeakPolarHBondContact O-CB 3.31Å; V5-L8 PolarHBondContact O-N 2.68Å; V5-L8 VanDerWaalsContact O-N 3.1Å; V5-S9 WeakPolarHBondContact O-CB 3.32Å; V5-S9 PolarHBondContact O-N 3.2Å
6K63.4Low60.9Low161 Ų161116.2 Ų116.270%0.760%0.597SS**Hα-helixtrans-53.8-45.2178.3-159.9175.9-174.8178.40114.3Y2 S9 K10Y2-K6 PolarHBondContact O-N 3.46Å; K6-S9 PolarHBondContact O-N 3.06Å; K6-K10 PolarHBondContact O-N 3.24Å
7P70.4Confident61.4Low84 Ų84109.8 Ų109.855%0.54557%0.565SS.*Hα-helixtrans-65.6-38.1174.622.3-31.5000112.8A3 A4 K10 Y11A3-P7 WeakPolarHBondContact O-CD 3.39Å; A4-P7 WeakPolarHBondContact O-CD 3.42Å; A4-P7 WeakPolarHBondContact O-CG 3.28Å; P7-K10 PolarHBondContact O-N 2.98Å; P7-Y11 WeakPolarHBondContact O-CB 3.48Å; P7-Y11 PolarHBondContact O-N 3.14Å
8L62Low62.2Low74 Ų74108.6 Ų108.639%0.38756%0.556SS.*Hα-helixtrans-66.1-42.1177-164.975.1000111.5V5 Y11 L12 A33V5-L8 WeakPolarHBondContact O-CB 3.31Å; V5-L8 PolarHBondContact O-N 2.68Å; V5-L8 VanDerWaalsContact O-N 3.1Å; L8-Y11 WeakPolarHBondContact O-CB 3.45Å; L8-Y11 PolarHBondContact O-N 2.91Å; L8-L12 HydrophobicContact CG-CD1 4.12Å; L8-L12 WeakPolarHBondContact O-CG 3.49Å; L8-L12 PolarHBondContact O-N 3.26Å; L8-A33 HydrophobicContact CD1-CB 4.07Å
9S65.7Low63.3Low62 Ų62104.2 Ų104.243%0.43453%0.533SS..Hα-helixtrans-58.9-47.9174.2178.40000111V5 K6 Y11 L12 Q13V5-S9 WeakPolarHBondContact O-CB 3.32Å; V5-S9 PolarHBondContact O-N 3.2Å; K6-S9 PolarHBondContact O-N 3.06Å; S9-Y11 VanDerWaalsContact C-N 3.28Å; S9-Y11 PolarHBondContact O-N 2.85Å; S9-L12 PolarHBondContact O-N 3.36Å; S9-Q13 VanDerWaalsContact O-CG 3.28Å; S9-Q13 WeakPolarHBondContact O-CG 3.36Å; S9-Q13 PolarHBondContact O-N 2.69Å
10K69.8Low64.3Low163 Ų163100.8 Ų100.871%0.70951%0.514SS*.Hα-helixtrans-63.6-31.9176.3-167.9179.1-179-1790112.9K6 P7K6-K10 PolarHBondContact O-N 3.24Å; P7-K10 PolarHBondContact O-N 2.98Å
11Y67.6Low65.3Low74 Ų7497.1 Ų97.129%0.2950%0.495SS..Hα-helixtrans-72.5-39.6177.8-177.2-97.5000112.8P7 L8 S9 K29 Y125P7-Y11 WeakPolarHBondContact O-CB 3.48Å; P7-Y11 PolarHBondContact O-N 3.14Å; L8-Y11 WeakPolarHBondContact O-CB 3.45Å; L8-Y11 PolarHBondContact O-N 2.91Å; S9-Y11 VanDerWaalsContact C-N 3.28Å; S9-Y11 PolarHBondContact O-N 2.85Å; Y11-K29 HydrophobicContact CE1-CB 3.84Å; Y11-K29 HydrophobicContact CE1-CD 4.37Å; Y11-K29 HydrophobicContact CE1-CG 4.1Å; Y11-Y125 HydrophobicContact CE2-CE2 4.33Å; Y11-Y125 WeakPolarHBondContact OH-CD2 3.33Å; Y11-Y125 WeakPolarHBondContact OH-CE2 3.4Å
12L64.4Low67.5Low71 Ų7191 Ų9137%0.37248%0.479SS..Hα-helixtrans-85.3-7.6178.6-66.9173.2000113.8L8 S9 F14 A33L8-L12 HydrophobicContact CG-CD1 4.12Å; L8-L12 WeakPolarHBondContact O-CG 3.49Å; L8-L12 PolarHBondContact O-N 3.26Å; S9-L12 PolarHBondContact O-N 3.36Å; L12-F14 PolarHBondContact O-N 2.75Å; L12-A33 HydrophobicContact CD2-CB 4.44Å
13Q66.9Low69.5Low111 Ų11182.6 Ų82.652%0.51945%0.448SS..PPolyproline II helixtrans-57129.7175.4-90.8170.51000111.5S9 K15S9-Q13 VanDerWaalsContact O-CG 3.28Å; S9-Q13 WeakPolarHBondContact O-CG 3.36Å; S9-Q13 PolarHBondContact O-N 2.69Å; Q13-K15 PolarHBondContact O-N 3.38Å
14F58.2Low71.2Confident180 Ų18078.9 Ų78.979%0.78942%0.416SS*.PPolyproline II helixtrans-65.2126.4168.6-67.5-81.7000108.8L12L12-F14 PolarHBondContact O-N 2.75Å
15K62.9Low72.9Confident138 Ų13876.5 Ų76.560%0.639%0.393SS*.PPolyproline II helixtrans-85156.3177.2-68-172.4176.2-174.40109.9Q13 V17Q13-K15 PolarHBondContact O-N 3.38Å; K15-V17 PolarHBondContact O-N 2.64Å
16S57.7Low74.5Confident58 Ų5874.5 Ų74.541%0.40638%0.38SS..SBendtrans-53.4-36.7173.752.70000112.5D144S16-D144 PolarHBondContact OG-OD1 3.36Å; S16-D144 VanDerWaalsContact OG-OD1 3.06Å
17V68.5Low75.9Confident8 Ų866.9 Ų66.95%0.04835%0.346CS..SBendtrans-113.2118.1178-176.10000110.4K15 I19 L139 K140 C143 D144 N338K15-V17 PolarHBondContact O-N 2.64Å; V17-I19 HydrophobicContact CG1-CG1 4.33Å; V17-I19 PolarHBondContact O-N 3.08Å; V17-L139 HydrophobicContact CG1-CB 4.42Å; V17-L139 HydrophobicContact CG1-CD2 4.11Å; V17-L139 HydrophobicContact CG1-CG 3.88Å; V17-K140 HydrophobicContact CG2-CG 4.48Å; V17-C143 HydrophobicContact CG1-CB 4.26Å; V17-C143 HydrophobicContact CG2-CB 4.08Å; V17-D144 HydrophobicContact CG2-CB 4.29Å; V17-N338 WeakPolarHBondContact CA-OD1 3.16Å
18H76.8Confident76.9Confident88 Ų8862.9 Ų62.941%0.40732%0.32SS..  trans-81.791.9175.2-63.883.3000110.2Y20 N338H18-Y20 VanDerWaalsContact C-N 3.33Å; H18-N338 WeakPolarHBondContact CA-OD1 3.04Å; H18-N338 WeakPolarHBondContact CB-OD1 3.21Å; H18-N338 PolarHBondContact N-OD1 3.3Å; H18-N338 PolarHBondContact O-ND2 3.28Å; H18-N338 PolarHBondContact O-OD1 3.44Å
19I82.3Confident78.2Confident25 Ų2560.9 Ų60.913%0.12831%0.309CS..  trans-78-22.6171.9-64.7165.4000111.5V17 W131 E135 L139V17-I19 HydrophobicContact CG1-CG1 4.33Å; V17-I19 PolarHBondContact O-N 3.08Å; I19-W131 PolarHBondContact O-NE1 2.94Å; I19-E135 HydrophobicContact CG2-CB 4.37Å; I19-E135 HydrophobicContact CG2-CG 3.79Å; I19-L139 HydrophobicContact CG1-CD2 4.27Å
20Y83.9Confident79.5Confident36 Ų3660.4 Ų60.414%0.14130%0.303CS..SBendtrans-111.3147.6-177.5-55.7-78.7000110.9H18 F24 T25 A128 W131H18-Y20 VanDerWaalsContact C-N 3.33Å; Y20-F24 AromaticContact CD1-CD1 3.38Å; Y20-F24 HydrophobicContact CD1-CD1 3.38Å; Y20-F24 AromaticContact CD1-CE1 3.6Å; Y20-F24 HydrophobicContact CD1-CE1 3.6Å; Y20-F24 HydrophobicContact CD1-CG 4.14Å; Y20-F24 HydrophobicContact CD1-CZ 4.48Å; Y20-F24 AromaticContact CE1-CD1 3.99Å; Y20-F24 HydrophobicContact CE1-CD1 3.99Å; Y20-F24 AromaticContact CE1-CE1 3.73Å; Y20-F24 HydrophobicContact CE1-CE1 3.73Å; Y20-F24 HydrophobicContact CG-CD1 4.27Å; Y20-T25 WeakPolarHBondContact CB-OG1 3.49Å; Y20-A128 HydrophobicContact CE1-CB 4.06Å; Y20-A128 PolarHBondContact OH-O 2.93Å; Y20-W131 AromaticContact CD1-CD1 3.82Å; Y20-W131 HydrophobicContact CE1-CB 4.45Å; Y20-W131 AromaticContact CE1-CD1 3.44Å; Y20-W131 VanDerWaalsContact CE1-CD1 3.44Å; Y20-W131 HydrophobicContact CE1-CG 4.31Å
21D85.8Confident80.8Confident24 Ų2452.6 Ų52.613%0.12827%0.269CS..  trans-73.1161.4164.5-71.8-32.9000110.8I23 F24 T25 Y182 K287 R334D21-I23 VanDerWaalsContact C-N 3.31Å; D21-I23 PolarHBondContact O-N 3.41Å; D21-F24 HydrophobicContact CB-CB 4.38Å; D21-F24 PolarHBondContact O-N 3.37Å; D21-T25 WeakPolarHBondContact O-CB 3.25Å; D21-T25 PolarHBondContact O-N 2.93Å; D21-T25 PolarHBondContact O-OG1 3.2Å; D21-Y182 PolarHBondContact OD2-OH 3.46Å; D21-K287 WeakPolarHBondContact OD2-CE 3.48Å; D21-K287 IonicContact OD2-NZ 2.78Å; D21-K287 PolarHBondContact OD2-NZ 3.24Å; D21-R334 VanDerWaalsContact CG-NH1 3.25Å; D21-R334 IonicContact OD1-CZ 3.45Å; D21-R334 IonicContact OD1-NH1 2.64Å; D21-R334 PolarHBondContact OD1-NH1 3.42Å; D21-R334 IonicContact OD1-NH2 3.71Å; D21-R334 PolarHBondContact OD1-NH2 3.3Å; D21-R334 IonicContact OD2-CZ 2.64Å; D21-R334 IonicContact OD2-NH1 2.92Å; D21-R334 PolarHBondContact OD2-NH1 2.93Å; D21-R334 IonicContact OD2-NH2 3.49Å; D21-R334 PolarHBondContact OD2-NH2 3.09Å
22A89.4Confident82.1Confident85 Ų8549.4 Ų49.470%0.70226%0.257SS*.Hα-helixtrans-55.7-45.6176.600000112F24 T25 L26A22-F24 PolarHBondContact O-N 3.4Å; A22-T25 WeakPolarHBondContact O-CB 3.39Å; A22-T25 PolarHBondContact O-N 2.95Å; A22-L26 WeakPolarHBondContact O-CB 3.49Å; A22-L26 PolarHBondContact O-N 3.42Å
23I92.7Very high83.5Confident44 Ų4446.6 Ų46.623%0.22624%0.244CC..Hα-helixtrans-64.3-42.2179.1-61.5171.7000111.2D21 T25 L26 H27 L283 I284 K287D21-I23 VanDerWaalsContact C-N 3.31Å; D21-I23 PolarHBondContact O-N 3.41Å; I23-T25 VanDerWaalsContact C-N 3.31Å; I23-T25 PolarHBondContact O-N 2.98Å; I23-L26 WeakPolarHBondContact O-CB 3.42Å; I23-L26 PolarHBondContact O-N 2.86Å; I23-H27 PolarHBondContact O-N 2.97Å; I23-L283 HydrophobicContact CG2-CB 4.04Å; I23-I284 HydrophobicContact CG2-CG1 3.96Å; I23-K287 HydrophobicContact CD1-CB 3.94Å; I23-K287 HydrophobicContact CD1-CD 4.37Å; I23-K287 HydrophobicContact CD1-CG 4.45Å; I23-K287 HydrophobicContact CG2-CB 4.29Å
24F91.9Very high84.8Confident7 Ų743 Ų433%0.03123%0.229CC..Hα-helixtrans-64.2-39.6176.9-161.5-66.7000111Y20 D21 A22 H27 S28 P127 A128 W131 Y182 C185 N189Y20-F24 AromaticContact CD1-CD1 3.38Å; Y20-F24 HydrophobicContact CD1-CD1 3.38Å; Y20-F24 AromaticContact CD1-CE1 3.6Å; Y20-F24 HydrophobicContact CD1-CE1 3.6Å; Y20-F24 HydrophobicContact CD1-CG 4.14Å; Y20-F24 HydrophobicContact CD1-CZ 4.48Å; Y20-F24 AromaticContact CE1-CD1 3.99Å; Y20-F24 HydrophobicContact CE1-CD1 3.99Å; Y20-F24 AromaticContact CE1-CE1 3.73Å; Y20-F24 HydrophobicContact CE1-CE1 3.73Å; Y20-F24 HydrophobicContact CG-CD1 4.27Å; D21-F24 HydrophobicContact CB-CB 4.38Å; D21-F24 PolarHBondContact O-N 3.37Å; A22-F24 PolarHBondContact O-N 3.4Å; F24-H27 PolarHBondContact O-N 3.01Å; F24-S28 WeakPolarHBondContact CD1-OG 3.35Å; F24-S28 WeakPolarHBondContact O-CB 3.36Å; F24-S28 PolarHBondContact O-N 2.89Å; F24-S28 PolarHBondContact O-OG 3.15Å; F24-P127 HydrophobicContact CZ-CB 4.1Å; F24-A128 HydrophobicContact CE1-CB 3.95Å; F24-W131 HydrophobicContact CZ-CB 4.42Å; F24-Y182 HydrophobicContact CD2-CE2 4.48Å; F24-C185 HydrophobicContact CE2-CB 3.86Å; F24-C185 HydrophobicContact CZ-CB 4.04Å; F24-N189 WeakPolarHBondContact CD2-ND2 3.46Å; F24-N189 WeakPolarHBondContact CE2-ND2 3.38Å
25T90.9Very high86.6Confident33 Ų3334.5 Ų34.520%0.20219%0.191CC..Hα-helixtrans-64.9-41.9176.5-55.50000111.3Y20 D21 A22 I23 K29 V30Y20-T25 WeakPolarHBondContact CB-OG1 3.49Å; D21-T25 WeakPolarHBondContact O-CB 3.25Å; D21-T25 PolarHBondContact O-N 2.93Å; D21-T25 PolarHBondContact O-OG1 3.2Å; A22-T25 WeakPolarHBondContact O-CB 3.39Å; A22-T25 PolarHBondContact O-N 2.95Å; I23-T25 VanDerWaalsContact C-N 3.31Å; I23-T25 PolarHBondContact O-N 2.98Å; T25-K29 HydrophobicContact CG2-CB 4.37Å; T25-K29 HydrophobicContact CG2-CD 4.05Å; T25-K29 HydrophobicContact CG2-CG 4.37Å; T25-K29 WeakPolarHBondContact O-CA 3.45Å; T25-K29 WeakPolarHBondContact O-CB 3.46Å; T25-K29 PolarHBondContact O-N 3.39Å; T25-V30 PolarHBondContact O-N 3.29Å
26L93Very high88.1Confident39 Ų3931.5 Ų31.520%0.20418%0.181CC..Iπ-helixtrans-59.6-50.2175.2-171.873.9000111A22 I23 V30 T31 W276 L279 V280 L283A22-L26 WeakPolarHBondContact O-CB 3.49Å; A22-L26 PolarHBondContact O-N 3.42Å; I23-L26 WeakPolarHBondContact O-CB 3.42Å; I23-L26 PolarHBondContact O-N 2.86Å; L26-V30 HydrophobicContact CD1-CB 4.05Å; L26-V30 HydrophobicContact CD1-CG1 4.18Å; L26-V30 HydrophobicContact CD1-CG2 4.16Å; L26-V30 WeakPolarHBondContact O-CB 3.4Å; L26-V30 PolarHBondContact O-N 2.72Å; L26-T31 PolarHBondContact O-N 2.97Å; L26-T31 PolarHBondContact O-OG1 3.42Å; L26-T31 VanDerWaalsContact O-OG1 3.05Å; L26-W276 HydrophobicContact CD1-CH2 3.63Å; L26-W276 HydrophobicContact CD1-CZ2 3.82Å; L26-W276 HydrophobicContact CG-CH2 4.42Å; L26-W276 HydrophobicContact CG-CZ2 4.21Å; L26-L279 HydrophobicContact CD2-CD2 4.1Å; L26-V280 HydrophobicContact CD2-CG2 4.36Å; L26-V280 HydrophobicContact CG-CG2 4.47Å; L26-L283 HydrophobicContact CD2-CD1 3.51Å
27H93.9Very high89.8Confident1 Ų131 Ų311%0.00518%0.181CC..Iπ-helixtrans-62.2-52178.8179.5-97.5000112.3I23 F24 T31 F124 N189 S193 V280 I284I23-H27 PolarHBondContact O-N 2.97Å; F24-H27 PolarHBondContact O-N 3.01Å; H27-T31 WeakPolarHBondContact O-CB 3.38Å; H27-T31 PolarHBondContact O-OG1 3.3Å; H27-F124 AromaticContact CD2-CD1 3.58Å; H27-F124 AromaticContact CD2-CE1 3.54Å; H27-F124 AromaticContact CE1-CD1 3.51Å; H27-F124 AromaticContact CE1-CE1 3.99Å; H27-F124 AromaticContact NE2-CD1 3.22Å; H27-F124 WeakPolarHBondContact NE2-CD1 3.17Å; H27-F124 AromaticContact NE2-CE1 3.22Å; H27-F124 WeakPolarHBondContact NE2-CE1 3.37Å; H27-N189 PolarHBondContact CE1-OD1 3.3Å; H27-N189 PolarHBondContact ND1-OD1 3.45Å; H27-N189 PolarHBondContact NE2-O 3.1Å; H27-S193 PolarHBondContact CD2-OG 2.83Å; H27-S193 PolarHBondContact NE2-OG 3.15Å; H27-S193 VanDerWaalsContact NE2-OG 3.15Å; H27-V280 HydrophobicContact CB-CG1 4.21Å; H27-I284 HydrophobicContact CB-CD1 3.71Å; H27-I284 HydrophobicContact CB-CG1 4.45Å; H27-I284 WeakPolarHBondContact CD2-CD1 3.46Å; H27-I284 VanDerWaalsContact CG-CD1 3.45Å
28S89.9Confident91.1Very high0 Ų031 Ų310%018%0.181CC..Iπ-helixtrans-93.4-17.4-166.861.10000115.9F24 V32F24-S28 WeakPolarHBondContact CD1-OG 3.35Å; F24-S28 WeakPolarHBondContact O-CB 3.36Å; F24-S28 PolarHBondContact O-N 2.89Å; F24-S28 PolarHBondContact O-OG 3.15Å; S28-V32 WeakPolarHBondContact O-CG2 3.34Å
29K90.4Very high91.9Very high32 Ų3227.4 Ų27.414%0.13917%0.165CC..Iπ-helixtrans-114.1-50.4178.3-60.8-165.4-173.9176.70112.4Y11 T25 V32 A33Y11-K29 HydrophobicContact CE1-CB 3.84Å; Y11-K29 HydrophobicContact CE1-CD 4.37Å; Y11-K29 HydrophobicContact CE1-CG 4.1Å; T25-K29 HydrophobicContact CG2-CB 4.37Å; T25-K29 HydrophobicContact CG2-CD 4.05Å; T25-K29 HydrophobicContact CG2-CG 4.37Å; T25-K29 WeakPolarHBondContact O-CA 3.45Å; T25-K29 WeakPolarHBondContact O-CB 3.46Å; T25-K29 PolarHBondContact O-N 3.39Å; K29-V32 PolarHBondContact O-N 2.88Å; K29-A33 VanDerWaalsContact O-CB 3.3Å; K29-A33 WeakPolarHBondContact O-CB 3.45Å; K29-A33 PolarHBondContact O-N 3.44Å
30V93.1Very high92.3Very high51 Ų5133.4 Ų33.431%0.30919%0.19SC..Iπ-helixtrans-70.5-45.9-175.5-175.40000110.2T25 L26 V32 A33 L34 W276T25-V30 PolarHBondContact O-N 3.29Å; L26-V30 HydrophobicContact CD1-CB 4.05Å; L26-V30 HydrophobicContact CD1-CG1 4.18Å; L26-V30 HydrophobicContact CD1-CG2 4.16Å; L26-V30 WeakPolarHBondContact O-CB 3.4Å; L26-V30 PolarHBondContact O-N 2.72Å; V30-V32 VanDerWaalsContact C-N 3.32Å; V30-V32 PolarHBondContact O-N 3.48Å; V30-A33 PolarHBondContact O-N 3.09Å; V30-L34 WeakPolarHBondContact O-CB 3.38Å; V30-L34 PolarHBondContact O-N 3.18Å; V30-W276 HydrophobicContact CB-CZ2 4.17Å; V30-W276 HydrophobicContact CG1-CH2 3.64Å; V30-W276 HydrophobicContact CG1-CZ2 3.6Å
31T95.5Very high92.6Very high0 Ų036.3 Ų36.30%021%0.208CC..Hα-helixtrans-61.6-40.8175.4-48.40000111.6L26 H27 L34 L35 F124 W276 F277L26-T31 PolarHBondContact O-N 2.97Å; L26-T31 PolarHBondContact O-OG1 3.42Å; L26-T31 VanDerWaalsContact O-OG1 3.05Å; H27-T31 WeakPolarHBondContact O-CB 3.38Å; H27-T31 PolarHBondContact O-OG1 3.3Å; T31-L34 WeakPolarHBondContact O-CB 3.19Å; T31-L34 PolarHBondContact O-N 2.97Å; T31-L35 HydrophobicContact CG2-CD1 4.03Å; T31-L35 HydrophobicContact CG2-CG 4.34Å; T31-L35 WeakPolarHBondContact O-CB 3.28Å; T31-L35 VanDerWaalsContact O-CG 3.25Å; T31-L35 WeakPolarHBondContact O-CG 3.26Å; T31-L35 PolarHBondContact O-N 3.32Å; T31-F124 HydrophobicContact CG2-CD1 3.9Å; T31-F124 HydrophobicContact CG2-CE1 4Å; T31-F124 HydrophobicContact CG2-CG 4.24Å; T31-F124 HydrophobicContact CG2-CZ 4.4Å; T31-W276 PolarHBondContact OG1-NE1 2.99Å; T31-F277 HydrophobicContact CG2-CD1 4.44Å; T31-F277 HydrophobicContact CG2-CE1 3.92Å
32V95.3Very high92.9Very high6 Ų635.2 Ų35.24%0.03620%0.202CC..Hα-helixtrans-63.8-46176.4175.50000111.6S28 K29 V30 L34 L35 L36 S121 F124S28-V32 WeakPolarHBondContact O-CG2 3.34Å; K29-V32 PolarHBondContact O-N 2.88Å; V30-V32 VanDerWaalsContact C-N 3.32Å; V30-V32 PolarHBondContact O-N 3.48Å; V32-L34 VanDerWaalsContact C-N 3.29Å; V32-L34 PolarHBondContact O-N 2.96Å; V32-L35 PolarHBondContact O-N 3.11Å; V32-L36 HydrophobicContact CG1-CD1 3.98Å; V32-L36 HydrophobicContact CG1-CG 4.4Å; V32-L36 WeakPolarHBondContact O-CB 3.44Å; V32-L36 VanDerWaalsContact O-CG 3.3Å; V32-L36 WeakPolarHBondContact O-CG 3.44Å; V32-L36 PolarHBondContact O-N 2.94Å; V32-S121 WeakPolarHBondContact CG2-O 3.26Å; V32-F124 HydrophobicContact CG2-CB 3.75Å
33A93.8Very high92.9Very high13 Ų1332.4 Ų32.411%0.10718%0.177CC..Hα-helixtrans-60.4-41.1176.300000111.8L8 L12 K29 V30 A37L8-A33 HydrophobicContact CD1-CB 4.07Å; L12-A33 HydrophobicContact CD2-CB 4.44Å; K29-A33 VanDerWaalsContact O-CB 3.3Å; K29-A33 WeakPolarHBondContact O-CB 3.45Å; K29-A33 PolarHBondContact O-N 3.44Å; V30-A33 PolarHBondContact O-N 3.09Å; A33-A37 WeakPolarHBondContact O-CB 3.37Å; A33-A37 PolarHBondContact O-N 3.48Å
34L95.1Very high92.6Very high36 Ų3632.3 Ų32.319%0.18818%0.181CC..Hα-helixtrans-63.4-49.1175.7176.665.7000111.6V30 T31 V32 L36 A37 C38 F272 L273 W276V30-L34 WeakPolarHBondContact O-CB 3.38Å; V30-L34 PolarHBondContact O-N 3.18Å; T31-L34 WeakPolarHBondContact O-CB 3.19Å; T31-L34 PolarHBondContact O-N 2.97Å; V32-L34 VanDerWaalsContact C-N 3.29Å; V32-L34 PolarHBondContact O-N 2.96Å; L34-L36 PolarHBondContact O-N 2.88Å; L34-A37 WeakPolarHBondContact O-CB 3.47Å; L34-A37 PolarHBondContact O-N 3.31Å; L34-C38 PolarHBondContact O-N 3.34Å; L34-C38 PolarHBondContact O-SG 3.4Å; L34-C38 VanDerWaalsContact O-SG 3.36Å; L34-F272 HydrophobicContact CD1-CD1 4.32Å; L34-F272 HydrophobicContact CD1-CE1 3.58Å; L34-F272 HydrophobicContact CD1-CZ 4.47Å; L34-F272 HydrophobicContact CD2-CD1 4.43Å; L34-F272 HydrophobicContact CD2-CE1 3.68Å; L34-F272 HydrophobicContact CG-CE1 4.21Å; L34-L273 HydrophobicContact CD2-CD2 3.75Å; L34-L273 HydrophobicContact CG-CD2 4.01Å; L34-W276 HydrophobicContact CD2-CB 4.37Å; L34-W276 HydrophobicContact CD2-CD2 3.8Å; L34-W276 HydrophobicContact CD2-CE3 4.48Å; L34-W276 HydrophobicContact CD2-CG 3.69Å
35L95.8Very high92.3Very high0 Ų037.4 Ų37.40%020%0.203CC..Hα-helixtrans-60.4-43.2178.1-73.9171.5000112.2T31 V32 A37 C38 T39 L117 E120 F124 L273 F277T31-L35 HydrophobicContact CG2-CD1 4.03Å; T31-L35 HydrophobicContact CG2-CG 4.34Å; T31-L35 WeakPolarHBondContact O-CB 3.28Å; T31-L35 VanDerWaalsContact O-CG 3.25Å; T31-L35 WeakPolarHBondContact O-CG 3.26Å; T31-L35 PolarHBondContact O-N 3.32Å; V32-L35 PolarHBondContact O-N 3.11Å; L35-A37 VanDerWaalsContact C-N 3.34Å; L35-A37 PolarHBondContact O-N 3.24Å; L35-C38 PolarHBondContact O-N 3.46Å; L35-T39 WeakPolarHBondContact O-CB 3.23Å; L35-T39 PolarHBondContact O-N 3.44Å; L35-T39 PolarHBondContact O-OG1 3.41Å; L35-L117 HydrophobicContact CD2-CD2 3.78Å; L35-E120 HydrophobicContact CD1-CB 3.89Å; L35-F124 HydrophobicContact CD1-CD2 3.89Å; L35-F124 HydrophobicContact CD1-CE2 4.38Å; L35-F124 HydrophobicContact CD1-CG 4.41Å; L35-L273 HydrophobicContact CD2-CD1 4.38Å; L35-L273 HydrophobicContact CD2-CD2 4.23Å; L35-F277 HydrophobicContact CD2-CZ 3.99Å
36L94.8Very high91.9Very high75 Ų7536.6 Ų36.639%0.39320%0.197SC..Hα-helixtrans-64.8-38.4175.7-71174.1000112V32 L34 T39 F40 L118 S121V32-L36 HydrophobicContact CG1-CD1 3.98Å; V32-L36 HydrophobicContact CG1-CG 4.4Å; V32-L36 WeakPolarHBondContact O-CB 3.44Å; V32-L36 VanDerWaalsContact O-CG 3.3Å; V32-L36 WeakPolarHBondContact O-CG 3.44Å; V32-L36 PolarHBondContact O-N 2.94Å; L34-L36 PolarHBondContact O-N 2.88Å; L36-T39 PolarHBondContact O-N 3.48Å; L36-F40 WeakPolarHBondContact O-CB 3.39Å; L36-F40 PolarHBondContact O-N 3.11Å; L36-L118 HydrophobicContact CD2-CD1 3.98Å; L36-S121 WeakPolarHBondContact CD2-OG 3.47Å
37A93.7Very high91.3Very high48 Ų4841.8 Ų41.840%0.39722%0.215SC..Hα-helixtrans-64-45.7174.500000111.5A33 L34 L35 F40 L41A33-A37 WeakPolarHBondContact O-CB 3.37Å; A33-A37 PolarHBondContact O-N 3.48Å; L34-A37 WeakPolarHBondContact O-CB 3.47Å; L34-A37 PolarHBondContact O-N 3.31Å; L35-A37 VanDerWaalsContact C-N 3.34Å; L35-A37 PolarHBondContact O-N 3.24Å; A37-F40 PolarHBondContact O-N 3.36Å; A37-L41 VanDerWaalsContact O-CG 3.29Å; A37-L41 WeakPolarHBondContact O-CG 3.42Å; A37-L41 PolarHBondContact O-N 3.29Å
38C94Very high90.4Very high9 Ų950.8 Ų50.86%0.06125%0.254CS..Hα-helixtrans-61.4-43.2174.7-68.20000112L34 L35 F40 L41 L42 L117 I269L34-C38 PolarHBondContact O-N 3.34Å; L34-C38 PolarHBondContact O-SG 3.4Å; L34-C38 VanDerWaalsContact O-SG 3.36Å; L35-C38 PolarHBondContact O-N 3.46Å; C38-F40 PolarHBondContact O-N 3.09Å; C38-L41 PolarHBondContact O-N 3.36Å; C38-L42 PolarHBondContact O-N 3.39Å; C38-L117 HydrophobicContact CB-CD1 4.27Å; C38-I269 HydrophobicContact CB-CG2 4.01Å
39T94.1Very high89.8Confident11 Ų1151.9 Ų51.97%0.06727%0.266CS..Hα-helixtrans-58.3-47.6176-580000110.7L35 L36 S43 V114 L117 L118L35-T39 WeakPolarHBondContact O-CB 3.23Å; L35-T39 PolarHBondContact O-N 3.44Å; L35-T39 PolarHBondContact O-OG1 3.41Å; L36-T39 PolarHBondContact O-N 3.48Å; T39-S43 VanDerWaalsContact O-CB 3.27Å; T39-S43 WeakPolarHBondContact O-CB 3.48Å; T39-S43 PolarHBondContact O-N 2.98Å; T39-S43 PolarHBondContact O-OG 3.17Å; T39-V114 HydrophobicContact CG2-CG1 3.87Å; T39-L117 WeakPolarHBondContact OG1-CB 3.39Å; T39-L118 HydrophobicContact CG2-CB 4.02Å; T39-L118 HydrophobicContact CG2-CD1 4.41Å
40F91.8Very high89.3Confident151 Ų15155.7 Ų55.766%0.66229%0.288SS*.Hα-helixtrans-62.9-45.9177.6177.7-98.8000112.1L36 A37 C38 L42 S43 S44L36-F40 WeakPolarHBondContact O-CB 3.39Å; L36-F40 PolarHBondContact O-N 3.11Å; A37-F40 PolarHBondContact O-N 3.36Å; C38-F40 PolarHBondContact O-N 3.09Å; F40-L42 PolarHBondContact O-N 2.85Å; F40-S43 PolarHBondContact O-N 3.14Å; F40-S44 WeakPolarHBondContact O-CB 3.38Å; F40-S44 PolarHBondContact O-N 3.35Å
41L90.7Very high88.8Confident97 Ų9754.4 Ų54.451%0.50828%0.28SS..Hα-helixtrans-59.4-47.3178.5-73.2170.9000111.8A37 C38 S44 K45A37-L41 VanDerWaalsContact O-CG 3.29Å; A37-L41 WeakPolarHBondContact O-CG 3.42Å; A37-L41 PolarHBondContact O-N 3.29Å; C38-L41 PolarHBondContact O-N 3.36Å; L41-S44 PolarHBondContact O-N 3.17Å; L41-S44 PolarHBondContact O-OG 2.99Å; L41-K45 PolarHBondContact O-N 3.02Å
42L90.3Very high88.4Confident1 Ų154.7 Ų54.71%0.00528%0.282CS..Hα-helixtrans-68.9-41.6178.9-72.7175.6000112.4C38 F40 S44 K45 Q46 V113 V114 L117 L262 L265 N266 I269C38-L42 PolarHBondContact O-N 3.39Å; F40-L42 PolarHBondContact O-N 2.85Å; L42-S44 VanDerWaalsContact C-N 3.25Å; L42-S44 PolarHBondContact O-N 3.06Å; L42-K45 PolarHBondContact O-N 3.39Å; L42-K45 VanDerWaalsContact O-N 3.11Å; L42-Q46 WeakPolarHBondContact O-CB 3.49Å; L42-Q46 PolarHBondContact O-N 2.88Å; L42-V113 HydrophobicContact CD1-CG1 3.58Å; L42-V114 HydrophobicContact CB-CG2 3.74Å; L42-L117 HydrophobicContact CD1-CD1 3.61Å; L42-L262 HydrophobicContact CD2-CD1 4.18Å; L42-L265 HydrophobicContact CD2-CB 4.05Å; L42-N266 WeakPolarHBondContact CD1-OD1 3.37Å; L42-N266 WeakPolarHBondContact CD2-OD1 3.26Å; L42-I269 HydrophobicContact CD1-CD1 4.04Å; L42-I269 HydrophobicContact CD2-CD1 3.7Å; L42-I269 HydrophobicContact CG-CD1 3.66Å
43S90.1Very high88Confident26 Ų2658.3 Ų58.318%0.18230%0.298CS..Hα-helixtrans-57.4-41.3174.8-58.90000111.5T39 F40 K45 Q46 Y47 V114T39-S43 VanDerWaalsContact O-CB 3.27Å; T39-S43 WeakPolarHBondContact O-CB 3.48Å; T39-S43 PolarHBondContact O-N 2.98Å; T39-S43 PolarHBondContact O-OG 3.17Å; F40-S43 PolarHBondContact O-N 3.14Å; S43-K45 PolarHBondContact O-N 3.25Å; S43-Q46 PolarHBondContact O-N 2.99Å; S43-Y47 VanDerWaalsContact O-CD2 3.31Å; S43-Y47 WeakPolarHBondContact O-CD2 3.29Å; S43-Y47 PolarHBondContact O-N 3.44Å; S43-V114 WeakPolarHBondContact OG-CG1 3.39Å
44S87.1Confident87.8Confident43 Ų4358.4 Ų58.430%0.30130%0.298SS..Hα-helixtrans-58.7-37.9179.478.50000112F40 L41 L42 F48 G49F40-S44 WeakPolarHBondContact O-CB 3.38Å; F40-S44 PolarHBondContact O-N 3.35Å; L41-S44 PolarHBondContact O-N 3.17Å; L41-S44 PolarHBondContact O-OG 2.99Å; L42-S44 VanDerWaalsContact C-N 3.25Å; L42-S44 PolarHBondContact O-N 3.06Å; S44-F48 WeakPolarHBondContact O-CB 3.37Å; S44-F48 PolarHBondContact O-N 2.95Å; S44-G49 PolarHBondContact O-N 3.42Å
45K84.2Confident87.4Confident113 Ų11364.3 Ų64.349%0.49132%0.322SS..Hα-helixtrans-84.1-31.7179.3-75.8-70.3-172.9177.80113.4L41 L42 S43 G49 L262 L265L41-K45 PolarHBondContact O-N 3.02Å; L42-K45 PolarHBondContact O-N 3.39Å; L42-K45 VanDerWaalsContact O-N 3.11Å; S43-K45 PolarHBondContact O-N 3.25Å; K45-G49 WeakPolarHBondContact O-CA 3.41Å; K45-G49 PolarHBondContact O-N 3.28Å; K45-L262 HydrophobicContact CB-CD1 3.95Å; K45-L265 HydrophobicContact CB-CD1 4.11Å; K45-L265 HydrophobicContact CD-CD1 4.38Å; K45-L265 HydrophobicContact CG-CD1 3.65Å
46Q83.6Confident86.8Confident17 Ų1765.6 Ų65.68%0.07934%0.336CS..Hα-helixtrans-73.8-35.7-179.9-174.3167.9-23.500112.8L42 S43 W68 Y110 Q111 L262L42-Q46 WeakPolarHBondContact O-CB 3.49Å; L42-Q46 PolarHBondContact O-N 2.88Å; S43-Q46 PolarHBondContact O-N 2.99Å; Q46-W68 HydrophobicContact CG-CH2 4.01Å; Q46-W68 HydrophobicContact CG-CZ2 3.68Å; Q46-Y110 PolarHBondContact OE1-O 3.19Å; Q46-Q111 PolarHBondContact NE2-O 3.4Å; Q46-L262 HydrophobicContact CB-CD1 4.5Å; Q46-L262 HydrophobicContact CB-CD2 4.34Å; Q46-L262 HydrophobicContact CG-CD2 4.35Å
47Y80.1Confident85.9Confident147 Ų14769.4 Ų69.458%0.57636%0.356SS*.Hα-helixtrans-105.9-27.4-175-63.9-69.3000114.7S43S43-Y47 VanDerWaalsContact O-CD2 3.31Å; S43-Y47 WeakPolarHBondContact O-CD2 3.29Å; S43-Y47 PolarHBondContact O-N 3.44Å
48F75.1Confident85.4Confident190 Ų19075 Ų7583%0.83337%0.372SS*.Hα-helixtrans-116.6-3-178-55.4-84.2000113.7S44S44-F48 WeakPolarHBondContact O-CB 3.37Å; S44-F48 PolarHBondContact O-N 2.95Å
49G77.8Confident85Confident24 Ų2480 Ų8025%0.24740%0.398CS..SBendtrans-108.9-174.917300000111.7S44 K45 P51S44-G49 PolarHBondContact O-N 3.42Å; K45-G49 WeakPolarHBondContact O-CA 3.41Å; K45-G49 PolarHBondContact O-N 3.28Å; G49-P51 WeakPolarHBondContact O-CD 3.48Å
50D80Confident84.7Confident111 Ų11181.1 Ų81.159%0.59440%0.403SS*.  trans-92.499.1171.5-54.5-38.3000109I52 Q53D50-I52 VanDerWaalsContact C-N 3.3Å; D50-I52 PolarHBondContact O-N 2.89Å; D50-Q53 HydrophobicContact CB-CG 3.94Å; D50-Q53 PolarHBondContact OD2-NE2 3.4Å
51P81.3Confident84.6Confident24 Ų2480.6 Ų80.616%0.15641%0.407CS..SBendtrans-75.3-24-172.633.1-38.6000112.4G49 W68G49-P51 WeakPolarHBondContact O-CD 3.48Å; P51-W68 HydrophobicContact CB-CD2 4.2Å; P51-W68 HydrophobicContact CB-CE3 3.74Å; P51-W68 HydrophobicContact CB-CH2 3.66Å; P51-W68 HydrophobicContact CB-CZ2 4.13Å; P51-W68 HydrophobicContact CB-CZ3 3.46Å; P51-W68 VanDerWaalsContact CB-CZ3 3.46Å; P51-W68 HydrophobicContact CG-CD2 3.79Å; P51-W68 HydrophobicContact CG-CE3 3.77Å; P51-W68 HydrophobicContact CG-CG 4.36Å; P51-W68 HydrophobicContact CG-CH2 4.24Å; P51-W68 HydrophobicContact CG-CZ2 4.28Å; P51-W68 HydrophobicContact CG-CZ3 4.01Å
52I87.2Confident84.6Confident6 Ų682.7 Ų82.73%0.03141%0.409CS..  trans-140.6136175.7-166.8166.9000109.6D50 H64 C67 W68 A72 C258 L259D50-I52 VanDerWaalsContact C-N 3.3Å; D50-I52 PolarHBondContact O-N 2.89Å; I52-H64 WeakPolarHBondContact CG2-O 3.45Å; I52-C67 HydrophobicContact CD1-CB 3.94Å; I52-W68 HydrophobicContact CB-CE3 4.33Å; I52-W68 HydrophobicContact CG2-CB 3.8Å; I52-W68 HydrophobicContact CG2-CE3 4.31Å; I52-A72 HydrophobicContact CD1-CB 4.4Å; I52-C258 HydrophobicContact CD1-CB 3.67Å; I52-C258 HydrophobicContact CG1-CB 3.6Å; I52-L259 WeakPolarHBondContact CA-O 3.46Å
53Q88.4Confident84.6Confident83 Ų8382.7 Ų82.739%0.38841%0.409SS..EExtended strand (participates in β ladder)trans-127.8111.3177.5-72.3-175.6-25.100109.3D50 C258 L259D50-Q53 HydrophobicContact CB-CG 3.94Å; D50-Q53 PolarHBondContact OD2-NE2 3.4Å; Q53-C258 CarbonylContact O-C 3.47Å; Q53-C258 WeakPolarHBondContact O-CA 3.46Å; Q53-L259 PolarHBondContact N-O 3.17Å; Q53-L259 PolarHBondContact O-N 3.4Å
54C88.6Confident84.6Confident15 Ų1583.7 Ų83.710%0.10141%0.411CS..EExtended strand (participates in β ladder)trans-96.2154.5-179.2-53.20000112.5M60 V63 H64 L257 C258C54-M60 HydrophobicContact CB-CE 3.98Å; C54-M60 WeakPolarHBondContact O-CE 3.43Å; C54-V63 HydrophobicContact CB-CG1 4.03Å; C54-H64 PolarHBondContact N-CE1 3.4Å; C54-H64 PolarHBondContact N-ND1 3.04Å; C54-H64 VanDerWaalsContact N-ND1 3.11Å; C54-H64 PolarHBondContact O-CE1 3.47Å; C54-L257 CarbonylContact C-O 3.32Å; C54-L257 VanDerWaalsContact CA-O 3.23Å; C54-L257 WeakPolarHBondContact CA-O 3.37Å; C54-C258 HydrophobicContact CB-CB 4.06Å; C54-C258 WeakPolarHBondContact CB-SG 3.46Å; C54-C258 WeakPolarHBondContact SG-CB 3.36Å; C54-C258 CovalentContact SG-SG 2.05Å; C54-C258 PolarHBondContact SG-SG 2.91Å
55F86.3Confident84.8Confident159 Ų15983.9 Ų83.970%0.69742%0.415SS*.EExtended strand (participates in β ladder)trans-98.6133.4174.7-177.1-95.8000110.5M60 L257F55-M60 VanDerWaalsContact C-CE 3.46Å; F55-L257 PolarHBondContact N-O 2.9Å
56G84.1Confident85.1Confident27 Ų2780.2 Ų80.228%0.27840%0.399SS..  trans169.1171.8179.300000112.5M60G56-M60 WeakPolarHBondContact CA-SD 3.32Å; G56-M60 VanDerWaalsContact N-CE 3.32Å
57D76.5Confident85.3Confident155 Ų15579.4 Ų79.483%0.82940%0.395SS*.SBendtrans-100.9-20.7-168.1-63.5-33.2000114.9
58K82.3Confident85.7Confident166 Ų16674.6 Ų74.672%0.72238%0.376SS*.SBendtrans-143.3147-172.7-63.3-172.9-178.2-179.50112.6M60K58-M60 VanDerWaalsContact C-N 3.26Å; K58-M60 PolarHBondContact O-N 3.11Å
59D84.8Confident86.3Confident114 Ų11470.6 Ų70.661%0.6136%0.363SS*.  trans52.438.6173.8-53.7-36.5000114.1D61 Y62 V63D59-D61 VanDerWaalsContact C-N 3.29Å; D59-D61 PolarHBondContact O-N 3.37Å; D59-Y62 WeakPolarHBondContact O-CB 3.39Å; D59-Y62 PolarHBondContact O-N 3.03Å; D59-Y62 VanDerWaalsContact O-N 3.1Å; D59-V63 PolarHBondContact O-N 3.36Å; D59-V63 VanDerWaalsContact O-N 3.14Å
