A0A078N0E5_HUMAN Loading...

Rhesus blood group, cE antigen

AlphaFold DB , UniProt , Accession A0A078N0E5, Species HUMAN (Homo sapiens, Human), Gene RHCE, Length 417 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
1M33.4Very low43.8Very low246 Ų246143 Ų143100%1.21268%0.675SS**  0115.60-82.817415800108.8S3M1-S3 PolarHBondContact O-N 3.26Å; M1-S3 VanDerWaalsContact O-N 3.16Å
2S28Very low45.3Very low113 Ų113137.4 Ų137.479%0.7966%0.661SS**  trans-58.9115.6175.4168.80000109.3K4S2-K4 PolarHBondContact O-N 3.35Å
3S36Very low47.2Very low64 Ų64130.5 Ų130.545%0.44863%0.629SS.*  trans-57.6103.8170.1173.40000107.8M1 Y5M1-S3 PolarHBondContact O-N 3.26Å; M1-S3 VanDerWaalsContact O-N 3.16Å; S3-Y5 WeakPolarHBondContact O-CD2 3.42Å; S3-Y5 PolarHBondContact O-N 3.35Å; S3-Y5 VanDerWaalsContact OG-CD2 3.24Å; S3-Y5 WeakPolarHBondContact OG-CD2 3.3Å; S3-Y5 WeakPolarHBondContact OG-CE2 3.39Å
4K39.2Very low49Very low196 Ų196125.4 Ų125.485%0.85261%0.612SS**  trans-70.476.7170.5-73.9-177.8179.11770107.6S2S2-K4 PolarHBondContact O-N 3.35Å
5Y46.1Very low51Low78 Ų78124.4 Ų124.431%0.30661%0.61SS.*  trans-56.5128.6164.1-74-91000107.5S3 R7 Q405 L413S3-Y5 WeakPolarHBondContact O-CD2 3.42Å; S3-Y5 PolarHBondContact O-N 3.35Å; S3-Y5 VanDerWaalsContact OG-CD2 3.24Å; S3-Y5 WeakPolarHBondContact OG-CD2 3.3Å; S3-Y5 WeakPolarHBondContact OG-CE2 3.39Å; Y5-R7 PolarHBondContact O-N 3.02Å; Y5-R7 VanDerWaalsContact O-N 3.16Å; Y5-Q405 HydrophobicContact CE1-CB 4.21Å; Y5-Q405 PolarHBondContact OH-OE1 3.27Å; Y5-L413 WeakPolarHBondContact OH-CD2 3.1Å
6P44.9Very low52.8Low92 Ų92127.7 Ų127.760%0.59761%0.614SS**  trans-58.1125.7172.123.3-30.3000107.9S8P6-S8 PolarHBondContact O-N 3.31Å
7R46.8Very low54.6Low245 Ų245121.8 Ų121.893%0.92559%0.591SS**  trans-67.944.1177.6-73.2178.4170.3168.6-3111.7Y5 V9Y5-R7 PolarHBondContact O-N 3.02Å; Y5-R7 VanDerWaalsContact O-N 3.16Å; R7-V9 PolarHBondContact O-N 3.28Å
8S50.5Low56.4Low50 Ų50121.8 Ų121.835%0.3559%0.594SS.*  trans-85.3-3-153.573.50000116.5P6P6-S8 PolarHBondContact O-N 3.31Å
9V53.2Low58.1Low43 Ų43119.5 Ų119.526%0.26159%0.587SS.*SBendtrans-123.9-11.4-169.7-159.10000114.3R7 R11 L13 P14R7-V9 PolarHBondContact O-N 3.28Å; V9-R11 PolarHBondContact O-N 2.75Å; V9-L13 HydrophobicContact CG1-CB 3.45Å; V9-L13 VanDerWaalsContact CG1-CB 3.45Å; V9-L13 HydrophobicContact CG1-CD1 4.08Å; V9-L13 HydrophobicContact CG1-CD2 3.65Å; V9-L13 HydrophobicContact CG1-CG 3.93Å; V9-P14 WeakPolarHBondContact O-CD 3.24Å
10R51.3Low59.7Low234 Ų234115.4 Ų115.488%0.88357%0.568SS**THydrogen-bonded Turntrans-70-22-163.5-142.9-178-157.6-1644.5116.7