60M89.3Confident86.7Confident35 Ų3577 Ų7717%0.17238%0.38CS..Hα-helixtrans-63.2-31.4-170.5-66-54.2-68.800113.6C54 F55 G56 K58 Y62 V63 H64C54-M60 HydrophobicContact CB-CE 3.98Å; C54-M60 WeakPolarHBondContact O-CE 3.43Å; F55-M60 VanDerWaalsContact C-CE 3.46Å; G56-M60 WeakPolarHBondContact CA-SD 3.32Å; G56-M60 VanDerWaalsContact N-CE 3.32Å; K58-M60 VanDerWaalsContact C-N 3.26Å; K58-M60 PolarHBondContact O-N 3.11Å; M60-Y62 VanDerWaalsContact C-N 3.32Å; M60-Y62 PolarHBondContact O-N 3.37Å; M60-V63 PolarHBondContact O-N 3.3Å; M60-H64 WeakPolarHBondContact O-CB 3.44Å; M60-H64 PolarHBondContact O-CD2 3.15Å; M60-H64 PolarHBondContact O-N 3.15Å
61D89.9Confident86.9Confident140 Ų14072 Ų7275%0.74936%0.355SS*.Hα-helixtrans-61.1-41.3175.4-62.8-27.2000112D59 A65D59-D61 VanDerWaalsContact C-N 3.29Å; D59-D61 PolarHBondContact O-N 3.37Å; D61-A65 WeakPolarHBondContact O-CB 3.4Å; D61-A65 PolarHBondContact O-N 3.49Å; D61-A65 VanDerWaalsContact O-N 3.09Å
62Y89.7Confident87.1Confident141 Ų14170.9 Ų70.955%0.55335%0.348SS*.Hα-helixtrans-67.1-43174.9176.3-97.6000111D59 M60 A65 F66 M242D59-Y62 WeakPolarHBondContact O-CB 3.39Å; D59-Y62 PolarHBondContact O-N 3.03Å; D59-Y62 VanDerWaalsContact O-N 3.1Å; M60-Y62 VanDerWaalsContact C-N 3.32Å; M60-Y62 PolarHBondContact O-N 3.37Å; Y62-A65 PolarHBondContact O-N 3Å; Y62-F66 HydrophobicContact CE1-CB 4.44Å; Y62-F66 VanDerWaalsContact O-CB 3.26Å; Y62-F66 WeakPolarHBondContact O-CB 3.4Å; Y62-F66 PolarHBondContact O-N 2.97Å; Y62-M242 HydrophobicContact CD1-SD 4.08Å; Y62-M242 HydrophobicContact CE1-CE 4.38Å; Y62-M242 HydrophobicContact CE1-SD 3.56Å; Y62-M242 VanDerWaalsContact CE1-SD 3.56Å
63V90.3Very high86.9Confident1 Ų170.8 Ų70.81%0.00635%0.347CS..Hα-helixtrans-61.8-46177.9175.70000110.9C54 D59 M60 A65 F66 C67 Y256C54-V63 HydrophobicContact CB-CG1 4.03Å; D59-V63 PolarHBondContact O-N 3.36Å; D59-V63 VanDerWaalsContact O-N 3.14Å; M60-V63 PolarHBondContact O-N 3.3Å; V63-A65 PolarHBondContact O-N 3.05Å; V63-F66 PolarHBondContact O-N 3.4Å; V63-C67 VanDerWaalsContact O-CB 3.32Å; V63-C67 WeakPolarHBondContact O-CB 3.5Å; V63-C67 PolarHBondContact O-N 3.18Å; V63-C67 PolarHBondContact O-SG 3.22Å; V63-Y256 HydrophobicContact CB-CE1 4.47Å; V63-Y256 HydrophobicContact CG1-CD1 3.62Å; V63-Y256 HydrophobicContact CG1-CD2 3.74Å; V63-Y256 HydrophobicContact CG1-CE1 3.88Å; V63-Y256 HydrophobicContact CG1-CE2 4Å; V63-Y256 HydrophobicContact CG1-CG 3.53Å; V63-Y256 HydrophobicContact CG2-CD1 4.41Å; V63-Y256 HydrophobicContact CG2-CE1 3.8Å; V63-Y256 HydrophobicContact CG2-CE2 4.02Å
64H90.6Very high86.3Confident46 Ų4668.4 Ų68.421%0.21334%0.338CS..Hα-helixtrans-58-48.4176.5-64.1-30.6000111.1I52 C54 M60 W68I52-H64 WeakPolarHBondContact CG2-O 3.45Å; C54-H64 PolarHBondContact N-CE1 3.4Å; C54-H64 PolarHBondContact N-ND1 3.04Å; C54-H64 VanDerWaalsContact N-ND1 3.11Å; C54-H64 PolarHBondContact O-CE1 3.47Å; M60-H64 WeakPolarHBondContact O-CB 3.44Å; M60-H64 PolarHBondContact O-CD2 3.15Å; M60-H64 PolarHBondContact O-N 3.15Å; H64-W68 VanDerWaalsContact O-CB 3.26Å; H64-W68 WeakPolarHBondContact O-CB 3.37Å; H64-W68 PolarHBondContact O-N 2.96Å
65A90Very high85.5Confident47 Ų4768.6 Ų68.639%0.38834%0.339SS..Hα-helixtrans-64.4-44.4178.400000112.3D61 Y62 V63 W68 I69D61-A65 WeakPolarHBondContact O-CB 3.4Å; D61-A65 PolarHBondContact O-N 3.49Å; D61-A65 VanDerWaalsContact O-N 3.09Å; Y62-A65 PolarHBondContact O-N 3Å; V63-A65 PolarHBondContact O-N 3.05Å; A65-W68 PolarHBondContact O-N 3.19Å; A65-I69 WeakPolarHBondContact O-CB 3.29Å; A65-I69 WeakPolarHBondContact O-CD1 3.41Å; A65-I69 VanDerWaalsContact O-CG1 3.25Å; A65-I69 WeakPolarHBondContact O-CG1 3.38Å; A65-I69 PolarHBondContact O-N 3.39Å
66F90.4Very high84.2Confident36 Ų3664.8 Ų64.816%0.15833%0.327CS..Hα-helixtrans-60.5-51.4178.6-178.3-87.2000111.2Y62 V63 W68 I69 Y70 M242Y62-F66 HydrophobicContact CE1-CB 4.44Å; Y62-F66 VanDerWaalsContact O-CB 3.26Å; Y62-F66 WeakPolarHBondContact O-CB 3.4Å; Y62-F66 PolarHBondContact O-N 2.97Å; V63-F66 PolarHBondContact O-N 3.4Å; F66-W68 VanDerWaalsContact C-N 3.28Å; F66-W68 PolarHBondContact O-N 3.18Å; F66-I69 PolarHBondContact O-N 3.07Å; F66-Y70 HydrophobicContact CD1-CD2 4.31Å; F66-Y70 AromaticContact CD2-CD2 3.54Å; F66-Y70 HydrophobicContact CD2-CD2 3.54Å; F66-Y70 AromaticContact CD2-CE2 3.68Å; F66-Y70 HydrophobicContact CD2-CE2 3.68Å; F66-Y70 HydrophobicContact CE1-CD2 4.21Å; F66-Y70 AromaticContact CE2-CD2 3.42Å; F66-Y70 HydrophobicContact CE2-CD2 3.42Å; F66-Y70 VanDerWaalsContact CE2-CD2 3.42Å; F66-Y70 AromaticContact CE2-CE2 3.54Å; F66-Y70 HydrophobicContact CE2-CE2 3.54Å; F66-Y70 HydrophobicContact CE2-CG 4.21Å; F66-Y70 AromaticContact CG-CD2 3.99Å; F66-Y70 HydrophobicContact CG-CD2 3.99Å; F66-Y70 AromaticContact CZ-CD2 3.77Å; F66-Y70 HydrophobicContact CZ-CD2 3.77Å; F66-Y70 HydrophobicContact CZ-CE2 4.28Å; F66-Y70 HydrophobicContact CZ-CG 4.14Å; F66-Y70 WeakPolarHBondContact O-CD2 3.34Å; F66-Y70 PolarHBondContact O-N 3.41Å; F66-M242 HydrophobicContact CD1-CB 4.12Å; F66-M242 HydrophobicContact CD1-CG 3.91Å; F66-M242 HydrophobicContact CD1-SD 4.17Å; F66-M242 HydrophobicContact CD2-CG 4.43Å; F66-M242 HydrophobicContact CE1-CB 3.84Å; F66-M242 HydrophobicContact CE1-CG 3.74Å; F66-M242 HydrophobicContact CE2-CG 4.27Å; F66-M242 HydrophobicContact CG-CG 4.27Å; F66-M242 HydrophobicContact CG-SD 4.15Å; F66-M242 HydrophobicContact CZ-CB 4.41Å; F66-M242 HydrophobicContact CZ-CG 3.94Å
67C88.8Confident82.7Confident0 Ų068.8 Ų68.80%034%0.342CS..Hα-helixtrans-66.6-30.6-179.5-63.50000112.6I52 V63 G71 C240I52-C67 HydrophobicContact CD1-CB 3.94Å; V63-C67 VanDerWaalsContact O-CB 3.32Å; V63-C67 WeakPolarHBondContact O-CB 3.5Å; V63-C67 PolarHBondContact O-N 3.18Å; V63-C67 PolarHBondContact O-SG 3.22Å; C67-G71 CarbonylContact O-C 3.31Å; C67-G71 VanDerWaalsContact O-CA 3.25Å; C67-G71 WeakPolarHBondContact O-CA 3.41Å; C67-G71 PolarHBondContact O-N 3.19Å; C67-G71 VanDerWaalsContact O-N 3.09Å; C67-C240 WeakPolarHBondContact CA-SG 3.49Å; C67-C240 HydrophobicContact CB-CB 3.71Å; C67-C240 WeakPolarHBondContact CB-SG 3.43Å; C67-C240 WeakPolarHBondContact SG-CB 3.46Å; C67-C240 CovalentContact SG-SG 2.03Å; C67-C240 PolarHBondContact SG-SG 3.41Å
68W88.8Confident81.6Confident47 Ų4764.4 Ų64.418%0.17832%0.32CS..Hα-helixtrans-67.4-42.5171.9178.8-110.6000112.8Q46 P51 I52 H64 A65 F66 Y110 Q111 L262Q46-W68 HydrophobicContact CG-CH2 4.01Å; Q46-W68 HydrophobicContact CG-CZ2 3.68Å; P51-W68 HydrophobicContact CB-CD2 4.2Å; P51-W68 HydrophobicContact CB-CE3 3.74Å; P51-W68 HydrophobicContact CB-CH2 3.66Å; P51-W68 HydrophobicContact CB-CZ2 4.13Å; P51-W68 HydrophobicContact CB-CZ3 3.46Å; P51-W68 VanDerWaalsContact CB-CZ3 3.46Å; P51-W68 HydrophobicContact CG-CD2 3.79Å; P51-W68 HydrophobicContact CG-CE3 3.77Å; P51-W68 HydrophobicContact CG-CG 4.36Å; P51-W68 HydrophobicContact CG-CH2 4.24Å; P51-W68 HydrophobicContact CG-CZ2 4.28Å; P51-W68 HydrophobicContact CG-CZ3 4.01Å; I52-W68 HydrophobicContact CB-CE3 4.33Å; I52-W68 HydrophobicContact CG2-CB 3.8Å; I52-W68 HydrophobicContact CG2-CE3 4.31Å; H64-W68 VanDerWaalsContact O-CB 3.26Å; H64-W68 WeakPolarHBondContact O-CB 3.37Å; H64-W68 PolarHBondContact O-N 2.96Å; A65-W68 PolarHBondContact O-N 3.19Å; F66-W68 VanDerWaalsContact C-N 3.28Å; F66-W68 PolarHBondContact O-N 3.18Å; W68-Y110 HydrophobicContact CD2-CE2 4.28Å; W68-Y110 HydrophobicContact CE3-CD2 4.06Å; W68-Y110 AromaticContact CE3-CE2 3.51Å; W68-Y110 HydrophobicContact CE3-CE2 3.51Å; W68-Y110 AromaticContact CH2-CD2 3.29Å; W68-Y110 HydrophobicContact CH2-CD2 3.29Å; W68-Y110 AromaticContact CH2-CE2 3.61Å; W68-Y110 HydrophobicContact CH2-CE2 3.61Å; W68-Y110 HydrophobicContact CH2-CG 4.38Å; W68-Y110 HydrophobicContact CZ2-CD2 4.21Å; W68-Y110 HydrophobicContact CZ2-CE2 4.34Å; W68-Y110 AromaticContact CZ3-CD2 3.18Å; W68-Y110 HydrophobicContact CZ3-CD2 3.18Å; W68-Y110 AromaticContact CZ3-CE2 3.11Å; W68-Y110 HydrophobicContact CZ3-CE2 3.11Å; W68-Y110 HydrophobicContact CZ3-CG 4.21Å; W68-Q111 HydrophobicContact CZ2-CG 4.48Å; W68-Q111 PolarHBondContact O-NE2 3.44Å; W68-L262 HydrophobicContact CH2-CD2 3.67Å; W68-L262 HydrophobicContact CZ3-CD2 4.18Å
69I88Confident79.7Confident106 Ų10661.4 Ų61.454%0.54432%0.316SS..Hα-helixtrans-75.9-51.7-175.5-69.4165000111.3A65 F66 G71 Q111A65-I69 WeakPolarHBondContact O-CB 3.29Å; A65-I69 WeakPolarHBondContact O-CD1 3.41Å; A65-I69 VanDerWaalsContact O-CG1 3.25Å; A65-I69 WeakPolarHBondContact O-CG1 3.38Å; A65-I69 PolarHBondContact O-N 3.39Å; F66-I69 PolarHBondContact O-N 3.07Å; I69-G71 VanDerWaalsContact C-N 3.34Å; I69-Q111 PolarHBondContact O-NE2 2.86Å
70Y86Confident77.9Confident159 Ų15958.2 Ų58.262%0.62430%0.3SS*.Hα-helixtrans-85.4-10.5-175.2-68.8-79.7000113.3F66F66-Y70 HydrophobicContact CD1-CD2 4.31Å; F66-Y70 AromaticContact CD2-CD2 3.54Å; F66-Y70 HydrophobicContact CD2-CD2 3.54Å; F66-Y70 AromaticContact CD2-CE2 3.68Å; F66-Y70 HydrophobicContact CD2-CE2 3.68Å; F66-Y70 HydrophobicContact CE1-CD2 4.21Å; F66-Y70 AromaticContact CE2-CD2 3.42Å; F66-Y70 HydrophobicContact CE2-CD2 3.42Å; F66-Y70 VanDerWaalsContact CE2-CD2 3.42Å; F66-Y70 AromaticContact CE2-CE2 3.54Å; F66-Y70 HydrophobicContact CE2-CE2 3.54Å; F66-Y70 HydrophobicContact CE2-CG 4.21Å; F66-Y70 AromaticContact CG-CD2 3.99Å; F66-Y70 HydrophobicContact CG-CD2 3.99Å; F66-Y70 AromaticContact CZ-CD2 3.77Å; F66-Y70 HydrophobicContact CZ-CD2 3.77Å; F66-Y70 HydrophobicContact CZ-CE2 4.28Å; F66-Y70 HydrophobicContact CZ-CG 4.14Å; F66-Y70 WeakPolarHBondContact O-CD2 3.34Å; F66-Y70 PolarHBondContact O-N 3.41Å
71G83.8Confident75.6Confident6 Ų660.7 Ų60.76%0.06232%0.317CS..  trans86.6157176.700000113.5C67 I69C67-G71 CarbonylContact O-C 3.31Å; C67-G71 VanDerWaalsContact O-CA 3.25Å; C67-G71 WeakPolarHBondContact O-CA 3.41Å; C67-G71 PolarHBondContact O-N 3.19Å; C67-G71 VanDerWaalsContact O-N 3.09Å; I69-G71 VanDerWaalsContact C-N 3.34Å
72A84.4Confident73.4Confident0 Ų058.5 Ų58.50%031%0.311CS..EExtended strand (participates in β ladder)trans-109.3155.1171.600000109.4I52 I107 A238 K239 C240I52-A72 HydrophobicContact CD1-CB 4.4Å; A72-I107 PolarHBondContact O-N 3.29Å; A72-A238 HydrophobicContact CB-CB 3.49Å; A72-A238 VanDerWaalsContact CB-CB 3.49Å; A72-K239 CarbonylContact C-O 3.6Å; A72-K239 WeakPolarHBondContact CA-O 3.47Å; A72-C240 HydrophobicContact CB-CB 4.48Å
73Y83.1Confident71.4Confident3 Ų353.7 Ų53.71%0.01230%0.295CS..EExtended strand (participates in β ladder)trans-119.8155.6-17972.2-95.3000112.1V99 R104 N105 Y106 K239 E241Y73-V99 HydrophobicContact CE2-CB 4.15Å; Y73-V99 HydrophobicContact CE2-CG2 4.28Å; Y73-R104 HydrophobicContact CD2-CB 3.94Å; Y73-R104 HydrophobicContact CD2-CG 3.7Å; Y73-R104 HydrophobicContact CE2-CG 3.88Å; Y73-R104 HydrophobicContact CG-CB 4.11Å; Y73-R104 HydrophobicContact CG-CG 4.17Å; Y73-N105 CarbonylContact C-O 3.56Å; Y73-N105 WeakPolarHBondContact CA-O 3.44Å; Y73-Y106 HydrophobicContact CD1-CE1 4.24Å; Y73-K239 VanDerWaalsContact CD1-O 3.3Å; Y73-K239 WeakPolarHBondContact CD1-O 3.46Å; Y73-K239 HydrophobicContact CE1-CB 4.27Å; Y73-K239 HydrophobicContact CE1-CG 4.21Å; Y73-K239 HydrophobicContact CE2-CB 4.12Å; Y73-K239 HydrophobicContact CE2-CD 4.3Å; Y73-K239 HydrophobicContact CE2-CG 4.46Å; Y73-K239 PolarHBondContact N-O 3.1Å; Y73-K239 PolarHBondContact O-N 3.23Å; Y73-K239 VanDerWaalsContact OH-CD 3.24Å; Y73-K239 WeakPolarHBondContact OH-CD 3.21Å; Y73-K239 WeakPolarHBondContact OH-CE 3.43Å; Y73-K239 PolarHBondContact OH-NZ 3.37Å; Y73-E241 HydrophobicContact CE1-CB 4.2Å; Y73-E241 HydrophobicContact CE1-CG 3.88Å; Y73-E241 PolarHBondContact OH-OE1 3.2Å
74V77.3Confident69.3Low33 Ų3365.7 Ų65.720%0.234%0.34CS..EExtended strand (participates in β ladder)trans-119.6146.8169.2170.50000108.5V78 N105 I107 P235 C237 A238V74-V78 HydrophobicContact CG1-CG2 3.76Å; V74-N105 PolarHBondContact N-O 3.01Å; V74-N105 PolarHBondContact O-N 2.6Å; V74-I107 HydrophobicContact CB-CD1 4.35Å; V74-I107 HydrophobicContact CG2-CD1 3.59Å; V74-P235 HydrophobicContact CG2-CB 3.78Å; V74-P235 HydrophobicContact CG2-CG 4.21Å; V74-C237 WeakPolarHBondContact CG2-O 3.48Å; V74-A238 HydrophobicContact CG2-CB 3.93Å
75S70.6Confident67.2Low19 Ų1970.2 Ų70.213%0.13337%0.365CS..EExtended strand (participates in β ladder)trans-71.2135.3175.5-178.40000110.2N77 V78S75-N77 PolarHBondContact O-N 3.43Å; S75-N77 PolarHBondContact OG-N 3.33Å; S75-V78 VanDerWaalsContact O-CG2 3.22Å; S75-V78 WeakPolarHBondContact O-CG2 3.22Å; S75-V78 PolarHBondContact O-N 3.25Å
76D59.8Low65.3Low80 Ų8070 Ų7043%0.42837%0.368SS..THydrogen-bonded Turntrans-59-31.9171-80.1-60.3000112.9V78 N103 N105D76-V78 VanDerWaalsContact C-N 3.32Å; D76-V78 PolarHBondContact O-N 3.33Å; D76-N103 PolarHBondContact N-O 3.34Å; D76-N103 VanDerWaalsContact N-O 3.08Å; D76-N103 VanDerWaalsContact OD2-C 3.29Å; D76-N105 VanDerWaalsContact OD1-CG 3.28Å; D76-N105 PolarHBondContact OD1-ND2 2.88Å
77N53.1Low63.3Low111 Ų11171.1 Ų71.159%0.59438%0.384SS*.THydrogen-bonded Turntrans-93.244-178.2-73.5-31000112.1S75 T79S75-N77 PolarHBondContact O-N 3.43Å; S75-N77 PolarHBondContact OG-N 3.33Å; N77-T79 PolarHBondContact O-N 2.95Å
78V52.9Low61.4Low63 Ų6373.3 Ų73.338%0.38240%0.402SS..  trans-70.976.7162.9-166.20000108.1V74 S75 D76 V80V74-V78 HydrophobicContact CG1-CG2 3.76Å; S75-V78 VanDerWaalsContact O-CG2 3.22Å; S75-V78 WeakPolarHBondContact O-CG2 3.22Å; S75-V78 PolarHBondContact O-N 3.25Å; D76-V78 VanDerWaalsContact C-N 3.32Å; D76-V78 PolarHBondContact O-N 3.33Å; V78-V80 HydrophobicContact CG1-CG2 3.51Å; V78-V80 PolarHBondContact O-N 2.95Å
79T41.6Very low59.7Low102 Ų10277 Ų7763%0.62642%0.422SS*.  trans-62.993.5150.651.70000104.9N77 T81N77-T79 PolarHBondContact O-N 2.95Å; T79-T81 PolarHBondContact O-N 3.07Å
80V47.5Very low58Low47 Ų4774.3 Ų74.329%0.28541%0.411SS..  trans-64.382.8164.7-176.50000104.7V78 P82 I228V78-V80 HydrophobicContact CG1-CG2 3.51Å; V78-V80 PolarHBondContact O-N 2.95Å; V80-P82 WeakPolarHBondContact O-CD 3.37Å; V80-I228 HydrophobicContact CB-CD1 4.19Å; V80-I228 HydrophobicContact CB-CG1 3.85Å; V80-I228 HydrophobicContact CG1-CG1 4.37Å; V80-I228 HydrophobicContact CG2-CG1 3.84Å
81T41.3Very low56.3Low87 Ų8772.2 Ų72.253%0.53440%0.402SS..  trans-60.2113.9166.844.40000104.7T79 L83T79-T81 PolarHBondContact O-N 3.07Å; T81-L83 PolarHBondContact O-N 3.45Å
82P42.6Very low54.5Low95 Ų9574.1 Ų74.162%0.61741%0.414SS*.  trans-56.4130.7179.622.8-30.8000106.9V80V80-P82 WeakPolarHBondContact O-CD 3.37Å
83L48.6Very low52.4Low39 Ų3979.7 Ų79.720%0.20444%0.443CS..  trans-54.2150.6165.7-93.388000107.7T81 N85 G86 R91T81-L83 PolarHBondContact O-N 3.45Å; L83-N85 PolarHBondContact O-N 3.42Å; L83-G86 PolarHBondContact O-N 3.12Å; L83-R91 HydrophobicContact CD1-CG 4.48Å
84R46.3Very low50.5Low254 Ų25482.6 Ų82.696%0.95847%0.468SS*.THydrogen-bonded Turntrans-47.8-12.7172-143.6176.9-174.2-1720.7114.1
85N46.3Very low49Very low140 Ų14082.6 Ų82.675%0.74947%0.468SS*.THydrogen-bonded Turntrans-119.46.2-175-55.81.5000114.5L83 A87L83-N85 PolarHBondContact O-N 3.42Å; N85-A87 VanDerWaalsContact C-N 3.29Å; N85-A87 PolarHBondContact O-N 3.43Å
86G49.5Very low47.6Very low43 Ų4386.6 Ų86.644%0.44350%0.496SS..  trans72.56172.900000117.3L83L83-G86 PolarHBondContact O-N 3.12Å
87A48.6Very low47.4Very low60 Ų6091.5 Ų91.550%0.49651%0.513SS..  trans-87.8119.9174.100000110.9N85 Q89N85-A87 VanDerWaalsContact C-N 3.29Å; N85-A87 PolarHBondContact O-N 3.43Å; A87-Q89 PolarHBondContact O-N 3.4Å
88A49.9Very low47.8Very low46 Ų4691.8 Ų91.838%0.3852%0.519SS..  trans-70.996.2169.700000109.2N227A88-N227 HydrophobicContact CB-CB 4.02Å
89Q52.9Low48.4Very low125 Ų12589.1 Ų89.158%0.58450%0.503SS*.  trans-99.9142.8175.2-162.516916.200109.3A87 R91A87-Q89 PolarHBondContact O-N 3.4Å; Q89-R91 PolarHBondContact O-N 2.88Å
90C52.1Low49.8Very low49 Ų4986.6 Ų86.633%0.33149%0.488SS..  trans-59.6104.8163.6-76.60000107.9P92 C237C90-P92 WeakPolarHBondContact O-CD 3.13Å; C90-C237 HydrophobicContact CB-CB 3.78Å; C90-C237 WeakPolarHBondContact CB-SG 3.43Å; C90-C237 WeakPolarHBondContact SG-CB 3.49Å; C90-C237 CovalentContact SG-SG 2.03Å; C90-C237 PolarHBondContact SG-SG 3.49Å
91R50.6Low51.1Low115 Ų11589.1 Ų89.143%0.43451%0.505SS..  trans-104.7103.5175.2-91.4-163.8162.8169-2.3110L83 Q89 D93L83-R91 HydrophobicContact CD1-CG 4.48Å; Q89-R91 PolarHBondContact O-N 2.88Å; R91-D93 PolarHBondContact O-N 3.09Å
92P46.1Very low52.7Low46 Ų4692.4 Ų92.430%0.29952%0.515SS..G310 helixtrans-62-25.5165.2-14.730.2000111.3C90 A94 V95 L257C90-P92 WeakPolarHBondContact O-CD 3.13Å; P92-A94 VanDerWaalsContact C-N 3.31Å; P92-A94 PolarHBondContact O-N 3.04Å; P92-V95 CarbonylContact O-C 3.51Å; P92-V95 VanDerWaalsContact O-C 3.31Å; P92-V95 WeakPolarHBondContact O-CA 3.31Å; P92-V95 WeakPolarHBondContact O-CB 3.34Å; P92-V95 PolarHBondContact O-N 2.84Å; P92-L257 HydrophobicContact CB-CD1 3.86Å; P92-L257 HydrophobicContact CB-CD2 4.14Å; P92-L257 HydrophobicContact CB-CG 4.41Å; P92-L257 HydrophobicContact CG-CD1 3.61Å; P92-L257 HydrophobicContact CG-CD2 3.21Å; P92-L257 HydrophobicContact CG-CG 3.9Å
93D40.1Very low54.2Low117 Ų11790.3 Ų90.363%0.62650%0.498SS*.G310 helixtrans-75.3-18-171.8-45.6-27.2000113.3R91 S96R91-D93 PolarHBondContact O-N 3.09Å; D93-S96 WeakPolarHBondContact O-CB 3.04Å; D93-S96 PolarHBondContact O-N 3.38Å
94A43.6Very low55.5Low63 Ų6389.8 Ų89.852%0.52149%0.494SS..G310 helixtrans-77.4-11.3165.900000112.1P92P92-A94 VanDerWaalsContact C-N 3.31Å; P92-A94 PolarHBondContact O-N 3.04Å
95V45.3Very low57Low34 Ų3481.8 Ų81.821%0.20647%0.47CS..G310 helixtrans-100.722.9171.4-159.10000110.2P92 K97 V99 K239P92-V95 CarbonylContact O-C 3.51Å; P92-V95 VanDerWaalsContact O-C 3.31Å; P92-V95 WeakPolarHBondContact O-CA 3.31Å; P92-V95 WeakPolarHBondContact O-CB 3.34Å; P92-V95 PolarHBondContact O-N 2.84Å; V95-K97 PolarHBondContact O-N 3.46Å; V95-V99 HydrophobicContact CG1-CG2 3.8Å; V95-K239 HydrophobicContact CG1-CD 3.91Å
96S41.8Very low58.6Low103 Ų10380.9 Ų80.972%0.7246%0.457SS*.  trans-78.30.1-179-1710000114D93D93-S96 WeakPolarHBondContact O-CB 3.04Å; D93-S96 PolarHBondContact O-N 3.38Å
97K54.7Low60Low182 Ų18279.2 Ų79.279%0.79144%0.438SS*.SBendtrans-98134.1164.5-68.5-177.2179.8179.50108.5V95 V99V95-K97 PolarHBondContact O-N 3.46Å; K97-V99 PolarHBondContact O-N 3.21Å
98V60.9Low61.3Low118 Ų11879.1 Ų79.172%0.71543%0.431SS*.  trans-46.9109.2165.5176.40000107.1P100V98-P100 WeakPolarHBondContact O-CD 3.36Å
99V66.1Low62.8Low7 Ų778.7 Ų78.74%0.04242%0.42CS..  trans-75.1118.3-179.6-176.70000105.5Y73 V95 K97 N103 R104Y73-V99 HydrophobicContact CE2-CB 4.15Å; Y73-V99 HydrophobicContact CE2-CG2 4.28Å; V95-V99 HydrophobicContact CG1-CG2 3.8Å; K97-V99 PolarHBondContact O-N 3.21Å; V99-N103 HydrophobicContact CG1-CB 3.87Å; V99-N103 WeakPolarHBondContact CG1-O 3.47Å; V99-R104 HydrophobicContact CB-CG 4.22Å; V99-R104 HydrophobicContact CG1-CG 3.74Å; V99-R104 VanDerWaalsContact O-CZ 3.24Å; V99-R104 PolarHBondContact O-NE 3.45Å; V99-R104 PolarHBondContact O-NH2 3.08Å
100P71.1Confident64.1Low48 Ų4872.9 Ų72.931%0.31239%0.393SS..  trans-61.8148.5176.527.1-33.6000109.2V98 E102 N103V98-P100 WeakPolarHBondContact O-CD 3.36Å; P100-E102 HydrophobicContact CB-CG 4.08Å; P100-E102 HydrophobicContact CG-CG 4.07Å; P100-E102 PolarHBondContact O-N 3.26Å; P100-N103 HydrophobicContact CG-CB 4.37Å; P100-N103 WeakPolarHBondContact CG-ND2 3.04Å; P100-N103 PolarHBondContact O-N 3.47Å
101P74.3Confident65.6Low100 Ų10072.9 Ų72.965%0.64939%0.388SS*.G310 helixtrans-56.4-26.8-172.520.7-32.3000113.8N103 R104P101-N103 VanDerWaalsContact C-N 3.3Å; P101-N103 PolarHBondContact O-N 2.98Å; P101-R104 PolarHBondContact O-N 2.98Å
102E75.7Confident67.5Low157 Ų15774.2 Ų74.273%0.73439%0.393SS*.G310 helixtrans-66.2-23.5176.565.9-165.1171.800114.9P100P100-E102 HydrophobicContact CB-CG 4.08Å; P100-E102 HydrophobicContact CG-CG 4.07Å; P100-E102 PolarHBondContact O-N 3.26Å
103N73.9Confident69.6Low51 Ų5172.1 Ų72.127%0.27338%0.379SS..G310 helixtrans-107.119.3-177.7-66.5-37.4000112.4D76 V99 P100 P101D76-N103 PolarHBondContact N-O 3.34Å; D76-N103 VanDerWaalsContact N-O 3.08Å; D76-N103 VanDerWaalsContact OD2-C 3.29Å; V99-N103 HydrophobicContact CG1-CB 3.87Å; V99-N103 WeakPolarHBondContact CG1-O 3.47Å; P100-N103 HydrophobicContact CG-CB 4.37Å; P100-N103 WeakPolarHBondContact CG-ND2 3.04Å; P100-N103 PolarHBondContact O-N 3.47Å; P101-N103 VanDerWaalsContact C-N 3.3Å; P101-N103 PolarHBondContact O-N 2.98Å
104R76.3Confident72Confident27 Ų2766.9 Ų66.910%0.10235%0.351CS..EExtended strand (participates in β ladder)trans-104.8113.1-177.9-62.5-178.2-169.2-171.5-9.9110.3Y73 V99 P101 Y106 E241Y73-R104 HydrophobicContact CD2-CB 3.94Å; Y73-R104 HydrophobicContact CD2-CG 3.7Å; Y73-R104 HydrophobicContact CE2-CG 3.88Å; Y73-R104 HydrophobicContact CG-CB 4.11Å; Y73-R104 HydrophobicContact CG-CG 4.17Å; V99-R104 HydrophobicContact CB-CG 4.22Å; V99-R104 HydrophobicContact CG1-CG 3.74Å; V99-R104 VanDerWaalsContact O-CZ 3.24Å; V99-R104 PolarHBondContact O-NE 3.45Å; V99-R104 PolarHBondContact O-NH2 3.08Å; P101-R104 PolarHBondContact O-N 2.98Å; R104-Y106 HydrophobicContact CB-CD2 4.35Å; R104-Y106 HydrophobicContact CB-CE2 3.85Å; R104-Y106 PolarHBondContact O-N 3.14Å; R104-E241 IonicContact CZ-OE1 2.6Å; R104-E241 VanDerWaalsContact CZ-OE1 3.25Å; R104-E241 IonicContact CZ-OE2 3.65Å; R104-E241 VanDerWaalsContact NH1-CD 3.32Å; R104-E241 IonicContact NH1-OE1 3.63Å; R104-E241 PolarHBondContact NH1-OE1 3.31Å; R104-E241 IonicContact NH1-OE2 3.7Å; R104-E241 PolarHBondContact NH1-OE2 2.78Å; R104-E241 VanDerWaalsContact NH2-CD 3.25Å; R104-E241 IonicContact NH2-OE1 2.84Å; R104-E241 PolarHBondContact NH2-OE1 3.35Å; R104-E241 IonicContact NH2-OE2 2.79Å; R104-E241 PolarHBondContact NH2-OE2 3.11Å
105N77.3Confident74.4Confident86 Ų8667.9 Ų67.946%0.4635%0.348SS..EExtended strand (participates in β ladder)trans-89.2105.7167.8-77.6-21.2000110.2Y73 V74 D76Y73-N105 CarbonylContact C-O 3.56Å; Y73-N105 WeakPolarHBondContact CA-O 3.44Å; V74-N105 PolarHBondContact N-O 3.01Å; V74-N105 PolarHBondContact O-N 2.6Å; D76-N105 VanDerWaalsContact OD1-CG 3.28Å; D76-N105 PolarHBondContact OD1-ND2 2.88Å
106Y80.3Confident76.6Confident121 Ų12167.5 Ų67.548%0.47535%0.345SS..EExtended strand (participates in β ladder)trans-74.2127.5174.3-71.5-90.2000110.8Y73 R104Y73-Y106 HydrophobicContact CD1-CE1 4.24Å; R104-Y106 HydrophobicContact CB-CD2 4.35Å; R104-Y106 HydrophobicContact CB-CE2 3.85Å; R104-Y106 PolarHBondContact O-N 3.14Å
107I77.6Confident79.1Confident9 Ų962.6 Ų62.65%0.04631%0.311CS..EExtended strand (participates in β ladder)trans-98.2100.1-179.9-49.9152.2000106.3A72 V74 Y109 Y110 P235 A238A72-I107 PolarHBondContact O-N 3.29Å; V74-I107 HydrophobicContact CB-CD1 4.35Å; V74-I107 HydrophobicContact CG2-CD1 3.59Å; I107-Y109 HydrophobicContact CG2-CD1 4.02Å; I107-Y109 HydrophobicContact CG2-CE1 3.49Å; I107-Y109 VanDerWaalsContact CG2-CE1 3.49Å; I107-Y110 HydrophobicContact CB-CD1 4.5Å; I107-Y110 HydrophobicContact CB-CE1 3.98Å; I107-Y110 HydrophobicContact CG2-CD1 3.58Å; I107-Y110 HydrophobicContact CG2-CE1 3.54Å; I107-Y110 WeakPolarHBondContact O-CE1 3.42Å; I107-Y110 PolarHBondContact O-OH 3.35Å; I107-P235 HydrophobicContact CD1-CB 4.01Å; I107-P235 HydrophobicContact CD1-CG 3.25Å; I107-P235 HydrophobicContact CG1-CG 3.78Å; I107-P235 HydrophobicContact CG2-CG 4.36Å; I107-A238 HydrophobicContact CD1-CB 3.69Å
108T76.9Confident81Confident58 Ų5856.8 Ų56.836%0.35629%0.288SS..  trans-124.2-9.917855.50000112.8Y110 Q111T108-Y110 PolarHBondContact O-N 2.76Å; T108-Y110 VanDerWaalsContact O-N 3.13Å; T108-Q111 WeakPolarHBondContact O-CB 3.41Å; T108-Q111 PolarHBondContact O-N 3.15Å; T108-Q111 VanDerWaalsContact O-N 3.15Å
109Y81.4Confident82.6Confident36 Ų3656.6 Ų56.614%0.14128%0.282CS..Hα-helixtrans-59.1-30.6-177.367.6-101.9000112.9I107 Q111 W112 V113 F204 V233 F234 N263I107-Y109 HydrophobicContact CG2-CD1 4.02Å; I107-Y109 HydrophobicContact CG2-CE1 3.49Å; I107-Y109 VanDerWaalsContact CG2-CE1 3.49Å; Y109-Q111 PolarHBondContact O-N 3.06Å; Y109-Q111 VanDerWaalsContact O-N 3.16Å; Y109-W112 WeakPolarHBondContact O-CA 3.02Å; Y109-W112 PolarHBondContact O-N 3.06Å; Y109-V113 HydrophobicContact CD2-CG2 3.83Å; Y109-V113 HydrophobicContact CE2-CG2 4.44Å; Y109-V113 WeakPolarHBondContact O-CG2 3.39Å; Y109-V113 PolarHBondContact O-N 2.8Å; Y109-F204 HydrophobicContact CD2-CD1 4.24Å; Y109-F204 AromaticContact CD2-CE1 3.87Å; Y109-F204 HydrophobicContact CD2-CE1 3.87Å; Y109-F204 HydrophobicContact CE2-CD1 4.44Å; Y109-F204 HydrophobicContact CE2-CE1 4.11Å; Y109-V233 PolarHBondContact OH-O 2.9Å; Y109-F234 HydrophobicContact CE2-CD1 4.05Å; Y109-F234 AromaticContact CE2-CE1 3.91Å; Y109-F234 HydrophobicContact CE2-CE1 3.91Å; Y109-F234 AromaticContact CZ-CD1 3.91Å; Y109-F234 VanDerWaalsContact OH-CD1 3.25Å; Y109-F234 WeakPolarHBondContact OH-CD1 3.45Å; Y109-N263 PolarHBondContact OH-ND2 3.4Å; Y109-N263 PolarHBondContact OH-OD1 3.49Å
110Y80.6Confident84Confident3 Ų356.8 Ų56.81%0.01228%0.283CS..Hα-helixtrans-62.1-24.4-178.354.3-108.9000113Q46 W68 I107 T108 W112 L260Q46-Y110 PolarHBondContact OE1-O 3.19Å; W68-Y110 HydrophobicContact CD2-CE2 4.28Å; W68-Y110 HydrophobicContact CE3-CD2 4.06Å; W68-Y110 AromaticContact CE3-CE2 3.51Å; W68-Y110 HydrophobicContact CE3-CE2 3.51Å; W68-Y110 AromaticContact CH2-CD2 3.29Å; W68-Y110 HydrophobicContact CH2-CD2 3.29Å; W68-Y110 AromaticContact CH2-CE2 3.61Å; W68-Y110 HydrophobicContact CH2-CE2 3.61Å; W68-Y110 HydrophobicContact CH2-CG 4.38Å; W68-Y110 HydrophobicContact CZ2-CD2 4.21Å; W68-Y110 HydrophobicContact CZ2-CE2 4.34Å; W68-Y110 AromaticContact CZ3-CD2 3.18Å; W68-Y110 HydrophobicContact CZ3-CD2 3.18Å; W68-Y110 AromaticContact CZ3-CE2 3.11Å; W68-Y110 HydrophobicContact CZ3-CE2 3.11Å; W68-Y110 HydrophobicContact CZ3-CG 4.21Å; I107-Y110 HydrophobicContact CB-CD1 4.5Å; I107-Y110 HydrophobicContact CB-CE1 3.98Å; I107-Y110 HydrophobicContact CG2-CD1 3.58Å; I107-Y110 HydrophobicContact CG2-CE1 3.54Å; I107-Y110 WeakPolarHBondContact O-CE1 3.42Å; I107-Y110 PolarHBondContact O-OH 3.35Å; T108-Y110 PolarHBondContact O-N 2.76Å; T108-Y110 VanDerWaalsContact O-N 3.13Å; Y110-W112 PolarHBondContact O-N 3.07Å; Y110-L260 HydrophobicContact CD1-CD2 4.2Å; Y110-L260 HydrophobicContact CE1-CD2 3.84Å
111Q83.9Confident85.2Confident50 Ų5054.6 Ų54.623%0.23427%0.269CS..Hα-helixtrans-66.8-31.7174-62175.8-27.400111.1Q46 W68 I69 T108 Y109Q46-Q111 PolarHBondContact NE2-O 3.4Å; W68-Q111 HydrophobicContact CZ2-CG 4.48Å; W68-Q111 PolarHBondContact O-NE2 3.44Å; I69-Q111 PolarHBondContact O-NE2 2.86Å; T108-Q111 WeakPolarHBondContact O-CB 3.41Å; T108-Q111 PolarHBondContact O-N 3.15Å; T108-Q111 VanDerWaalsContact O-N 3.15Å; Y109-Q111 PolarHBondContact O-N 3.06Å; Y109-Q111 VanDerWaalsContact O-N 3.16Å
112W88.8Confident86.2Confident143 Ų14356.1 Ų56.154%0.54227%0.266SS..Hα-helixtrans-97.2-20.6-173.7-63.197.3000114Y109 Y110 V114 L115 V116 F203Y109-W112 WeakPolarHBondContact O-CA 3.02Å; Y109-W112 PolarHBondContact O-N 3.06Å; Y110-W112 PolarHBondContact O-N 3.07Å; W112-V114 VanDerWaalsContact C-N 3.28Å; W112-V114 PolarHBondContact O-N 3.2Å; W112-L115 HydrophobicContact CE3-CD1 3.7Å; W112-L115 HydrophobicContact CZ3-CD1 3.84Å; W112-L115 WeakPolarHBondContact O-CB 3.24Å; W112-L115 PolarHBondContact O-N 2.92Å; W112-V116 WeakPolarHBondContact O-CG2 3.45Å; W112-V116 PolarHBondContact O-N 3.23Å; W112-F203 HydrophobicContact CB-CE2 4.27Å; W112-F203 HydrophobicContact CB-CZ 4.05Å
113V90.2Very high87.1Confident1 Ų151.5 Ų51.51%0.00625%0.248CC..Hα-helixtrans-49.1-46.5-176.9162.50000112.8L42 Y109 L115 V116 L117 F203 F204 F270L42-V113 HydrophobicContact CD1-CG1 3.58Å; Y109-V113 HydrophobicContact CD2-CG2 3.83Å; Y109-V113 HydrophobicContact CE2-CG2 4.44Å; Y109-V113 WeakPolarHBondContact O-CG2 3.39Å; Y109-V113 PolarHBondContact O-N 2.8Å; V113-L115 VanDerWaalsContact C-N 3.35Å; V113-L115 PolarHBondContact O-N 3.14Å; V113-V116 PolarHBondContact O-N 3.39Å; V113-L117 HydrophobicContact CG1-CD1 4.04Å; V113-L117 WeakPolarHBondContact O-CG 3.32Å; V113-L117 PolarHBondContact O-N 3.04Å; V113-F203 HydrophobicContact CG2-CE1 4.07Å; V113-F203 HydrophobicContact CG2-CZ 4.49Å; V113-F204 HydrophobicContact CG2-CE1 4.26Å; V113-F204 HydrophobicContact CG2-CZ 4.39Å; V113-F270 HydrophobicContact CG1-CE2 3.62Å; V113-F270 HydrophobicContact CG1-CZ 3.85Å; V113-F270 HydrophobicContact CG2-CE2 4.31Å
114V92.1Very high88.2Confident7 Ų749.1 Ų49.14%0.04224%0.235CC..Hα-helixtrans-63.3-41.8-179.91710000111.5T39 L42 S43 W112 L118T39-V114 HydrophobicContact CG2-CG1 3.87Å; L42-V114 HydrophobicContact CB-CG2 3.74Å; S43-V114 WeakPolarHBondContact OG-CG1 3.39Å; W112-V114 VanDerWaalsContact C-N 3.28Å; W112-V114 PolarHBondContact O-N 3.2Å; V114-L118 WeakPolarHBondContact O-CB 3.44Å; V114-L118 PolarHBondContact O-N 3.24Å
115L92.5Very high89Confident85 Ų8551.1 Ų51.145%0.44524%0.243SC..Hα-helixtrans-67.7-39178.8-62.3177.4000111.4W112 V113 L118 L119W112-L115 HydrophobicContact CE3-CD1 3.7Å; W112-L115 HydrophobicContact CZ3-CD1 3.84Å; W112-L115 WeakPolarHBondContact O-CB 3.24Å; W112-L115 PolarHBondContact O-N 2.92Å; V113-L115 VanDerWaalsContact C-N 3.35Å; V113-L115 PolarHBondContact O-N 3.14Å; L115-L118 PolarHBondContact O-N 3.04Å; L115-L119 WeakPolarHBondContact O-CB 3.28Å; L115-L119 PolarHBondContact O-N 3.42Å
116V93.3Very high89.8Confident25 Ų2551.3 Ų51.315%0.15224%0.242CC..Hα-helixtrans-63-51.3175.9172.90000110.6W112 V113 L118 L119 E120 L200 F203W112-V116 WeakPolarHBondContact O-CG2 3.45Å; W112-V116 PolarHBondContact O-N 3.23Å; V113-V116 PolarHBondContact O-N 3.39Å; V116-L118 VanDerWaalsContact C-N 3.27Å; V116-L118 PolarHBondContact O-N 2.84Å; V116-L119 PolarHBondContact O-N 3.4Å; V116-L119 VanDerWaalsContact O-N 3.15Å; V116-E120 HydrophobicContact CG1-CG 4.42Å; V116-E120 WeakPolarHBondContact O-CG 3.25Å; V116-E120 PolarHBondContact O-N 3.48Å; V116-L200 HydrophobicContact CG1-CD2 4.16Å; V116-F203 HydrophobicContact CG2-CD2 4.42Å; V116-F203 HydrophobicContact CG2-CE2 3.87Å; V116-F203 HydrophobicContact CG2-CZ 3.96Å
117L93.8Very high90.4Very high0 Ų045.5 Ų45.50%022%0.22CC..Hα-helixtrans-60.9-36.7178.5-70173.1000112.6L35 C38 T39 L42 V113 S121 F270 L273L35-L117 HydrophobicContact CD2-CD2 3.78Å; C38-L117 HydrophobicContact CB-CD1 4.27Å; T39-L117 WeakPolarHBondContact OG1-CB 3.39Å; L42-L117 HydrophobicContact CD1-CD1 3.61Å; V113-L117 HydrophobicContact CG1-CD1 4.04Å; V113-L117 WeakPolarHBondContact O-CG 3.32Å; V113-L117 PolarHBondContact O-N 3.04Å; L117-S121 PolarHBondContact O-N 3.43Å; L117-F270 HydrophobicContact CD1-CZ 4.18Å; L117-F270 HydrophobicContact CD2-CE1 3.95Å; L117-F270 HydrophobicContact CD2-CZ 3.88Å; L117-F270 HydrophobicContact CG-CZ 4.1Å; L117-L273 HydrophobicContact CD2-CD1 3.74Å
118L94.4Very high91.1Very high60 Ų6045.1 Ų45.131%0.31422%0.218SC..Hα-helixtrans-66-46.9175.2-176.762.5000111.1L36 T39 V114 L115 V116 E120 S121 F122L36-L118 HydrophobicContact CD2-CD1 3.98Å; T39-L118 HydrophobicContact CG2-CB 4.02Å; T39-L118 HydrophobicContact CG2-CD1 4.41Å; V114-L118 WeakPolarHBondContact O-CB 3.44Å; V114-L118 PolarHBondContact O-N 3.24Å; L115-L118 PolarHBondContact O-N 3.04Å; V116-L118 VanDerWaalsContact C-N 3.27Å; V116-L118 PolarHBondContact O-N 2.84Å; L118-E120 VanDerWaalsContact C-N 3.34Å; L118-E120 PolarHBondContact O-N 3.49Å; L118-S121 WeakPolarHBondContact O-CB 3.43Å; L118-S121 PolarHBondContact O-N 3.37Å; L118-S121 PolarHBondContact O-OG 3.32Å; L118-F122 HydrophobicContact CD1-CE2 3.85Å; L118-F122 HydrophobicContact CD1-CZ 4.38Å; L118-F122 HydrophobicContact CD2-CE2 4.4Å; L118-F122 HydrophobicContact CG-CD2 4.34Å; L118-F122 HydrophobicContact CG-CE2 3.78Å; L118-F122 WeakPolarHBondContact O-CD2 3.49Å; L118-F122 PolarHBondContact O-N 3.4Å
119L95.1Very high91.8Very high114 Ų11447.3 Ų47.360%0.59722%0.222SC*.Hα-helixtrans-60.1-44.6176.4179.161.6000111.4L115 V116 S121 F122 V123L115-L119 WeakPolarHBondContact O-CB 3.28Å; L115-L119 PolarHBondContact O-N 3.42Å; V116-L119 PolarHBondContact O-N 3.4Å; V116-L119 VanDerWaalsContact O-N 3.15Å; L119-S121 VanDerWaalsContact C-N 3.28Å; L119-S121 PolarHBondContact O-N 2.86Å; L119-F122 WeakPolarHBondContact O-CB 3.5Å; L119-F122 PolarHBondContact O-N 3.08Å; L119-F122 VanDerWaalsContact O-N 3.1Å; L119-V123 HydrophobicContact CD1-CG2 4.41Å; L119-V123 HydrophobicContact CG-CG2 4.47Å; L119-V123 WeakPolarHBondContact O-CG2 3.34Å; L119-V123 PolarHBondContact O-N 3.42Å
120E95.1Very high92.4Very high12 Ų1247.2 Ų47.26%0.05622%0.224CC..Hα-helixtrans-56-44.5174.6-73.9176.717800111.1L35 V116 L118 F122 V123 F124 N196 L200L35-E120 HydrophobicContact CD1-CB 3.89Å; V116-E120 HydrophobicContact CG1-CG 4.42Å; V116-E120 WeakPolarHBondContact O-CG 3.25Å; V116-E120 PolarHBondContact O-N 3.48Å; L118-E120 VanDerWaalsContact C-N 3.34Å; L118-E120 PolarHBondContact O-N 3.49Å; E120-F122 PolarHBondContact O-N 3.03Å; E120-V123 PolarHBondContact O-N 3.16Å; E120-V123 VanDerWaalsContact O-N 3.09Å; E120-F124 HydrophobicContact CB-CD2 4.43Å; E120-F124 VanDerWaalsContact O-CD2 3.32Å; E120-F124 WeakPolarHBondContact O-CD2 3.44Å; E120-F124 PolarHBondContact O-N 2.9Å; E120-N196 VanDerWaalsContact CD-OD1 3.23Å; E120-N196 WeakPolarHBondContact CG-OD1 3.29Å; E120-N196 PolarHBondContact OE1-OD1 3.01Å; E120-L200 WeakPolarHBondContact OE1-CD1 3.45Å; E120-L200 WeakPolarHBondContact OE1-CD2 3.25Å; E120-L200 VanDerWaalsContact OE1-CG 3.29Å; E120-L200 WeakPolarHBondContact OE1-CG 3.42Å
121S95.5Very high93Very high2 Ų247 Ų471%0.01422%0.224CC..Hα-helixtrans-57.9-36.6178.883.30000112.6V32 L36 L117 L118 L119 Y125V32-S121 WeakPolarHBondContact CG2-O 3.26Å; L36-S121 WeakPolarHBondContact CD2-OG 3.47Å; L117-S121 PolarHBondContact O-N 3.43Å; L118-S121 WeakPolarHBondContact O-CB 3.43Å; L118-S121 PolarHBondContact O-N 3.37Å; L118-S121 PolarHBondContact O-OG 3.32Å; L119-S121 VanDerWaalsContact C-N 3.28Å; L119-S121 PolarHBondContact O-N 2.86Å; S121-Y125 WeakPolarHBondContact O-CB 3.46Å; S121-Y125 PolarHBondContact O-N 3.35Å
122F94.8Very high93.3Very high132 Ų13250.2 Ų50.258%0.57924%0.237SC*.Hα-helixtrans-71.4-43.8174.9-70.4-64.5000112.1L118 L119 E120 Y125 M126L118-F122 HydrophobicContact CD1-CE2 3.85Å; L118-F122 HydrophobicContact CD1-CZ 4.38Å; L118-F122 HydrophobicContact CD2-CE2 4.4Å; L118-F122 HydrophobicContact CG-CD2 4.34Å; L118-F122 HydrophobicContact CG-CE2 3.78Å; L118-F122 WeakPolarHBondContact O-CD2 3.49Å; L118-F122 PolarHBondContact O-N 3.4Å; L119-F122 WeakPolarHBondContact O-CB 3.5Å; L119-F122 PolarHBondContact O-N 3.08Å; L119-F122 VanDerWaalsContact O-N 3.1Å; E120-F122 PolarHBondContact O-N 3.03Å; F122-Y125 PolarHBondContact O-N 2.9Å; F122-M126 PolarHBondContact O-N 3.38Å
123V96Very high93.4Very high59 Ų5948.1 Ų48.136%0.35824%0.235SC..Hα-helixtrans-62.7-46179.4175.20000110.8L119 E120 Y125 M126 P127 I192L119-V123 HydrophobicContact CD1-CG2 4.41Å; L119-V123 HydrophobicContact CG-CG2 4.47Å; L119-V123 WeakPolarHBondContact O-CG2 3.34Å; L119-V123 PolarHBondContact O-N 3.42Å; E120-V123 PolarHBondContact O-N 3.16Å; E120-V123 VanDerWaalsContact O-N 3.09Å; V123-Y125 PolarHBondContact O-N 3.13Å; V123-M126 VanDerWaalsContact O-CB 3.26Å; V123-M126 WeakPolarHBondContact O-CB 3.1Å; V123-M126 PolarHBondContact O-N 3.48Å; V123-M126 VanDerWaalsContact O-N 3.14Å; V123-P127 WeakPolarHBondContact O-CD 3.48Å; V123-I192 HydrophobicContact CG1-CB 4.48Å; V123-I192 HydrophobicContact CG1-CD1 4.08Å; V123-I192 HydrophobicContact CG1-CG1 3.87Å; V123-I192 HydrophobicContact CG1-CG2 3.83Å; V123-I192 WeakPolarHBondContact O-CD1 3.48Å
124F95.6Very high93.4Very high1 Ų153 Ų530%0.00425%0.253CS..Hα-helixtrans-64-27175.9-86-91.4000113.3H27 T31 V32 L35 E120 P127 I192 N196 F277H27-F124 AromaticContact CD2-CD1 3.58Å; H27-F124 AromaticContact CD2-CE1 3.54Å; H27-F124 AromaticContact CE1-CD1 3.51Å; H27-F124 AromaticContact CE1-CE1 3.99Å; H27-F124 AromaticContact NE2-CD1 3.22Å; H27-F124 WeakPolarHBondContact NE2-CD1 3.17Å; H27-F124 AromaticContact NE2-CE1 3.22Å; H27-F124 WeakPolarHBondContact NE2-CE1 3.37Å; T31-F124 HydrophobicContact CG2-CD1 3.9Å; T31-F124 HydrophobicContact CG2-CE1 4Å; T31-F124 HydrophobicContact CG2-CG 4.24Å; T31-F124 HydrophobicContact CG2-CZ 4.4Å; V32-F124 HydrophobicContact CG2-CB 3.75Å; L35-F124 HydrophobicContact CD1-CD2 3.89Å; L35-F124 HydrophobicContact CD1-CE2 4.38Å; L35-F124 HydrophobicContact CD1-CG 4.41Å; E120-F124 HydrophobicContact CB-CD2 4.43Å; E120-F124 VanDerWaalsContact O-CD2 3.32Å; E120-F124 WeakPolarHBondContact O-CD2 3.44Å; E120-F124 PolarHBondContact O-N 2.9Å; F124-P127 WeakPolarHBondContact O-CD 2.94Å; F124-I192 HydrophobicContact CD1-CG2 4.19Å; F124-I192 HydrophobicContact CD2-CG2 4.17Å; F124-I192 HydrophobicContact CE1-CG2 4.17Å; F124-I192 HydrophobicContact CE2-CG2 4.16Å; F124-I192 HydrophobicContact CG-CG2 4.19Å; F124-I192 HydrophobicContact CZ-CG2 4.16Å; F124-N196 HydrophobicContact CE2-CB 3.97Å; F124-N196 WeakPolarHBondContact CE2-OD1 3.45Å; F124-N196 HydrophobicContact CZ-CB 3.96Å; F124-F277 AromaticContact CE2-CE1 3.99Å; F124-F277 HydrophobicContact CE2-CE1 3.99Å; F124-F277 HydrophobicContact CZ-CD1 4.06Å; F124-F277 AromaticContact CZ-CE1 3.77Å; F124-F277 HydrophobicContact CZ-CE1 3.77Å
125Y94.3Very high93.3Very high69 Ų6953 Ų5327%0.27125%0.253SS..Hα-helixtrans-78.8-25.7175.2-174.7-114000113.4Y11 S121 F122 V123 A128 F129Y11-Y125 HydrophobicContact CE2-CE2 4.33Å; Y11-Y125 WeakPolarHBondContact OH-CD2 3.33Å; Y11-Y125 WeakPolarHBondContact OH-CE2 3.4Å; S121-Y125 WeakPolarHBondContact O-CB 3.46Å; S121-Y125 PolarHBondContact O-N 3.35Å; F122-Y125 PolarHBondContact O-N 2.9Å; V123-Y125 PolarHBondContact O-N 3.13Å; Y125-A128 HydrophobicContact CD2-CB 4.37Å; Y125-A128 HydrophobicContact CE2-CB 4.33Å; Y125-A128 PolarHBondContact O-N 2.67Å; Y125-A128 VanDerWaalsContact O-N 3.07Å; Y125-F129 HydrophobicContact CD1-CB 4.12Å; Y125-F129 HydrophobicContact CE1-CB 3.83Å; Y125-F129 HydrophobicContact CE1-CD2 4.19Å; Y125-F129 HydrophobicContact CE1-CG 4.4Å; Y125-F129 PolarHBondContact O-N 3.14Å
126M93.6Very high92.9Very high90 Ų9051.9 Ų51.944%0.44326%0.262SS..Hα-helixtrans-51.6-45.8-173.7-172.1-149.5-17200113.9F122 V123 A128 F129 L130 L188F122-M126 PolarHBondContact O-N 3.38Å; V123-M126 VanDerWaalsContact O-CB 3.26Å; V123-M126 WeakPolarHBondContact O-CB 3.1Å; V123-M126 PolarHBondContact O-N 3.48Å; V123-M126 VanDerWaalsContact O-N 3.14Å; M126-A128 VanDerWaalsContact C-N 3.33Å; M126-A128 PolarHBondContact O-N 3.4Å; M126-F129 WeakPolarHBondContact O-CB 3.22Å; M126-F129 PolarHBondContact O-N 2.8Å; M126-L130 HydrophobicContact CE-CD1 4.12Å; M126-L130 HydrophobicContact CG-CD1 4.4Å; M126-L130 WeakPolarHBondContact O-CG 3.34Å; M126-L130 PolarHBondContact O-N 3.34Å; M126-L188 HydrophobicContact SD-CD2 3.96Å
127P93.4Very high92.4Very high0 Ų051.6 Ų51.60%026%0.264CS..Hα-helixtrans-65.3-35-179.5-22.736.4000113F24 V123 F124 W131 C185 L188 N189 I192F24-P127 HydrophobicContact CZ-CB 4.1Å; V123-P127 WeakPolarHBondContact O-CD 3.48Å; F124-P127 WeakPolarHBondContact O-CD 2.94Å; P127-W131 WeakPolarHBondContact O-CB 3.5Å; P127-W131 PolarHBondContact O-N 3.12Å; P127-C185 HydrophobicContact CB-CB 4.5Å; P127-L188 HydrophobicContact CB-CD2 4.21Å; P127-L188 HydrophobicContact CG-CB 4.41Å; P127-L188 HydrophobicContact CG-CD2 3.88Å; P127-L188 HydrophobicContact CG-CG 3.97Å; P127-N189 WeakPolarHBondContact CB-OD1 3.45Å; P127-N189 WeakPolarHBondContact CG-OD1 3.42Å; P127-I192 HydrophobicContact CG-CD1 3.43Å; P127-I192 VanDerWaalsContact CG-CD1 3.43Å
128A91.6Very high92Very high1 Ų154.9 Ų54.91%0.00828%0.277CS..Hα-helixtrans-70.2-38.3175.500000111.9Y20 F24 Y125 M126 W131 K132Y20-A128 HydrophobicContact CE1-CB 4.06Å; Y20-A128 PolarHBondContact OH-O 2.93Å; F24-A128 HydrophobicContact CE1-CB 3.95Å; Y125-A128 HydrophobicContact CD2-CB 4.37Å; Y125-A128 HydrophobicContact CE2-CB 4.33Å; Y125-A128 PolarHBondContact O-N 2.67Å; Y125-A128 VanDerWaalsContact O-N 3.07Å; M126-A128 VanDerWaalsContact C-N 3.33Å; M126-A128 PolarHBondContact O-N 3.4Å; A128-W131 PolarHBondContact O-N 3.38Å; A128-K132 WeakPolarHBondContact O-CB 3.08Å; A128-K132 PolarHBondContact O-N 3.47Å
129F91.8Very high91.5Very high103 Ų10352.2 Ų52.245%0.45226%0.262SS..Hα-helixtrans-61.1-49.7174.8177.8-105000111.4Y125 M126 W131 K132 I133Y125-F129 HydrophobicContact CD1-CB 4.12Å; Y125-F129 HydrophobicContact CE1-CB 3.83Å; Y125-F129 HydrophobicContact CE1-CD2 4.19Å; Y125-F129 HydrophobicContact CE1-CG 4.4Å; Y125-F129 PolarHBondContact O-N 3.14Å; M126-F129 WeakPolarHBondContact O-CB 3.22Å; M126-F129 PolarHBondContact O-N 2.8Å; F129-W131 PolarHBondContact O-N 3.27Å; F129-K132 PolarHBondContact O-N 2.87Å; F129-I133 HydrophobicContact CD1-CD1 3.94Å; F129-I133 HydrophobicContact CE1-CD1 3.43Å; F129-I133 VanDerWaalsContact CE1-CD1 3.43Å; F129-I133 HydrophobicContact CE2-CD1 4.11Å; F129-I133 HydrophobicContact CG-CD1 4.48Å; F129-I133 HydrophobicContact CZ-CD1 3.54Å; F129-I133 PolarHBondContact O-N 3.41Å
130L93.4Very high91Very high34 Ų3451.8 Ų51.818%0.17826%0.256CS..Hα-helixtrans-59.7-47175.9-70.2177.4000111.9M126 K132 I133 W134 F184 L188M126-L130 HydrophobicContact CE-CD1 4.12Å; M126-L130 HydrophobicContact CG-CD1 4.4Å; M126-L130 WeakPolarHBondContact O-CG 3.34Å; M126-L130 PolarHBondContact O-N 3.34Å; L130-K132 VanDerWaalsContact C-N 3.3Å; L130-K132 PolarHBondContact O-N 3.24Å; L130-I133 PolarHBondContact O-N 2.9Å; L130-I133 VanDerWaalsContact O-N 3.15Å; L130-W134 HydrophobicContact CB-CZ3 4.48Å; L130-W134 PolarHBondContact O-N 3.5Å; L130-F184 HydrophobicContact CD1-CE1 4.24Å; L130-L188 HydrophobicContact CD1-CD2 3.79Å
131W93.4Very high90.4Very high0 Ų058.7 Ų58.70%029%0.288CS..Hα-helixtrans-60.4-40.7178.8-179.9-119.6000112.3I19 Y20 F24 P127 A128 F129 I133 W134 E135 Y178 Y182I19-W131 PolarHBondContact O-NE1 2.94Å; Y20-W131 AromaticContact CD1-CD1 3.82Å; Y20-W131 HydrophobicContact CE1-CB 4.45Å; Y20-W131 AromaticContact CE1-CD1 3.44Å; Y20-W131 VanDerWaalsContact CE1-CD1 3.44Å; Y20-W131 HydrophobicContact CE1-CG 4.31Å; F24-W131 HydrophobicContact CZ-CB 4.42Å; P127-W131 WeakPolarHBondContact O-CB 3.5Å; P127-W131 PolarHBondContact O-N 3.12Å; A128-W131 PolarHBondContact O-N 3.38Å; F129-W131 PolarHBondContact O-N 3.27Å; W131-I133 VanDerWaalsContact C-N 3.3Å; W131-I133 PolarHBondContact O-N 3.42Å; W131-W134 PolarHBondContact O-N 3.32Å; W131-E135 HydrophobicContact CD2-CB 4.44Å; W131-E135 HydrophobicContact CZ2-CB 4.22Å; W131-E135 HydrophobicContact CZ2-CG 4.34Å; W131-E135 WeakPolarHBondContact O-CB 3.29Å; W131-E135 PolarHBondContact O-N 2.86Å; W131-Y178 HydrophobicContact CH2-CD1 4.06Å; W131-Y178 AromaticContact CH2-CD2 3.93Å; W131-Y178 HydrophobicContact CH2-CD2 3.93Å; W131-Y178 AromaticContact CH2-CE1 3.64Å; W131-Y178 HydrophobicContact CH2-CE1 3.64Å; W131-Y178 AromaticContact CH2-CE2 3.5Å; W131-Y178 HydrophobicContact CH2-CE2 3.5Å; W131-Y178 VanDerWaalsContact CH2-CE2 3.5Å; W131-Y178 HydrophobicContact CH2-CG 4.2Å; W131-Y178 AromaticContact CH2-CZ 3.34Å; W131-Y178 HydrophobicContact CZ2-CE1 4.03Å; W131-Y178 AromaticContact CZ2-CE2 3.86Å; W131-Y178 HydrophobicContact CZ2-CE2 3.86Å; W131-Y178 AromaticContact CZ2-CZ 3.46Å; W131-Y178 VanDerWaalsContact CZ2-CZ 3.46Å; W131-Y178 VanDerWaalsContact CZ2-OH 3.29Å; W131-Y178 WeakPolarHBondContact CZ2-OH 3.21Å; W131-Y178 HydrophobicContact CZ3-CE2 4.45Å; W131-Y182 AromaticContact CD2-CD2 3.68Å; W131-Y182 HydrophobicContact CD2-CD2 3.68Å; W131-Y182 HydrophobicContact CD2-CE2 4.23Å; W131-Y182 AromaticContact CE2-CD2 3.44Å; W131-Y182 VanDerWaalsContact CE2-CD2 3.44Å; W131-Y182 AromaticContact CE2-CE2 3.84Å; W131-Y182 AromaticContact CE3-CD2 3.78Å; W131-Y182 HydrophobicContact CE3-CD2 3.78Å; W131-Y182 HydrophobicContact CE3-CG 4.5Å; W131-Y182 HydrophobicContact CG-CD2 4.48Å; W131-Y182 AromaticContact CH2-CD2 3.51Å; W131-Y182 HydrophobicContact CH2-CD2 3.51Å; W131-Y182 HydrophobicContact CH2-CG 4.02Å; W131-Y182 AromaticContact CZ2-CD2 3.36Å; W131-Y182 HydrophobicContact CZ2-CD2 3.36Å; W131-Y182 HydrophobicContact CZ2-CE2 4.01Å; W131-Y182 HydrophobicContact CZ2-CG 4.27Å; W131-Y182 VanDerWaalsContact CZ3-CA 3.5Å; W131-Y182 AromaticContact CZ3-CD2 3.72Å; W131-Y182 HydrophobicContact CZ3-CD2 3.72Å; W131-Y182 HydrophobicContact CZ3-CG 4.15Å; W131-Y182 AromaticContact NE1-CE2 3.99Å
132K90.2Very high89.6Confident117 Ų11759.6 Ų59.651%0.50929%0.292SS..Hα-helixtrans-62.7-36.8178-172.8-176.1173.2-163.50112.3A128 F129 L130 G136A128-K132 WeakPolarHBondContact O-CB 3.08Å; A128-K132 PolarHBondContact O-N 3.47Å; F129-K132 PolarHBondContact O-N 2.87Å; L130-K132 VanDerWaalsContact C-N 3.3Å; L130-K132 PolarHBondContact O-N 3.24Å; K132-G136 PolarHBondContact O-N 3.27Å
133I90.6Very high88.7Confident99 Ų9953.4 Ų53.451%0.50827%0.265SS..Hα-helixtrans-68.2-46.5176-67.9166.8000110.1F129 L130 W131F129-I133 HydrophobicContact CD1-CD1 3.94Å; F129-I133 HydrophobicContact CE1-CD1 3.43Å; F129-I133 VanDerWaalsContact CE1-CD1 3.43Å; F129-I133 HydrophobicContact CE2-CD1 4.11Å; F129-I133 HydrophobicContact CG-CD1 4.48Å; F129-I133 HydrophobicContact CZ-CD1 3.54Å; F129-I133 PolarHBondContact O-N 3.41Å; L130-I133 PolarHBondContact O-N 2.9Å; L130-I133 VanDerWaalsContact O-N 3.15Å; W131-I133 VanDerWaalsContact C-N 3.3Å; W131-I133 PolarHBondContact O-N 3.42Å
134W90.8Very high87.2Confident102 Ų10252.4 Ų52.439%0.38626%0.258SS..Hα-helixtrans-73.9-30.6-177.4-64.3-23.9000114.2L130 W131 G136 S181 F184L130-W134 HydrophobicContact CB-CZ3 4.48Å; L130-W134 PolarHBondContact O-N 3.5Å; W131-W134 PolarHBondContact O-N 3.32Å; W134-G136 VanDerWaalsContact C-N 3.32Å; W134-S181 VanDerWaalsContact CE3-CB 3.47Å; W134-S181 WeakPolarHBondContact CZ3-O 3.02Å; W134-F184 AromaticContact CH2-CD1 3.34Å; W134-F184 HydrophobicContact CH2-CD1 3.34Å; W134-F184 AromaticContact CH2-CE1 3.67Å; W134-F184 HydrophobicContact CH2-CE1 3.67Å; W134-F184 HydrophobicContact CH2-CG 4.08Å; W134-F184 HydrophobicContact CZ3-CB 4.23Å; W134-F184 AromaticContact CZ3-CD1 3.5Å; W134-F184 HydrophobicContact CZ3-CD1 3.5Å; W134-F184 HydrophobicContact CZ3-CE1 4.23Å; W134-F184 HydrophobicContact CZ3-CG 4.18Å
135E89.4Confident85.6Confident8 Ų855.7 Ų55.74%0.03728%0.275CS..Hα-helixtrans-68.2-33.1176.2-176.9-85.7160.700111.9I19 W131 G137 R138 L139 Y178I19-E135 HydrophobicContact CG2-CB 4.37Å; I19-E135 HydrophobicContact CG2-CG 3.79Å; W131-E135 HydrophobicContact CD2-CB 4.44Å; W131-E135 HydrophobicContact CZ2-CB 4.22Å; W131-E135 HydrophobicContact CZ2-CG 4.34Å; W131-E135 WeakPolarHBondContact O-CB 3.29Å; W131-E135 PolarHBondContact O-N 2.86Å; E135-G137 VanDerWaalsContact CD-N 3.31Å; E135-G137 PolarHBondContact O-N 3.47Å; E135-G137 VanDerWaalsContact OE1-C 3.23Å; E135-G137 WeakPolarHBondContact OE1-CA 3.36Å; E135-G137 WeakPolarHBondContact OE2-CA 3.43Å; E135-G137 PolarHBondContact OE2-N 3.2Å; E135-R138 WeakPolarHBondContact O-CB 3.46Å; E135-R138 PolarHBondContact O-N 3.1Å; E135-R138 PolarHBondContact OE1-N 3.24Å; E135-L139 WeakPolarHBondContact OE1-CB 3.43Å; E135-L139 PolarHBondContact OE1-N 3.1Å; E135-Y178 HydrophobicContact CB-CE2 4.36Å; E135-Y178 HydrophobicContact CG-CE2 4.04Å
136G84.8Confident84Confident61 Ų6153 Ų5363%0.62927%0.266SS*.THydrogen-bonded Turntrans59.821.3169.100000115.2K132 W134 R138K132-G136 PolarHBondContact O-N 3.27Å; W134-G136 VanDerWaalsContact C-N 3.32Å; G136-R138 VanDerWaalsContact C-N 3.27Å; G136-R138 PolarHBondContact O-N 2.97Å
137G83.8Confident82.2Confident20 Ų2054.6 Ų54.621%0.20627%0.272CS..THydrogen-bonded Turntrans75.37.9-176.800000115E135 L139 K140 H141E135-G137 VanDerWaalsContact CD-N 3.31Å; E135-G137 PolarHBondContact O-N 3.47Å; E135-G137 VanDerWaalsContact OE1-C 3.23Å; E135-G137 WeakPolarHBondContact OE1-CA 3.36Å; E135-G137 WeakPolarHBondContact OE2-CA 3.43Å; E135-G137 PolarHBondContact OE2-N 3.2Å; G137-L139 PolarHBondContact O-N 2.85Å; G137-K140 WeakPolarHBondContact O-CB 3.41Å; G137-K140 PolarHBondContact O-N 3.2Å; G137-H141 PolarHBondContact O-CD2 3.41Å; G137-H141 PolarHBondContact O-N 2.96Å
138R84.4Confident80.4Confident69 Ų6962.4 Ų62.426%0.2631%0.305SS..Hα-helixtrans-58.6-48.2-175.9-177.2-177.4-66.2174.44.7112.6E135 G136 K140 H141 L142 T174E135-R138 WeakPolarHBondContact O-CB 3.46Å; E135-R138 PolarHBondContact O-N 3.1Å; E135-R138 PolarHBondContact OE1-N 3.24Å; G136-R138 VanDerWaalsContact C-N 3.27Å; G136-R138 PolarHBondContact O-N 2.97Å; R138-K140 PolarHBondContact O-N 2.82Å; R138-H141 PolarHBondContact O-N 3.13Å; R138-L142 HydrophobicContact CG-CD1 3.81Å; R138-L142 WeakPolarHBondContact O-CD1 3.39Å; R138-L142 WeakPolarHBondContact O-CG 3.24Å; R138-L142 PolarHBondContact O-N 3.32Å; R138-T174 VanDerWaalsContact CZ-CG2 3.45Å; R138-T174 PolarHBondContact NH1-O 3.35Å
139L84.6Confident78.5Confident3 Ų365 Ų652%0.01632%0.318CS..Hα-helixtrans-68-32.3-178.5-170.565000110.7V17 I19 E135 G137 L142 C143 R334 V335 N338V17-L139 HydrophobicContact CG1-CB 4.42Å; V17-L139 HydrophobicContact CG1-CD2 4.11Å; V17-L139 HydrophobicContact CG1-CG 3.88Å; I19-L139 HydrophobicContact CG1-CD2 4.27Å; E135-L139 WeakPolarHBondContact OE1-CB 3.43Å; E135-L139 PolarHBondContact OE1-N 3.1Å; G137-L139 PolarHBondContact O-N 2.85Å; L139-L142 PolarHBondContact O-N 2.95Å; L139-C143 VanDerWaalsContact O-CB 3.31Å; L139-C143 WeakPolarHBondContact O-CB 3.47Å; L139-C143 PolarHBondContact O-N 3.5Å; L139-R334 HydrophobicContact CD1-CB 4.24Å; L139-V335 HydrophobicContact CD1-CG2 3.84Å; L139-N338 WeakPolarHBondContact CD2-ND2 3.44Å
140K83.3Confident76.6Confident106 Ų10664.4 Ų64.446%0.46133%0.332SS..Hα-helixtrans-62.7-50.7172.1-169.3-178.4175-167.70110.8V17 G137 R138 L142 C143 D144V17-K140 HydrophobicContact CG2-CG 4.48Å; G137-K140 WeakPolarHBondContact O-CB 3.41Å; G137-K140 PolarHBondContact O-N 3.2Å; R138-K140 PolarHBondContact O-N 2.82Å; K140-L142 PolarHBondContact O-N 2.92Å; K140-C143 PolarHBondContact O-N 2.69Å; K140-C143 VanDerWaalsContact O-N 3.14Å; K140-D144 WeakPolarHBondContact CE-OD2 2.85Å; K140-D144 HydrophobicContact CG-CB 3.87Å; K140-D144 IonicContact NZ-OD2 3.67Å; K140-D144 WeakPolarHBondContact O-CB 3.44Å; K140-D144 PolarHBondContact O-N 3.14Å
141H82.4Confident74.8Confident157 Ų15769.6 Ų69.673%0.72737%0.365SS*.Hα-helixtrans-58.4-33.6176.5-79.1-71.1000113.5G137 R138G137-H141 PolarHBondContact O-CD2 3.41Å; G137-H141 PolarHBondContact O-N 2.96Å; R138-H141 PolarHBondContact O-N 3.13Å
142L79.6Confident73Confident21 Ų2172.8 Ų72.811%0.1139%0.387CS..Hα-helixtrans-76.8-26.8178.3-71156.6000113.8R138 L139 K140 H159 L163 Y166 V335R138-L142 HydrophobicContact CG-CD1 3.81Å; R138-L142 WeakPolarHBondContact O-CD1 3.39Å; R138-L142 WeakPolarHBondContact O-CG 3.24Å; R138-L142 PolarHBondContact O-N 3.32Å; L139-L142 PolarHBondContact O-N 2.95Å; K140-L142 PolarHBondContact O-N 2.92Å; L142-H159 PolarHBondContact O-CE1 3.19Å; L142-L163 HydrophobicContact CD2-CD1 3.57Å; L142-Y166 HydrophobicContact CD1-CE1 4.25Å; L142-Y166 HydrophobicContact CD2-CD1 3.94Å; L142-Y166 HydrophobicContact CD2-CE1 4.02Å; L142-Y166 HydrophobicContact CD2-CG 4.27Å; L142-V335 HydrophobicContact CD1-CG2 4.44Å
143C75.3Confident71.6Confident1 Ų176.2 Ų76.21%0.00740%0.401CS..Hα-helixtrans-122.3-21.4-167.5-630000116.3V17 L139 K140 D145 F146 N338V17-C143 HydrophobicContact CG1-CB 4.26Å; V17-C143 HydrophobicContact CG2-CB 4.08Å; L139-C143 VanDerWaalsContact O-CB 3.31Å; L139-C143 WeakPolarHBondContact O-CB 3.47Å; L139-C143 PolarHBondContact O-N 3.5Å; K140-C143 PolarHBondContact O-N 2.69Å; K140-C143 VanDerWaalsContact O-N 3.14Å; C143-D145 PolarHBondContact O-N 2.86Å; C143-D145 VanDerWaalsContact O-N 3.15Å; C143-F146 PolarHBondContact O-N 3.28Å; C143-N338 HydrophobicContact CB-CB 4.02Å
144D65.9Low70.2Confident38 Ų3877 Ų7720%0.20341%0.407CS..THydrogen-bonded Turntrans-65.4-21.7-168.2-15531.8000113.2S16 V17 K140S16-D144 PolarHBondContact OG-OD1 3.36Å; S16-D144 VanDerWaalsContact OG-OD1 3.06Å; V17-D144 HydrophobicContact CG2-CB 4.29Å; K140-D144 WeakPolarHBondContact CE-OD2 2.85Å; K140-D144 HydrophobicContact CG-CB 3.87Å; K140-D144 IonicContact NZ-OD2 3.67Å; K140-D144 WeakPolarHBondContact O-CB 3.44Å; K140-D144 PolarHBondContact O-N 3.14Å
145D61.8Low68.9Low70 Ų7078.4 Ų78.437%0.37442%0.415SS..THydrogen-bonded Turntrans-83.6-26179.2-80.2-14.4000113.7C143 K148 M149C143-D145 PolarHBondContact O-N 2.86Å; C143-D145 VanDerWaalsContact O-N 3.15Å; D145-K148 PolarHBondContact O-N 3.4Å; D145-M149 HydrophobicContact CB-CE 3.53Å; D145-M149 HydrophobicContact CB-SD 3.98Å; D145-M149 VanDerWaalsContact CG-CE 3.49Å; D145-M149 WeakPolarHBondContact O-CB 3.48Å; D145-M149 WeakPolarHBondContact O-CG 3.46Å; D145-M149 PolarHBondContact O-N 2.94Å; D145-M149 VanDerWaalsContact O-N 3.14Å
146F59.4Low67.8Low14 Ų1479.1 Ų79.16%0.06142%0.421CS..Hα-helixtrans-72.7-34.3-175.5-74.3-74.6000113.8C143 K148 M149 A150 H159 I339 L343C143-F146 PolarHBondContact O-N 3.28Å; F146-K148 VanDerWaalsContact C-N 3.26Å; F146-K148 PolarHBondContact O-N 3.24Å; F146-M149 PolarHBondContact O-N 2.73Å; F146-A150 PolarHBondContact O-N 2.97Å; F146-H159 HydrophobicContact CE1-CB 4.15Å; F146-H159 AromaticContact CE2-CE1 3.34Å; F146-H159 WeakPolarHBondContact CE2-CE1 3.45Å; F146-H159 AromaticContact CE2-CG 3.94Å; F146-H159 AromaticContact CE2-ND1 3.04Å; F146-H159 WeakPolarHBondContact CE2-ND1 3.44Å; F146-H159 HydrophobicContact CZ-CB 3.94Å; F146-H159 AromaticContact CZ-CE1 3.85Å; F146-H159 AromaticContact CZ-CG 3.7Å; F146-H159 AromaticContact CZ-ND1 3.04Å; F146-H159 WeakPolarHBondContact CZ-ND1 3.5Å; F146-I339 HydrophobicContact CD2-CD1 3.81Å; F146-I339 HydrophobicContact CD2-CG1 4.32Å; F146-I339 HydrophobicContact CE2-CD1 3.86Å; F146-I339 HydrophobicContact CG-CD1 4.43Å; F146-L343 HydrophobicContact CD1-CD1 4.17Å
147H56.2Low67.1Low123 Ų12384 Ų8457%0.56942%0.421SS*.Hα-helixtrans-66.9-27.9179.2-100.582.8000112.7N338H147-N338 PolarHBondContact CE1-O 3.41Å
148K54.9Low66.6Low164 Ų16487.2 Ų87.271%0.71344%0.437SS*.Hα-helixtrans-90.8-21.8177-68.2177.5-178.1170.50113.1D145 F146D145-K148 PolarHBondContact O-N 3.4Å; F146-K148 VanDerWaalsContact C-N 3.26Å; F146-K148 PolarHBondContact O-N 3.24Å
149M51.8Low66.1Low56 Ų5685.5 Ų85.528%0.27643%0.431SS..Hα-helixtrans-102.24.4-170.1-66.9-179.9-163.400115.2D145 F146 V151 C152 K155D145-M149 HydrophobicContact CB-CE 3.53Å; D145-M149 HydrophobicContact CB-SD 3.98Å; D145-M149 VanDerWaalsContact CG-CE 3.49Å; D145-M149 WeakPolarHBondContact O-CB 3.48Å; D145-M149 WeakPolarHBondContact O-CG 3.46Å; D145-M149 PolarHBondContact O-N 2.94Å; D145-M149 VanDerWaalsContact O-N 3.14Å; F146-M149 PolarHBondContact O-N 2.73Å; M149-V151 PolarHBondContact O-N 2.86Å; M149-C152 PolarHBondContact O-N 3.31Å; M149-C152 VanDerWaalsContact O-N 3.11Å; M149-K155 HydrophobicContact SD-CB 4.48Å
150A53Low65.8Low90 Ų9085.6 Ų85.674%0.74443%0.432SS*.THydrogen-bonded Turntrans-57.1-8175.700000114.7F146F146-A150 PolarHBondContact O-N 2.97Å
151V54.2Low65.7Low142 Ų14288.4 Ų88.486%0.86144%0.44SS*.THydrogen-bonded Turntrans-91.2-16-179-172.20000113.1M149M149-V151 PolarHBondContact O-N 2.86Å
152C56.8Low65.7Low68 Ų6885.2 Ų85.246%0.45943%0.431SS..  trans-130.4109.9-174.9-150.20000113.2M149 D154 S156M149-C152 PolarHBondContact O-N 3.31Å; M149-C152 VanDerWaalsContact O-N 3.11Å; C152-D154 PolarHBondContact O-N 3.46Å; C152-S156 PolarHBondContact O-N 3.44Å
153K61.3Low65.8Low189 Ų18984.3 Ų84.382%0.82243%0.426SS*.Hα-helixtrans-62.7-33.9-173.1-75.7-179.1179.2173.90114.5R157K153-R157 PolarHBondContact O-N 3.21Å
154D61.6Low66.2Low116 Ų11684.8 Ų84.862%0.6243%0.429SS*.Hα-helixtrans-74.4-38.9-176.8-92.8-20.9000113.7C152 S156 R157 T158C152-D154 PolarHBondContact O-N 3.46Å; D154-S156 VanDerWaalsContact C-N 3.32Å; D154-S156 PolarHBondContact O-N 2.96Å; D154-R157 PolarHBondContact O-N 3.36Å; D154-T158 PolarHBondContact O-N 3.29Å; D154-T158 PolarHBondContact O-OG1 2.95Å; D154-T158 VanDerWaalsContact O-OG1 3.05Å
155K63.5Low67.1Low130 Ų13087.5 Ų87.557%0.56544%0.444SS*.Hα-helixtrans-69.5-30.8176.3-69.3-175178.6-1790112.4M149 T158 H159M149-K155 HydrophobicContact SD-CB 4.48Å; K155-T158 WeakPolarHBondContact CA-OG1 3.41Å; K155-T158 PolarHBondContact O-OG1 3.49Å; K155-H159 PolarHBondContact O-N 3.48Å
156S65.3Low68.2Low23 Ų2386.1 Ų86.116%0.16143%0.433CS..Hα-helixtrans-65.6-36.7175.8177.70000112.6C152 D154 L160 L343C152-S156 PolarHBondContact O-N 3.44Å; D154-S156 VanDerWaalsContact C-N 3.32Å; D154-S156 PolarHBondContact O-N 2.96Å; S156-L160 WeakPolarHBondContact O-CB 3.15Å; S156-L160 PolarHBondContact O-N 3.03Å; S156-L343 WeakPolarHBondContact OG-CD2 3.1Å
157R70.8Confident69.3Low164 Ų16486.4 Ų86.462%0.61944%0.435SS*.Hα-helixtrans-68-40.2177.2-77176.6169.2161.8-6.6112.8K153 D154 L160 R161K153-R157 PolarHBondContact O-N 3.21Å; D154-R157 PolarHBondContact O-N 3.36Å; R157-L160 PolarHBondContact O-N 3.3Å; R157-R161 PolarHBondContact O-N 3.26Å
158T73.1Confident70.4Confident88 Ų8883.6 Ų83.654%0.5443%0.429SS..Hα-helixtrans-63.5-44.2178.37.10000111.2D154 K155 R161 V162D154-T158 PolarHBondContact O-N 3.29Å; D154-T158 PolarHBondContact O-OG1 2.95Å; D154-T158 VanDerWaalsContact O-OG1 3.05Å; K155-T158 WeakPolarHBondContact CA-OG1 3.41Å; K155-T158 PolarHBondContact O-OG1 3.49Å; T158-R161 PolarHBondContact O-N 3.5Å; T158-V162 WeakPolarHBondContact O-CG2 3.26Å; T158-V162 PolarHBondContact O-N 2.67Å; T158-V162 VanDerWaalsContact O-N 3.15Å