11R52Low61.3Low212 Ų212113.2 Ų113.280%0.856%0.556SS**THydrogen-bonded Turntrans-115.7-44.8179-87.7-173.3178.4173.2-0.9113.4V9 L15V9-R11 PolarHBondContact O-N 2.75Å; R11-L15 WeakPolarHBondContact O-CB 3.31Å; R11-L15 WeakPolarHBondContact O-CD1 3.47Å
12C62.5Low64.2Low76 Ų76103.8 Ų103.851%0.51452%0.518SS..Hα-helixtrans-68.9-55.5-171.7-146.10000111.7L15 W16C12-L15 PolarHBondContact O-N 2.81Å; C12-W16 PolarHBondContact O-N 3.44Å; C12-W16 PolarHBondContact SG-NE1 3.16Å
13L69.1Low67.3Low47 Ų47100.5 Ų100.525%0.24650%0.497CS..Hα-helixtrans-58.6-49.5-173.2-160.798.9000114.7V9 L15 W16 A17 L136 A137V9-L13 HydrophobicContact CG1-CB 3.45Å; V9-L13 VanDerWaalsContact CG1-CB 3.45Å; V9-L13 HydrophobicContact CG1-CD1 4.08Å; V9-L13 HydrophobicContact CG1-CD2 3.65Å; V9-L13 HydrophobicContact CG1-CG 3.93Å; L13-L15 PolarHBondContact O-N 2.82Å; L13-W16 PolarHBondContact O-N 3.31Å; L13-A17 WeakPolarHBondContact O-CB 3.42Å; L13-A17 PolarHBondContact O-N 3.38Å; L13-L136 HydrophobicContact CD1-CB 3.88Å; L13-L136 HydrophobicContact CD1-CD2 4.4Å; L13-L136 HydrophobicContact CD1-CG 4.46Å; L13-L136 HydrophobicContact CD2-CB 4.3Å; L13-L136 HydrophobicContact CD2-CD2 3.63Å; L13-L136 HydrophobicContact CD2-CG 4.5Å; L13-L136 HydrophobicContact CG-CD2 4.28Å; L13-A137 HydrophobicContact CD1-CB 4.04Å
14P73.3Confident70Confident60 Ų6097.6 Ų97.639%0.3948%0.476SS..Hα-helixtrans-67.2-36.5179.424.8-33.1000112.3V9 L18V9-P14 WeakPolarHBondContact O-CD 3.24Å; P14-L18 VanDerWaalsContact O-CB 3.32Å; P14-L18 WeakPolarHBondContact O-CB 3.41Å; P14-L18 WeakPolarHBondContact O-CG 3.37Å; P14-L18 PolarHBondContact O-N 3.44Å
15L78.2Confident72.5Confident110 Ų11092.9 Ų92.958%0.57646%0.46SS*.Hα-helixtrans-62.6-50.2175-87.9160.8000111R11 C12 L13 A17 L18 T19R11-L15 WeakPolarHBondContact O-CB 3.31Å; R11-L15 WeakPolarHBondContact O-CD1 3.47Å; C12-L15 PolarHBondContact O-N 2.81Å; L13-L15 PolarHBondContact O-N 2.82Å; L15-A17 PolarHBondContact O-N 3.31Å; L15-L18 PolarHBondContact O-N 2.92Å; L15-T19 WeakPolarHBondContact O-CB 3.42Å; L15-T19 VanDerWaalsContact O-CG2 3.29Å; L15-T19 WeakPolarHBondContact O-CG2 3.43Å; L15-T19 PolarHBondContact O-N 3.23Å; L15-T19 PolarHBondContact O-OG1 3.09Å
16W80.5Confident74.8Confident177 Ų17794 Ų9467%0.6747%0.47SS*.Hα-helixtrans-60.7-44.5178.8-81.2102000112.7C12 L13 T19 L20C12-W16 PolarHBondContact O-N 3.44Å; C12-W16 PolarHBondContact SG-NE1 3.16Å; L13-W16 PolarHBondContact O-N 3.31Å; W16-T19 VanDerWaalsContact CA-OG1 3.3Å; W16-T19 WeakPolarHBondContact CA-OG1 3.49Å; W16-T19 PolarHBondContact O-N 3.37Å; W16-T19 PolarHBondContact O-OG1 3.49Å; W16-L20 WeakPolarHBondContact O-CB 3.35Å; W16-L20 PolarHBondContact O-N 3.39Å