159H72.9Confident71.7Confident32 Ų3278.5 Ų78.515%0.14841%0.414CS..Hα-helixtrans-72.8-29.8177.8-160.6-63.7000113L142 F146 K155 V162 L163L142-H159 PolarHBondContact O-CE1 3.19Å; F146-H159 HydrophobicContact CE1-CB 4.15Å; F146-H159 AromaticContact CE2-CE1 3.34Å; F146-H159 WeakPolarHBondContact CE2-CE1 3.45Å; F146-H159 AromaticContact CE2-CG 3.94Å; F146-H159 AromaticContact CE2-ND1 3.04Å; F146-H159 WeakPolarHBondContact CE2-ND1 3.44Å; F146-H159 HydrophobicContact CZ-CB 3.94Å; F146-H159 AromaticContact CZ-CE1 3.85Å; F146-H159 AromaticContact CZ-CG 3.7Å; F146-H159 AromaticContact CZ-ND1 3.04Å; F146-H159 WeakPolarHBondContact CZ-ND1 3.5Å; K155-H159 PolarHBondContact O-N 3.48Å; H159-V162 PolarHBondContact O-N 3.18Å; H159-L163 PolarHBondContact O-N 3.44Å; H159-L163 VanDerWaalsContact O-N 3.11Å
160L78.5Confident72.8Confident6 Ų682.3 Ų82.33%0.03144%0.435CS..Hα-helixtrans-62.3-44.6171.3-170.465000110.9S156 R157 V162 L163 V164 K346 L347 E350S156-L160 WeakPolarHBondContact O-CB 3.15Å; S156-L160 PolarHBondContact O-N 3.03Å; R157-L160 PolarHBondContact O-N 3.3Å; L160-V162 VanDerWaalsContact C-N 3.33Å; L160-V162 PolarHBondContact O-N 3.07Å; L160-L163 WeakPolarHBondContact O-CA 3Å; L160-L163 WeakPolarHBondContact O-CB 3.19Å; L160-L163 PolarHBondContact O-N 3.31Å; L160-V164 WeakPolarHBondContact O-CG2 3.49Å; L160-V164 PolarHBondContact O-N 2.94Å; L160-K346 HydrophobicContact CD2-CB 3.85Å; L160-L347 HydrophobicContact CD1-CB 3.74Å; L160-L347 HydrophobicContact CD1-CD1 3.96Å; L160-L347 HydrophobicContact CD1-CG 4.45Å; L160-E350 VanDerWaalsContact CD2-CD 3.48Å; L160-E350 HydrophobicContact CD2-CG 4.35Å; L160-E350 VanDerWaalsContact CD2-OE1 3.29Å; L160-E350 WeakPolarHBondContact CD2-OE1 3.23Å; L160-E350 WeakPolarHBondContact CG-OE2 2.99Å
161R80.8Confident74.2Confident164 Ų16483.2 Ų83.262%0.61942%0.42SS*.Hα-helixtrans-61-38.8175.1-168.6179.4-65.8170.3-2.4112.7R157 T158 L163 V164 N165R157-R161 PolarHBondContact O-N 3.26Å; T158-R161 PolarHBondContact O-N 3.5Å; R161-L163 VanDerWaalsContact C-N 3.29Å; R161-L163 PolarHBondContact O-N 3.04Å; R161-V164 PolarHBondContact O-N 2.99Å; R161-N165 WeakPolarHBondContact O-CB 3.48Å; R161-N165 VanDerWaalsContact O-CG 3.27Å; R161-N165 PolarHBondContact O-N 3.18Å
162V82.8Confident75.5Confident91 Ų9180.8 Ų80.855%0.55240%0.398SS*.Hα-helixtrans-59.7-41.8172.9172.40000110.9T158 H159 L160 N165 Y166T158-V162 WeakPolarHBondContact O-CG2 3.26Å; T158-V162 PolarHBondContact O-N 2.67Å; T158-V162 VanDerWaalsContact O-N 3.15Å; H159-V162 PolarHBondContact O-N 3.18Å; L160-V162 VanDerWaalsContact C-N 3.33Å; L160-V162 PolarHBondContact O-N 3.07Å; V162-N165 PolarHBondContact O-N 3.2Å; V162-Y166 WeakPolarHBondContact O-CB 3.34Å; V162-Y166 PolarHBondContact O-N 3.44Å
163L82.1Confident76.9Confident2 Ų284.8 Ų84.81%0.0141%0.41CS..Hα-helixtrans-69.8-40.4179.3-166.861.8000112.3L142 H159 L160 R161 Y166 F167 V335 I339 L347L142-L163 HydrophobicContact CD2-CD1 3.57Å; H159-L163 PolarHBondContact O-N 3.44Å; H159-L163 VanDerWaalsContact O-N 3.11Å; L160-L163 WeakPolarHBondContact O-CA 3Å; L160-L163 WeakPolarHBondContact O-CB 3.19Å; L160-L163 PolarHBondContact O-N 3.31Å; R161-L163 VanDerWaalsContact C-N 3.29Å; R161-L163 PolarHBondContact O-N 3.04Å; L163-Y166 WeakPolarHBondContact O-CB 3.45Å; L163-Y166 PolarHBondContact O-N 3.2Å; L163-F167 HydrophobicContact CD1-CD2 4.04Å; L163-F167 HydrophobicContact CD1-CE2 3.54Å; L163-F167 HydrophobicContact CD2-CE2 4.46Å; L163-F167 HydrophobicContact CG-CD2 3.97Å; L163-F167 HydrophobicContact CG-CE2 3.77Å; L163-F167 VanDerWaalsContact O-CD2 3.23Å; L163-F167 WeakPolarHBondContact O-CD2 3.35Å; L163-F167 PolarHBondContact O-N 3.06Å; L163-V335 HydrophobicContact CD2-CG1 3.94Å; L163-I339 HydrophobicContact CD2-CD1 4.34Å; L163-L347 HydrophobicContact CB-CD1 4.05Å; L163-L347 HydrophobicContact CD2-CD1 3.74Å; L163-L347 HydrophobicContact CD2-CD2 3.51Å; L163-L347 HydrophobicContact CD2-CG 4.21Å; L163-L347 HydrophobicContact CG-CD1 3.76Å; L163-L347 HydrophobicContact CG-CD2 4.14Å
164V83.4Confident78.1Confident10 Ų1077.5 Ų77.56%0.06138%0.381CS..Hα-helixtrans-61.8-46.8173.2173.70000110.4L160 R161 Y166 F167 S168 L347 E350 L351 A354L160-V164 WeakPolarHBondContact O-CG2 3.49Å; L160-V164 PolarHBondContact O-N 2.94Å; R161-V164 PolarHBondContact O-N 2.99Å; V164-Y166 VanDerWaalsContact C-N 3.29Å; V164-Y166 PolarHBondContact O-N 3.15Å; V164-F167 PolarHBondContact O-N 3.44Å; V164-S168 VanDerWaalsContact O-CB 3.25Å; V164-S168 WeakPolarHBondContact O-CB 3.26Å; V164-S168 PolarHBondContact O-N 3.37Å; V164-S168 PolarHBondContact O-OG 3.41Å; V164-L347 HydrophobicContact CG2-CD1 3.75Å; V164-E350 HydrophobicContact CG2-CB 3.63Å; V164-L351 HydrophobicContact CG1-CD2 4.1Å; V164-L351 HydrophobicContact CG2-CG 4.48Å; V164-A354 HydrophobicContact CG1-CB 4.39Å
165N84.4Confident79.4Confident95 Ų9572 Ų7251%0.50835%0.352SS..Hα-helixtrans-60.8-39.8175.8-75.7-6.5000111.7R161 V162 S168 S169R161-N165 WeakPolarHBondContact O-CB 3.48Å; R161-N165 VanDerWaalsContact O-CG 3.27Å; R161-N165 PolarHBondContact O-N 3.18Å; V162-N165 PolarHBondContact O-N 3.2Å; N165-S168 PolarHBondContact O-N 3.14Å; N165-S169 WeakPolarHBondContact O-CB 3.38Å; N165-S169 PolarHBondContact O-N 2.86Å; N165-S169 PolarHBondContact O-OG 3.33Å
166Y85.6Confident80.6Confident41 Ų4170.8 Ų70.816%0.16135%0.347CS..Hα-helixtrans-60.8-48.6176176.4-103.5000112.4L142 V162 L163 V164 S168 S169 Y171 H175L142-Y166 HydrophobicContact CD1-CE1 4.25Å; L142-Y166 HydrophobicContact CD2-CD1 3.94Å; L142-Y166 HydrophobicContact CD2-CE1 4.02Å; L142-Y166 HydrophobicContact CD2-CG 4.27Å; V162-Y166 WeakPolarHBondContact O-CB 3.34Å; V162-Y166 PolarHBondContact O-N 3.44Å; L163-Y166 WeakPolarHBondContact O-CB 3.45Å; L163-Y166 PolarHBondContact O-N 3.2Å; V164-Y166 VanDerWaalsContact C-N 3.29Å; V164-Y166 PolarHBondContact O-N 3.15Å; Y166-S168 VanDerWaalsContact C-N 3.34Å; Y166-S169 PolarHBondContact O-N 3.11Å; Y166-Y171 HydrophobicContact CD2-CD2 4.12Å; Y166-Y171 HydrophobicContact CD2-CE2 4.11Å; Y166-Y171 HydrophobicContact CE2-CD2 4.13Å; Y166-Y171 HydrophobicContact CE2-CE2 4.35Å; Y166-Y171 WeakPolarHBondContact O-CD2 3.48Å; Y166-H175 AromaticContact CE1-CE1 3.78Å; Y166-H175 AromaticContact CE1-NE2 3.28Å; Y166-H175 VanDerWaalsContact CE1-NE2 3.28Å; Y166-H175 WeakPolarHBondContact CE1-NE2 3.31Å; Y166-H175 AromaticContact CZ-CE1 4Å; Y166-H175 AromaticContact CZ-NE2 3.17Å; Y166-H175 PolarHBondContact OH-NE2 3.34Å
167F83Confident81.9Confident21 Ų2177.2 Ų77.29%0.09237%0.368CS..Hα-helixtrans-75.8-21179.3-75.8-67.2000113.9L163 V164 V331 L332 V335 L347 L351L163-F167 HydrophobicContact CD1-CD2 4.04Å; L163-F167 HydrophobicContact CD1-CE2 3.54Å; L163-F167 HydrophobicContact CD2-CE2 4.46Å; L163-F167 HydrophobicContact CG-CD2 3.97Å; L163-F167 HydrophobicContact CG-CE2 3.77Å; L163-F167 VanDerWaalsContact O-CD2 3.23Å; L163-F167 WeakPolarHBondContact O-CD2 3.35Å; L163-F167 PolarHBondContact O-N 3.06Å; V164-F167 PolarHBondContact O-N 3.44Å; F167-V331 HydrophobicContact CE1-CB 4.23Å; F167-V331 HydrophobicContact CE1-CG1 3.9Å; F167-V331 HydrophobicContact CZ-CG1 3.97Å; F167-L332 HydrophobicContact CD2-CD1 4.29Å; F167-L332 HydrophobicContact CE1-CB 4.23Å; F167-L332 HydrophobicContact CE1-CD1 4.42Å; F167-L332 HydrophobicContact CE2-CD1 3.87Å; F167-L332 HydrophobicContact CZ-CB 4.24Å; F167-L332 HydrophobicContact CZ-CD1 3.95Å; F167-V335 HydrophobicContact CZ-CG2 4.23Å; F167-L347 HydrophobicContact CE2-CD2 4.44Å; F167-L351 HydrophobicContact CB-CD2 3.95Å
168S79.3Confident82.8Confident63 Ų6370 Ų7044%0.44134%0.34SS..Hα-helixtrans-84.3-19.2175.1-54.20000112.7V164 N165 Y166V164-S168 VanDerWaalsContact O-CB 3.25Å; V164-S168 WeakPolarHBondContact O-CB 3.26Å; V164-S168 PolarHBondContact O-N 3.37Å; V164-S168 PolarHBondContact O-OG 3.41Å; N165-S168 PolarHBondContact O-N 3.14Å; Y166-S168 VanDerWaalsContact C-N 3.34Å
169S81Confident83.7Confident58 Ų5866.7 Ų66.741%0.40632%0.319SS..SBendtrans-79.7154175.9-62.60000111.7N165 Y166 Y171N165-S169 WeakPolarHBondContact O-CB 3.38Å; N165-S169 PolarHBondContact O-N 2.86Å; N165-S169 PolarHBondContact O-OG 3.33Å; Y166-S169 PolarHBondContact O-N 3.11Å; S169-Y171 VanDerWaalsContact C-N 3.33Å; S169-Y171 PolarHBondContact O-N 3.39Å
170D75Confident84.7Confident135 Ų13568.5 Ų68.572%0.72233%0.332SS*.SBendtrans-78.974.3-173.2-15813.8000113.3
171Y82.4Confident85.4Confident109 Ų10969.2 Ų69.243%0.42734%0.337SS..  trans-105.918.1177.6-68.7-70000113.9Y166 S169 E173 T174 H175Y166-Y171 HydrophobicContact CD2-CD2 4.12Å; Y166-Y171 HydrophobicContact CD2-CE2 4.11Å; Y166-Y171 HydrophobicContact CE2-CD2 4.13Å; Y166-Y171 HydrophobicContact CE2-CE2 4.35Å; Y166-Y171 WeakPolarHBondContact O-CD2 3.48Å; S169-Y171 VanDerWaalsContact C-N 3.33Å; S169-Y171 PolarHBondContact O-N 3.39Å; Y171-E173 PolarHBondContact O-N 3.46Å; Y171-T174 WeakPolarHBondContact O-CA 3.43Å; Y171-T174 WeakPolarHBondContact O-CB 3.21Å; Y171-T174 PolarHBondContact O-N 2.86Å; Y171-H175 PolarHBondContact O-N 3.47Å
172K81.8Confident86Confident92 Ų9261.5 Ų61.540%0.431%0.308SS..Hα-helixtrans-53.7-47.6-171.8-68.9175.4-178.5170.20113.6T174 H175 F176K172-T174 VanDerWaalsContact C-N 3.29Å; K172-T174 PolarHBondContact O-N 2.9Å; K172-H175 PolarHBondContact O-N 3.37Å; K172-F176 WeakPolarHBondContact O-CB 3.21Å; K172-F176 PolarHBondContact O-N 2.91Å
173E85.3Confident86.5Confident152 Ų15258.5 Ų58.571%0.7129%0.29SS*.Hα-helixtrans-60.2-39.7177.4-70.4-58.3145.200112.4Y171 F176 R177Y171-E173 PolarHBondContact O-N 3.46Å; E173-F176 PolarHBondContact O-N 2.89Å; E173-R177 WeakPolarHBondContact O-CB 3.45Å; E173-R177 PolarHBondContact O-N 3.43Å
174T87.1Confident87.1Confident35 Ų3563.2 Ų63.222%0.21531%0.311CS..Hα-helixtrans-74.1-32-178.7-72.20000112.1R138 Y171 K172 Y178R138-T174 VanDerWaalsContact CZ-CG2 3.45Å; R138-T174 PolarHBondContact NH1-O 3.35Å; Y171-T174 WeakPolarHBondContact O-CA 3.43Å; Y171-T174 WeakPolarHBondContact O-CB 3.21Å; Y171-T174 PolarHBondContact O-N 2.86Å; K172-T174 VanDerWaalsContact C-N 3.29Å; K172-T174 PolarHBondContact O-N 2.9Å; T174-Y178 PolarHBondContact O-N 3.5Å
175H89.2Confident87.6Confident1 Ų162.8 Ų62.81%0.00531%0.308CS..Hα-helixtrans-73.7-36.5171.1-64.8162.9000112.2Y166 Y171 K172 Y178 F179 D328 V331Y166-H175 AromaticContact CE1-CE1 3.78Å; Y166-H175 AromaticContact CE1-NE2 3.28Å; Y166-H175 VanDerWaalsContact CE1-NE2 3.28Å; Y166-H175 WeakPolarHBondContact CE1-NE2 3.31Å; Y166-H175 AromaticContact CZ-CE1 4Å; Y166-H175 AromaticContact CZ-NE2 3.17Å; Y166-H175 PolarHBondContact OH-NE2 3.34Å; Y171-H175 PolarHBondContact O-N 3.47Å; K172-H175 PolarHBondContact O-N 3.37Å; H175-Y178 WeakPolarHBondContact O-CB 3.38Å; H175-Y178 PolarHBondContact O-N 3.24Å; H175-F179 PolarHBondContact O-N 2.83Å; H175-D328 IonicContact CE1-OD1 3.2Å; H175-D328 IonicContact CG-OD1 3.94Å; H175-D328 IonicContact ND1-OD1 3.71Å; H175-D328 PolarHBondContact ND1-OD1 3.15Å; H175-V331 HydrophobicContact CB-CG2 4.1Å
176F89.8Confident88.1Confident105 Ų10558.6 Ų58.646%0.46129%0.285SS..Hα-helixtrans-65.2-46.6175.2-175.3-106.6000111.8K172 E173 Y178 F179 V180K172-F176 WeakPolarHBondContact O-CB 3.21Å; K172-F176 PolarHBondContact O-N 2.91Å; E173-F176 PolarHBondContact O-N 2.89Å; F176-Y178 VanDerWaalsContact C-N 3.31Å; F176-Y178 PolarHBondContact O-N 3.01Å; F176-F179 HydrophobicContact CD2-CD1 4.35Å; F176-F179 HydrophobicContact CE2-CD1 4.29Å; F176-F179 WeakPolarHBondContact O-CB 3.45Å; F176-F179 PolarHBondContact O-N 3.27Å; F176-F179 VanDerWaalsContact O-N 3.09Å; F176-V180 HydrophobicContact CD1-CG2 4.06Å; F176-V180 HydrophobicContact CE1-CG2 3.62Å; F176-V180 HydrophobicContact CE2-CG2 4.17Å; F176-V180 HydrophobicContact CZ-CG2 3.68Å; F176-V180 WeakPolarHBondContact O-CG2 3.22Å; F176-V180 PolarHBondContact O-N 3.46Å
177R90.7Very high88.5Confident158 Ų15860.3 Ų60.360%0.59630%0.296SS*.Hα-helixtrans-57.9-42.6173.8179.8171.351.7172.7-5.9112.3E173 F179 V180 S181E173-R177 WeakPolarHBondContact O-CB 3.45Å; E173-R177 PolarHBondContact O-N 3.43Å; R177-F179 VanDerWaalsContact C-N 3.3Å; R177-F179 PolarHBondContact O-N 3.42Å; R177-V180 PolarHBondContact O-N 3.45Å; R177-S181 WeakPolarHBondContact O-CB 3.11Å; R177-S181 PolarHBondContact O-N 3.47Å; R177-S181 PolarHBondContact O-OG 2.98Å
178Y91.4Very high89.1Confident11 Ų1161 Ų614%0.04330%0.301CS..Hα-helixtrans-58.9-43175.3-178.3-92.4000111.9W131 E135 T174 H175 F176 Y182 F330 V331W131-Y178 HydrophobicContact CH2-CD1 4.06Å; W131-Y178 AromaticContact CH2-CD2 3.93Å; W131-Y178 HydrophobicContact CH2-CD2 3.93Å; W131-Y178 AromaticContact CH2-CE1 3.64Å; W131-Y178 HydrophobicContact CH2-CE1 3.64Å; W131-Y178 AromaticContact CH2-CE2 3.5Å; W131-Y178 HydrophobicContact CH2-CE2 3.5Å; W131-Y178 VanDerWaalsContact CH2-CE2 3.5Å; W131-Y178 HydrophobicContact CH2-CG 4.2Å; W131-Y178 AromaticContact CH2-CZ 3.34Å; W131-Y178 HydrophobicContact CZ2-CE1 4.03Å; W131-Y178 AromaticContact CZ2-CE2 3.86Å; W131-Y178 HydrophobicContact CZ2-CE2 3.86Å; W131-Y178 AromaticContact CZ2-CZ 3.46Å; W131-Y178 VanDerWaalsContact CZ2-CZ 3.46Å; W131-Y178 VanDerWaalsContact CZ2-OH 3.29Å; W131-Y178 WeakPolarHBondContact CZ2-OH 3.21Å; W131-Y178 HydrophobicContact CZ3-CE2 4.45Å; E135-Y178 HydrophobicContact CB-CE2 4.36Å; E135-Y178 HydrophobicContact CG-CE2 4.04Å; T174-Y178 PolarHBondContact O-N 3.5Å; H175-Y178 WeakPolarHBondContact O-CB 3.38Å; H175-Y178 PolarHBondContact O-N 3.24Å; F176-Y178 VanDerWaalsContact C-N 3.31Å; F176-Y178 PolarHBondContact O-N 3.01Å; Y178-Y182 PolarHBondContact O-N 3.41Å; Y178-Y182 VanDerWaalsContact O-N 3.12Å; Y178-F330 AromaticContact CD1-CD1 3.99Å; Y178-F330 HydrophobicContact CD1-CD1 3.99Å; Y178-F330 AromaticContact CD1-CE1 3.85Å; Y178-F330 HydrophobicContact CD1-CE1 3.85Å; Y178-F330 HydrophobicContact CE1-CD1 4.13Å; Y178-F330 AromaticContact CE1-CE1 3.7Å; Y178-F330 HydrophobicContact CE1-CE1 3.7Å; Y178-V331 HydrophobicContact CD1-CG2 3.79Å; Y178-V331 HydrophobicContact CE1-CG2 4.23Å; Y178-V331 HydrophobicContact CG-CG2 4.45Å
179F91.8Very high89.9Confident20 Ų2058.1 Ų58.19%0.08828%0.281CS..Hα-helixtrans-63.9-49.3175.5165.5-108.8000112.5H175 F176 R177 S181 Y182 V183 V295 F326 F330H175-F179 PolarHBondContact O-N 2.83Å; F176-F179 HydrophobicContact CD2-CD1 4.35Å; F176-F179 HydrophobicContact CE2-CD1 4.29Å; F176-F179 WeakPolarHBondContact O-CB 3.45Å; F176-F179 PolarHBondContact O-N 3.27Å; F176-F179 VanDerWaalsContact O-N 3.09Å; R177-F179 VanDerWaalsContact C-N 3.3Å; R177-F179 PolarHBondContact O-N 3.42Å; F179-S181 VanDerWaalsContact C-N 3.35Å; F179-S181 PolarHBondContact O-N 3.16Å; F179-Y182 WeakPolarHBondContact O-CB 3.22Å; F179-Y182 PolarHBondContact O-N 3.16Å; F179-Y182 VanDerWaalsContact O-N 3.07Å; F179-V183 HydrophobicContact CD2-CG2 3.88Å; F179-V183 HydrophobicContact CE1-CG2 4.21Å; F179-V183 HydrophobicContact CE2-CG2 3.2Å; F179-V183 HydrophobicContact CZ-CG2 3.43Å; F179-V183 VanDerWaalsContact CZ-CG2 3.43Å; F179-V183 PolarHBondContact O-N 2.72Å; F179-V295 HydrophobicContact CZ-CG2 4.08Å; F179-F326 AromaticContact CD1-CD1 3.9Å; F179-F326 HydrophobicContact CD1-CD1 3.9Å; F179-F326 HydrophobicContact CD1-CE1 4.05Å; F179-F326 HydrophobicContact CD2-CD1 4.19Å; F179-F326 AromaticContact CD2-CE1 3.66Å; F179-F326 HydrophobicContact CD2-CE1 3.66Å; F179-F326 AromaticContact CE1-CD1 3.76Å; F179-F326 HydrophobicContact CE1-CD1 3.76Å; F179-F326 AromaticContact CE1-CE1 3.66Å; F179-F326 HydrophobicContact CE1-CE1 3.66Å; F179-F326 HydrophobicContact CE2-CD1 4.09Å; F179-F326 AromaticContact CE2-CE1 3.26Å; F179-F326 HydrophobicContact CE2-CE1 3.26Å; F179-F326 HydrophobicContact CE2-CZ 4.07Å; F179-F326 HydrophobicContact CG-CD1 4.1Å; F179-F326 HydrophobicContact CG-CE1 4.03Å; F179-F326 AromaticContact CZ-CD1 3.85Å; F179-F326 HydrophobicContact CZ-CD1 3.85Å; F179-F326 AromaticContact CZ-CE1 3.23Å; F179-F326 HydrophobicContact CZ-CE1 3.23Å; F179-F326 AromaticContact CZ-CZ 3.97Å; F179-F326 HydrophobicContact CZ-CZ 3.97Å; F179-F330 HydrophobicContact CB-CD1 4.02Å; F179-F330 HydrophobicContact CB-CG 4.4Å; F179-F330 HydrophobicContact CD2-CB 4.19Å; F179-F330 HydrophobicContact CD2-CD1 4.03Å; F179-F330 HydrophobicContact CD2-CD2 4.03Å; F179-F330 HydrophobicContact CD2-CE1 4.43Å; F179-F330 HydrophobicContact CD2-CE2 4.45Å; F179-F330 AromaticContact CD2-CG 3.8Å; F179-F330 HydrophobicContact CD2-CG 3.8Å
180V92.9Very high90.6Very high70 Ų7056.7 Ų56.742%0.42427%0.268SS..Hα-helixtrans-59.9-45.7179.9171.70000111F176 R177 Y182 V183 F184F176-V180 HydrophobicContact CD1-CG2 4.06Å; F176-V180 HydrophobicContact CE1-CG2 3.62Å; F176-V180 HydrophobicContact CE2-CG2 4.17Å; F176-V180 HydrophobicContact CZ-CG2 3.68Å; F176-V180 WeakPolarHBondContact O-CG2 3.22Å; F176-V180 PolarHBondContact O-N 3.46Å; R177-V180 PolarHBondContact O-N 3.45Å; V180-Y182 VanDerWaalsContact C-N 3.26Å; V180-Y182 PolarHBondContact O-N 3.5Å; V180-V183 PolarHBondContact O-N 2.86Å; V180-F184 WeakPolarHBondContact O-CB 3.34Å; V180-F184 PolarHBondContact O-N 2.78Å
181S93.2Very high91.6Very high21 Ų2152.5 Ų52.515%0.14725%0.249CC..Hα-helixtrans-57.5-39.2174.4-72.30000112.2W134 R177 F179 C185W134-S181 VanDerWaalsContact CE3-CB 3.47Å; W134-S181 WeakPolarHBondContact CZ3-O 3.02Å; R177-S181 WeakPolarHBondContact O-CB 3.11Å; R177-S181 PolarHBondContact O-N 3.47Å; R177-S181 PolarHBondContact O-OG 2.98Å; F179-S181 VanDerWaalsContact C-N 3.35Å; F179-S181 PolarHBondContact O-N 3.16Å; S181-C185 PolarHBondContact O-N 3.22Å; S181-C185 PolarHBondContact O-SG 3.09Å
182Y92.7Very high92.3Very high1 Ų147.9 Ų47.90%0.00423%0.232CC..Hα-helixtrans-67.5-46.4176.9-168.7-102000112.5D21 F24 W131 Y178 F179 V180 F184 C185 E186 F330 R334D21-Y182 PolarHBondContact OD2-OH 3.46Å; F24-Y182 HydrophobicContact CD2-CE2 4.48Å; W131-Y182 AromaticContact CD2-CD2 3.68Å; W131-Y182 HydrophobicContact CD2-CD2 3.68Å; W131-Y182 HydrophobicContact CD2-CE2 4.23Å; W131-Y182 AromaticContact CE2-CD2 3.44Å; W131-Y182 VanDerWaalsContact CE2-CD2 3.44Å; W131-Y182 AromaticContact CE2-CE2 3.84Å; W131-Y182 AromaticContact CE3-CD2 3.78Å; W131-Y182 HydrophobicContact CE3-CD2 3.78Å; W131-Y182 HydrophobicContact CE3-CG 4.5Å; W131-Y182 HydrophobicContact CG-CD2 4.48Å; W131-Y182 AromaticContact CH2-CD2 3.51Å; W131-Y182 HydrophobicContact CH2-CD2 3.51Å; W131-Y182 HydrophobicContact CH2-CG 4.02Å; W131-Y182 AromaticContact CZ2-CD2 3.36Å; W131-Y182 HydrophobicContact CZ2-CD2 3.36Å; W131-Y182 HydrophobicContact CZ2-CE2 4.01Å; W131-Y182 HydrophobicContact CZ2-CG 4.27Å; W131-Y182 VanDerWaalsContact CZ3-CA 3.5Å; W131-Y182 AromaticContact CZ3-CD2 3.72Å; W131-Y182 HydrophobicContact CZ3-CD2 3.72Å; W131-Y182 HydrophobicContact CZ3-CG 4.15Å; W131-Y182 AromaticContact NE1-CE2 3.99Å; Y178-Y182 PolarHBondContact O-N 3.41Å; Y178-Y182 VanDerWaalsContact O-N 3.12Å; F179-Y182 WeakPolarHBondContact O-CB 3.22Å; F179-Y182 PolarHBondContact O-N 3.16Å; F179-Y182 VanDerWaalsContact O-N 3.07Å; V180-Y182 VanDerWaalsContact C-N 3.26Å; V180-Y182 PolarHBondContact O-N 3.5Å; Y182-F184 VanDerWaalsContact C-N 3.27Å; Y182-F184 PolarHBondContact O-N 3.48Å; Y182-C185 WeakPolarHBondContact O-CB 3.37Å; Y182-C185 PolarHBondContact O-N 3.02Å; Y182-C185 VanDerWaalsContact O-N 3.1Å; Y182-E186 HydrophobicContact CD1-CG 4.05Å; Y182-E186 VanDerWaalsContact CE1-CD 3.4Å; Y182-E186 HydrophobicContact CE1-CG 3.72Å; Y182-E186 VanDerWaalsContact CE1-OE1 3.28Å; Y182-E186 WeakPolarHBondContact CE1-OE1 3.14Å; Y182-E186 PolarHBondContact O-N 3.14Å; Y182-F330 HydrophobicContact CD1-CE1 4.31Å; Y182-F330 HydrophobicContact CD1-CE2 4.02Å; Y182-F330 AromaticContact CD1-CZ 3.39Å; Y182-F330 HydrophobicContact CD1-CZ 3.39Å; Y182-F330 HydrophobicContact CD2-CZ 4.38Å; Y182-F330 HydrophobicContact CE1-CE2 4.41Å; Y182-F330 AromaticContact CE1-CZ 3.98Å; Y182-F330 HydrophobicContact CE1-CZ 3.98Å; Y182-F330 HydrophobicContact CG-CE1 4.14Å; Y182-F330 AromaticContact CG-CZ 3.61Å; Y182-F330 HydrophobicContact CG-CZ 3.61Å; Y182-R334 PolarHBondContact OH-NH2 3.41Å
183V93.3Very high92.9Very high28 Ų2843.8 Ų43.817%0.1722%0.215CC..Hα-helixtrans-63.4-37.5179.1171.40000110.9F179 V180 C185 E186 I187 R291F179-V183 HydrophobicContact CD2-CG2 3.88Å; F179-V183 HydrophobicContact CE1-CG2 4.21Å; F179-V183 HydrophobicContact CE2-CG2 3.2Å; F179-V183 HydrophobicContact CZ-CG2 3.43Å; F179-V183 VanDerWaalsContact CZ-CG2 3.43Å; F179-V183 PolarHBondContact O-N 2.72Å; V180-V183 PolarHBondContact O-N 2.86Å; V183-C185 VanDerWaalsContact C-N 3.3Å; V183-C185 PolarHBondContact O-N 2.85Å; V183-E186 WeakPolarHBondContact O-CB 3.32Å; V183-E186 PolarHBondContact O-N 2.9Å; V183-E186 VanDerWaalsContact O-N 3.1Å; V183-I187 HydrophobicContact CG1-CD1 3.89Å; V183-I187 HydrophobicContact CG1-CG1 4.34Å; V183-I187 WeakPolarHBondContact O-CG1 3.46Å; V183-I187 PolarHBondContact O-N 3.06Å; V183-R291 HydrophobicContact CG2-CG 4.34Å
184F95.1Very high93.3Very high102 Ų10240.7 Ų40.745%0.44720%0.202SC..Hα-helixtrans-56.9-45.3172.2179.9-89.5000111.5L130 W134 V180 Y182 E186 I187 L188L130-F184 HydrophobicContact CD1-CE1 4.24Å; W134-F184 AromaticContact CH2-CD1 3.34Å; W134-F184 HydrophobicContact CH2-CD1 3.34Å; W134-F184 AromaticContact CH2-CE1 3.67Å; W134-F184 HydrophobicContact CH2-CE1 3.67Å; W134-F184 HydrophobicContact CH2-CG 4.08Å; W134-F184 HydrophobicContact CZ3-CB 4.23Å; W134-F184 AromaticContact CZ3-CD1 3.5Å; W134-F184 HydrophobicContact CZ3-CD1 3.5Å; W134-F184 HydrophobicContact CZ3-CE1 4.23Å; W134-F184 HydrophobicContact CZ3-CG 4.18Å; V180-F184 WeakPolarHBondContact O-CB 3.34Å; V180-F184 PolarHBondContact O-N 2.78Å; Y182-F184 VanDerWaalsContact C-N 3.27Å; Y182-F184 PolarHBondContact O-N 3.48Å; F184-E186 VanDerWaalsContact C-N 3.35Å; F184-E186 PolarHBondContact O-N 2.71Å; F184-I187 PolarHBondContact O-N 3.18Å; F184-L188 HydrophobicContact CE1-CD2 4.23Å; F184-L188 VanDerWaalsContact O-CB 3.32Å; F184-L188 WeakPolarHBondContact O-CB 3.45Å; F184-L188 PolarHBondContact O-N 3.23Å
185C95.1Very high93.7Very high0 Ų044.3 Ų44.30%022%0.22CC..Hα-helixtrans-64.7-35.7174.5-65.30000112.8F24 P127 S181 Y182 V183 L188 N189F24-C185 HydrophobicContact CE2-CB 3.86Å; F24-C185 HydrophobicContact CZ-CB 4.04Å; P127-C185 HydrophobicContact CB-CB 4.5Å; S181-C185 PolarHBondContact O-N 3.22Å; S181-C185 PolarHBondContact O-SG 3.09Å; Y182-C185 WeakPolarHBondContact O-CB 3.37Å; Y182-C185 PolarHBondContact O-N 3.02Å; Y182-C185 VanDerWaalsContact O-N 3.1Å; V183-C185 VanDerWaalsContact C-N 3.3Å; V183-C185 PolarHBondContact O-N 2.85Å; C185-L188 PolarHBondContact O-N 2.83Å; C185-N189 VanDerWaalsContact O-CG 3.25Å; C185-N189 PolarHBondContact O-N 3.14Å; C185-N189 PolarHBondContact O-ND2 3.29Å
186E94.1Very high93.9Very high8 Ų844.9 Ų44.94%0.03722%0.223CC..Hα-helixtrans-63.5-44.2173.5-73.2-175.9140.300111.5Y182 V183 F184 N189 L190 K287 R291Y182-E186 HydrophobicContact CD1-CG 4.05Å; Y182-E186 VanDerWaalsContact CE1-CD 3.4Å; Y182-E186 HydrophobicContact CE1-CG 3.72Å; Y182-E186 VanDerWaalsContact CE1-OE1 3.28Å; Y182-E186 WeakPolarHBondContact CE1-OE1 3.14Å; Y182-E186 PolarHBondContact O-N 3.14Å; V183-E186 WeakPolarHBondContact O-CB 3.32Å; V183-E186 PolarHBondContact O-N 2.9Å; V183-E186 VanDerWaalsContact O-N 3.1Å; F184-E186 VanDerWaalsContact C-N 3.35Å; F184-E186 PolarHBondContact O-N 2.71Å; E186-N189 PolarHBondContact O-N 3.49Å; E186-L190 PolarHBondContact O-N 3.23Å; E186-L190 VanDerWaalsContact O-N 3.16Å; E186-K287 VanDerWaalsContact OE1-CE 3.25Å; E186-K287 WeakPolarHBondContact OE1-CE 3.42Å; E186-R291 IonicContact OE1-CZ 3.48Å; E186-R291 IonicContact OE1-NE 3.25Å; E186-R291 IonicContact OE1-NH2 3.14Å; E186-R291 PolarHBondContact OE1-NH2 3.09Å; E186-R291 WeakPolarHBondContact OE2-CG 3.24Å; E186-R291 IonicContact OE2-CZ 2.72Å; E186-R291 IonicContact OE2-NE 2.78Å; E186-R291 PolarHBondContact OE2-NE 3Å; E186-R291 IonicContact OE2-NH2 3.56Å
187I94.9Very high93.9Very high76 Ų7643.1 Ų43.139%0.3922%0.215SC..Hα-helixtrans-64-42.9175.8-68.3166.9000110.8V183 F184 N189 L190 S191 F288V183-I187 HydrophobicContact CG1-CD1 3.89Å; V183-I187 HydrophobicContact CG1-CG1 4.34Å; V183-I187 WeakPolarHBondContact O-CG1 3.46Å; V183-I187 PolarHBondContact O-N 3.06Å; F184-I187 PolarHBondContact O-N 3.18Å; I187-N189 PolarHBondContact O-N 3.27Å; I187-L190 PolarHBondContact O-N 2.72Å; I187-S191 WeakPolarHBondContact O-CB 3.43Å; I187-S191 PolarHBondContact O-N 2.92Å; I187-S191 PolarHBondContact O-OG 3.48Å; I187-F288 HydrophobicContact CG1-CE2 3.79Å
188L95.8Very high93.9Very high35 Ų3540.3 Ų40.318%0.18321%0.211CC..Hα-helixtrans-63.8-41.4178.8-171.363.8000111.3M126 P127 L130 F184 C185 L190 S191 I192M126-L188 HydrophobicContact SD-CD2 3.96Å; P127-L188 HydrophobicContact CB-CD2 4.21Å; P127-L188 HydrophobicContact CG-CB 4.41Å; P127-L188 HydrophobicContact CG-CD2 3.88Å; P127-L188 HydrophobicContact CG-CG 3.97Å; L130-L188 HydrophobicContact CD1-CD2 3.79Å; F184-L188 HydrophobicContact CE1-CD2 4.23Å; F184-L188 VanDerWaalsContact O-CB 3.32Å; F184-L188 WeakPolarHBondContact O-CB 3.45Å; F184-L188 PolarHBondContact O-N 3.23Å; C185-L188 PolarHBondContact O-N 2.83Å; L188-L190 PolarHBondContact O-N 3.41Å; L188-S191 PolarHBondContact O-N 3.3Å; L188-I192 HydrophobicContact CD1-CD1 4.28Å; L188-I192 HydrophobicContact CG-CD1 3.84Å; L188-I192 HydrophobicContact CG-CG1 4.49Å; L188-I192 WeakPolarHBondContact O-CB 3.08Å; L188-I192 WeakPolarHBondContact O-CD1 3.48Å; L188-I192 VanDerWaalsContact O-CG1 3.24Å; L188-I192 WeakPolarHBondContact O-CG1 3.33Å; L188-I192 PolarHBondContact O-N 2.92Å
189N95.2Very high93.9Very high4 Ų444.5 Ų44.52%0.02123%0.234CC..Hα-helixtrans-58.9-45173.5-74.9-34.6000112.2F24 H27 P127 C185 E186 I187 I192 S193 I284F24-N189 WeakPolarHBondContact CD2-ND2 3.46Å; F24-N189 WeakPolarHBondContact CE2-ND2 3.38Å; H27-N189 PolarHBondContact CE1-OD1 3.3Å; H27-N189 PolarHBondContact ND1-OD1 3.45Å; H27-N189 PolarHBondContact NE2-O 3.1Å; P127-N189 WeakPolarHBondContact CB-OD1 3.45Å; P127-N189 WeakPolarHBondContact CG-OD1 3.42Å; C185-N189 VanDerWaalsContact O-CG 3.25Å; C185-N189 PolarHBondContact O-N 3.14Å; C185-N189 PolarHBondContact O-ND2 3.29Å; E186-N189 PolarHBondContact O-N 3.49Å; I187-N189 PolarHBondContact O-N 3.27Å; N189-I192 PolarHBondContact O-N 3.49Å; N189-S193 WeakPolarHBondContact O-CB 3.44Å; N189-S193 PolarHBondContact O-N 3.47Å; N189-S193 PolarHBondContact O-OG 3.36Å; N189-S193 VanDerWaalsContact O-OG 3.09Å; N189-I284 HydrophobicContact CB-CD1 4.15Å; N189-I284 HydrophobicContact CB-CG2 4.28Å
190L95.6Very high93.8Very high28 Ų2843.6 Ų43.615%0.14723%0.23CC..Hα-helixtrans-63.5-45.9178.4-179.363.5000110.8E186 I187 L188 I192 S193 I194 I284 S285 F288E186-L190 PolarHBondContact O-N 3.23Å; E186-L190 VanDerWaalsContact O-N 3.16Å; I187-L190 PolarHBondContact O-N 2.72Å; L188-L190 PolarHBondContact O-N 3.41Å; L190-I192 PolarHBondContact O-N 3.43Å; L190-S193 PolarHBondContact O-N 3.27Å; L190-I194 HydrophobicContact CD1-CD1 4.04Å; L190-I194 HydrophobicContact CD1-CG1 4.46Å; L190-I194 HydrophobicContact CG-CD1 3.96Å; L190-I194 WeakPolarHBondContact O-CG1 3.43Å; L190-I194 PolarHBondContact O-N 2.72Å; L190-I284 HydrophobicContact CB-CG2 3.86Å; L190-I284 HydrophobicContact CD1-CG2 4.08Å; L190-S285 WeakPolarHBondContact CD1-OG 3.39Å; L190-F288 HydrophobicContact CD2-CB 4.4Å; L190-F288 HydrophobicContact CD2-CD1 4.12Å; L190-F288 HydrophobicContact CD2-CD2 4.45Å; L190-F288 HydrophobicContact CD2-CG 4.06Å
191S96.2Very high93.6Very high46 Ų4642.6 Ų42.632%0.32222%0.222SC..Hα-helixtrans-61.1-46178.9-54.40000111.2I187 L188 S193 I194 L195I187-S191 WeakPolarHBondContact O-CB 3.43Å; I187-S191 PolarHBondContact O-N 2.92Å; I187-S191 PolarHBondContact O-OG 3.48Å; L188-S191 PolarHBondContact O-N 3.3Å; S191-S193 PolarHBondContact O-N 2.98Å; S191-I194 PolarHBondContact O-N 3.47Å; S191-L195 VanDerWaalsContact O-CB 3.29Å; S191-L195 WeakPolarHBondContact O-CB 3.17Å; S191-L195 WeakPolarHBondContact O-CG 3.42Å; S191-L195 PolarHBondContact O-N 2.95Å
192I96.6Very high93.4Very high12 Ų1247.2 Ų47.26%0.06225%0.25CC..Hα-helixtrans-60.3-45.4176.1-72.7163.6000110.9V123 F124 P127 L188 N189 L190 I194 L195 N196V123-I192 HydrophobicContact CG1-CB 4.48Å; V123-I192 HydrophobicContact CG1-CD1 4.08Å; V123-I192 HydrophobicContact CG1-CG1 3.87Å; V123-I192 HydrophobicContact CG1-CG2 3.83Å; V123-I192 WeakPolarHBondContact O-CD1 3.48Å; F124-I192 HydrophobicContact CD1-CG2 4.19Å; F124-I192 HydrophobicContact CD2-CG2 4.17Å; F124-I192 HydrophobicContact CE1-CG2 4.17Å; F124-I192 HydrophobicContact CE2-CG2 4.16Å; F124-I192 HydrophobicContact CG-CG2 4.19Å; F124-I192 HydrophobicContact CZ-CG2 4.16Å; P127-I192 HydrophobicContact CG-CD1 3.43Å; P127-I192 VanDerWaalsContact CG-CD1 3.43Å; L188-I192 HydrophobicContact CD1-CD1 4.28Å; L188-I192 HydrophobicContact CG-CD1 3.84Å; L188-I192 HydrophobicContact CG-CG1 4.49Å; L188-I192 WeakPolarHBondContact O-CB 3.08Å; L188-I192 WeakPolarHBondContact O-CD1 3.48Å; L188-I192 VanDerWaalsContact O-CG1 3.24Å; L188-I192 WeakPolarHBondContact O-CG1 3.33Å; L188-I192 PolarHBondContact O-N 2.92Å; N189-I192 PolarHBondContact O-N 3.49Å; L190-I192 PolarHBondContact O-N 3.43Å; I192-I194 PolarHBondContact O-N 3.35Å; I192-L195 PolarHBondContact O-N 3.46Å; I192-N196 WeakPolarHBondContact O-CB 3.36Å; I192-N196 PolarHBondContact O-N 3.05Å
193S95.5Very high93Very high6 Ų650 Ų504%0.04226%0.262CS..Hα-helixtrans-62.3-41.2179.7-680000112.5H27 N189 L190 S191 F197 I284H27-S193 PolarHBondContact CD2-OG 2.83Å; H27-S193 PolarHBondContact NE2-OG 3.15Å; H27-S193 VanDerWaalsContact NE2-OG 3.15Å; N189-S193 WeakPolarHBondContact O-CB 3.44Å; N189-S193 PolarHBondContact O-N 3.47Å; N189-S193 PolarHBondContact O-OG 3.36Å; N189-S193 VanDerWaalsContact O-OG 3.09Å; L190-S193 PolarHBondContact O-N 3.27Å; S191-S193 PolarHBondContact O-N 2.98Å; S193-F197 PolarHBondContact O-N 3.22Å; S193-I284 WeakPolarHBondContact OG-CD1 3.49Å
194I93.4Very high92.5Very high87 Ų8749.3 Ų49.345%0.44626%0.256SS..Hα-helixtrans-69.2-49.5177.5-65.9168000110.7L190 S191 I192 N196 F197 L198L190-I194 HydrophobicContact CD1-CD1 4.04Å; L190-I194 HydrophobicContact CD1-CG1 4.46Å; L190-I194 HydrophobicContact CG-CD1 3.96Å; L190-I194 WeakPolarHBondContact O-CG1 3.43Å; L190-I194 PolarHBondContact O-N 2.72Å; S191-I194 PolarHBondContact O-N 3.47Å; I192-I194 PolarHBondContact O-N 3.35Å; I194-N196 VanDerWaalsContact C-N 3.31Å; I194-N196 PolarHBondContact O-N 2.94Å; I194-F197 PolarHBondContact O-N 3.21Å; I194-L198 HydrophobicContact CG2-CD1 4.07Å; I194-L198 WeakPolarHBondContact O-CG 3.27Å; I194-L198 PolarHBondContact O-N 3.35Å; I194-L198 VanDerWaalsContact O-N 3.1Å
195L94.3Very high91.6Very high112 Ų11246.5 Ų46.559%0.58626%0.257SS*.Hα-helixtrans-61.8-40-179.7-71.4172.1000111.6S191 I192 F197 L198 L199S191-L195 VanDerWaalsContact O-CB 3.29Å; S191-L195 WeakPolarHBondContact O-CB 3.17Å; S191-L195 WeakPolarHBondContact O-CG 3.42Å; S191-L195 PolarHBondContact O-N 2.95Å; I192-L195 PolarHBondContact O-N 3.46Å; L195-F197 PolarHBondContact O-N 2.99Å; L195-L198 PolarHBondContact O-N 2.7Å; L195-L199 WeakPolarHBondContact O-CB 3.44Å; L195-L199 PolarHBondContact O-N 3.44Å
196N93.9Very high90.9Very high12 Ų1247.6 Ų47.66%0.06427%0.268CS..Hα-helixtrans-59.7-46175.8-176.179.4000111.9E120 F124 I192 I194 L198 L199 L200 F277E120-N196 VanDerWaalsContact CD-OD1 3.23Å; E120-N196 WeakPolarHBondContact CG-OD1 3.29Å; E120-N196 PolarHBondContact OE1-OD1 3.01Å; F124-N196 HydrophobicContact CE2-CB 3.97Å; F124-N196 WeakPolarHBondContact CE2-OD1 3.45Å; F124-N196 HydrophobicContact CZ-CB 3.96Å; I192-N196 WeakPolarHBondContact O-CB 3.36Å; I192-N196 PolarHBondContact O-N 3.05Å; I194-N196 VanDerWaalsContact C-N 3.31Å; I194-N196 PolarHBondContact O-N 2.94Å; N196-L198 PolarHBondContact O-N 3.3Å; N196-L199 PolarHBondContact O-N 3.23Å; N196-L200 WeakPolarHBondContact O-CB 3.37Å; N196-L200 WeakPolarHBondContact O-CG 3.31Å; N196-L200 PolarHBondContact O-N 2.89Å; N196-F277 WeakPolarHBondContact ND2-CE1 3.31Å; N196-F277 WeakPolarHBondContact ND2-CE2 3.35Å; N196-F277 VanDerWaalsContact ND2-CZ 3.31Å; N196-F277 WeakPolarHBondContact ND2-CZ 3.13Å
197F90.6Very high90.3Very high69 Ų6947.3 Ų47.330%0.30327%0.267SS..Hα-helixtrans-61.5-44.9178.8-172.3-91.2000111.9S193 I194 L195 D201 W208 W274 I278S193-F197 PolarHBondContact O-N 3.22Å; I194-F197 PolarHBondContact O-N 3.21Å; L195-F197 PolarHBondContact O-N 2.99Å; F197-D201 PolarHBondContact O-N 3.21Å; F197-W208 AromaticContact CE1-CD1 3.92Å; F197-W208 AromaticContact CE2-CD1 3.97Å; F197-W208 HydrophobicContact CE2-CG 4.24Å; F197-W208 HydrophobicContact CZ-CB 4.16Å; F197-W208 AromaticContact CZ-CD1 3.73Å; F197-W208 HydrophobicContact CZ-CG 4.03Å; F197-W208 PolarHBondContact O-NE1 2.92Å; F197-W208 VanDerWaalsContact O-NE1 3.09Å; F197-W274 AromaticContact CE2-CD1 3.91Å; F197-W274 AromaticContact CE2-NE1 3.7Å; F197-I278 HydrophobicContact CD2-CG1 4.49Å; F197-I278 HydrophobicContact CE2-CD1 4.27Å; F197-I278 HydrophobicContact CE2-CG1 3.91Å
198L91.1Very high89.6Confident98 Ų9844.1 Ų44.151%0.51325%0.25SC..Hα-helixtrans-67.6-45178.7-65.8174.9000112.4I194 L195 N196 L200 D201 V202I194-L198 HydrophobicContact CG2-CD1 4.07Å; I194-L198 WeakPolarHBondContact O-CG 3.27Å; I194-L198 PolarHBondContact O-N 3.35Å; I194-L198 VanDerWaalsContact O-N 3.1Å; L195-L198 PolarHBondContact O-N 2.7Å; N196-L198 PolarHBondContact O-N 3.3Å; L198-L200 PolarHBondContact O-N 2.88Å; L198-D201 PolarHBondContact O-N 3.36Å; L198-V202 WeakPolarHBondContact O-CG2 3.34Å; L198-V202 PolarHBondContact O-N 2.91Å; L198-V202 VanDerWaalsContact O-N 3.1Å
199L91.1Very high89Confident100 Ų10044 Ų4452%0.52426%0.257SS..Hα-helixtrans-61.9-45.3-178.9-173.4156000110.8L195 N196 D201 V202 F203L195-L199 WeakPolarHBondContact O-CB 3.44Å; L195-L199 PolarHBondContact O-N 3.44Å; N196-L199 PolarHBondContact O-N 3.23Å; L199-D201 VanDerWaalsContact C-N 3.32Å; L199-D201 PolarHBondContact O-N 2.85Å; L199-V202 PolarHBondContact O-N 3.15Å; L199-F203 VanDerWaalsContact O-CB 3.31Å; L199-F203 WeakPolarHBondContact O-CB 3.44Å; L199-F203 PolarHBondContact O-N 3.1Å
200L89Confident88.4Confident0 Ų049.3 Ų49.30%028%0.277CS..Hα-helixtrans-66.6-32.7177.5-74.1178.8000112.9V116 E120 N196 L198 F203 F204 W208 F270 F277V116-L200 HydrophobicContact CG1-CD2 4.16Å; E120-L200 WeakPolarHBondContact OE1-CD1 3.45Å; E120-L200 WeakPolarHBondContact OE1-CD2 3.25Å; E120-L200 VanDerWaalsContact OE1-CG 3.29Å; E120-L200 WeakPolarHBondContact OE1-CG 3.42Å; N196-L200 WeakPolarHBondContact O-CB 3.37Å; N196-L200 WeakPolarHBondContact O-CG 3.31Å; N196-L200 PolarHBondContact O-N 2.89Å; L198-L200 PolarHBondContact O-N 2.88Å; L200-F203 PolarHBondContact O-N 3.3Å; L200-F204 HydrophobicContact CD2-CE2 4Å; L200-F204 VanDerWaalsContact O-CD2 3.27Å; L200-F204 WeakPolarHBondContact O-CD2 3.11Å; L200-F204 PolarHBondContact O-N 3.49Å; L200-F204 VanDerWaalsContact O-N 3.11Å; L200-W208 HydrophobicContact CB-CZ2 3.56Å; L200-W208 HydrophobicContact CD1-CZ2 3.89Å; L200-W208 HydrophobicContact CG-CZ2 4.38Å; L200-F270 HydrophobicContact CD2-CE1 4.35Å; L200-F277 HydrophobicContact CD1-CD2 4.07Å; L200-F277 HydrophobicContact CD1-CE2 3.49Å; L200-F277 VanDerWaalsContact CD1-CE2 3.49Å; L200-F277 HydrophobicContact CD1-CZ 4.3Å
201D89.3Confident87.8Confident49 Ų4949.2 Ų49.226%0.26227%0.274SS..Hα-helixtrans-63.8-45175-159.646.3000111F197 L198 L199 G205 G206 F207 W208F197-D201 PolarHBondContact O-N 3.21Å; L198-D201 PolarHBondContact O-N 3.36Å; L199-D201 VanDerWaalsContact C-N 3.32Å; L199-D201 PolarHBondContact O-N 2.85Å; D201-G205 PolarHBondContact O-N 2.85Å; D201-G206 PolarHBondContact O-N 3.48Å; D201-G206 WeakPolarHBondContact OD1-CA 3.34Å; D201-F207 PolarHBondContact OD1-N 3.18Å; D201-W208 HydrophobicContact CB-CG 4.41Å; D201-W208 WeakPolarHBondContact OD1-CB 3.42Å; D201-W208 PolarHBondContact OD1-N 3.03Å; D201-W208 VanDerWaalsContact OD1-N 3.11Å
202V88.1Confident87.3Confident119 Ų11953.8 Ų53.872%0.72128%0.284SS*.Hα-helixtrans-65.5-44.1176.3174.90000110.8L198 L199 F204 G205L198-V202 WeakPolarHBondContact O-CG2 3.34Å; L198-V202 PolarHBondContact O-N 2.91Å; L198-V202 VanDerWaalsContact O-N 3.1Å; L199-V202 PolarHBondContact O-N 3.15Å; V202-F204 VanDerWaalsContact C-N 3.3Å; V202-F204 PolarHBondContact O-N 3.45Å; V202-G205 PolarHBondContact O-N 3.21Å; V202-G205 VanDerWaalsContact O-N 3.11Å
203F85.9Confident86.7Confident58 Ų5856.5 Ų56.525%0.25430%0.299SS..Hα-helixtrans-59.6-38.3-178.3-177.8-99.5000112.8W112 V113 V116 L199 L200W112-F203 HydrophobicContact CB-CE2 4.27Å; W112-F203 HydrophobicContact CB-CZ 4.05Å; V113-F203 HydrophobicContact CG2-CE1 4.07Å; V113-F203 HydrophobicContact CG2-CZ 4.49Å; V116-F203 HydrophobicContact CG2-CD2 4.42Å; V116-F203 HydrophobicContact CG2-CE2 3.87Å; V116-F203 HydrophobicContact CG2-CZ 3.96Å; L199-F203 VanDerWaalsContact O-CB 3.31Å; L199-F203 WeakPolarHBondContact O-CB 3.44Å; L199-F203 PolarHBondContact O-N 3.1Å; L200-F203 PolarHBondContact O-N 3.3Å
204F80.9Confident86.2Confident14 Ų1456.2 Ų56.26%0.06130%0.297CS..THydrogen-bonded Turntrans-96.611.4177.5-64.9-65.7000114.5Y109 V113 L200 V202 F207 F234 F270Y109-F204 HydrophobicContact CD2-CD1 4.24Å; Y109-F204 AromaticContact CD2-CE1 3.87Å; Y109-F204 HydrophobicContact CD2-CE1 3.87Å; Y109-F204 HydrophobicContact CE2-CD1 4.44Å; Y109-F204 HydrophobicContact CE2-CE1 4.11Å; V113-F204 HydrophobicContact CG2-CE1 4.26Å; V113-F204 HydrophobicContact CG2-CZ 4.39Å; L200-F204 HydrophobicContact CD2-CE2 4Å; L200-F204 VanDerWaalsContact O-CD2 3.27Å; L200-F204 WeakPolarHBondContact O-CD2 3.11Å; L200-F204 PolarHBondContact O-N 3.49Å; L200-F204 VanDerWaalsContact O-N 3.11Å; V202-F204 VanDerWaalsContact C-N 3.3Å; V202-F204 PolarHBondContact O-N 3.45Å; F204-F207 HydrophobicContact CB-CB 3.36Å; F204-F207 HydrophobicContact CB-CG 4.21Å; F204-F207 HydrophobicContact CD2-CB 4.43Å; F204-F207 HydrophobicContact CD2-CD1 4.27Å; F204-F207 HydrophobicContact CG-CB 4.18Å; F204-F234 AromaticContact CD1-CE1 3.93Å; F204-F234 HydrophobicContact CD1-CE1 3.93Å; F204-F234 AromaticContact CD1-CZ 3.93Å; F204-F234 HydrophobicContact CD1-CZ 3.93Å; F204-F234 AromaticContact CE1-CE1 3.72Å; F204-F234 HydrophobicContact CE1-CE1 3.72Å; F204-F234 AromaticContact CE1-CZ 3.89Å; F204-F234 HydrophobicContact CE1-CZ 3.89Å; F204-F234 HydrophobicContact CG-CZ 4.43Å; F204-F234 HydrophobicContact CZ-CE1 4.47Å; F204-F234 HydrophobicContact CZ-CZ 4.34Å; F204-F270 HydrophobicContact CE1-CD2 4.43Å; F204-F270 HydrophobicContact CE1-CE2 4.31Å; F204-F270 AromaticContact CE2-CD1 3.56Å; F204-F270 HydrophobicContact CE2-CD1 3.56Å; F204-F270 HydrophobicContact CE2-CD2 4.22Å; F204-F270 AromaticContact CE2-CE1 3.54Å; F204-F270 HydrophobicContact CE2-CE1 3.54Å; F204-F270 HydrophobicContact CE2-CE2 4.22Å; F204-F270 AromaticContact CE2-CG 3.92Å; F204-F270 HydrophobicContact CE2-CG 3.92Å; F204-F270 AromaticContact CE2-CZ 3.9Å; F204-F270 HydrophobicContact CE2-CZ 3.9Å; F204-F270 AromaticContact CZ-CD1 3.83Å; F204-F270 HydrophobicContact CZ-CD1 3.83Å; F204-F270 AromaticContact CZ-CD2 3.69Å; F204-F270 HydrophobicContact CZ-CD2 3.69Å; F204-F270 AromaticContact CZ-CE1 3.6Å; F204-F270 HydrophobicContact CZ-CE1 3.6Å; F204-F270 AromaticContact CZ-CE2 3.47Å; F204-F270 HydrophobicContact CZ-CE2 3.47Å; F204-F270 VanDerWaalsContact CZ-CE2 3.47Å; F204-F270 AromaticContact CZ-CG 3.88Å; F204-F270 HydrophobicContact CZ-CG 3.88Å; F204-F270 AromaticContact CZ-CZ 3.44Å; F204-F270 HydrophobicContact CZ-CZ 3.44Å; F204-F270 VanDerWaalsContact CZ-CZ 3.44Å
205G78Confident85.8Confident44 Ų4455.1 Ų55.145%0.45429%0.292SS..THydrogen-bonded Turntrans67.343.5175.900000114.4D201 V202D201-G205 PolarHBondContact O-N 2.85Å; V202-G205 PolarHBondContact O-N 3.21Å; V202-G205 VanDerWaalsContact O-N 3.11Å
206G80.2Confident85.5Confident23 Ų2354.2 Ų54.224%0.23729%0.287CS..SBendtrans83.332.7179.700000113.5D201 W208 G209 R210D201-G206 PolarHBondContact O-N 3.48Å; D201-G206 WeakPolarHBondContact OD1-CA 3.34Å; G206-W208 VanDerWaalsContact C-N 3.32Å; G206-W208 PolarHBondContact O-N 2.64Å; G206-G209 PolarHBondContact O-N 3.25Å; G206-R210 WeakPolarHBondContact O-CG 3.44Å; G206-R210 PolarHBondContact O-N 3.36Å
207F79.8Confident85Confident2 Ų254.7 Ų54.71%0.00929%0.291CS..Hα-helixtrans-56.2-43.5-176.3172.3-131.3000112.7D201 F204 G209 R210 Y211 V233 F234 F270D201-F207 PolarHBondContact OD1-N 3.18Å; F204-F207 HydrophobicContact CB-CB 3.36Å; F204-F207 HydrophobicContact CB-CG 4.21Å; F204-F207 HydrophobicContact CD2-CB 4.43Å; F204-F207 HydrophobicContact CD2-CD1 4.27Å; F204-F207 HydrophobicContact CG-CB 4.18Å; F207-G209 PolarHBondContact O-N 2.94Å; F207-R210 PolarHBondContact O-N 2.94Å; F207-Y211 HydrophobicContact CD2-CD2 4.46Å; F207-Y211 HydrophobicContact CD2-CG 4.47Å; F207-Y211 AromaticContact CE2-CD2 3.38Å; F207-Y211 HydrophobicContact CE2-CD2 3.38Å; F207-Y211 HydrophobicContact CE2-CE2 4.26Å; F207-Y211 AromaticContact CE2-CG 3.63Å; F207-Y211 HydrophobicContact CE2-CG 3.63Å; F207-Y211 HydrophobicContact CZ-CD1 4.28Å; F207-Y211 AromaticContact CZ-CD2 3.57Å; F207-Y211 HydrophobicContact CZ-CD2 3.57Å; F207-Y211 HydrophobicContact CZ-CE2 4.15Å; F207-Y211 AromaticContact CZ-CG 3.64Å; F207-Y211 HydrophobicContact CZ-CG 3.64Å; F207-Y211 WeakPolarHBondContact O-CB 3.46Å; F207-Y211 PolarHBondContact O-N 3.18Å; F207-V233 HydrophobicContact CB-CG1 3.94Å; F207-V233 HydrophobicContact CD2-CB 3.96Å; F207-V233 HydrophobicContact CD2-CG1 3.41Å; F207-V233 VanDerWaalsContact CD2-CG1 3.41Å; F207-V233 HydrophobicContact CD2-CG2 4.09Å; F207-V233 HydrophobicContact CE2-CG1 4.2Å; F207-V233 HydrophobicContact CG-CG1 3.93Å; F207-F234 HydrophobicContact CD1-CE2 4.26Å; F207-F234 HydrophobicContact CD1-CZ 4.45Å; F207-F234 HydrophobicContact CD2-CD2 4.46Å; F207-F234 AromaticContact CD2-CE2 3.81Å; F207-F234 HydrophobicContact CD2-CE2 3.81Å; F207-F234 AromaticContact CE1-CE2 3.86Å; F207-F234 HydrophobicContact CE1-CE2 3.86Å; F207-F234 HydrophobicContact CE1-CZ 4.28Å; F207-F234 AromaticContact CE2-CD2 3.93Å; F207-F234 HydrophobicContact CE2-CD2 3.93Å; F207-F234 AromaticContact CE2-CE2 3.36Å; F207-F234 HydrophobicContact CE2-CE2 3.36Å; F207-F234 HydrophobicContact CE2-CZ 4.39Å; F207-F234 HydrophobicContact CG-CE2 4.26Å; F207-F234 HydrophobicContact CZ-CD2 4.31Å; F207-F234 AromaticContact CZ-CE2 3.45Å; F207-F234 HydrophobicContact CZ-CE2 3.45Å; F207-F234 VanDerWaalsContact CZ-CE2 3.45Å; F207-F234 HydrophobicContact CZ-CZ 4.31Å; F207-F270 HydrophobicContact CE1-CB 3.91Å
208W81.2Confident84.8Confident9 Ų954.5 Ų54.53%0.03429%0.293CS..Hα-helixtrans-66.1-41.6-172-52.8137000111.8F197 L200 D201 G206 R212 F270 W274F197-W208 AromaticContact CE1-CD1 3.92Å; F197-W208 AromaticContact CE2-CD1 3.97Å; F197-W208 HydrophobicContact CE2-CG 4.24Å; F197-W208 HydrophobicContact CZ-CB 4.16Å; F197-W208 AromaticContact CZ-CD1 3.73Å; F197-W208 HydrophobicContact CZ-CG 4.03Å; F197-W208 PolarHBondContact O-NE1 2.92Å; F197-W208 VanDerWaalsContact O-NE1 3.09Å; L200-W208 HydrophobicContact CB-CZ2 3.56Å; L200-W208 HydrophobicContact CD1-CZ2 3.89Å; L200-W208 HydrophobicContact CG-CZ2 4.38Å; D201-W208 HydrophobicContact CB-CG 4.41Å; D201-W208 WeakPolarHBondContact OD1-CB 3.42Å; D201-W208 PolarHBondContact OD1-N 3.03Å; D201-W208 VanDerWaalsContact OD1-N 3.11Å; G206-W208 VanDerWaalsContact C-N 3.32Å; G206-W208 PolarHBondContact O-N 2.64Å; W208-R212 WeakPolarHBondContact O-CB 3.36Å; W208-R212 PolarHBondContact O-N 2.97Å; W208-F270 HydrophobicContact CH2-CD1 4.44Å; W208-W274 AromaticContact CD2-CD1 3.31Å; W208-W274 HydrophobicContact CD2-CG 4.23Å; W208-W274 AromaticContact CD2-NE1 3.69Å; W208-W274 AromaticContact CE2-CD1 3.97Å; W208-W274 HydrophobicContact CE3-CB 3.88Å; W208-W274 AromaticContact CE3-CD1 2.96Å; W208-W274 HydrophobicContact CE3-CD2 4.31Å; W208-W274 AromaticContact CE3-CG 3.45Å; W208-W274 HydrophobicContact CE3-CG 3.45Å; W208-W274 VanDerWaalsContact CE3-CG 3.45Å; W208-W274 AromaticContact CE3-NE1 3.55Å; W208-W274 AromaticContact CG-CD1 3.89Å; W208-W274 AromaticContact CG-NE1 3.76Å; W208-W274 HydrophobicContact CH2-CB 3.96Å; W208-W274 AromaticContact CH2-CD1 3.98Å; W208-W274 HydrophobicContact CH2-CG 4.3Å; W208-W274 HydrophobicContact CZ3-CB 3.34Å; W208-W274 AromaticContact CZ3-CD1 3.33Å; W208-W274 AromaticContact CZ3-CG 3.49Å; W208-W274 HydrophobicContact CZ3-CG 3.49Å; W208-W274 VanDerWaalsContact CZ3-CG 3.49Å
209G82.5Confident84.7Confident32 Ų3259.4 Ų59.433%0.3331%0.306SS..Hα-helixtrans-63.1-45.4175.500000112.1G206 F207 N213G206-G209 PolarHBondContact O-N 3.25Å; F207-G209 PolarHBondContact O-N 2.94Å; G209-N213 VanDerWaalsContact O-CG 3.3Å; G209-N213 PolarHBondContact O-N 3.33Å; G209-N213 PolarHBondContact O-ND2 3.1Å; G209-N213 PolarHBondContact O-OD1 2.79Å
210R82.3Confident84.6Confident116 Ų11660.7 Ų60.744%0.43831%0.314SS..Hα-helixtrans-65.4-45.2177.9-67.4175.8-174.8-169.62.6111.5G206 F207 R212 N213 A214 I229 V233G206-R210 WeakPolarHBondContact O-CG 3.44Å; G206-R210 PolarHBondContact O-N 3.36Å; F207-R210 PolarHBondContact O-N 2.94Å; R210-R212 PolarHBondContact O-N 3.41Å; R210-N213 WeakPolarHBondContact O-CB 3.39Å; R210-N213 PolarHBondContact O-N 3.32Å; R210-N213 VanDerWaalsContact O-N 3.14Å; R210-A214 PolarHBondContact O-N 3.34Å; R210-I229 HydrophobicContact CB-CG2 3.98Å; R210-I229 VanDerWaalsContact O-CG2 3.26Å; R210-I229 WeakPolarHBondContact O-CG2 3.35Å; R210-V233 HydrophobicContact CB-CG2 4.07Å
211Y82.9Confident84.4Confident25 Ų2562.8 Ų62.810%0.09834%0.335CS..Hα-helixtrans-65.4-39.2-179.1-165.1-107.6000112.6F207 N213 A214 L215 T230 A271 W274F207-Y211 HydrophobicContact CD2-CD2 4.46Å; F207-Y211 HydrophobicContact CD2-CG 4.47Å; F207-Y211 AromaticContact CE2-CD2 3.38Å; F207-Y211 HydrophobicContact CE2-CD2 3.38Å; F207-Y211 HydrophobicContact CE2-CE2 4.26Å; F207-Y211 AromaticContact CE2-CG 3.63Å; F207-Y211 HydrophobicContact CE2-CG 3.63Å; F207-Y211 HydrophobicContact CZ-CD1 4.28Å; F207-Y211 AromaticContact CZ-CD2 3.57Å; F207-Y211 HydrophobicContact CZ-CD2 3.57Å; F207-Y211 HydrophobicContact CZ-CE2 4.15Å; F207-Y211 AromaticContact CZ-CG 3.64Å; F207-Y211 HydrophobicContact CZ-CG 3.64Å; F207-Y211 WeakPolarHBondContact O-CB 3.46Å; F207-Y211 PolarHBondContact O-N 3.18Å; Y211-N213 VanDerWaalsContact C-N 3.31Å; Y211-N213 PolarHBondContact O-N 3.11Å; Y211-A214 WeakPolarHBondContact O-CB 3.25Å; Y211-A214 PolarHBondContact O-N 3.19Å; Y211-L215 HydrophobicContact CD1-CD1 3.96Å; Y211-L215 HydrophobicContact CD1-CG 4.33Å; Y211-L215 HydrophobicContact CE1-CD1 3.78Å; Y211-L215 HydrophobicContact CE1-CD2 4.38Å; Y211-L215 HydrophobicContact CE1-CG 4.06Å; Y211-L215 PolarHBondContact O-N 3.48Å; Y211-T230 HydrophobicContact CE2-CG2 4.44Å; Y211-A271 HydrophobicContact CE1-CB 3.93Å; Y211-A271 HydrophobicContact CE2-CB 4.34Å; Y211-A271 WeakPolarHBondContact OH-CB 3.25Å; Y211-W274 HydrophobicContact CD1-CE3 4.07Å; Y211-W274 HydrophobicContact CD1-CZ3 4.29Å; Y211-W274 HydrophobicContact CE1-CE3 4.3Å
212R86.6Confident84.2Confident142 Ų14263.5 Ų63.554%0.53634%0.339SS..Hα-helixtrans-56.2-46.9170.9-176.4-168.171-1671111.3W208 R210 A214 L215 L216W208-R212 WeakPolarHBondContact O-CB 3.36Å; W208-R212 PolarHBondContact O-N 2.97Å; R210-R212 PolarHBondContact O-N 3.41Å; R212-A214 VanDerWaalsContact C-N 3.32Å; R212-A214 PolarHBondContact O-N 3.22Å; R212-L215 PolarHBondContact O-N 3.09Å; R212-L216 PolarHBondContact O-N 2.9Å; R212-L216 VanDerWaalsContact O-N 3.13Å
213N85.1Confident83.7Confident70 Ų7065 Ų6537%0.37433%0.333SS..Hα-helixtrans-65.1-37.7178.5-62-14.2000111.2G209 R210 Y211 L215 L216 S217G209-N213 VanDerWaalsContact O-CG 3.3Å; G209-N213 PolarHBondContact O-N 3.33Å; G209-N213 PolarHBondContact O-ND2 3.1Å; G209-N213 PolarHBondContact O-OD1 2.79Å; R210-N213 WeakPolarHBondContact O-CB 3.39Å; R210-N213 PolarHBondContact O-N 3.32Å; R210-N213 VanDerWaalsContact O-N 3.14Å; Y211-N213 VanDerWaalsContact C-N 3.31Å; Y211-N213 PolarHBondContact O-N 3.11Å; N213-L215 VanDerWaalsContact C-N 3.34Å; N213-L215 PolarHBondContact O-N 3.02Å; N213-L216 PolarHBondContact O-N 3.38Å; N213-S217 PolarHBondContact O-N 3.32Å; N213-S217 PolarHBondContact O-OG 3.32Å
214A83.3Confident83.2Confident0 Ų065.4 Ų65.40%034%0.338CS..Hα-helixtrans-61.6-39.5174.300000112.8R210 Y211 R212 S217 L218 I229 T230R210-A214 PolarHBondContact O-N 3.34Å; Y211-A214 WeakPolarHBondContact O-CB 3.25Å; Y211-A214 PolarHBondContact O-N 3.19Å; R212-A214 VanDerWaalsContact C-N 3.32Å; R212-A214 PolarHBondContact O-N 3.22Å; A214-S217 PolarHBondContact O-N 3.45Å; A214-L218 PolarHBondContact O-N 3.18Å; A214-I229 HydrophobicContact CB-CB 3.9Å; A214-I229 HydrophobicContact CB-CD1 4.23Å; A214-I229 HydrophobicContact CB-CG2 3.78Å; A214-T230 HydrophobicContact CB-CG2 4.32Å
215L85.4Confident83Confident63 Ų6368.6 Ų68.633%0.3335%0.353SS..Hα-helixtrans-66-37.7175.4-73.4171.2000112.2Y211 R212 N213 L218 Y219 W274Y211-L215 HydrophobicContact CD1-CD1 3.96Å; Y211-L215 HydrophobicContact CD1-CG 4.33Å; Y211-L215 HydrophobicContact CE1-CD1 3.78Å; Y211-L215 HydrophobicContact CE1-CD2 4.38Å; Y211-L215 HydrophobicContact CE1-CG 4.06Å; Y211-L215 PolarHBondContact O-N 3.48Å; R212-L215 PolarHBondContact O-N 3.09Å; N213-L215 VanDerWaalsContact C-N 3.34Å; N213-L215 PolarHBondContact O-N 3.02Å; L215-L218 PolarHBondContact O-N 3.49Å; L215-Y219 PolarHBondContact O-N 3.48Å; L215-W274 HydrophobicContact CD1-CH2 4.28Å; L215-W274 HydrophobicContact CD1-CZ3 3.69Å
216L87.6Confident83.1Confident93 Ų9368.7 Ų68.749%0.48734%0.34SS..Hα-helixtrans-64.8-41.1174.5-69.4170.4000111.6R212 N213 L218 Y219 N220R212-L216 PolarHBondContact O-N 2.9Å; R212-L216 VanDerWaalsContact O-N 3.13Å; N213-L216 PolarHBondContact O-N 3.38Å; L216-L218 VanDerWaalsContact C-N 3.32Å; L216-L218 PolarHBondContact O-N 3.45Å; L216-Y219 WeakPolarHBondContact O-CB 3.35Å; L216-Y219 PolarHBondContact O-N 3Å; L216-N220 VanDerWaalsContact O-CG 3.27Å; L216-N220 PolarHBondContact O-N 3.24Å; L216-N220 PolarHBondContact O-ND2 3.05Å
217S84.9Confident82.9Confident22 Ų2269.2 Ų69.215%0.15434%0.337CS..Hα-helixtrans-61-40.9173.1-60.20000112.2N213 A214 N220 G221 D222N213-S217 PolarHBondContact O-N 3.32Å; N213-S217 PolarHBondContact O-OG 3.32Å; A214-S217 PolarHBondContact O-N 3.45Å; S217-N220 CarbonylContact O-C 3.55Å; S217-N220 PolarHBondContact O-N 3.38Å; S217-G221 PolarHBondContact O-N 3.47Å; S217-D222 PolarHBondContact O-N 3Å
218L85.8Confident82.6Confident65 Ų6571.6 Ų71.634%0.3435%0.349SS..Hα-helixtrans-64.8-41.1176-175.166.2000111.9A214 L215 L216 N220 G221 Y223 W226A214-L218 PolarHBondContact O-N 3.18Å; L215-L218 PolarHBondContact O-N 3.49Å; L216-L218 VanDerWaalsContact C-N 3.32Å; L216-L218 PolarHBondContact O-N 3.45Å; L218-N220 VanDerWaalsContact C-N 3.26Å; L218-N220 PolarHBondContact O-N 2.85Å; L218-G221 PolarHBondContact O-N 3.34Å; L218-Y223 HydrophobicContact CD1-CD1 3.79Å; L218-Y223 HydrophobicContact CD1-CE1 3.58Å; L218-W226 HydrophobicContact CB-CG 4.49Å; L218-W226 HydrophobicContact CD1-CG 4.49Å
219Y88.5Confident82.4Confident202 Ų20272.8 Ų72.879%0.79236%0.356SS*.Hα-helixtrans-60.4-37.8174179.4-100.1000112L215 L216 G221L215-Y219 PolarHBondContact O-N 3.48Å; L216-Y219 WeakPolarHBondContact O-CB 3.35Å; L216-Y219 PolarHBondContact O-N 3Å; Y219-G221 PolarHBondContact O-N 3.43Å
220N89.4Confident82.1Confident126 Ų12671.4 Ų71.467%0.67434%0.341SS*.THydrogen-bonded Turntrans-76.90.9175.7-65.2-16.8000113.7L216 S217 L218 D222L216-N220 VanDerWaalsContact O-CG 3.27Å; L216-N220 PolarHBondContact O-N 3.24Å; L216-N220 PolarHBondContact O-ND2 3.05Å; S217-N220 CarbonylContact O-C 3.55Å; S217-N220 PolarHBondContact O-N 3.38Å; L218-N220 VanDerWaalsContact C-N 3.26Å; L218-N220 PolarHBondContact O-N 2.85Å; N220-D222 VanDerWaalsContact C-N 3.31Å; N220-D222 PolarHBondContact O-N 3.11Å
221G85.3Confident81.8Confident44 Ų4468 Ų6845%0.45433%0.331SS..THydrogen-bonded Turntrans77.69-179.600000115S217 L218 Y219 Y223S217-G221 PolarHBondContact O-N 3.47Å; L218-G221 PolarHBondContact O-N 3.34Å; Y219-G221 PolarHBondContact O-N 3.43Å; G221-Y223 WeakPolarHBondContact O-CD2 3.41Å; G221-Y223 PolarHBondContact O-N 2.86Å
222D84Confident81.3Confident65 Ų6569.9 Ų69.935%0.34835%0.351SS..  trans-89.783.8179-168-17.7000111.3S217 N220 N224 Q225 W226S217-D222 PolarHBondContact O-N 3Å; N220-D222 VanDerWaalsContact C-N 3.31Å; N220-D222 PolarHBondContact O-N 3.11Å; D222-N224 PolarHBondContact O-N 3.44Å; D222-N224 WeakPolarHBondContact OD1-CB 3.44Å; D222-N224 PolarHBondContact OD1-N 3.32Å; D222-N224 VanDerWaalsContact OD1-N 3.08Å; D222-Q225 HydrophobicContact CB-CB 4.31Å; D222-Q225 HydrophobicContact CB-CG 4.49Å; D222-Q225 VanDerWaalsContact CG-CG 3.47Å; D222-Q225 PolarHBondContact O-N 2.91Å; D222-Q225 PolarHBondContact OD1-N 3.34Å; D222-Q225 WeakPolarHBondContact OD2-CG 3.3Å; D222-W226 PolarHBondContact O-N 3.3Å
223Y78.9Confident80.8Confident151 Ų15163.6 Ų63.659%0.59233%0.328SS*.Hα-helixtrans-64.2-24.4176.6-65.5-80.6000113.3L218 G221 N227L218-Y223 HydrophobicContact CD1-CD1 3.79Å; L218-Y223 HydrophobicContact CD1-CE1 3.58Å; G221-Y223 WeakPolarHBondContact O-CD2 3.41Å; G221-Y223 PolarHBondContact O-N 2.86Å; Y223-N227 PolarHBondContact O-N 3.04Å; Y223-N227 VanDerWaalsContact O-N 3.1Å; Y223-N227 PolarHBondContact O-ND2 2.71Å
224N74.3Confident80.7Confident66 Ų6660.3 Ų60.335%0.35331%0.311SS..Hα-helixtrans-72.4-46.8-179.8-70-36.2000110.3D222 W226 N227 I228D222-N224 PolarHBondContact O-N 3.44Å; D222-N224 WeakPolarHBondContact OD1-CB 3.44Å; D222-N224 PolarHBondContact OD1-N 3.32Å; D222-N224 VanDerWaalsContact OD1-N 3.08Å; N224-W226 VanDerWaalsContact C-N 3.35Å; N224-W226 PolarHBondContact O-N 2.79Å; N224-N227 PolarHBondContact O-N 2.87Å; N224-I228 VanDerWaalsContact O-CG1 3.3Å; N224-I228 WeakPolarHBondContact O-CG1 3.34Å; N224-I228 PolarHBondContact O-N 3.03Å
225Q76.4Confident80.5Confident81 Ų8160.8 Ų60.838%0.37931%0.314SS..Hα-helixtrans-64.4-39.1175.8-71.5-63.5-35.100112.2D222 N227 I228 I229D222-Q225 HydrophobicContact CB-CB 4.31Å; D222-Q225 HydrophobicContact CB-CG 4.49Å; D222-Q225 VanDerWaalsContact CG-CG 3.47Å; D222-Q225 PolarHBondContact O-N 2.91Å; D222-Q225 PolarHBondContact OD1-N 3.34Å; D222-Q225 WeakPolarHBondContact OD2-CG 3.3Å; Q225-N227 VanDerWaalsContact C-N 3.34Å; Q225-N227 PolarHBondContact O-N 2.97Å; Q225-I228 PolarHBondContact O-N 3.46Å; Q225-I229 VanDerWaalsContact O-CG1 3.29Å; Q225-I229 WeakPolarHBondContact O-CG1 3.3Å; Q225-I229 PolarHBondContact O-N 3.18Å
226W81Confident80.3Confident46 Ų4660 Ų6017%0.17431%0.308CS..Hα-helixtrans-56.7-47.2172.8174.281.9000112L218 D222 N224 T230L218-W226 HydrophobicContact CB-CG 4.49Å; L218-W226 HydrophobicContact CD1-CG 4.49Å; D222-W226 PolarHBondContact O-N 3.3Å; N224-W226 VanDerWaalsContact C-N 3.35Å; N224-W226 PolarHBondContact O-N 2.79Å; W226-T230 HydrophobicContact CD2-CG2 4.38Å; W226-T230 HydrophobicContact CZ2-CG2 4.12Å; W226-T230 WeakPolarHBondContact O-CB 3.13Å; W226-T230 WeakPolarHBondContact O-CG2 3.38Å; W226-T230 PolarHBondContact O-N 2.91Å; W226-T230 PolarHBondContact O-OG1 3.34Å
227N75.1Confident80Confident34 Ų3456.6 Ų56.618%0.18229%0.291CS..Hα-helixtrans-62.8-44.5178.1-82.4-55000112A88 Y223 N224 Q225 I229 T230 M231A88-N227 HydrophobicContact CB-CB 4.02Å; Y223-N227 PolarHBondContact O-N 3.04Å; Y223-N227 VanDerWaalsContact O-N 3.1Å; Y223-N227 PolarHBondContact O-ND2 2.71Å; N224-N227 PolarHBondContact O-N 2.87Å; Q225-N227 VanDerWaalsContact C-N 3.34Å; Q225-N227 PolarHBondContact O-N 2.97Å; N227-I229 PolarHBondContact O-N 3.45Å; N227-T230 PolarHBondContact O-N 2.82Å; N227-T230 PolarHBondContact O-OG1 2.97Å; N227-M231 WeakPolarHBondContact O-CB 3.5Å; N227-M231 WeakPolarHBondContact O-CG 3.48Å; N227-M231 PolarHBondContact O-N 3.49Å
228I74.1Confident79.9Confident52 Ų5255.8 Ų55.827%0.26729%0.286SS..Hα-helixtrans-59.4-49.9179.9-69.4165000110.8V80 N224 Q225 M231 A232V80-I228 HydrophobicContact CB-CD1 4.19Å; V80-I228 HydrophobicContact CB-CG1 3.85Å; V80-I228 HydrophobicContact CG1-CG1 4.37Å; V80-I228 HydrophobicContact CG2-CG1 3.84Å; N224-I228 VanDerWaalsContact O-CG1 3.3Å; N224-I228 WeakPolarHBondContact O-CG1 3.34Å; N224-I228 PolarHBondContact O-N 3.03Å; Q225-I228 PolarHBondContact O-N 3.46Å; I228-M231 PolarHBondContact O-N 3.32Å; I228-A232 WeakPolarHBondContact O-CB 3.45Å; I228-A232 PolarHBondContact O-N 2.84Å
229I76.5Confident79.8Confident33 Ų3353.9 Ų53.917%0.16928%0.275CS..Hα-helixtrans-68.9-40.9-175.6-60.4163.9000111.1R210 A214 Q225 N227 A232 V233R210-I229 HydrophobicContact CB-CG2 3.98Å; R210-I229 VanDerWaalsContact O-CG2 3.26Å; R210-I229 WeakPolarHBondContact O-CG2 3.35Å; A214-I229 HydrophobicContact CB-CB 3.9Å; A214-I229 HydrophobicContact CB-CD1 4.23Å; A214-I229 HydrophobicContact CB-CG2 3.78Å; Q225-I229 VanDerWaalsContact O-CG1 3.29Å; Q225-I229 WeakPolarHBondContact O-CG1 3.3Å; Q225-I229 PolarHBondContact O-N 3.18Å; N227-I229 PolarHBondContact O-N 3.45Å; I229-A232 PolarHBondContact O-N 3.41Å; I229-V233 PolarHBondContact O-N 2.9Å
230T76.8Confident79.7Confident3 Ų344.3 Ų44.32%0.01824%0.238CC..Hα-helixtrans-69-38.3178.352.70000112.2Y211 A214 W226 N227 A232 V233 F234Y211-T230 HydrophobicContact CE2-CG2 4.44Å; A214-T230 HydrophobicContact CB-CG2 4.32Å; W226-T230 HydrophobicContact CD2-CG2 4.38Å; W226-T230 HydrophobicContact CZ2-CG2 4.12Å; W226-T230 WeakPolarHBondContact O-CB 3.13Å; W226-T230 WeakPolarHBondContact O-CG2 3.38Å; W226-T230 PolarHBondContact O-N 2.91Å; W226-T230 PolarHBondContact O-OG1 3.34Å; N227-T230 PolarHBondContact O-N 2.82Å; N227-T230 PolarHBondContact O-OG1 2.97Å; T230-A232 VanDerWaalsContact C-N 3.29Å; T230-A232 PolarHBondContact O-N 3.31Å; T230-V233 PolarHBondContact O-N 3.3Å; T230-F234 PolarHBondContact O-N 3.42Å
231M74.9Confident79.6Confident45 Ų4539.4 Ų39.422%0.22221%0.211CC..Hα-helixtrans-67.7-28174.9-72.1176.572.900112.9N227 I228 V233 P235N227-M231 WeakPolarHBondContact O-CB 3.5Å; N227-M231 WeakPolarHBondContact O-CG 3.48Å; N227-M231 PolarHBondContact O-N 3.49Å; I228-M231 PolarHBondContact O-N 3.32Å; M231-V233 VanDerWaalsContact C-N 3.32Å; M231-P235 VanDerWaalsContact O-CA 3.24Å; M231-P235 WeakPolarHBondContact O-CA 3.43Å; M231-P235 WeakPolarHBondContact O-CB 3.42Å; M231-P235 WeakPolarHBondContact O-CD 3.46Å
232A73.9Confident79.7Confident64 Ų6437.8 Ų37.853%0.52919%0.191SC..Hα-helixtrans-70.3-26.8175.700000113.1I228 I229 T230I228-A232 WeakPolarHBondContact O-CB 3.45Å; I228-A232 PolarHBondContact O-N 2.84Å; I229-A232 PolarHBondContact O-N 3.41Å; T230-A232 VanDerWaalsContact C-N 3.29Å; T230-A232 PolarHBondContact O-N 3.31Å
233V75.8Confident79.7Confident10 Ų1041.4 Ų41.46%0.06120%0.201CC..Hα-helixtrans-98.8-45.3178.6-173.50000112.3Y109 F207 R210 I229 T230 M231 P235Y109-V233 PolarHBondContact OH-O 2.9Å; F207-V233 HydrophobicContact CB-CG1 3.94Å; F207-V233 HydrophobicContact CD2-CB 3.96Å; F207-V233 HydrophobicContact CD2-CG1 3.41Å; F207-V233 VanDerWaalsContact CD2-CG1 3.41Å; F207-V233 HydrophobicContact CD2-CG2 4.09Å; F207-V233 HydrophobicContact CE2-CG1 4.2Å; F207-V233 HydrophobicContact CG-CG1 3.93Å; R210-V233 HydrophobicContact CB-CG2 4.07Å; I229-V233 PolarHBondContact O-N 2.9Å; T230-V233 PolarHBondContact O-N 3.3Å; M231-V233 VanDerWaalsContact C-N 3.32Å; V233-P235 VanDerWaalsContact C-CD 3.4Å; V233-P235 VanDerWaalsContact O-CD 3.3Å; V233-P235 WeakPolarHBondContact O-CD 3.47Å
234F82.1Confident79.9Confident1 Ų139.4 Ų39.40%0.00420%0.196CC..SBendtrans-119.874.3177.5-64.1-70.1000110.3Y109 F204 F207 T230 K236 N263 N266 E267 F270Y109-F234 HydrophobicContact CE2-CD1 4.05Å; Y109-F234 AromaticContact CE2-CE1 3.91Å; Y109-F234 HydrophobicContact CE2-CE1 3.91Å; Y109-F234 AromaticContact CZ-CD1 3.91Å; Y109-F234 VanDerWaalsContact OH-CD1 3.25Å; Y109-F234 WeakPolarHBondContact OH-CD1 3.45Å; F204-F234 AromaticContact CD1-CE1 3.93Å; F204-F234 HydrophobicContact CD1-CE1 3.93Å; F204-F234 AromaticContact CD1-CZ 3.93Å; F204-F234 HydrophobicContact CD1-CZ 3.93Å; F204-F234 AromaticContact CE1-CE1 3.72Å; F204-F234 HydrophobicContact CE1-CE1 3.72Å; F204-F234 AromaticContact CE1-CZ 3.89Å; F204-F234 HydrophobicContact CE1-CZ 3.89Å; F204-F234 HydrophobicContact CG-CZ 4.43Å; F204-F234 HydrophobicContact CZ-CE1 4.47Å; F204-F234 HydrophobicContact CZ-CZ 4.34Å; F207-F234 HydrophobicContact CD1-CE2 4.26Å; F207-F234 HydrophobicContact CD1-CZ 4.45Å; F207-F234 HydrophobicContact CD2-CD2 4.46Å; F207-F234 AromaticContact CD2-CE2 3.81Å; F207-F234 HydrophobicContact CD2-CE2 3.81Å; F207-F234 AromaticContact CE1-CE2 3.86Å; F207-F234 HydrophobicContact CE1-CE2 3.86Å; F207-F234 HydrophobicContact CE1-CZ 4.28Å; F207-F234 AromaticContact CE2-CD2 3.93Å; F207-F234 HydrophobicContact CE2-CD2 3.93Å; F207-F234 AromaticContact CE2-CE2 3.36Å; F207-F234 HydrophobicContact CE2-CE2 3.36Å; F207-F234 HydrophobicContact CE2-CZ 4.39Å; F207-F234 HydrophobicContact CG-CE2 4.26Å; F207-F234 HydrophobicContact CZ-CD2 4.31Å; F207-F234 AromaticContact CZ-CE2 3.45Å; F207-F234 HydrophobicContact CZ-CE2 3.45Å; F207-F234 VanDerWaalsContact CZ-CE2 3.45Å; F207-F234 HydrophobicContact CZ-CZ 4.31Å; T230-F234 PolarHBondContact O-N 3.42Å; F234-K236 PolarHBondContact O-N 2.99Å; F234-N263 WeakPolarHBondContact CA-ND2 3.28Å; F234-N263 VanDerWaalsContact CD1-OD1 3.31Å; F234-N263 WeakPolarHBondContact CD1-OD1 3.4Å; F234-N266 HydrophobicContact CD1-CB 4.06Å; F234-N266 HydrophobicContact CE1-CB 3.96Å; F234-E267 HydrophobicContact CB-CB 4.06Å; F234-E267 HydrophobicContact CB-CG 4.37Å; F234-E267 HydrophobicContact CD2-CB 3.96Å; F234-E267 HydrophobicContact CD2-CG 4.01Å; F234-E267 HydrophobicContact CG-CB 4.1Å; F234-E267 HydrophobicContact CG-CG 4.49Å; F234-F270 HydrophobicContact CZ-CB 4.2Å; F234-F270 HydrophobicContact CZ-CD2 4.24Å; F234-F270 HydrophobicContact CZ-CG 4.45Å
235P80.1Confident80.1Confident10 Ų1039.3 Ų39.37%0.06521%0.21CC..  trans-60.9127.2178.222.9-33.3000111.9V74 I107 M231 V233 C237 N263V74-P235 HydrophobicContact CG2-CB 3.78Å; V74-P235 HydrophobicContact CG2-CG 4.21Å; I107-P235 HydrophobicContact CD1-CB 4.01Å; I107-P235 HydrophobicContact CD1-CG 3.25Å; I107-P235 HydrophobicContact CG1-CG 3.78Å; I107-P235 HydrophobicContact CG2-CG 4.36Å; M231-P235 VanDerWaalsContact O-CA 3.24Å; M231-P235 WeakPolarHBondContact O-CA 3.43Å; M231-P235 WeakPolarHBondContact O-CB 3.42Å; M231-P235 WeakPolarHBondContact O-CD 3.46Å; V233-P235 VanDerWaalsContact C-CD 3.4Å; V233-P235 VanDerWaalsContact O-CD 3.3Å; V233-P235 WeakPolarHBondContact O-CD 3.47Å; P235-C237 VanDerWaalsContact C-N 3.35Å; P235-N263 VanDerWaalsContact CD-ND2 3.32Å; P235-N263 WeakPolarHBondContact CD-ND2 3.43Å; P235-N263 WeakPolarHBondContact O-CB 3.37Å; P235-N263 PolarHBondContact O-ND2 3.48Å
236K81.9Confident80.2Confident48 Ų4836.2 Ų36.221%0.20920%0.2CC..SBendtrans-86.7-13179.5-65.7160.3-170.6165.60112.5F234 L259 L260 E267F234-K236 PolarHBondContact O-N 2.99Å; K236-L259 WeakPolarHBondContact O-CA 3.31Å; K236-L260 PolarHBondContact O-N 2.82Å; K236-E267 WeakPolarHBondContact CE-OE2 3.38Å; K236-E267 IonicContact NZ-OE2 2.72Å; K236-E267 PolarHBondContact NZ-OE2 2.94Å
237C80.1Confident80Confident20 Ų2041 Ų4114%0.13524%0.237CC..EExtended strand (participates in β ladder)trans-141.7137.5-177.6-60.10000108.4V74 C90 P235 C258 L259V74-C237 WeakPolarHBondContact CG2-O 3.48Å; C90-C237 HydrophobicContact CB-CB 3.78Å; C90-C237 WeakPolarHBondContact CB-SG 3.43Å; C90-C237 WeakPolarHBondContact SG-CB 3.49Å; C90-C237 CovalentContact SG-SG 2.03Å; C90-C237 PolarHBondContact SG-SG 3.49Å; P235-C237 VanDerWaalsContact C-N 3.35Å; C237-C258 CarbonylContact C-O 3.54Å; C237-C258 VanDerWaalsContact CA-O 3.27Å; C237-C258 WeakPolarHBondContact CA-O 3.41Å; C237-L259 HydrophobicContact CB-CD2 4.41Å; C237-L259 WeakPolarHBondContact SG-CD2 3.47Å
238A83.3Confident80.3Confident5 Ų544.5 Ų44.54%0.04126%0.264CS..EExtended strand (participates in β ladder)trans-146.4163.5-179.600000110.9A72 V74 I107 C258 L260A72-A238 HydrophobicContact CB-CB 3.49Å; A72-A238 VanDerWaalsContact CB-CB 3.49Å; V74-A238 HydrophobicContact CG2-CB 3.93Å; I107-A238 HydrophobicContact CD1-CB 3.69Å; A238-C258 PolarHBondContact N-O 2.87Å; A238-C258 PolarHBondContact O-N 3.16Å; A238-L260 HydrophobicContact CB-CD1 3.58Å
239K83.6Confident80.5Confident25 Ų2545.4 Ų45.411%0.10929%0.286CS..EExtended strand (participates in β ladder)trans-102.7139.8177.3-171.9170.7173.1-160.60109.9A72 Y73 V95 D255 Y256A72-K239 CarbonylContact C-O 3.6Å; A72-K239 WeakPolarHBondContact CA-O 3.47Å; Y73-K239 VanDerWaalsContact CD1-O 3.3Å; Y73-K239 WeakPolarHBondContact CD1-O 3.46Å; Y73-K239 HydrophobicContact CE1-CB 4.27Å; Y73-K239 HydrophobicContact CE1-CG 4.21Å; Y73-K239 HydrophobicContact CE2-CB 4.12Å; Y73-K239 HydrophobicContact CE2-CD 4.3Å; Y73-K239 HydrophobicContact CE2-CG 4.46Å; Y73-K239 PolarHBondContact N-O 3.1Å; Y73-K239 PolarHBondContact O-N 3.23Å; Y73-K239 VanDerWaalsContact OH-CD 3.24Å; Y73-K239 WeakPolarHBondContact OH-CD 3.21Å; Y73-K239 WeakPolarHBondContact OH-CE 3.43Å; Y73-K239 PolarHBondContact OH-NZ 3.37Å; V95-K239 HydrophobicContact CG1-CD 3.91Å; K239-D255 VanDerWaalsContact CE-CB 3.44Å; K239-D255 WeakPolarHBondContact CE-OD1 3.38Å; K239-D255 WeakPolarHBondContact CE-OD2 3.31Å; K239-D255 IonicContact NZ-OD1 2.85Å; K239-D255 PolarHBondContact NZ-OD1 3.38Å; K239-D255 IonicContact NZ-OD2 3.25Å; K239-D255 PolarHBondContact NZ-OD2 3.02Å; K239-Y256 CarbonylContact C-O 3.52Å; K239-Y256 WeakPolarHBondContact CA-O 3.45Å
240C86.8Confident80.7Confident1 Ų146.7 Ų46.71%0.00730%0.298CS..EExtended strand (participates in β ladder)trans-122.3130.1177.7173.30000109.1C67 A72 Y256C67-C240 WeakPolarHBondContact CA-SG 3.49Å; C67-C240 HydrophobicContact CB-CB 3.71Å; C67-C240 WeakPolarHBondContact CB-SG 3.43Å; C67-C240 WeakPolarHBondContact SG-CB 3.46Å; C67-C240 CovalentContact SG-SG 2.03Å; C67-C240 PolarHBondContact SG-SG 3.41Å; A72-C240 HydrophobicContact CB-CB 4.48Å; C240-Y256 PolarHBondContact N-O 3.05Å; C240-Y256 PolarHBondContact O-N 3.47Å
241E87Confident80.8Confident23 Ų2350.5 Ų50.511%0.10733%0.325CS..EExtended strand (participates in β ladder)trans-109122.3179.7-92.6178-148.900110.4Y73 R104 I253 D255Y73-E241 HydrophobicContact CE1-CB 4.2Å; Y73-E241 HydrophobicContact CE1-CG 3.88Å; Y73-E241 PolarHBondContact OH-OE1 3.2Å; R104-E241 IonicContact CZ-OE1 2.6Å; R104-E241 VanDerWaalsContact CZ-OE1 3.25Å; R104-E241 IonicContact CZ-OE2 3.65Å; R104-E241 VanDerWaalsContact NH1-CD 3.32Å; R104-E241 IonicContact NH1-OE1 3.63Å; R104-E241 PolarHBondContact NH1-OE1 3.31Å; R104-E241 IonicContact NH1-OE2 3.7Å; R104-E241 PolarHBondContact NH1-OE2 2.78Å; R104-E241 VanDerWaalsContact NH2-CD 3.25Å; R104-E241 IonicContact NH2-OE1 2.84Å; R104-E241 PolarHBondContact NH2-OE1 3.35Å; R104-E241 IonicContact NH2-OE2 2.79Å; R104-E241 PolarHBondContact NH2-OE2 3.11Å; E241-I253 HydrophobicContact CG-CG2 4.13Å; E241-D255 WeakPolarHBondContact CG-OD1 3.48Å
242M86.4Confident81.1Confident10 Ų1052 Ų525%0.04933%0.334CS..EExtended strand (participates in β ladder)trans-119.1126179.7-171.1177.778.100110.6Y62 F66 Y254 Y256Y62-M242 HydrophobicContact CD1-SD 4.08Å; Y62-M242 HydrophobicContact CE1-CE 4.38Å; Y62-M242 HydrophobicContact CE1-SD 3.56Å; Y62-M242 VanDerWaalsContact CE1-SD 3.56Å; F66-M242 HydrophobicContact CD1-CB 4.12Å; F66-M242 HydrophobicContact CD1-CG 3.91Å; F66-M242 HydrophobicContact CD1-SD 4.17Å; F66-M242 HydrophobicContact CD2-CG 4.43Å; F66-M242 HydrophobicContact CE1-CB 3.84Å; F66-M242 HydrophobicContact CE1-CG 3.74Å; F66-M242 HydrophobicContact CE2-CG 4.27Å; F66-M242 HydrophobicContact CG-CG 4.27Å; F66-M242 HydrophobicContact CG-SD 4.15Å; F66-M242 HydrophobicContact CZ-CB 4.41Å; F66-M242 HydrophobicContact CZ-CG 3.94Å; M242-Y254 PolarHBondContact N-O 3.15Å; M242-Y254 PolarHBondContact O-N 3.13Å; M242-Y256 HydrophobicContact CB-CD2 4.42Å; M242-Y256 HydrophobicContact CB-CE2 4.08Å; M242-Y256 HydrophobicContact CE-CE2 3.85Å; M242-Y256 HydrophobicContact SD-CE2 4.38Å
243Y84.5Confident81.5Confident142 Ų14253.5 Ų53.556%0.55733%0.332SS*.EExtended strand (participates in β ladder)trans-90114.8175.3-61.2-91.8000109.1I253Y243-I253 HydrophobicContact CD1-CD1 4.42Å; Y243-I253 HydrophobicContact CD1-CG1 3.81Å; Y243-I253 HydrophobicContact CE1-CD1 3.79Å; Y243-I253 HydrophobicContact CE1-CG1 3.66Å
244K82.6Confident81.9Confident109 Ų10957.7 Ų57.747%0.47435%0.347SS..EExtended strand (participates in β ladder)trans-109.9121.9174.7-168.5173.7-176.9169.50109.2G246 N252 Y254K244-G246 PolarHBondContact O-N 3.43Å; K244-N252 PolarHBondContact N-O 3.34Å; K244-N252 PolarHBondContact O-N 3.11Å; K244-Y254 HydrophobicContact CB-CD2 3.82Å; K244-Y254 HydrophobicContact CB-CE2 3.68Å; K244-Y254 HydrophobicContact CD-CE2 4.08Å; K244-Y254 HydrophobicContact CG-CE2 4.42Å
245G79.7Confident82Confident64 Ų6461.6 Ų61.666%0.6637%0.368SS*.EExtended strand (participates in β ladder)trans-68.1124.1173.300000110.5
246G78.6Confident82.3Confident16 Ų1662.8 Ų62.817%0.16537%0.372CS..  trans-73.516116800000111.4K244 S248 G249 S250K244-G246 PolarHBondContact O-N 3.43Å; G246-S248 PolarHBondContact O-N 2.88Å; G246-G249 PolarHBondContact O-N 3.35Å; G246-S250 PolarHBondContact N-O 3.27Å
247P75.4Confident82.4Confident145 Ų14563.1 Ų63.194%0.94238%0.376SS*.THydrogen-bonded Turntrans-59-21.8178.723.1-32.5000113.2
248S82.9Confident82.7Confident109 Ų10962.2 Ų62.276%0.76237%0.369SS*.THydrogen-bonded Turntrans-86.80.2177.2-24.30000114.4G246 S250G246-S248 PolarHBondContact O-N 2.88Å; S248-S250 VanDerWaalsContact C-N 3.28Å; S248-S250 PolarHBondContact O-N 3.42Å
249G77.3Confident82.8Confident70 Ų7065.9 Ų65.972%0.72239%0.388SS*.SBendtrans80.7-1.4-172.600000115.1G246G246-G249 PolarHBondContact O-N 3.35Å
250S81.1Confident82.9Confident60 Ų6065 Ų6542%0.4238%0.384SS..PPolyproline II helixtrans-72.5128.8171.657.60000110.7G246 S248G246-S250 PolarHBondContact N-O 3.27Å; S248-S250 VanDerWaalsContact C-N 3.28Å; S248-S250 PolarHBondContact O-N 3.42Å
251S78.9Confident82.8Confident83 Ų8367.5 Ų67.558%0.5840%0.4SS*.EExtended strand (participates in β ladder)trans-81121.2174.757.70000110.9
252N80.9Confident82.8Confident78 Ų7866.7 Ų66.742%0.41740%0.397SS..EExtended strand (participates in β ladder)trans-100.2133.5169.3-69-29.6000109.2K244 Y254K244-N252 PolarHBondContact N-O 3.34Å; K244-N252 PolarHBondContact O-N 3.11Å; N252-Y254 HydrophobicContact CB-CD2 4.46Å; N252-Y254 HydrophobicContact CB-CE2 3.75Å
253I82.4Confident82.8Confident94 Ų9466.3 Ų66.348%0.48240%0.395SS..EExtended strand (participates in β ladder)trans-94.2125.5177.9-56.7174000108.1E241 Y243E241-I253 HydrophobicContact CG-CG2 4.13Å; Y243-I253 HydrophobicContact CD1-CD1 4.42Å; Y243-I253 HydrophobicContact CD1-CG1 3.81Å; Y243-I253 HydrophobicContact CE1-CD1 3.79Å; Y243-I253 HydrophobicContact CE1-CG1 3.66Å
254Y84.2Confident82.8Confident98 Ų9863.5 Ų63.538%0.38439%0.389SS..EExtended strand (participates in β ladder)trans-110.8125.7174.7-69.1-91000109.6M242 K244 N252M242-Y254 PolarHBondContact N-O 3.15Å; M242-Y254 PolarHBondContact O-N 3.13Å; K244-Y254 HydrophobicContact CB-CD2 3.82Å; K244-Y254 HydrophobicContact CB-CE2 3.68Å; K244-Y254 HydrophobicContact CD-CE2 4.08Å; K244-Y254 HydrophobicContact CG-CE2 4.42Å; N252-Y254 HydrophobicContact CB-CD2 4.46Å; N252-Y254 HydrophobicContact CB-CE2 3.75Å
255D83.9Confident83.1Confident84 Ų8461.4 Ų61.445%0.44938%0.382SS..EExtended strand (participates in β ladder)trans-101.1116.5-179.6-78.1-28000110.1K239 E241K239-D255 VanDerWaalsContact CE-CB 3.44Å; K239-D255 WeakPolarHBondContact CE-OD1 3.38Å; K239-D255 WeakPolarHBondContact CE-OD2 3.31Å; K239-D255 IonicContact NZ-OD1 2.85Å; K239-D255 PolarHBondContact NZ-OD1 3.38Å; K239-D255 IonicContact NZ-OD2 3.25Å; K239-D255 PolarHBondContact NZ-OD2 3.02Å; E241-D255 WeakPolarHBondContact CG-OD1 3.48Å
256Y85.9Confident83.5Confident35 Ų3558.4 Ų58.414%0.13735%0.351CS..EExtended strand (participates in β ladder)trans-110.2132.8176.3-62.3-83.9000110.6V63 K239 C240 M242V63-Y256 HydrophobicContact CB-CE1 4.47Å; V63-Y256 HydrophobicContact CG1-CD1 3.62Å; V63-Y256 HydrophobicContact CG1-CD2 3.74Å; V63-Y256 HydrophobicContact CG1-CE1 3.88Å; V63-Y256 HydrophobicContact CG1-CE2 4Å; V63-Y256 HydrophobicContact CG1-CG 3.53Å; V63-Y256 HydrophobicContact CG2-CD1 4.41Å; V63-Y256 HydrophobicContact CG2-CE1 3.8Å; V63-Y256 HydrophobicContact CG2-CE2 4.02Å; K239-Y256 CarbonylContact C-O 3.52Å; K239-Y256 WeakPolarHBondContact CA-O 3.45Å; C240-Y256 PolarHBondContact N-O 3.05Å; C240-Y256 PolarHBondContact O-N 3.47Å; M242-Y256 HydrophobicContact CB-CD2 4.42Å; M242-Y256 HydrophobicContact CB-CE2 4.08Å; M242-Y256 HydrophobicContact CE-CE2 3.85Å; M242-Y256 HydrophobicContact SD-CE2 4.38Å
257L84.2Confident84Confident55 Ų5557.7 Ų57.729%0.28834%0.343SS..EExtended strand (participates in β ladder)trans-85.7129167.5176.373.3000109C54 F55 P92C54-L257 CarbonylContact C-O 3.32Å; C54-L257 VanDerWaalsContact CA-O 3.23Å; C54-L257 WeakPolarHBondContact CA-O 3.37Å; F55-L257 PolarHBondContact N-O 2.9Å; P92-L257 HydrophobicContact CB-CD1 3.86Å; P92-L257 HydrophobicContact CB-CD2 4.14Å; P92-L257 HydrophobicContact CB-CG 4.41Å; P92-L257 HydrophobicContact CG-CD1 3.61Å; P92-L257 HydrophobicContact CG-CD2 3.21Å; P92-L257 HydrophobicContact CG-CG 3.9Å
258C86.3Confident84.6Confident0 Ų055.9 Ų55.90%032%0.321CS..EExtended strand (participates in β ladder)trans-125.3138.7179-50.90000112.6I52 Q53 C54 C237 A238 L260I52-C258 HydrophobicContact CD1-CB 3.67Å; I52-C258 HydrophobicContact CG1-CB 3.6Å; Q53-C258 CarbonylContact O-C 3.47Å; Q53-C258 WeakPolarHBondContact O-CA 3.46Å; C54-C258 HydrophobicContact CB-CB 4.06Å; C54-C258 WeakPolarHBondContact CB-SG 3.46Å; C54-C258 WeakPolarHBondContact SG-CB 3.36Å; C54-C258 CovalentContact SG-SG 2.05Å; C54-C258 PolarHBondContact SG-SG 2.91Å; C237-C258 CarbonylContact C-O 3.54Å; C237-C258 VanDerWaalsContact CA-O 3.27Å; C237-C258 WeakPolarHBondContact CA-O 3.41Å; A238-C258 PolarHBondContact N-O 2.87Å; A238-C258 PolarHBondContact O-N 3.16Å; C258-L260 WeakPolarHBondContact O-CD1 3.48Å
259L86Confident85Confident82 Ų8251.9 Ų51.943%0.42929%0.291SS..EExtended strand (participates in β ladder)trans-86.9142166.5-58-178.6000109.3I52 Q53 K236 C237 P261I52-L259 WeakPolarHBondContact CA-O 3.46Å; Q53-L259 PolarHBondContact N-O 3.17Å; Q53-L259 PolarHBondContact O-N 3.4Å; K236-L259 WeakPolarHBondContact O-CA 3.31Å; C237-L259 HydrophobicContact CB-CD2 4.41Å; C237-L259 WeakPolarHBondContact SG-CD2 3.47Å; L259-P261 VanDerWaalsContact C-CD 3.45Å; L259-P261 VanDerWaalsContact O-CD 3.28Å; L259-P261 WeakPolarHBondContact O-CD 3.27Å
260L86.2Confident85.6Confident7 Ų748.6 Ų48.64%0.03726%0.256CS..  trans-118.477.4179.8-70.982.5000109.9Y110 K236 A238 C258 L262 N263Y110-L260 HydrophobicContact CD1-CD2 4.2Å; Y110-L260 HydrophobicContact CE1-CD2 3.84Å; K236-L260 PolarHBondContact O-N 2.82Å; A238-L260 HydrophobicContact CB-CD1 3.58Å; C258-L260 WeakPolarHBondContact O-CD1 3.48Å; L260-L262 PolarHBondContact O-N 2.78Å; L260-N263 HydrophobicContact CB-CB 4.17Å; L260-N263 WeakPolarHBondContact O-CB 3.49Å; L260-N263 PolarHBondContact O-N 3.39Å
261P85Confident86Confident53 Ų5346.2 Ų46.234%0.34424%0.24SC..Hα-helixtrans-56.8-32.7177.2-2433.4000112.7L259 N263 I264L259-P261 VanDerWaalsContact C-CD 3.45Å; L259-P261 VanDerWaalsContact O-CD 3.28Å; L259-P261 WeakPolarHBondContact O-CD 3.27Å; P261-N263 PolarHBondContact O-N 3.42Å; P261-N263 VanDerWaalsContact O-N 3.15Å; P261-I264 WeakPolarHBondContact O-CG2 3.25Å; P261-I264 PolarHBondContact O-N 3.36Å
262L85.7Confident86.6Confident6 Ų647.4 Ų47.43%0.03124%0.235CC..Hα-helixtrans-59.1-29.9178.8-16764000112.2L42 K45 Q46 W68 L260 L265 N266L42-L262 HydrophobicContact CD2-CD1 4.18Å; K45-L262 HydrophobicContact CB-CD1 3.95Å; Q46-L262 HydrophobicContact CB-CD1 4.5Å; Q46-L262 HydrophobicContact CB-CD2 4.34Å; Q46-L262 HydrophobicContact CG-CD2 4.35Å; W68-L262 HydrophobicContact CH2-CD2 3.67Å; W68-L262 HydrophobicContact CZ3-CD2 4.18Å; L260-L262 PolarHBondContact O-N 2.78Å; L262-L265 PolarHBondContact O-N 3.45Å; L262-N266 PolarHBondContact O-N 2.9Å
263N86.4Confident87.2Confident2 Ų243.7 Ų43.71%0.01122%0.215CC..Hα-helixtrans-76.1-26-176.5-131.117.8000113.9Y109 F234 P235 L260 P261 L265 N266 E267Y109-N263 PolarHBondContact OH-ND2 3.4Å; Y109-N263 PolarHBondContact OH-OD1 3.49Å; F234-N263 WeakPolarHBondContact CA-ND2 3.28Å; F234-N263 VanDerWaalsContact CD1-OD1 3.31Å; F234-N263 WeakPolarHBondContact CD1-OD1 3.4Å; P235-N263 VanDerWaalsContact CD-ND2 3.32Å; P235-N263 WeakPolarHBondContact CD-ND2 3.43Å; P235-N263 WeakPolarHBondContact O-CB 3.37Å; P235-N263 PolarHBondContact O-ND2 3.48Å; L260-N263 HydrophobicContact CB-CB 4.17Å; L260-N263 WeakPolarHBondContact O-CB 3.49Å; L260-N263 PolarHBondContact O-N 3.39Å; P261-N263 PolarHBondContact O-N 3.42Å; P261-N263 VanDerWaalsContact O-N 3.15Å; N263-L265 VanDerWaalsContact C-N 3.27Å; N263-L265 PolarHBondContact O-N 3.43Å; N263-N266 PolarHBondContact O-N 3.18Å; N263-E267 WeakPolarHBondContact O-CB 3.48Å; N263-E267 PolarHBondContact O-N 3.48Å
264I85.8Confident87.6Confident83 Ų8341 Ų4143%0.42620%0.199SC..Hα-helixtrans-66-36.6172.7-152.3173.3000110.7P261 K268P261-I264 WeakPolarHBondContact O-CG2 3.25Å; P261-I264 PolarHBondContact O-N 3.36Å; I264-K268 WeakPolarHBondContact O-CG 3.42Å; I264-K268 PolarHBondContact O-N 3.31Å
265L88.3Confident87.9Confident66 Ų6641.3 Ų41.335%0.34621%0.206SC..Hα-helixtrans-71-44.9177.3-67.7172.8000110.6L42 K45 L262 N263 E267 K268 I269L42-L265 HydrophobicContact CD2-CB 4.05Å; K45-L265 HydrophobicContact CB-CD1 4.11Å; K45-L265 HydrophobicContact CD-CD1 4.38Å; K45-L265 HydrophobicContact CG-CD1 3.65Å; L262-L265 PolarHBondContact O-N 3.45Å; N263-L265 VanDerWaalsContact C-N 3.27Å; N263-L265 PolarHBondContact O-N 3.43Å; L265-E267 VanDerWaalsContact C-N 3.34Å; L265-E267 PolarHBondContact O-N 2.94Å; L265-K268 PolarHBondContact O-N 3.47Å; L265-I269 WeakPolarHBondContact O-CB 3.29Å; L265-I269 WeakPolarHBondContact O-CG1 3.31Å; L265-I269 PolarHBondContact O-N 2.95Å
266N89.1Confident88.5Confident1 Ų139.5 Ų39.51%0.00519%0.194CC..Hα-helixtrans-56.8-47.5174.8-70.8-19.7000111.4L42 F234 L262 N263 K268 I269 F270L42-N266 WeakPolarHBondContact CD1-OD1 3.37Å; L42-N266 WeakPolarHBondContact CD2-OD1 3.26Å; F234-N266 HydrophobicContact CD1-CB 4.06Å; F234-N266 HydrophobicContact CE1-CB 3.96Å; L262-N266 PolarHBondContact O-N 2.9Å; N263-N266 PolarHBondContact O-N 3.18Å; N266-K268 VanDerWaalsContact C-N 3.29Å; N266-K268 PolarHBondContact O-N 2.68Å; N266-I269 PolarHBondContact O-N 3.41Å; N266-F270 HydrophobicContact CB-CD2 4.27Å; N266-F270 WeakPolarHBondContact O-CB 3.18Å; N266-F270 VanDerWaalsContact O-CD2 3.31Å; N266-F270 WeakPolarHBondContact O-CD2 3.2Å; N266-F270 PolarHBondContact O-N 2.89Å
267E87.2Confident88.8Confident0 Ų038.2 Ų38.20%019%0.188CC..Hα-helixtrans-52.5-46.9177.6-169.4-156.2126.600111.5F234 K236 N263 L265 A271F234-E267 HydrophobicContact CB-CB 4.06Å; F234-E267 HydrophobicContact CB-CG 4.37Å; F234-E267 HydrophobicContact CD2-CB 3.96Å; F234-E267 HydrophobicContact CD2-CG 4.01Å; F234-E267 HydrophobicContact CG-CB 4.1Å; F234-E267 HydrophobicContact CG-CG 4.49Å; K236-E267 WeakPolarHBondContact CE-OE2 3.38Å; K236-E267 IonicContact NZ-OE2 2.72Å; K236-E267 PolarHBondContact NZ-OE2 2.94Å; N263-E267 WeakPolarHBondContact O-CB 3.48Å; N263-E267 PolarHBondContact O-N 3.48Å; L265-E267 VanDerWaalsContact C-N 3.34Å; L265-E267 PolarHBondContact O-N 2.94Å; E267-A271 VanDerWaalsContact O-CB 3.22Å; E267-A271 WeakPolarHBondContact O-CB 3.31Å; E267-A271 PolarHBondContact O-N 2.93Å; E267-A271 VanDerWaalsContact O-N 3.12Å
268K88.7Confident89.3Confident107 Ų10738.5 Ų38.547%0.46519%0.19SC..Hα-helixtrans-76.2-39.6-177.7-58.4-44.8179.1-1680113.2I264 L265 N266 F272I264-K268 WeakPolarHBondContact O-CG 3.42Å; I264-K268 PolarHBondContact O-N 3.31Å; L265-K268 PolarHBondContact O-N 3.47Å; N266-K268 VanDerWaalsContact C-N 3.29Å; N266-K268 PolarHBondContact O-N 2.68Å; K268-F272 PolarHBondContact O-N 3.44Å; K268-F272 VanDerWaalsContact O-N 3.13Å
269I91.6Very high89.7Confident25 Ų2542.1 Ų42.113%0.12821%0.209CC..Hα-helixtrans-64.5-48.6178.2-73.1170.3000110.1C38 L42 L265 N266 A271 F272 L273C38-I269 HydrophobicContact CB-CG2 4.01Å; L42-I269 HydrophobicContact CD1-CD1 4.04Å; L42-I269 HydrophobicContact CD2-CD1 3.7Å; L42-I269 HydrophobicContact CG-CD1 3.66Å; L265-I269 WeakPolarHBondContact O-CB 3.29Å; L265-I269 WeakPolarHBondContact O-CG1 3.31Å; L265-I269 PolarHBondContact O-N 2.95Å; N266-I269 PolarHBondContact O-N 3.41Å; I269-A271 PolarHBondContact O-N 3.37Å; I269-F272 WeakPolarHBondContact O-CB 3.43Å; I269-F272 PolarHBondContact O-N 3.47Å; I269-L273 HydrophobicContact CG2-CD1 3.75Å; I269-L273 HydrophobicContact CG2-CG 4.26Å; I269-L273 WeakPolarHBondContact O-CG 3.3Å; I269-L273 PolarHBondContact O-N 2.6Å
270F90.8Very high90.1Very high1 Ų138.3 Ų38.30%0.00419%0.189CC..Hα-helixtrans-71.5-29.9-178.7-78-73.8000112.9V113 L117 L200 F204 F207 W208 F234 N266 F272 L273 W274V113-F270 HydrophobicContact CG1-CE2 3.62Å; V113-F270 HydrophobicContact CG1-CZ 3.85Å; V113-F270 HydrophobicContact CG2-CE2 4.31Å; L117-F270 HydrophobicContact CD1-CZ 4.18Å; L117-F270 HydrophobicContact CD2-CE1 3.95Å; L117-F270 HydrophobicContact CD2-CZ 3.88Å; L117-F270 HydrophobicContact CG-CZ 4.1Å; L200-F270 HydrophobicContact CD2-CE1 4.35Å; F204-F270 HydrophobicContact CE1-CD2 4.43Å; F204-F270 HydrophobicContact CE1-CE2 4.31Å; F204-F270 AromaticContact CE2-CD1 3.56Å; F204-F270 HydrophobicContact CE2-CD1 3.56Å; F204-F270 HydrophobicContact CE2-CD2 4.22Å; F204-F270 AromaticContact CE2-CE1 3.54Å; F204-F270 HydrophobicContact CE2-CE1 3.54Å; F204-F270 HydrophobicContact CE2-CE2 4.22Å; F204-F270 AromaticContact CE2-CG 3.92Å; F204-F270 HydrophobicContact CE2-CG 3.92Å; F204-F270 AromaticContact CE2-CZ 3.9Å; F204-F270 HydrophobicContact CE2-CZ 3.9Å; F204-F270 AromaticContact CZ-CD1 3.83Å; F204-F270 HydrophobicContact CZ-CD1 3.83Å; F204-F270 AromaticContact CZ-CD2 3.69Å; F204-F270 HydrophobicContact CZ-CD2 3.69Å; F204-F270 AromaticContact CZ-CE1 3.6Å; F204-F270 HydrophobicContact CZ-CE1 3.6Å; F204-F270 AromaticContact CZ-CE2 3.47Å; F204-F270 HydrophobicContact CZ-CE2 3.47Å; F204-F270 VanDerWaalsContact CZ-CE2 3.47Å; F204-F270 AromaticContact CZ-CG 3.88Å; F204-F270 HydrophobicContact CZ-CG 3.88Å; F204-F270 AromaticContact CZ-CZ 3.44Å; F204-F270 HydrophobicContact CZ-CZ 3.44Å; F204-F270 VanDerWaalsContact CZ-CZ 3.44Å; F207-F270 HydrophobicContact CE1-CB 3.91Å; W208-F270 HydrophobicContact CH2-CD1 4.44Å; F234-F270 HydrophobicContact CZ-CB 4.2Å; F234-F270 HydrophobicContact CZ-CD2 4.24Å; F234-F270 HydrophobicContact CZ-CG 4.45Å; N266-F270 HydrophobicContact CB-CD2 4.27Å; N266-F270 WeakPolarHBondContact O-CB 3.18Å; N266-F270 VanDerWaalsContact O-CD2 3.31Å; N266-F270 WeakPolarHBondContact O-CD2 3.2Å; N266-F270 PolarHBondContact O-N 2.89Å; F270-F272 VanDerWaalsContact C-N 3.34Å; F270-L273 HydrophobicContact CD1-CD1 4.18Å; F270-L273 HydrophobicContact CE1-CD1 4.17Å; F270-L273 PolarHBondContact O-N 3.34Å; F270-W274 VanDerWaalsContact O-CB 3.31Å; F270-W274 WeakPolarHBondContact O-CB 3.43Å; F270-W274 PolarHBondContact O-N 2.93Å
271A88.9Confident90.5Very high10 Ų1039.1 Ų39.18%0.08320%0.197CC..Hα-helixtrans-59.6-44.5168.300000112.2Y211 E267 I269 W274Y211-A271 HydrophobicContact CE1-CB 3.93Å; Y211-A271 HydrophobicContact CE2-CB 4.34Å; Y211-A271 WeakPolarHBondContact OH-CB 3.25Å; E267-A271 VanDerWaalsContact O-CB 3.22Å; E267-A271 WeakPolarHBondContact O-CB 3.31Å; E267-A271 PolarHBondContact O-N 2.93Å; E267-A271 VanDerWaalsContact O-N 3.12Å; I269-A271 PolarHBondContact O-N 3.37Å; A271-W274 WeakPolarHBondContact O-CB 3.22Å
272F92.1Very high91Very high108 Ų10842.6 Ų42.647%0.47421%0.21SC..Hα-helixtrans-66.8-47176.2176.7-96.7000112L34 K268 I269 F270 W274 I275 W276L34-F272 HydrophobicContact CD1-CD1 4.32Å; L34-F272 HydrophobicContact CD1-CE1 3.58Å; L34-F272 HydrophobicContact CD1-CZ 4.47Å; L34-F272 HydrophobicContact CD2-CD1 4.43Å; L34-F272 HydrophobicContact CD2-CE1 3.68Å; L34-F272 HydrophobicContact CG-CE1 4.21Å; K268-F272 PolarHBondContact O-N 3.44Å; K268-F272 VanDerWaalsContact O-N 3.13Å; I269-F272 WeakPolarHBondContact O-CB 3.43Å; I269-F272 PolarHBondContact O-N 3.47Å; F270-F272 VanDerWaalsContact C-N 3.34Å; F272-W274 VanDerWaalsContact C-N 3.27Å; F272-W274 PolarHBondContact O-N 3.14Å; F272-I275 PolarHBondContact O-N 3.47Å; F272-W276 PolarHBondContact O-N 3.26Å; F272-W276 VanDerWaalsContact O-N 3.11Å
273L93.2Very high91.5Very high0 Ų045 Ų450%022%0.222CC..Hα-helixtrans-62.4-34179.4-72175.5000112.3L34 L35 L117 I269 F270 W276 F277L34-L273 HydrophobicContact CD2-CD2 3.75Å; L34-L273 HydrophobicContact CG-CD2 4.01Å; L35-L273 HydrophobicContact CD2-CD1 4.38Å; L35-L273 HydrophobicContact CD2-CD2 4.23Å; L117-L273 HydrophobicContact CD2-CD1 3.74Å; I269-L273 HydrophobicContact CG2-CD1 3.75Å; I269-L273 HydrophobicContact CG2-CG 4.26Å; I269-L273 WeakPolarHBondContact O-CG 3.3Å; I269-L273 PolarHBondContact O-N 2.6Å; F270-L273 HydrophobicContact CD1-CD1 4.18Å; F270-L273 HydrophobicContact CE1-CD1 4.17Å; F270-L273 PolarHBondContact O-N 3.34Å; L273-W276 WeakPolarHBondContact O-CB 3.11Å; L273-W276 PolarHBondContact O-N 3.28Å; L273-F277 HydrophobicContact CB-CD2 4.19Å; L273-F277 HydrophobicContact CB-CE2 3.88Å; L273-F277 HydrophobicContact CD2-CZ 4.49Å; L273-F277 WeakPolarHBondContact O-CB 2.88Å; L273-F277 WeakPolarHBondContact O-CD2 3.25Å; L273-F277 VanDerWaalsContact O-CG 3.25Å; L273-F277 WeakPolarHBondContact O-CG 3.38Å; L273-F277 PolarHBondContact O-N 3.03Å
274W90.3Very high91.9Very high37 Ų3745.3 Ų45.314%0.1422%0.224CC..Hα-helixtrans-56.5-52.8175.6-174.552.4000112.9F197 W208 Y211 L215 F270 A271 F272 W276 F277 I278F197-W274 AromaticContact CE2-CD1 3.91Å; F197-W274 AromaticContact CE2-NE1 3.7Å; W208-W274 AromaticContact CD2-CD1 3.31Å; W208-W274 HydrophobicContact CD2-CG 4.23Å; W208-W274 AromaticContact CD2-NE1 3.69Å; W208-W274 AromaticContact CE2-CD1 3.97Å; W208-W274 HydrophobicContact CE3-CB 3.88Å; W208-W274 AromaticContact CE3-CD1 2.96Å; W208-W274 HydrophobicContact CE3-CD2 4.31Å; W208-W274 AromaticContact CE3-CG 3.45Å; W208-W274 HydrophobicContact CE3-CG 3.45Å; W208-W274 VanDerWaalsContact CE3-CG 3.45Å; W208-W274 AromaticContact CE3-NE1 3.55Å; W208-W274 AromaticContact CG-CD1 3.89Å; W208-W274 AromaticContact CG-NE1 3.76Å; W208-W274 HydrophobicContact CH2-CB 3.96Å; W208-W274 AromaticContact CH2-CD1 3.98Å; W208-W274 HydrophobicContact CH2-CG 4.3Å; W208-W274 HydrophobicContact CZ3-CB 3.34Å; W208-W274 AromaticContact CZ3-CD1 3.33Å; W208-W274 AromaticContact CZ3-CG 3.49Å; W208-W274 HydrophobicContact CZ3-CG 3.49Å; W208-W274 VanDerWaalsContact CZ3-CG 3.49Å; Y211-W274 HydrophobicContact CD1-CE3 4.07Å; Y211-W274 HydrophobicContact CD1-CZ3 4.29Å; Y211-W274 HydrophobicContact CE1-CE3 4.3Å; L215-W274 HydrophobicContact CD1-CH2 4.28Å; L215-W274 HydrophobicContact CD1-CZ3 3.69Å; F270-W274 VanDerWaalsContact O-CB 3.31Å; F270-W274 WeakPolarHBondContact O-CB 3.43Å; F270-W274 PolarHBondContact O-N 2.93Å; A271-W274 WeakPolarHBondContact O-CB 3.22Å; F272-W274 VanDerWaalsContact C-N 3.27Å; F272-W274 PolarHBondContact O-N 3.14Å; W274-W276 VanDerWaalsContact C-N 3.26Å; W274-W276 PolarHBondContact O-N 3.43Å; W274-F277 PolarHBondContact O-N 2.97Å; W274-I278 HydrophobicContact CD2-CD1 3.9Å; W274-I278 VanDerWaalsContact CE2-CD1 3.41Å; W274-I278 HydrophobicContact CG-CD1 4.27Å; W274-I278 HydrophobicContact CH2-CD1 4.31Å; W274-I278 HydrophobicContact CZ2-CD1 3.66Å; W274-I278 WeakPolarHBondContact O-CG1 3.41Å; W274-I278 PolarHBondContact O-N 3.08Å
275I91.2Very high92.4Very high105 Ų10543.6 Ų43.654%0.53822%0.219SC..Hα-helixtrans-62.5-42.1179.7-58.4175.7000109.1F272 I278 L279F272-I275 PolarHBondContact O-N 3.47Å; I275-I278 PolarHBondContact O-N 3.4Å; I275-L279 WeakPolarHBondContact O-CB 3.5Å; I275-L279 PolarHBondContact O-N 3.49Å
276W95Very high92.7Very high47 Ų4745.6 Ų45.618%0.17823%0.23CC..Hα-helixtrans-60.4-49177-175.7-95.3000112.5L26 V30 T31 L34 F272 L273 W274 I278 L279 V280L26-W276 HydrophobicContact CD1-CH2 3.63Å; L26-W276 HydrophobicContact CD1-CZ2 3.82Å; L26-W276 HydrophobicContact CG-CH2 4.42Å; L26-W276 HydrophobicContact CG-CZ2 4.21Å; V30-W276 HydrophobicContact CB-CZ2 4.17Å; V30-W276 HydrophobicContact CG1-CH2 3.64Å; V30-W276 HydrophobicContact CG1-CZ2 3.6Å; T31-W276 PolarHBondContact OG1-NE1 2.99Å; L34-W276 HydrophobicContact CD2-CB 4.37Å; L34-W276 HydrophobicContact CD2-CD2 3.8Å; L34-W276 HydrophobicContact CD2-CE3 4.48Å; L34-W276 HydrophobicContact CD2-CG 3.69Å; F272-W276 PolarHBondContact O-N 3.26Å; F272-W276 VanDerWaalsContact O-N 3.11Å; L273-W276 WeakPolarHBondContact O-CB 3.11Å; L273-W276 PolarHBondContact O-N 3.28Å; W274-W276 VanDerWaalsContact C-N 3.26Å; W274-W276 PolarHBondContact O-N 3.43Å; W276-I278 PolarHBondContact O-N 2.93Å; W276-L279 PolarHBondContact O-N 2.84Å; W276-V280 HydrophobicContact CD2-CG2 4.39Å; W276-V280 HydrophobicContact CG-CG2 4.47Å; W276-V280 HydrophobicContact CZ2-CG2 4.27Å; W276-V280 WeakPolarHBondContact O-CB 3.14Å; W276-V280 WeakPolarHBondContact O-CG2 3.26Å; W276-V280 PolarHBondContact O-N 2.94Å
277F94Very high92.9Very high7 Ų747.2 Ų47.23%0.03124%0.237CC..Hα-helixtrans-65.2-38.7-179.5-69-43000112.4T31 L35 F124 N196 L200 L273 W274 V280 A281T31-F277 HydrophobicContact CG2-CD1 4.44Å; T31-F277 HydrophobicContact CG2-CE1 3.92Å; L35-F277 HydrophobicContact CD2-CZ 3.99Å; F124-F277 AromaticContact CE2-CE1 3.99Å; F124-F277 HydrophobicContact CE2-CE1 3.99Å; F124-F277 HydrophobicContact CZ-CD1 4.06Å; F124-F277 AromaticContact CZ-CE1 3.77Å; F124-F277 HydrophobicContact CZ-CE1 3.77Å; N196-F277 WeakPolarHBondContact ND2-CE1 3.31Å; N196-F277 WeakPolarHBondContact ND2-CE2 3.35Å; N196-F277 VanDerWaalsContact ND2-CZ 3.31Å; N196-F277 WeakPolarHBondContact ND2-CZ 3.13Å; L200-F277 HydrophobicContact CD1-CD2 4.07Å; L200-F277 HydrophobicContact CD1-CE2 3.49Å; L200-F277 VanDerWaalsContact CD1-CE2 3.49Å; L200-F277 HydrophobicContact CD1-CZ 4.3Å; L273-F277 HydrophobicContact CB-CD2 4.19Å; L273-F277 HydrophobicContact CB-CE2 3.88Å; L273-F277 HydrophobicContact CD2-CZ 4.49Å; L273-F277 WeakPolarHBondContact O-CB 2.88Å; L273-F277 WeakPolarHBondContact O-CD2 3.25Å; L273-F277 VanDerWaalsContact O-CG 3.25Å; L273-F277 WeakPolarHBondContact O-CG 3.38Å; L273-F277 PolarHBondContact O-N 3.03Å; W274-F277 PolarHBondContact O-N 2.97Å; F277-V280 PolarHBondContact O-N 3.46Å; F277-A281 WeakPolarHBondContact O-CB 3.26Å; F277-A281 PolarHBondContact O-N 3.47Å
278I92.8Very high93.2Very high62 Ų6250.1 Ų50.132%0.31825%0.25SC..Hα-helixtrans-61.6-47.1173-70.6167.3000110.5F197 W274 I275 W276 V280 A281 M282F197-I278 HydrophobicContact CD2-CG1 4.49Å; F197-I278 HydrophobicContact CE2-CD1 4.27Å; F197-I278 HydrophobicContact CE2-CG1 3.91Å; W274-I278 HydrophobicContact CD2-CD1 3.9Å; W274-I278 VanDerWaalsContact CE2-CD1 3.41Å; W274-I278 HydrophobicContact CG-CD1 4.27Å; W274-I278 HydrophobicContact CH2-CD1 4.31Å; W274-I278 HydrophobicContact CZ2-CD1 3.66Å; W274-I278 WeakPolarHBondContact O-CG1 3.41Å; W274-I278 PolarHBondContact O-N 3.08Å; I275-I278 PolarHBondContact O-N 3.4Å; W276-I278 PolarHBondContact O-N 2.93Å; I278-V280 PolarHBondContact O-N 2.75Å; I278-A281 PolarHBondContact O-N 2.64Å; I278-M282 WeakPolarHBondContact O-CB 3.34Å; I278-M282 PolarHBondContact O-N 3.31Å
279L94.6Very high93.4Very high75 Ų7550 Ų5039%0.39325%0.253SS..Hα-helixtrans-60-46.7178.7177.9149.9000111.3L26 I275 W276 M282 L283L26-L279 HydrophobicContact CD2-CD2 4.1Å; I275-L279 WeakPolarHBondContact O-CB 3.5Å; I275-L279 PolarHBondContact O-N 3.49Å; W276-L279 PolarHBondContact O-N 2.84Å; L279-M282 PolarHBondContact O-N 2.82Å; L279-L283 HydrophobicContact CD2-CD1 3.6Å; L279-L283 HydrophobicContact CD2-CG 4.43Å; L279-L283 HydrophobicContact CG-CD1 4.3Å; L279-L283 WeakPolarHBondContact O-CG 3.44Å; L279-L283 PolarHBondContact O-N 3.12Å
280V95.1Very high93.5Very high3 Ų352.5 Ų52.52%0.01826%0.262CS..Hα-helixtrans-64.8-44.3179.5168.60000111.2L26 H27 W276 F277 I278 M282 L283 I284L26-V280 HydrophobicContact CD2-CG2 4.36Å; L26-V280 HydrophobicContact CG-CG2 4.47Å; H27-V280 HydrophobicContact CB-CG1 4.21Å; W276-V280 HydrophobicContact CD2-CG2 4.39Å; W276-V280 HydrophobicContact CG-CG2 4.47Å; W276-V280 HydrophobicContact CZ2-CG2 4.27Å; W276-V280 WeakPolarHBondContact O-CB 3.14Å; W276-V280 WeakPolarHBondContact O-CG2 3.26Å; W276-V280 PolarHBondContact O-N 2.94Å; F277-V280 PolarHBondContact O-N 3.46Å; I278-V280 PolarHBondContact O-N 2.75Å; V280-M282 VanDerWaalsContact C-N 3.34Å; V280-M282 PolarHBondContact O-N 2.65Å; V280-L283 PolarHBondContact O-N 3.48Å; V280-I284 HydrophobicContact CG1-CD1 3.84Å; V280-I284 WeakPolarHBondContact O-CG1 3.42Å; V280-I284 PolarHBondContact O-N 3.46Å
281A94.6Very high93.6Very high24 Ų2453 Ų5320%0.19826%0.264CS..Hα-helixtrans-61.4-41.5176.400000112F277 I278 S285F277-A281 WeakPolarHBondContact O-CB 3.26Å; F277-A281 PolarHBondContact O-N 3.47Å; I278-A281 PolarHBondContact O-N 2.64Å; A281-S285 VanDerWaalsContact O-CB 3.31Å; A281-S285 WeakPolarHBondContact O-CB 3.34Å; A281-S285 PolarHBondContact O-N 3.45Å; A281-S285 PolarHBondContact O-OG 2.88Å
282M95.7Very high93.7Very high125 Ų12556.2 Ų56.262%0.61628%0.279SS*.Hα-helixtrans-62.8-47.9176.3-174.3-168.2-62.400111.6I278 L279 V280 I284 S285 L286I278-M282 WeakPolarHBondContact O-CB 3.34Å; I278-M282 PolarHBondContact O-N 3.31Å; L279-M282 PolarHBondContact O-N 2.82Å; V280-M282 VanDerWaalsContact C-N 3.34Å; V280-M282 PolarHBondContact O-N 2.65Å; M282-I284 PolarHBondContact O-N 3.19Å; M282-S285 PolarHBondContact O-N 2.92Å; M282-L286 PolarHBondContact O-N 3.31Å
283L95.9Very high93.8Very high56 Ų5652.2 Ų52.229%0.29327%0.266SS..Hα-helixtrans-64.6-39.1-179.8-70.3176000112.3I23 L26 L279 V280 L286 K287I23-L283 HydrophobicContact CG2-CB 4.04Å; L26-L283 HydrophobicContact CD2-CD1 3.51Å; L279-L283 HydrophobicContact CD2-CD1 3.6Å; L279-L283 HydrophobicContact CD2-CG 4.43Å; L279-L283 HydrophobicContact CG-CD1 4.3Å; L279-L283 WeakPolarHBondContact O-CG 3.44Å; L279-L283 PolarHBondContact O-N 3.12Å; V280-L283 PolarHBondContact O-N 3.48Å; L283-L286 PolarHBondContact O-N 3.45Å; L283-K287 WeakPolarHBondContact O-CB 3.29Å; L283-K287 PolarHBondContact O-N 3.06Å
284I95.7Very high93.6Very high10 Ų1052.2 Ų52.25%0.05127%0.266CS..Hα-helixtrans-68.4-41.2175.7-68.9168.3000111.1I23 H27 N189 L190 S193 V280 M282 L286 K287 F288I23-I284 HydrophobicContact CG2-CG1 3.96Å; H27-I284 HydrophobicContact CB-CD1 3.71Å; H27-I284 HydrophobicContact CB-CG1 4.45Å; H27-I284 WeakPolarHBondContact CD2-CD1 3.46Å; H27-I284 VanDerWaalsContact CG-CD1 3.45Å; N189-I284 HydrophobicContact CB-CD1 4.15Å; N189-I284 HydrophobicContact CB-CG2 4.28Å; L190-I284 HydrophobicContact CB-CG2 3.86Å; L190-I284 HydrophobicContact CD1-CG2 4.08Å; S193-I284 WeakPolarHBondContact OG-CD1 3.49Å; V280-I284 HydrophobicContact CG1-CD1 3.84Å; V280-I284 WeakPolarHBondContact O-CG1 3.42Å; V280-I284 PolarHBondContact O-N 3.46Å; M282-I284 PolarHBondContact O-N 3.19Å; I284-L286 VanDerWaalsContact C-N 3.33Å; I284-L286 PolarHBondContact O-N 3.13Å; I284-K287 WeakPolarHBondContact O-CB 3.37Å; I284-K287 PolarHBondContact O-N 2.96Å; I284-K287 VanDerWaalsContact O-N 3.16Å; I284-F288 WeakPolarHBondContact O-CB 3.35Å; I284-F288 PolarHBondContact O-N 2.89Å
285S94.9Very high93.6Very high47 Ų4753.6 Ų53.633%0.32928%0.278SS..Hα-helixtrans-59.6-45.6175.5-59.90000110.8L190 A281 M282 K287 F288 L289L190-S285 WeakPolarHBondContact CD1-OG 3.39Å; A281-S285 VanDerWaalsContact O-CB 3.31Å; A281-S285 WeakPolarHBondContact O-CB 3.34Å; A281-S285 PolarHBondContact O-N 3.45Å; A281-S285 PolarHBondContact O-OG 2.88Å; M282-S285 PolarHBondContact O-N 2.92Å; S285-K287 VanDerWaalsContact C-N 3.33Å; S285-K287 PolarHBondContact O-N 3.27Å; S285-F288 PolarHBondContact O-N 2.9Å; S285-L289 WeakPolarHBondContact O-CG 3.43Å; S285-L289 PolarHBondContact O-N 3.38Å
286L95.6Very high93.5Very high108 Ų10853.7 Ų53.757%0.56528%0.279SS*.Hα-helixtrans-61.6-40.5175-178.361.3000112.1M282 L283 I284 L289 Y290M282-L286 PolarHBondContact O-N 3.31Å; L283-L286 PolarHBondContact O-N 3.45Å; I284-L286 VanDerWaalsContact C-N 3.33Å; I284-L286 PolarHBondContact O-N 3.13Å; L286-L289 PolarHBondContact O-N 3.09Å; L286-Y290 WeakPolarHBondContact O-CB 3.42Å; L286-Y290 PolarHBondContact O-N 2.97Å
287K93.5Very high93.3Very high34 Ų3458.4 Ų58.415%0.14830%0.298CS..Hα-helixtrans-63.7-41.7176.3-179.158.2175.3-1720112D21 I23 E186 L283 I284 S285 Y290 R291D21-K287 WeakPolarHBondContact OD2-CE 3.48Å; D21-K287 IonicContact OD2-NZ 2.78Å; D21-K287 PolarHBondContact OD2-NZ 3.24Å; I23-K287 HydrophobicContact CD1-CB 3.94Å; I23-K287 HydrophobicContact CD1-CD 4.37Å; I23-K287 HydrophobicContact CD1-CG 4.45Å; I23-K287 HydrophobicContact CG2-CB 4.29Å; E186-K287 VanDerWaalsContact OE1-CE 3.25Å; E186-K287 WeakPolarHBondContact OE1-CE 3.42Å; L283-K287 WeakPolarHBondContact O-CB 3.29Å; L283-K287 PolarHBondContact O-N 3.06Å; I284-K287 WeakPolarHBondContact O-CB 3.37Å; I284-K287 PolarHBondContact O-N 2.96Å; I284-K287 VanDerWaalsContact O-N 3.16Å; S285-K287 VanDerWaalsContact C-N 3.33Å; S285-K287 PolarHBondContact O-N 3.27Å; K287-Y290 HydrophobicContact CD-CD1 4.19Å; K287-Y290 WeakPolarHBondContact O-CB 3.22Å; K287-Y290 PolarHBondContact O-N 3.36Å; K287-R291 PolarHBondContact O-N 3.36Å
288F93.2Very high92.8Very high62 Ų6261.9 Ų61.927%0.27232%0.321SS..Hα-helixtrans-64.8-43.5176.3-177.4-99.4000111.4I187 L190 I284 S285 Y290 R291 L292I187-F288 HydrophobicContact CG1-CE2 3.79Å; L190-F288 HydrophobicContact CD2-CB 4.4Å; L190-F288 HydrophobicContact CD2-CD1 4.12Å; L190-F288 HydrophobicContact CD2-CD2 4.45Å; L190-F288 HydrophobicContact CD2-CG 4.06Å; I284-F288 WeakPolarHBondContact O-CB 3.35Å; I284-F288 PolarHBondContact O-N 2.89Å; S285-F288 PolarHBondContact O-N 2.9Å; F288-Y290 PolarHBondContact O-N 3.31Å; F288-R291 WeakPolarHBondContact O-CB 3.41Å; F288-R291 PolarHBondContact O-N 3.19Å; F288-R291 VanDerWaalsContact O-N 3.12Å; F288-L292 PolarHBondContact O-N 2.82Å
289L93.8Very high92.4Very high103 Ų10361.4 Ų61.454%0.53933%0.332SS..Hα-helixtrans-60.6-43.2173.5-70.3173.9000112S285 L286 R291 L292 A293S285-L289 WeakPolarHBondContact O-CG 3.43Å; S285-L289 PolarHBondContact O-N 3.38Å; L286-L289 PolarHBondContact O-N 3.09Å; L289-R291 VanDerWaalsContact C-N 3.31Å; L289-R291 PolarHBondContact O-N 2.98Å; L289-L292 PolarHBondContact O-N 3.28Å; L289-A293 WeakPolarHBondContact O-CB 3.3Å; L289-A293 PolarHBondContact O-N 2.87Å
290Y92.8Very high92Very high79 Ų7960.7 Ų60.731%0.3133%0.327SS..Hα-helixtrans-58.8-42.7173164.1-92.8000111.6L286 K287 F288 A293 T294 L304L286-Y290 WeakPolarHBondContact O-CB 3.42Å; L286-Y290 PolarHBondContact O-N 2.97Å; K287-Y290 HydrophobicContact CD-CD1 4.19Å; K287-Y290 WeakPolarHBondContact O-CB 3.22Å; K287-Y290 PolarHBondContact O-N 3.36Å; F288-Y290 PolarHBondContact O-N 3.31Å; Y290-A293 PolarHBondContact O-N 3.32Å; Y290-T294 HydrophobicContact CD2-CG2 4.41Å; Y290-T294 HydrophobicContact CE1-CG2 4.11Å; Y290-T294 HydrophobicContact CE2-CG2 3.97Å; Y290-T294 VanDerWaalsContact O-CG2 3.24Å; Y290-T294 WeakPolarHBondContact O-CG2 3.41Å; Y290-T294 PolarHBondContact O-N 3.47Å; Y290-L304 HydrophobicContact CE2-CD2 3.88Å; Y290-L304 WeakPolarHBondContact OH-CD2 3.47Å
291R92.4Very high91.6Very high11 Ų1163.2 Ų63.24%0.04234%0.336CS..Hα-helixtrans-62.5-49.1176.3178.763.763.1-147.2-9.1111V183 E186 K287 F288 L289 A293 T294 V295V183-R291 HydrophobicContact CG2-CG 4.34Å; E186-R291 IonicContact OE1-CZ 3.48Å; E186-R291 IonicContact OE1-NE 3.25Å; E186-R291 IonicContact OE1-NH2 3.14Å; E186-R291 PolarHBondContact OE1-NH2 3.09Å; E186-R291 WeakPolarHBondContact OE2-CG 3.24Å; E186-R291 IonicContact OE2-CZ 2.72Å; E186-R291 IonicContact OE2-NE 2.78Å; E186-R291 PolarHBondContact OE2-NE 3Å; E186-R291 IonicContact OE2-NH2 3.56Å; K287-R291 PolarHBondContact O-N 3.36Å; F288-R291 WeakPolarHBondContact O-CB 3.41Å; F288-R291 PolarHBondContact O-N 3.19Å; F288-R291 VanDerWaalsContact O-N 3.12Å; L289-R291 VanDerWaalsContact C-N 3.31Å; L289-R291 PolarHBondContact O-N 2.98Å; R291-A293 VanDerWaalsContact C-N 3.29Å; R291-A293 PolarHBondContact O-N 3.11Å; R291-T294 PolarHBondContact O-N 3.27Å; R291-T294 VanDerWaalsContact O-N 3.08Å; R291-T294 PolarHBondContact O-OG1 2.66Å; R291-V295 WeakPolarHBondContact O-CG2 3.32Å; R291-V295 PolarHBondContact O-N 3.4Å
292L92.2Very high91.1Very high77 Ų7763.9 Ų63.940%0.40334%0.337SS..Hα-helixtrans-56.2-45.6177.8-17861.8000111.1F288 L289 T294 V295 L296F288-L292 PolarHBondContact O-N 2.82Å; L289-L292 PolarHBondContact O-N 3.28Å; L292-T294 VanDerWaalsContact C-N 3.34Å; L292-T294 PolarHBondContact O-N 3.31Å; L292-V295 PolarHBondContact O-N 3.18Å; L292-L296 HydrophobicContact CD1-CD1 3.88Å; L292-L296 HydrophobicContact CD1-CG 4.12Å; L292-L296 HydrophobicContact CG-CD1 3.85Å; L292-L296 HydrophobicContact CG-CG 4.42Å; L292-L296 WeakPolarHBondContact O-CG 3.43Å; L292-L296 PolarHBondContact O-N 3.48Å
293A92.5Very high90.7Very high24 Ų2464.7 Ų64.720%0.19834%0.339CS..Hα-helixtrans-60.7-40.5176.100000112.3L289 Y290 R291 V295 L296 Y297 M300L289-A293 WeakPolarHBondContact O-CB 3.3Å; L289-A293 PolarHBondContact O-N 2.87Å; Y290-A293 PolarHBondContact O-N 3.32Å; R291-A293 VanDerWaalsContact C-N 3.29Å; R291-A293 PolarHBondContact O-N 3.11Å; A293-V295 VanDerWaalsContact C-N 3.3Å; A293-V295 PolarHBondContact O-N 2.97Å; A293-L296 PolarHBondContact O-N 3.32Å; A293-Y297 WeakPolarHBondContact O-CB 3.24Å; A293-Y297 WeakPolarHBondContact O-CD2 3.2Å; A293-Y297 PolarHBondContact O-N 3.28Å; A293-M300 HydrophobicContact CB-CE 3.95Å; A293-M300 HydrophobicContact CB-SD 3.76Å
294T90.4Very high90.3Very high0 Ų064 Ų640%034%0.335CS..Hα-helixtrans-67.5-28.8177.463.50000113.5Y290 R291 L292 R301 W329Y290-T294 HydrophobicContact CD2-CG2 4.41Å; Y290-T294 HydrophobicContact CE1-CG2 4.11Å; Y290-T294 HydrophobicContact CE2-CG2 3.97Å; Y290-T294 VanDerWaalsContact O-CG2 3.24Å; Y290-T294 WeakPolarHBondContact O-CG2 3.41Å; Y290-T294 PolarHBondContact O-N 3.47Å; R291-T294 PolarHBondContact O-N 3.27Å; R291-T294 VanDerWaalsContact O-N 3.08Å; R291-T294 PolarHBondContact O-OG1 2.66Å; L292-T294 VanDerWaalsContact C-N 3.34Å; L292-T294 PolarHBondContact O-N 3.31Å; T294-R301 WeakPolarHBondContact O-CG 3.49Å; T294-W329 HydrophobicContact CG2-CH2 4.16Å
295V89.4Confident89.9Confident67 Ų6763.6 Ų63.641%0.40633%0.333SS..Hα-helixtrans-76.8-45.4176.7173.90000110.8F179 R291 L292 A293 F326F179-V295 HydrophobicContact CZ-CG2 4.08Å; R291-V295 WeakPolarHBondContact O-CG2 3.32Å; R291-V295 PolarHBondContact O-N 3.4Å; L292-V295 PolarHBondContact O-N 3.18Å; A293-V295 VanDerWaalsContact C-N 3.3Å; A293-V295 PolarHBondContact O-N 2.97Å; V295-F326 HydrophobicContact CB-CE2 4.43Å; V295-F326 HydrophobicContact CB-CZ 4.48Å; V295-F326 HydrophobicContact CG2-CE1 4.35Å; V295-F326 HydrophobicContact CG2-CE2 4.05Å; V295-F326 HydrophobicContact CG2-CZ 3.63Å
296L90.4Very high89.4Confident107 Ų10767 Ų6756%0.5634%0.339SS*.Hα-helixtrans-74.6-33.4-177.2-64.8175.7000113.4L292 A293 P298L292-L296 HydrophobicContact CD1-CD1 3.88Å; L292-L296 HydrophobicContact CD1-CG 4.12Å; L292-L296 HydrophobicContact CG-CD1 3.85Å; L292-L296 HydrophobicContact CG-CG 4.42Å; L292-L296 WeakPolarHBondContact O-CG 3.43Å; L292-L296 PolarHBondContact O-N 3.48Å; A293-L296 PolarHBondContact O-N 3.32Å; L296-P298 VanDerWaalsContact O-CD 3.32Å; L296-P298 WeakPolarHBondContact O-CD 3.47Å
297Y89.9Confident89Confident145 Ų14565.4 Ų65.457%0.56934%0.341SS*.  trans-114.499.7-172.8-62.2-74.1000112.8A293 G299 M300A293-Y297 WeakPolarHBondContact O-CB 3.24Å; A293-Y297 WeakPolarHBondContact O-CD2 3.2Å; A293-Y297 PolarHBondContact O-N 3.28Å; Y297-G299 PolarHBondContact O-N 3.35Å; Y297-M300 HydrophobicContact CD2-SD 4.21Å; Y297-M300 HydrophobicContact CG-SD 4.47Å; Y297-M300 PolarHBondContact O-N 3.28Å
298P83.5Confident88.6Confident80 Ų8067.3 Ų67.352%0.51935%0.348SS..Hα-helixtrans-56-33173.3-24.732.7000114.2L296 M300 R301 L302L296-P298 VanDerWaalsContact O-CD 3.32Å; L296-P298 WeakPolarHBondContact O-CD 3.47Å; P298-M300 VanDerWaalsContact C-N 3.31Å; P298-M300 PolarHBondContact O-N 3.23Å; P298-R301 WeakPolarHBondContact O-CB 3.01Å; P298-R301 PolarHBondContact O-N 3.13Å; P298-L302 PolarHBondContact O-N 3.45Å
299G83.6Confident88Confident52 Ų5264.4 Ų64.454%0.53634%0.335SS..Hα-helixtrans-61.7-36.7178.700000113.3Y297 R301 L302 Q303Y297-G299 PolarHBondContact O-N 3.35Å; G299-R301 VanDerWaalsContact C-N 3.34Å; G299-R301 PolarHBondContact O-N 3.39Å; G299-L302 PolarHBondContact O-N 3.28Å; G299-Q303 PolarHBondContact O-N 3.48Å; G299-Q303 VanDerWaalsContact O-N 3.13Å
300M85.9Confident87.2Confident61 Ų6167.2 Ų67.230%0.334%0.338SS..Hα-helixtrans-64-40.6176.2-70.1-176.667.600111.3A293 Y297 P298 L302 Q303 L304A293-M300 HydrophobicContact CB-CE 3.95Å; A293-M300 HydrophobicContact CB-SD 3.76Å; Y297-M300 HydrophobicContact CD2-SD 4.21Å; Y297-M300 HydrophobicContact CG-SD 4.47Å; Y297-M300 PolarHBondContact O-N 3.28Å; P298-M300 VanDerWaalsContact C-N 3.31Å; P298-M300 PolarHBondContact O-N 3.23Å; M300-L302 VanDerWaalsContact C-N 3.31Å; M300-L302 PolarHBondContact O-N 2.95Å; M300-Q303 PolarHBondContact O-N 3.18Å; M300-Q303 VanDerWaalsContact O-N 3.16Å; M300-L304 HydrophobicContact CB-CD1 4.3Å; M300-L304 WeakPolarHBondContact O-CD1 3.01Å; M300-L304 PolarHBondContact O-N 3.03Å
301R86.8Confident86.4Confident55 Ų5573.2 Ų73.221%0.20837%0.366CS..Hα-helixtrans-57.7-43.5178.9-68-171.2-81.4153.3-0.2112.4T294 P298 G299 L305 W329T294-R301 WeakPolarHBondContact O-CG 3.49Å; P298-R301 WeakPolarHBondContact O-CB 3.01Å; P298-R301 PolarHBondContact O-N 3.13Å; G299-R301 VanDerWaalsContact C-N 3.34Å; G299-R301 PolarHBondContact O-N 3.39Å; R301-L305 PolarHBondContact O-N 2.87Å; R301-L305 VanDerWaalsContact O-N 3.14Å; R301-W329 HydrophobicContact CB-CD2 4.22Å; R301-W329 HydrophobicContact CB-CG 4.5Å; R301-W329 HydrophobicContact CB-CZ2 3.92Å; R301-W329 HydrophobicContact CG-CD2 4Å; R301-W329 HydrophobicContact CG-CE3 4.29Å; R301-W329 HydrophobicContact CG-CH2 4.06Å; R301-W329 HydrophobicContact CG-CZ2 3.75Å; R301-W329 HydrophobicContact CG-CZ3 4.31Å; R301-W329 PolarHBondContact O-NE1 3.09Å
302L85.6Confident85.8Confident39 Ų3973.1 Ų73.120%0.20437%0.366CS..Hα-helixtrans-67.1-42.5177.2-174.169.1000111.6P298 G299 M300 L305 R306 L317 Q318 L321P298-L302 PolarHBondContact O-N 3.45Å; G299-L302 PolarHBondContact O-N 3.28Å; M300-L302 VanDerWaalsContact C-N 3.31Å; M300-L302 PolarHBondContact O-N 2.95Å; L302-L305 PolarHBondContact O-N 2.81Å; L302-R306 WeakPolarHBondContact O-CB 3.49Å; L302-R306 PolarHBondContact O-N 3.47Å; L302-L317 HydrophobicContact CD1-CB 4.21Å; L302-L317 HydrophobicContact CD1-CD2 3.51Å; L302-L317 HydrophobicContact CD1-CG 3.66Å; L302-L317 HydrophobicContact CG-CD2 4.31Å; L302-Q318 HydrophobicContact CD1-CG 4.21Å; L302-Q318 HydrophobicContact CD2-CG 3.95Å; L302-L321 HydrophobicContact CD1-CD1 3.84Å
303Q86.6Confident85.4Confident142 Ų14272.5 Ų72.566%0.66437%0.367SS*.Hα-helixtrans-65.2-40.4179.5-173.9171.3-600112.2G299 M300 R306 A307G299-Q303 PolarHBondContact O-N 3.48Å; G299-Q303 VanDerWaalsContact O-N 3.13Å; M300-Q303 PolarHBondContact O-N 3.18Å; M300-Q303 VanDerWaalsContact O-N 3.16Å; Q303-R306 PolarHBondContact O-N 3.02Å; Q303-A307 WeakPolarHBondContact O-CB 2.94Å; Q303-A307 PolarHBondContact O-N 3.25Å
304L87.7Confident84.9Confident42 Ų4277.2 Ų77.222%0.2238%0.383CS..Hα-helixtrans-64.9-43.3175.8-9094.1000112.6Y290 M300 R306 A307 R308 M333Y290-L304 HydrophobicContact CE2-CD2 3.88Å; Y290-L304 WeakPolarHBondContact OH-CD2 3.47Å; M300-L304 HydrophobicContact CB-CD1 4.3Å; M300-L304 WeakPolarHBondContact O-CD1 3.01Å; M300-L304 PolarHBondContact O-N 3.03Å; L304-R306 VanDerWaalsContact C-N 3.34Å; L304-A307 PolarHBondContact O-N 2.93Å; L304-R308 PolarHBondContact O-N 3.31Å; L304-M333 HydrophobicContact CB-CE 4.36Å; L304-M333 HydrophobicContact CD2-CE 4.39Å
305L86.1Confident84.6Confident0 Ų085 Ų850%042%0.417CS..Hα-helixtrans-61.7-44.1174.6-83.8173.8000111.4R301 L302 A307 R308 A309 L317 L321 L332 M333 F344R301-L305 PolarHBondContact O-N 2.87Å; R301-L305 VanDerWaalsContact O-N 3.14Å; L302-L305 PolarHBondContact O-N 2.81Å; L305-A307 PolarHBondContact O-N 3.04Å; L305-R308 PolarHBondContact O-N 2.88Å; L305-R308 VanDerWaalsContact O-N 3.14Å; L305-A309 VanDerWaalsContact O-CB 3.26Å; L305-A309 WeakPolarHBondContact O-CB 3.46Å; L305-A309 PolarHBondContact O-N 3.47Å; L305-L317 HydrophobicContact CB-CD1 4.4Å; L305-L317 HydrophobicContact CB-CD2 3.97Å; L305-L321 HydrophobicContact CD1-CD1 3.44Å; L305-L321 VanDerWaalsContact CD1-CD1 3.44Å; L305-L321 HydrophobicContact CD1-CD2 3.66Å; L305-L321 HydrophobicContact CD1-CG 4.15Å; L305-L332 HydrophobicContact CD2-CD2 4.21Å; L305-M333 HydrophobicContact CD2-CG 4.2Å; L305-M333 HydrophobicContact CD2-SD 3.5Å; L305-M333 WeakPolarHBondContact CD2-SD 3.49Å; L305-M333 HydrophobicContact CG-SD 3.93Å; L305-F344 HydrophobicContact CD2-CE1 4.02Å; L305-F344 HydrophobicContact CD2-CZ 3.63Å
306R86.1Confident84.3Confident118 Ų11885.6 Ų85.645%0.44542%0.415SS..Hα-helixtrans-61.2-41.9176.4179-178.1164133.7-3.6112.5L302 Q303 L304 R308 A309 L317L302-R306 WeakPolarHBondContact O-CB 3.49Å; L302-R306 PolarHBondContact O-N 3.47Å; Q303-R306 PolarHBondContact O-N 3.02Å; L304-R306 VanDerWaalsContact C-N 3.34Å; R306-R308 PolarHBondContact O-N 3.29Å; R306-A309 PolarHBondContact O-N 3.37Å; R306-L317 HydrophobicContact CB-CD2 4.04Å
307A86.1Confident84Confident76 Ų7680.6 Ų80.663%0.62839%0.389SS*.Hα-helixtrans-60.3-31.3178.100000111.6Q303 L304 L305Q303-A307 WeakPolarHBondContact O-CB 2.94Å; Q303-A307 PolarHBondContact O-N 3.25Å; L304-A307 PolarHBondContact O-N 2.93Å; L305-A307 PolarHBondContact O-N 3.04Å
308R84.5Confident83.8Confident74 Ų7479 Ų7928%0.27939%0.387SS..Hα-helixtrans-86-40.4178.7-158.1165.8-168.197.916.7113.3L304 L305 R306 R310 G336 N337 F344L304-R308 PolarHBondContact O-N 3.31Å; L305-R308 PolarHBondContact O-N 2.88Å; L305-R308 VanDerWaalsContact O-N 3.14Å; R306-R308 PolarHBondContact O-N 3.29Å; R308-R310 PolarHBondContact O-N 3.44Å; R308-G336 VanDerWaalsContact CZ-C 3.48Å; R308-G336 PolarHBondContact NE-O 3.03Å; R308-G336 PolarHBondContact NH2-O 2.99Å; R308-N337 PolarHBondContact NH1-OD1 3.23Å; R308-F344 HydrophobicContact CB-CD1 4.24Å; R308-F344 HydrophobicContact CB-CE1 4.04Å; R308-F344 HydrophobicContact CG-CD1 3.92Å; R308-F344 HydrophobicContact CG-CE1 4.05Å
309A81.6Confident83.8Confident0 Ų077.6 Ų77.60%038%0.377CS..SBendtrans-82.245-179.200000113.1L305 R306 F311 M312 F344 L348L305-A309 VanDerWaalsContact O-CB 3.26Å; L305-A309 WeakPolarHBondContact O-CB 3.46Å; L305-A309 PolarHBondContact O-N 3.47Å; R306-A309 PolarHBondContact O-N 3.37Å; A309-F311 PolarHBondContact O-N 2.9Å; A309-M312 HydrophobicContact CB-CB 4.42Å; A309-M312 WeakPolarHBondContact O-CB 3.45Å; A309-M312 PolarHBondContact O-N 3.48Å; A309-M312 VanDerWaalsContact O-N 3.13Å; A309-F344 HydrophobicContact CB-CD1 4.43Å; A309-F344 HydrophobicContact CB-CE1 4.42Å; A309-L348 HydrophobicContact CB-CD1 3.33Å
310R76.5Confident83.7Confident162 Ų16275.2 Ų75.261%0.61135%0.352SS*.THydrogen-bonded Turntrans-30.9126.2-171.8-70.9-177.8174.9174.5-3112.9R308 R345R308-R310 PolarHBondContact O-N 3.44Å; R310-R345 WeakPolarHBondContact O-CD 3.42Å
311F76.3Confident83.5Confident205 Ų20573.8 Ų73.890%0.89935%0.346SS*.THydrogen-bonded Turntrans74.86.6177-50.3-77.3000118.1A309A309-F311 PolarHBondContact O-N 2.9Å
312M79Confident83.1Confident9 Ų980 Ų804%0.04437%0.369CS..  trans-78.7133.5171.7-160.9-177.4-156.500112.6A309 H316 L317 L348 E349A309-M312 HydrophobicContact CB-CB 4.42Å; A309-M312 WeakPolarHBondContact O-CB 3.45Å; A309-M312 PolarHBondContact O-N 3.48Å; A309-M312 VanDerWaalsContact O-N 3.13Å; M312-H316 HydrophobicContact CE-CB 3.94Å; M312-H316 HydrophobicContact CG-CB 4.43Å; M312-L317 HydrophobicContact SD-CB 4.29Å; M312-L317 HydrophobicContact SD-CD1 4.1Å; M312-L348 HydrophobicContact CE-CB 4.05Å; M312-L348 HydrophobicContact SD-CB 3.91Å; M312-L348 HydrophobicContact SD-CD1 4.46Å; M312-E349 HydrophobicContact CE-CG 3.97Å
313P84.4Confident82.7Confident65 Ų6582.5 Ų82.542%0.42238%0.382SS..  trans-68.8146.5177.125.8-32.3000112.3K315 H316 L317P313-K315 PolarHBondContact O-N 3.04Å; P313-H316 HydrophobicContact CG-CB 4.14Å; P313-H316 PolarHBondContact O-N 2.92Å; P313-L317 PolarHBondContact O-N 2.79Å
314K83.2Confident82.4Confident122 Ų12277.3 Ų77.353%0.5336%0.362SS..Hα-helixtrans-56.8-38.1-176-61.1-169.2178.2176.60112.6L317 Q318K314-L317 PolarHBondContact O-N 2.52Å; K314-Q318 WeakPolarHBondContact O-CG 3.14Å; K314-Q318 PolarHBondContact O-N 3.43Å
315K83.5Confident82.3Confident165 Ų16577 Ų7772%0.71736%0.363SS*.Hα-helixtrans-63.1-44.8-177.1-66.2-175.4177.7-177.50111.5P313 L317 Q318 V319P313-K315 PolarHBondContact O-N 3.04Å; K315-L317 VanDerWaalsContact C-N 3.33Å; K315-L317 PolarHBondContact O-N 3.49Å; K315-Q318 PolarHBondContact O-N 2.86Å; K315-V319 WeakPolarHBondContact O-CG2 3.45Å; K315-V319 PolarHBondContact O-N 3.33Å; K315-V319 VanDerWaalsContact O-N 3.11Å
316H83.9Confident82.2Confident78 Ų7878.8 Ų78.836%0.36137%0.371SS..Hα-helixtrans-66.5-39.1179.6-62.6-166.5000110.9M312 P313 V319 A320 Y352M312-H316 HydrophobicContact CE-CB 3.94Å; M312-H316 HydrophobicContact CG-CB 4.43Å; P313-H316 HydrophobicContact CG-CB 4.14Å; P313-H316 PolarHBondContact O-N 2.92Å; H316-V319 PolarHBondContact O-N 2.85Å; H316-A320 WeakPolarHBondContact O-CB 3.01Å; H316-A320 PolarHBondContact O-N 2.91Å; H316-Y352 HydrophobicContact CB-CD2 3.98Å; H316-Y352 HydrophobicContact CB-CE2 4.12Å; H316-Y352 HydrophobicContact CB-CG 4.33Å; H316-Y352 WeakPolarHBondContact O-CD2 3.32Å
317L83.7Confident82.2Confident3 Ų373.2 Ų73.22%0.01635%0.35CS..Hα-helixtrans-66.8-37.1177.4-170.364.1000112.5L302 L305 R306 M312 P313 K314 K315 L321 L348L302-L317 HydrophobicContact CD1-CB 4.21Å; L302-L317 HydrophobicContact CD1-CD2 3.51Å; L302-L317 HydrophobicContact CD1-CG 3.66Å; L302-L317 HydrophobicContact CG-CD2 4.31Å; L305-L317 HydrophobicContact CB-CD1 4.4Å; L305-L317 HydrophobicContact CB-CD2 3.97Å; R306-L317 HydrophobicContact CB-CD2 4.04Å; M312-L317 HydrophobicContact SD-CB 4.29Å; M312-L317 HydrophobicContact SD-CD1 4.1Å; P313-L317 PolarHBondContact O-N 2.79Å; K314-L317 PolarHBondContact O-N 2.52Å; K315-L317 VanDerWaalsContact C-N 3.33Å; K315-L317 PolarHBondContact O-N 3.49Å; L317-L321 HydrophobicContact CD1-CD1 4.1Å; L317-L321 HydrophobicContact CD1-CG 4.45Å; L317-L321 HydrophobicContact CG-CD1 3.89Å; L317-L321 WeakPolarHBondContact O-CB 3.28Å; L317-L321 WeakPolarHBondContact O-CD1 3.11Å; L317-L321 WeakPolarHBondContact O-CG 3.19Å; L317-L321 PolarHBondContact O-N 2.85Å; L317-L348 HydrophobicContact CD1-CD1 4.05Å; L317-L348 HydrophobicContact CD1-CD2 4.18Å
318Q84.8Confident82.3Confident111 Ų11170 Ų7052%0.51932%0.322SS..Hα-helixtrans-65.5-39.4174.8-77.4176.3-28.500112.1L302 K314 K315 L321 R322L302-Q318 HydrophobicContact CD1-CG 4.21Å; L302-Q318 HydrophobicContact CD2-CG 3.95Å; K314-Q318 WeakPolarHBondContact O-CG 3.14Å; K314-Q318 PolarHBondContact O-N 3.43Å; K315-Q318 PolarHBondContact O-N 2.86Å; Q318-L321 PolarHBondContact O-N 2.83Å; Q318-R322 PolarHBondContact O-N 2.77Å
319V83.3Confident82.6Confident51 Ų5166.9 Ų66.931%0.30931%0.31SS..Hα-helixtrans-66-48.9176.6174.20000110.4K315 H316 L321 R322 Y352 Q355K315-V319 WeakPolarHBondContact O-CG2 3.45Å; K315-V319 PolarHBondContact O-N 3.33Å; K315-V319 VanDerWaalsContact O-N 3.11Å; H316-V319 PolarHBondContact O-N 2.85Å; V319-L321 PolarHBondContact O-N 2.84Å; V319-L321 VanDerWaalsContact O-N 3.14Å; V319-R322 VanDerWaalsContact O-CB 3.28Å; V319-R322 WeakPolarHBondContact O-CB 3.35Å; V319-R322 PolarHBondContact O-N 3.22Å; V319-Y352 HydrophobicContact CB-CD2 3.85Å; V319-Y352 HydrophobicContact CB-CE2 3.81Å; V319-Y352 HydrophobicContact CG1-CD2 3.79Å; V319-Y352 HydrophobicContact CG1-CE2 3.74Å; V319-Y352 HydrophobicContact CG2-CE2 4.32Å; V319-Q355 PolarHBondContact O-OE1 2.87Å
320A81.4Confident83.1Confident2 Ų267 Ų672%0.01731%0.311CS..Hα-helixtrans-61.1-23.8179.100000114.4H316 Q355H316-A320 WeakPolarHBondContact O-CB 3.01Å; H316-A320 PolarHBondContact O-N 2.91Å; A320-Q355 VanDerWaalsContact C-OE1 3.26Å; A320-Q355 PolarHBondContact O-NE2 2.97Å; A320-Q355 PolarHBondContact O-OE1 2.74Å; A320-Q355 VanDerWaalsContact O-OE1 3.08Å
321L82.1Confident83.8Confident31 Ų3159.5 Ų59.516%0.16228%0.283CS..THydrogen-bonded Turntrans-98.8-1179.9-65.8170.6000113.3L302 L305 L317 Q318 V319 N323 C324 L332L302-L321 HydrophobicContact CD1-CD1 3.84Å; L305-L321 HydrophobicContact CD1-CD1 3.44Å; L305-L321 VanDerWaalsContact CD1-CD1 3.44Å; L305-L321 HydrophobicContact CD1-CD2 3.66Å; L305-L321 HydrophobicContact CD1-CG 4.15Å; L317-L321 HydrophobicContact CD1-CD1 4.1Å; L317-L321 HydrophobicContact CD1-CG 4.45Å; L317-L321 HydrophobicContact CG-CD1 3.89Å; L317-L321 WeakPolarHBondContact O-CB 3.28Å; L317-L321 WeakPolarHBondContact O-CD1 3.11Å; L317-L321 WeakPolarHBondContact O-CG 3.19Å; L317-L321 PolarHBondContact O-N 2.85Å; Q318-L321 PolarHBondContact O-N 2.83Å; V319-L321 PolarHBondContact O-N 2.84Å; V319-L321 VanDerWaalsContact O-N 3.14Å; L321-N323 PolarHBondContact O-N 3.35Å; L321-C324 HydrophobicContact CD2-CB 4.2Å; L321-C324 PolarHBondContact O-N 2.79Å; L321-C324 VanDerWaalsContact O-N 3.09Å; L321-L332 HydrophobicContact CD2-CD2 4.39Å
322R78.9Confident84.4Confident185 Ų18549.9 Ų49.970%0.69824%0.241SC*.THydrogen-bonded Turntrans-58.6-36.6-171.9-167.8178.882.1-170.52.4112.4Q318 V319Q318-R322 PolarHBondContact O-N 2.77Å; V319-R322 VanDerWaalsContact O-CB 3.28Å; V319-R322 WeakPolarHBondContact O-CB 3.35Å; V319-R322 PolarHBondContact O-N 3.22Å
323N77.3Confident84.9Confident91 Ų9150.4 Ų50.449%0.48724%0.244SC..THydrogen-bonded Turntrans-100.50.6-179-68.7-6.5000113.7L321L321-N323 PolarHBondContact O-N 3.35Å
324C79.6Confident85.2Confident34 Ų3447.8 Ų47.823%0.2323%0.225CC..  trans-82.7121.1-177.2-71.60000111.2L321 D328L321-C324 HydrophobicContact CD2-CB 4.2Å; L321-C324 PolarHBondContact O-N 2.79Å; L321-C324 VanDerWaalsContact O-N 3.09Å; C324-D328 HydrophobicContact CB-CB 4.13Å
325S85.1Confident85.4Confident36 Ų3642 Ų4225%0.25220%0.2SC..  trans-68.4171169.873.60000111.5G327 D328 W329S325-G327 VanDerWaalsContact C-N 3.27Å; S325-G327 PolarHBondContact O-N 2.96Å; S325-G327 PolarHBondContact OG-N 3.48Å; S325-D328 VanDerWaalsContact CB-OD2 3.31Å; S325-D328 WeakPolarHBondContact CB-OD2 3.48Å; S325-D328 PolarHBondContact N-OD2 3.2Å; S325-D328 PolarHBondContact O-N 2.92Å; S325-D328 PolarHBondContact OG-N 3.44Å; S325-D328 PolarHBondContact OG-OD1 3.04Å; S325-D328 PolarHBondContact OG-OD2 3.06Å; S325-W329 PolarHBondContact O-N 2.78Å; S325-W329 VanDerWaalsContact O-N 3.11Å
326F85.4Confident85.6Confident37 Ų3734.1 Ų34.116%0.16217%0.166CC..Hα-helixtrans-60.3-38.6173.9-172-79.6000112.2F179 V295 W329 F330F179-F326 AromaticContact CD1-CD1 3.9Å; F179-F326 HydrophobicContact CD1-CD1 3.9Å; F179-F326 HydrophobicContact CD1-CE1 4.05Å; F179-F326 HydrophobicContact CD2-CD1 4.19Å; F179-F326 AromaticContact CD2-CE1 3.66Å; F179-F326 HydrophobicContact CD2-CE1 3.66Å; F179-F326 AromaticContact CE1-CD1 3.76Å; F179-F326 HydrophobicContact CE1-CD1 3.76Å; F179-F326 AromaticContact CE1-CE1 3.66Å; F179-F326 HydrophobicContact CE1-CE1 3.66Å; F179-F326 HydrophobicContact CE2-CD1 4.09Å; F179-F326 AromaticContact CE2-CE1 3.26Å; F179-F326 HydrophobicContact CE2-CE1 3.26Å; F179-F326 HydrophobicContact CE2-CZ 4.07Å; F179-F326 HydrophobicContact CG-CD1 4.1Å; F179-F326 HydrophobicContact CG-CE1 4.03Å; F179-F326 AromaticContact CZ-CD1 3.85Å; F179-F326 HydrophobicContact CZ-CD1 3.85Å; F179-F326 AromaticContact CZ-CE1 3.23Å; F179-F326 HydrophobicContact CZ-CE1 3.23Å; F179-F326 AromaticContact CZ-CZ 3.97Å; F179-F326 HydrophobicContact CZ-CZ 3.97Å; V295-F326 HydrophobicContact CB-CE2 4.43Å; V295-F326 HydrophobicContact CB-CZ 4.48Å; V295-F326 HydrophobicContact CG2-CE1 4.35Å; V295-F326 HydrophobicContact CG2-CE2 4.05Å; V295-F326 HydrophobicContact CG2-CZ 3.63Å; F326-W329 HydrophobicContact CE1-CE3 4.45Å; F326-W329 HydrophobicContact CE2-CE3 4.41Å; F326-W329 HydrophobicContact CZ-CE3 4.17Å; F326-W329 HydrophobicContact CZ-CZ3 4.09Å; F326-W329 PolarHBondContact O-N 3.47Å; F326-F330 PolarHBondContact O-N 2.95Å
327G86.7Confident85.6Confident0 Ų033.2 Ų33.20%016%0.164CC..Hα-helixtrans-61.9-43.9176.700000111.8S325 W329 F330 V331S325-G327 VanDerWaalsContact C-N 3.27Å; S325-G327 PolarHBondContact O-N 2.96Å; S325-G327 PolarHBondContact OG-N 3.48Å; G327-W329 PolarHBondContact O-N 3.18Å; G327-F330 PolarHBondContact O-N 2.84Å; G327-F330 VanDerWaalsContact O-N 3.17Å; G327-V331 WeakPolarHBondContact O-CG2 3.43Å; G327-V331 PolarHBondContact O-N 3.41Å
328D88.2Confident85.7Confident10 Ų1033.4 Ų33.45%0.05317%0.165CC..Hα-helixtrans-61.7-45.7178.7-53.1-33.7000110.9H175 C324 S325 F330 V331 L332H175-D328 IonicContact CE1-OD1 3.2Å; H175-D328 IonicContact CG-OD1 3.94Å; H175-D328 IonicContact ND1-OD1 3.71Å; H175-D328 PolarHBondContact ND1-OD1 3.15Å; C324-D328 HydrophobicContact CB-CB 4.13Å; S325-D328 VanDerWaalsContact CB-OD2 3.31Å; S325-D328 WeakPolarHBondContact CB-OD2 3.48Å; S325-D328 PolarHBondContact N-OD2 3.2Å; S325-D328 PolarHBondContact O-N 2.92Å; S325-D328 PolarHBondContact OG-N 3.44Å; S325-D328 PolarHBondContact OG-OD1 3.04Å; S325-D328 PolarHBondContact OG-OD2 3.06Å; D328-F330 VanDerWaalsContact C-N 3.29Å; D328-F330 PolarHBondContact O-N 2.03Å; D328-V331 PolarHBondContact O-N 3.18Å; D328-L332 WeakPolarHBondContact O-CB 3.16Å; D328-L332 PolarHBondContact O-N 2.05Å
329W90.3Very high85.6Confident8 Ų828.9 Ų28.93%0.0314%0.144CC..Hα-helixtrans-56.7-43.7174.9174.387.6000112T294 R301 S325 F326 G327 L332 M333T294-W329 HydrophobicContact CG2-CH2 4.16Å; R301-W329 HydrophobicContact CB-CD2 4.22Å; R301-W329 HydrophobicContact CB-CG 4.5Å; R301-W329 HydrophobicContact CB-CZ2 3.92Å; R301-W329 HydrophobicContact CG-CD2 4Å; R301-W329 HydrophobicContact CG-CE3 4.29Å; R301-W329 HydrophobicContact CG-CH2 4.06Å; R301-W329 HydrophobicContact CG-CZ2 3.75Å; R301-W329 HydrophobicContact CG-CZ3 4.31Å; R301-W329 PolarHBondContact O-NE1 3.09Å; S325-W329 PolarHBondContact O-N 2.78Å; S325-W329 VanDerWaalsContact O-N 3.11Å; F326-W329 HydrophobicContact CE1-CE3 4.45Å; F326-W329 HydrophobicContact CE2-CE3 4.41Å; F326-W329 HydrophobicContact CZ-CE3 4.17Å; F326-W329 HydrophobicContact CZ-CZ3 4.09Å; F326-W329 PolarHBondContact O-N 3.47Å; G327-W329 PolarHBondContact O-N 3.18Å; W329-L332 PolarHBondContact O-N 3.14Å; W329-M333 HydrophobicContact CD2-CG 4.23Å; W329-M333 HydrophobicContact CH2-CG 4.36Å; W329-M333 HydrophobicContact CZ2-CG 3.79Å; W329-M333 WeakPolarHBondContact O-CB 3.01Å; W329-M333 WeakPolarHBondContact O-CG 3.49Å; W329-M333 PolarHBondContact O-N 3.35Å
330F91.5Very high85.6Confident3 Ų328.8 Ų28.81%0.01315%0.146CC..Hα-helixtrans-65.8-45.8-179.2178.8-103.7000112Y178 F179 Y182 F326 G327 D328 M333 R334Y178-F330 AromaticContact CD1-CD1 3.99Å; Y178-F330 HydrophobicContact CD1-CD1 3.99Å; Y178-F330 AromaticContact CD1-CE1 3.85Å; Y178-F330 HydrophobicContact CD1-CE1 3.85Å; Y178-F330 HydrophobicContact CE1-CD1 4.13Å; Y178-F330 AromaticContact CE1-CE1 3.7Å; Y178-F330 HydrophobicContact CE1-CE1 3.7Å; F179-F330 HydrophobicContact CB-CD1 4.02Å; F179-F330 HydrophobicContact CB-CG 4.4Å; F179-F330 HydrophobicContact CD2-CB 4.19Å; F179-F330 HydrophobicContact CD2-CD1 4.03Å; F179-F330 HydrophobicContact CD2-CD2 4.03Å; F179-F330 HydrophobicContact CD2-CE1 4.43Å; F179-F330 HydrophobicContact CD2-CE2 4.45Å; F179-F330 AromaticContact CD2-CG 3.8Å; F179-F330 HydrophobicContact CD2-CG 3.8Å; Y182-F330 HydrophobicContact CD1-CE1 4.31Å; Y182-F330 HydrophobicContact CD1-CE2 4.02Å; Y182-F330 AromaticContact CD1-CZ 3.39Å; Y182-F330 HydrophobicContact CD1-CZ 3.39Å; Y182-F330 HydrophobicContact CD2-CZ 4.38Å; Y182-F330 HydrophobicContact CE1-CE2 4.41Å; Y182-F330 AromaticContact CE1-CZ 3.98Å; Y182-F330 HydrophobicContact CE1-CZ 3.98Å; Y182-F330 HydrophobicContact CG-CE1 4.14Å; Y182-F330 AromaticContact CG-CZ 3.61Å; Y182-F330 HydrophobicContact CG-CZ 3.61Å; F326-F330 PolarHBondContact O-N 2.95Å; G327-F330 PolarHBondContact O-N 2.84Å; G327-F330 VanDerWaalsContact O-N 3.17Å; D328-F330 VanDerWaalsContact C-N 3.29Å; D328-F330 PolarHBondContact O-N 2.03Å; F330-M333 PolarHBondContact O-N 2.78Å; F330-R334 HydrophobicContact CE1-CG 4.15Å; F330-R334 HydrophobicContact CZ-CG 4.15Å; F330-R334 WeakPolarHBondContact O-CG 3.3Å; F330-R334 PolarHBondContact O-N 3.45Å
331V90.7Very high85.7Confident3 Ų331 Ų312%0.01816%0.159CC..Hα-helixtrans-64.5-42176.6176.70000110.6F167 H175 Y178 G327 D328 M333 R334 V335F167-V331 HydrophobicContact CE1-CB 4.23Å; F167-V331 HydrophobicContact CE1-CG1 3.9Å; F167-V331 HydrophobicContact CZ-CG1 3.97Å; H175-V331 HydrophobicContact CB-CG2 4.1Å; Y178-V331 HydrophobicContact CD1-CG2 3.79Å; Y178-V331 HydrophobicContact CE1-CG2 4.23Å; Y178-V331 HydrophobicContact CG-CG2 4.45Å; G327-V331 WeakPolarHBondContact O-CG2 3.43Å; G327-V331 PolarHBondContact O-N 3.41Å; D328-V331 PolarHBondContact O-N 3.18Å; V331-M333 PolarHBondContact O-N 3.47Å; V331-R334 WeakPolarHBondContact O-CB 3.22Å; V331-R334 PolarHBondContact O-N 3.1Å; V331-R334 VanDerWaalsContact O-N 3.09Å; V331-V335 HydrophobicContact CG1-CG2 4.44Å; V331-V335 WeakPolarHBondContact O-CG2 3.22Å; V331-V335 PolarHBondContact O-N 3.43Å
332L89.9Confident85.7Confident4 Ų434.5 Ų34.52%0.02118%0.175CC..Hα-helixtrans-60.3-43.5177-173.565.9000111.9F167 L305 L321 D328 W329 R334 V335 G336 F344 L347 L348 L351F167-L332 HydrophobicContact CD2-CD1 4.29Å; F167-L332 HydrophobicContact CE1-CB 4.23Å; F167-L332 HydrophobicContact CE1-CD1 4.42Å; F167-L332 HydrophobicContact CE2-CD1 3.87Å; F167-L332 HydrophobicContact CZ-CB 4.24Å; F167-L332 HydrophobicContact CZ-CD1 3.95Å; L305-L332 HydrophobicContact CD2-CD2 4.21Å; L321-L332 HydrophobicContact CD2-CD2 4.39Å; D328-L332 WeakPolarHBondContact O-CB 3.16Å; D328-L332 PolarHBondContact O-N 2.05Å; W329-L332 PolarHBondContact O-N 3.14Å; L332-R334 VanDerWaalsContact C-N 3.33Å; L332-R334 PolarHBondContact O-N 3.47Å; L332-V335 PolarHBondContact O-N 3.01Å; L332-G336 PolarHBondContact O-N 3.29Å; L332-F344 HydrophobicContact CD1-CE2 3.99Å; L332-F344 HydrophobicContact CG-CE2 3.96Å; L332-F344 HydrophobicContact CG-CZ 4.13Å; L332-F344 WeakPolarHBondContact O-CE2 3.1Å; L332-L347 HydrophobicContact CD1-CD2 3.71Å; L332-L348 HydrophobicContact CD2-CD2 3.88Å; L332-L351 HydrophobicContact CD1-CD1 4.45Å
333M89.9Confident85.8Confident20 Ų2027 Ų2710%0.09915%0.149CC..Hα-helixtrans-63.7-36.7173.9-77.4-63.4-6200112.4L304 L305 W329 F330 V331 G336 N337L304-M333 HydrophobicContact CB-CE 4.36Å; L304-M333 HydrophobicContact CD2-CE 4.39Å; L305-M333 HydrophobicContact CD2-CG 4.2Å; L305-M333 HydrophobicContact CD2-SD 3.5Å; L305-M333 WeakPolarHBondContact CD2-SD 3.49Å; L305-M333 HydrophobicContact CG-SD 3.93Å; W329-M333 HydrophobicContact CD2-CG 4.23Å; W329-M333 HydrophobicContact CH2-CG 4.36Å; W329-M333 HydrophobicContact CZ2-CG 3.79Å; W329-M333 WeakPolarHBondContact O-CB 3.01Å; W329-M333 WeakPolarHBondContact O-CG 3.49Å; W329-M333 PolarHBondContact O-N 3.35Å; F330-M333 PolarHBondContact O-N 2.78Å; V331-M333 PolarHBondContact O-N 3.47Å; M333-G336 PolarHBondContact O-N 2.87Å; M333-N337 VanDerWaalsContact O-CG 3.3Å; M333-N337 PolarHBondContact O-N 2.99Å; M333-N337 PolarHBondContact O-OD1 3.25Å
334R89.5Confident86.3Confident9 Ų922.8 Ų22.83%0.03413%0.126CC..Hα-helixtrans-66.7-41.9175.6-74.1-77.9175-150.6-10.7112.3D21 L139 Y182 F330 V331 L332 N337 N338D21-R334 VanDerWaalsContact CG-NH1 3.25Å; D21-R334 IonicContact OD1-CZ 3.45Å; D21-R334 IonicContact OD1-NH1 2.64Å; D21-R334 PolarHBondContact OD1-NH1 3.42Å; D21-R334 IonicContact OD1-NH2 3.71Å; D21-R334 PolarHBondContact OD1-NH2 3.3Å; D21-R334 IonicContact OD2-CZ 2.64Å; D21-R334 IonicContact OD2-NH1 2.92Å; D21-R334 PolarHBondContact OD2-NH1 2.93Å; D21-R334 IonicContact OD2-NH2 3.49Å; D21-R334 PolarHBondContact OD2-NH2 3.09Å; L139-R334 HydrophobicContact CD1-CB 4.24Å; Y182-R334 PolarHBondContact OH-NH2 3.41Å; F330-R334 HydrophobicContact CE1-CG 4.15Å; F330-R334 HydrophobicContact CZ-CG 4.15Å; F330-R334 WeakPolarHBondContact O-CG 3.3Å; F330-R334 PolarHBondContact O-N 3.45Å; V331-R334 WeakPolarHBondContact O-CB 3.22Å; V331-R334 PolarHBondContact O-N 3.1Å; V331-R334 VanDerWaalsContact O-N 3.09Å; L332-R334 VanDerWaalsContact C-N 3.33Å; L332-R334 PolarHBondContact O-N 3.47Å; R334-N337 WeakPolarHBondContact O-CB 3.14Å; R334-N337 PolarHBondContact O-N 3.49Å; R334-N338 PolarHBondContact O-ND2 3.19Å
335V88.5Confident86.6Confident0 Ų024.8 Ų24.80%013%0.129CC..Hα-helixtrans-64.2-44.6173.3171.80000110.1L139 L142 L163 F167 V331 L332 N337 N338 I339L139-V335 HydrophobicContact CD1-CG2 3.84Å; L142-V335 HydrophobicContact CD1-CG2 4.44Å; L163-V335 HydrophobicContact CD2-CG1 3.94Å; F167-V335 HydrophobicContact CZ-CG2 4.23Å; V331-V335 HydrophobicContact CG1-CG2 4.44Å; V331-V335 WeakPolarHBondContact O-CG2 3.22Å; V331-V335 PolarHBondContact O-N 3.43Å; L332-V335 PolarHBondContact O-N 3.01Å; V335-N337 PolarHBondContact O-N 2.91Å; V335-N338 PolarHBondContact O-N 3.23Å; V335-I339 HydrophobicContact CG1-CD1 3.44Å; V335-I339 VanDerWaalsContact CG1-CD1 3.44Å; V335-I339 HydrophobicContact CG1-CG1 4.26Å; V335-I339 WeakPolarHBondContact O-CG1 3.27Å; V335-I339 PolarHBondContact O-N 3.03Å
336G86.1Confident86.7Confident0 Ų027.7 Ų27.70%014%0.137CC..Hα-helixtrans-57.2-35.1174.200000113.1R308 L332 M333 N338 I339 F344R308-G336 VanDerWaalsContact CZ-C 3.48Å; R308-G336 PolarHBondContact NE-O 3.03Å; R308-G336 PolarHBondContact NH2-O 2.99Å; L332-G336 PolarHBondContact O-N 3.29Å; M333-G336 PolarHBondContact O-N 2.87Å; G336-N338 PolarHBondContact O-N 3.48Å; G336-I339 VanDerWaalsContact O-O 3.14Å; G336-F344 VanDerWaalsContact CA-CD2 3.41Å
337N85.6Confident86.7Confident60 Ų6026.1 Ų26.132%0.32113%0.13SC..Hα-helixtrans-63.2-22.6174.5-74.8-5.9000114.1R308 M333 R334 V335R308-N337 PolarHBondContact NH1-OD1 3.23Å; M333-N337 VanDerWaalsContact O-CG 3.3Å; M333-N337 PolarHBondContact O-N 2.99Å; M333-N337 PolarHBondContact O-OD1 3.25Å; R334-N337 WeakPolarHBondContact O-CB 3.14Å; R334-N337 PolarHBondContact O-N 3.49Å; V335-N337 PolarHBondContact O-N 2.91Å
338N85.3Confident86.8Confident7 Ų726.1 Ų26.14%0.03713%0.13CC..Hα-helixtrans-107-9.8-173.9-76.4-77.9000114.2V17 H18 L139 C143 H147 R334 V335 G336V17-N338 WeakPolarHBondContact CA-OD1 3.16Å; H18-N338 WeakPolarHBondContact CA-OD1 3.04Å; H18-N338 WeakPolarHBondContact CB-OD1 3.21Å; H18-N338 PolarHBondContact N-OD1 3.3Å; H18-N338 PolarHBondContact O-ND2 3.28Å; H18-N338 PolarHBondContact O-OD1 3.44Å; L139-N338 WeakPolarHBondContact CD2-ND2 3.44Å; C143-N338 HydrophobicContact CB-CB 4.02Å; H147-N338 PolarHBondContact CE1-O 3.41Å; R334-N338 PolarHBondContact O-ND2 3.19Å; V335-N338 PolarHBondContact O-N 3.23Å; G336-N338 PolarHBondContact O-N 3.48Å
339I83.3Confident86.7Confident16 Ų1628.6 Ų28.68%0.08214%0.142CC..SBendtrans-117.5154.9-175.5-61.6-178.1000109.7F146 L163 V335 G336 L343F146-I339 HydrophobicContact CD2-CD1 3.81Å; F146-I339 HydrophobicContact CD2-CG1 4.32Å; F146-I339 HydrophobicContact CE2-CD1 3.86Å; F146-I339 HydrophobicContact CG-CD1 4.43Å; L163-I339 HydrophobicContact CD2-CD1 4.34Å; V335-I339 HydrophobicContact CG1-CD1 3.44Å; V335-I339 VanDerWaalsContact CG1-CD1 3.44Å; V335-I339 HydrophobicContact CG1-CG1 4.26Å; V335-I339 WeakPolarHBondContact O-CG1 3.27Å; V335-I339 PolarHBondContact O-N 3.03Å; G336-I339 VanDerWaalsContact O-O 3.14Å; I339-L343 HydrophobicContact CG2-CB 3.34Å; I339-L343 HydrophobicContact CG2-CD1 3.82Å; I339-L343 HydrophobicContact CG2-CG 4.24Å
340S82.9Confident86.5Confident49 Ų4931.1 Ų31.134%0.34315%0.153SC..  trans-62.2147.8176.694.40000111.8E342 L343 F344S340-E342 VanDerWaalsContact CB-OE2 3.26Å; S340-E342 WeakPolarHBondContact CB-OE2 3.25Å; S340-E342 PolarHBondContact O-N 3.32Å; S340-E342 PolarHBondContact OG-OE2 2.77Å; S340-L343 PolarHBondContact O-N 3.15Å; S340-L343 PolarHBondContact OG-N 3.1Å; S340-F344 PolarHBondContact O-N 2.72Å
341P83.3Confident86.2Confident47 Ų4731.1 Ų31.131%0.30515%0.154SC..Hα-helixtrans-57.1-31.8-180-25.335.1000113.9R345P341-R345 PolarHBondContact O-N 2.86Å
342E82Confident86Confident106 Ų10634.1 Ų34.150%0.49517%0.165SC..Hα-helixtrans-70-42.2180-54.971.7-153.400111.7S340 R345 K346S340-E342 VanDerWaalsContact CB-OE2 3.26Å; S340-E342 WeakPolarHBondContact CB-OE2 3.25Å; S340-E342 PolarHBondContact O-N 3.32Å; S340-E342 PolarHBondContact OG-OE2 2.77Å; E342-R345 PolarHBondContact O-N 2.84Å; E342-K346 WeakPolarHBondContact O-CG 3.49Å; E342-K346 PolarHBondContact O-N 2.83Å; E342-K346 VanDerWaalsContact O-N 3.14Å
343L81.9Confident85.9Confident28 Ų2840 Ų4015%0.14719%0.193CC..Hα-helixtrans-69.1-38.6175.6-74.6172.5000111F146 S156 I339 S340 R345 K346 L347F146-L343 HydrophobicContact CD1-CD1 4.17Å; S156-L343 WeakPolarHBondContact OG-CD2 3.1Å; I339-L343 HydrophobicContact CG2-CB 3.34Å; I339-L343 HydrophobicContact CG2-CD1 3.82Å; I339-L343 HydrophobicContact CG2-CG 4.24Å; S340-L343 PolarHBondContact O-N 3.15Å; S340-L343 PolarHBondContact OG-N 3.1Å; L343-R345 VanDerWaalsContact C-N 3.32Å; L343-R345 PolarHBondContact O-N 2.03Å; L343-K346 PolarHBondContact O-N 2.81Å; L343-L347 PolarHBondContact O-N 3.01Å
344F87.1Confident85.4Confident1 Ų142 Ų420%0.00421%0.213CC..Hα-helixtrans-63-38.1174.4-172.6-109.1000112.3L305 R308 A309 L332 G336 S340 L347 L348L305-F344 HydrophobicContact CD2-CE1 4.02Å; L305-F344 HydrophobicContact CD2-CZ 3.63Å; R308-F344 HydrophobicContact CB-CD1 4.24Å; R308-F344 HydrophobicContact CB-CE1 4.04Å; R308-F344 HydrophobicContact CG-CD1 3.92Å; R308-F344 HydrophobicContact CG-CE1 4.05Å; A309-F344 HydrophobicContact CB-CD1 4.43Å; A309-F344 HydrophobicContact CB-CE1 4.42Å; L332-F344 HydrophobicContact CD1-CE2 3.99Å; L332-F344 HydrophobicContact CG-CE2 3.96Å; L332-F344 HydrophobicContact CG-CZ 4.13Å; L332-F344 WeakPolarHBondContact O-CE2 3.1Å; G336-F344 VanDerWaalsContact CA-CD2 3.41Å; S340-F344 PolarHBondContact O-N 2.72Å; F344-L347 HydrophobicContact CD2-CD2 4.39Å; F344-L347 WeakPolarHBondContact O-CB 3.33Å; F344-L347 PolarHBondContact O-N 3.25Å; F344-L348 HydrophobicContact CD1-CD1 4.04Å; F344-L348 HydrophobicContact CE1-CD1 3.63Å; F344-L348 HydrophobicContact CE1-CG 4.42Å; F344-L348 HydrophobicContact CZ-CD1 4.09Å; F344-L348 HydrophobicContact CZ-CG 4.5Å; F344-L348 PolarHBondContact O-N 2.98Å
345R86.1Confident84.7Confident76 Ų7643.9 Ų43.929%0.28722%0.222SC..Hα-helixtrans-62.6-49173-177.7-174.46484.74.6111.6R310 P341 E342 L343 L347 L348 E349R310-R345 WeakPolarHBondContact O-CD 3.42Å; P341-R345 PolarHBondContact O-N 2.86Å; E342-R345 PolarHBondContact O-N 2.84Å; L343-R345 VanDerWaalsContact C-N 3.32Å; L343-R345 PolarHBondContact O-N 2.03Å; R345-L347 VanDerWaalsContact C-N 3.27Å; R345-L347 PolarHBondContact O-N 3.11Å; R345-L348 PolarHBondContact O-N 3.26Å; R345-L348 VanDerWaalsContact O-N 3.08Å; R345-E349 IonicContact CZ-OE1 2.69Å; R345-E349 IonicContact CZ-OE2 3.5Å; R345-E349 IonicContact NH1-OE1 3.86Å; R345-E349 PolarHBondContact NH1-OE1 3.18Å; R345-E349 IonicContact NH1-OE2 3.5Å; R345-E349 PolarHBondContact NH1-OE2 3.25Å; R345-E349 PolarHBondContact O-N 3.06Å
346K86.1Confident83.7Confident98 Ų9849.5 Ų49.543%0.42626%0.261SS..Hα-helixtrans-59.1-38.8178.4-71.6178.7-179.8179.10112.3L160 E342 L343 L348 E349 E350L160-K346 HydrophobicContact CD2-CB 3.85Å; E342-K346 WeakPolarHBondContact O-CG 3.49Å; E342-K346 PolarHBondContact O-N 2.83Å; E342-K346 VanDerWaalsContact O-N 3.14Å; L343-K346 PolarHBondContact O-N 2.81Å; K346-L348 VanDerWaalsContact C-N 3.33Å; K346-L348 PolarHBondContact O-N 3.41Å; K346-E349 PolarHBondContact O-N 3.35Å; K346-E350 PolarHBondContact O-N 3.47Å
347L86.8Confident83.6Confident3 Ų352 Ų522%0.01627%0.274CS..Hα-helixtrans-57.7-45.7173.8176.863.9000111.8L160 L163 V164 F167 L332 L343 F344 R345 E349 L351L160-L347 HydrophobicContact CD1-CB 3.74Å; L160-L347 HydrophobicContact CD1-CD1 3.96Å; L160-L347 HydrophobicContact CD1-CG 4.45Å; L163-L347 HydrophobicContact CB-CD1 4.05Å; L163-L347 HydrophobicContact CD2-CD1 3.74Å; L163-L347 HydrophobicContact CD2-CD2 3.51Å; L163-L347 HydrophobicContact CD2-CG 4.21Å; L163-L347 HydrophobicContact CG-CD1 3.76Å; L163-L347 HydrophobicContact CG-CD2 4.14Å; V164-L347 HydrophobicContact CG2-CD1 3.75Å; F167-L347 HydrophobicContact CE2-CD2 4.44Å; L332-L347 HydrophobicContact CD1-CD2 3.71Å; L343-L347 PolarHBondContact O-N 3.01Å; F344-L347 HydrophobicContact CD2-CD2 4.39Å; F344-L347 WeakPolarHBondContact O-CB 3.33Å; F344-L347 PolarHBondContact O-N 3.25Å; R345-L347 VanDerWaalsContact C-N 3.27Å; R345-L347 PolarHBondContact O-N 3.11Å; L347-E349 VanDerWaalsContact C-N 3.34Å; L347-L351 HydrophobicContact CD1-CD1 4.27Å; L347-L351 HydrophobicContact CD1-CG 4.49Å; L347-L351 HydrophobicContact CG-CD1 4.11Å; L347-L351 WeakPolarHBondContact O-CB 3.48Å; L347-L351 VanDerWaalsContact O-CG 3.26Å; L347-L351 WeakPolarHBondContact O-CG 3.2Å; L347-L351 PolarHBondContact O-N 2.75Å
348L87.4Confident83.5Confident1 Ų151.5 Ų51.51%0.00527%0.271CS..Hα-helixtrans-69.3-32.4179-70.5170.6000112.7A309 M312 L317 L332 F344 R345 K346 Y352A309-L348 HydrophobicContact CB-CD1 3.33Å; M312-L348 HydrophobicContact CE-CB 4.05Å; M312-L348 HydrophobicContact SD-CB 3.91Å; M312-L348 HydrophobicContact SD-CD1 4.46Å; L317-L348 HydrophobicContact CD1-CD1 4.05Å; L317-L348 HydrophobicContact CD1-CD2 4.18Å; L332-L348 HydrophobicContact CD2-CD2 3.88Å; F344-L348 HydrophobicContact CD1-CD1 4.04Å; F344-L348 HydrophobicContact CE1-CD1 3.63Å; F344-L348 HydrophobicContact CE1-CG 4.42Å; F344-L348 HydrophobicContact CZ-CD1 4.09Å; F344-L348 HydrophobicContact CZ-CG 4.5Å; F344-L348 PolarHBondContact O-N 2.98Å; R345-L348 PolarHBondContact O-N 3.26Å; R345-L348 VanDerWaalsContact O-N 3.08Å; K346-L348 VanDerWaalsContact C-N 3.33Å; K346-L348 PolarHBondContact O-N 3.41Å; L348-Y352 WeakPolarHBondContact O-CB 3.45Å; L348-Y352 PolarHBondContact O-N 3.32Å
349E87.4Confident83.4Confident62 Ų6254 Ų5429%0.2928%0.284SS..Hα-helixtrans-67.3-46.5174.1-73.7171.3177.800111.6M312 R345 K346 L347 L351 Y352 E353M312-E349 HydrophobicContact CE-CG 3.97Å; R345-E349 IonicContact CZ-OE1 2.69Å; R345-E349 IonicContact CZ-OE2 3.5Å; R345-E349 IonicContact NH1-OE1 3.86Å; R345-E349 PolarHBondContact NH1-OE1 3.18Å; R345-E349 IonicContact NH1-OE2 3.5Å; R345-E349 PolarHBondContact NH1-OE2 3.25Å; R345-E349 PolarHBondContact O-N 3.06Å; K346-E349 PolarHBondContact O-N 3.35Å; L347-E349 VanDerWaalsContact C-N 3.34Å; E349-L351 VanDerWaalsContact C-N 3.32Å; E349-L351 PolarHBondContact O-N 2.72Å; E349-Y352 WeakPolarHBondContact O-CB 3.35Å; E349-Y352 PolarHBondContact O-N 3.23Å; E349-Y352 VanDerWaalsContact O-N 3.14Å; E349-E353 PolarHBondContact O-N 3.37Å
350E85.8Confident83.4Confident60 Ų6056.2 Ų56.228%0.2830%0.296SS..Hα-helixtrans-67-33.2176-69.2-170.6-17600112.2L160 V164 K346 Y352 E353 A354L160-E350 VanDerWaalsContact CD2-CD 3.48Å; L160-E350 HydrophobicContact CD2-CG 4.35Å; L160-E350 VanDerWaalsContact CD2-OE1 3.29Å; L160-E350 WeakPolarHBondContact CD2-OE1 3.23Å; L160-E350 WeakPolarHBondContact CG-OE2 2.99Å; V164-E350 HydrophobicContact CG2-CB 3.63Å; K346-E350 PolarHBondContact O-N 3.47Å; E350-Y352 VanDerWaalsContact C-N 3.33Å; E350-E353 PolarHBondContact O-N 2.88Å; E350-A354 WeakPolarHBondContact O-CB 3.07Å; E350-A354 PolarHBondContact O-N 3.36Å
351L85.6Confident83.5Confident4 Ų456.7 Ų56.72%0.02129%0.293CS..Hα-helixtrans-67.5-33.4171.8-76.2169.9000112.7V164 F167 L332 L347 E349 Q355V164-L351 HydrophobicContact CG1-CD2 4.1Å; V164-L351 HydrophobicContact CG2-CG 4.48Å; F167-L351 HydrophobicContact CB-CD2 3.95Å; L332-L351 HydrophobicContact CD1-CD1 4.45Å; L347-L351 HydrophobicContact CD1-CD1 4.27Å; L347-L351 HydrophobicContact CD1-CG 4.49Å; L347-L351 HydrophobicContact CG-CD1 4.11Å; L347-L351 WeakPolarHBondContact O-CB 3.48Å; L347-L351 VanDerWaalsContact O-CG 3.26Å; L347-L351 WeakPolarHBondContact O-CG 3.2Å; L347-L351 PolarHBondContact O-N 2.75Å; E349-L351 VanDerWaalsContact C-N 3.32Å; E349-L351 PolarHBondContact O-N 2.72Å; L351-Q355 WeakPolarHBondContact O-CG 3.35Å; L351-Q355 PolarHBondContact O-N 3.08Å
352Y86.5Confident83.5Confident65 Ų6557.3 Ų57.326%0.25529%0.292SS..Hα-helixtrans-65.3-49.2172.3167.4-99.4000110.5H316 V319 L348 E349 E350 A354 Q355 S356H316-Y352 HydrophobicContact CB-CD2 3.98Å; H316-Y352 HydrophobicContact CB-CE2 4.12Å; H316-Y352 HydrophobicContact CB-CG 4.33Å; H316-Y352 WeakPolarHBondContact O-CD2 3.32Å; V319-Y352 HydrophobicContact CB-CD2 3.85Å; V319-Y352 HydrophobicContact CB-CE2 3.81Å; V319-Y352 HydrophobicContact CG1-CD2 3.79Å; V319-Y352 HydrophobicContact CG1-CE2 3.74Å; V319-Y352 HydrophobicContact CG2-CE2 4.32Å; L348-Y352 WeakPolarHBondContact O-CB 3.45Å; L348-Y352 PolarHBondContact O-N 3.32Å; E349-Y352 WeakPolarHBondContact O-CB 3.35Å; E349-Y352 PolarHBondContact O-N 3.23Å; E349-Y352 VanDerWaalsContact O-N 3.14Å; E350-Y352 VanDerWaalsContact C-N 3.33Å; Y352-A354 VanDerWaalsContact C-N 3.29Å; Y352-A354 PolarHBondContact O-N 3.38Å; Y352-Q355 PolarHBondContact O-N 2.9Å; Y352-Q355 VanDerWaalsContact O-N 3.09Å; Y352-S356 PolarHBondContact O-N 3.06Å; Y352-S356 PolarHBondContact O-OG 2.85Å
353E85.8Confident83.6Confident129 Ų12953.9 Ų53.960%0.60328%0.278SS*.Hα-helixtrans-62.6-33.4179.3-71176.6-175.800113E349 E350 Q355 S356E349-E353 PolarHBondContact O-N 3.37Å; E350-E353 PolarHBondContact O-N 2.88Å; E353-Q355 VanDerWaalsContact C-N 3.26Å; E353-Q355 PolarHBondContact O-N 3.2Å; E353-S356 WeakPolarHBondContact CA-OG 3Å; E353-S356 PolarHBondContact O-OG 3.19Å
354A80.4Confident83.7Confident62 Ų6255.8 Ų55.851%0.51229%0.288SS..THydrogen-bonded Turntrans-72.4-17176.200000113.8V164 E350 Y352V164-A354 HydrophobicContact CG1-CB 4.39Å; E350-A354 WeakPolarHBondContact O-CB 3.07Å; E350-A354 PolarHBondContact O-N 3.36Å; Y352-A354 VanDerWaalsContact C-N 3.29Å; Y352-A354 PolarHBondContact O-N 3.38Å
355Q74.2Confident83.4Confident48 Ų4860.4 Ų60.422%0.22431%0.311CS..THydrogen-bonded Turntrans-111.2-15.1-177.2-68.3-177.514.400113.8V319 A320 L351 Y352 E353V319-Q355 PolarHBondContact O-OE1 2.87Å; A320-Q355 VanDerWaalsContact C-OE1 3.26Å; A320-Q355 PolarHBondContact O-NE2 2.97Å; A320-Q355 PolarHBondContact O-OE1 2.74Å; A320-Q355 VanDerWaalsContact O-OE1 3.08Å; L351-Q355 WeakPolarHBondContact O-CG 3.35Å; L351-Q355 PolarHBondContact O-N 3.08Å; Y352-Q355 PolarHBondContact O-N 2.9Å; Y352-Q355 VanDerWaalsContact O-N 3.09Å; E353-Q355 VanDerWaalsContact C-N 3.26Å; E353-Q355 PolarHBondContact O-N 3.2Å
356S68.9Low83.2Confident117 Ų11759 Ų5982%0.81831%0.314SS*.  trans-79.1017164.10000110.9Y352 E353Y352-S356 PolarHBondContact O-N 3.06Å; Y352-S356 PolarHBondContact O-OG 2.85Å; E353-S356 WeakPolarHBondContact CA-OG 3Å; E353-S356 PolarHBondContact O-OG 3.19Å

Retrieved 356 of 356 residues in 163.2 ms (Link to these results)

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