17A83.2Confident76.9Confident27 Ų2792.2 Ų92.222%0.22346%0.456CS..Hα-helixtrans-63.2-45.9178.400000111.6L13 L15 L20 E21 F82L13-A17 WeakPolarHBondContact O-CB 3.42Å; L13-A17 PolarHBondContact O-N 3.38Å; L15-A17 PolarHBondContact O-N 3.31Å; A17-L20 PolarHBondContact O-N 3.42Å; A17-E21 WeakPolarHBondContact O-CB 3.44Å; A17-E21 PolarHBondContact O-N 2.83Å; A17-F82 HydrophobicContact CB-CZ 4.4Å
18L87.6Confident78.9Confident123 Ų12382.4 Ų82.464%0.64442%0.421SS*.Hα-helixtrans-67.7-36.8178.4-69.5173.2000112.5P14 L15 L20 E21 A22P14-L18 VanDerWaalsContact O-CB 3.32Å; P14-L18 WeakPolarHBondContact O-CB 3.41Å; P14-L18 WeakPolarHBondContact O-CG 3.37Å; P14-L18 PolarHBondContact O-N 3.44Å; L15-L18 PolarHBondContact O-N 2.92Å; L18-L20 VanDerWaalsContact C-N 3.34Å; L18-E21 PolarHBondContact O-N 3.16Å; L18-A22 WeakPolarHBondContact O-CB 3.26Å; L18-A22 PolarHBondContact O-N 3.44Å
19T88.7Confident80.8Confident77 Ų7788.2 Ų88.247%0.47244%0.437SS..Hα-helixtrans-66.4-38.4174.851.40000112L15 W16 A23L15-T19 WeakPolarHBondContact O-CB 3.42Å; L15-T19 VanDerWaalsContact O-CG2 3.29Å; L15-T19 WeakPolarHBondContact O-CG2 3.43Å; L15-T19 PolarHBondContact O-N 3.23Å; L15-T19 PolarHBondContact O-OG1 3.09Å; W16-T19 VanDerWaalsContact CA-OG1 3.3Å; W16-T19 WeakPolarHBondContact CA-OG1 3.49Å; W16-T19 PolarHBondContact O-N 3.37Å; W16-T19 PolarHBondContact O-OG1 3.49Å; T19-A23 WeakPolarHBondContact O-CB 3.27Å; T19-A23 PolarHBondContact O-N 3.21Å
20L90.1Very high82.4Confident38 Ų3892.2 Ų92.220%0.19945%0.451CS..Hα-helixtrans-66.8-44.8176.6-176.264.3000110.6W16 A17 L18 A22 A23 L24 L86 V140 L144W16-L20 WeakPolarHBondContact O-CB 3.35Å; W16-L20 PolarHBondContact O-N 3.39Å; A17-L20 PolarHBondContact O-N 3.42Å; L18-L20 VanDerWaalsContact C-N 3.34Å; L20-A22 PolarHBondContact O-N 2.94Å; L20-A23 WeakPolarHBondContact O-CB 3.38Å; L20-A23 PolarHBondContact O-N 2.77Å; L20-L24 HydrophobicContact CG-CD1 4.27Å; L20-L24 WeakPolarHBondContact O-CG 3.49Å; L20-L24 PolarHBondContact O-N 3.4Å; L20-L86 HydrophobicContact CD2-CD1 3.57Å; L20-L86 HydrophobicContact CD2-CD2 3.94Å; L20-L86 HydrophobicContact CD2-CG 4.41Å; L20-L86 HydrophobicContact CG-CD1 4.12Å; L20-V140 HydrophobicContact CD2-CG1 3.61Å; L20-L144 HydrophobicContact CD1-CD1 4.41Å
21E93.5Very high84Confident70 Ų7084.3 Ų84.333%0.32742%0.423SS..Hα-helixtrans-60.8-45.8175.9-167.466.5-159.100111.3A17 L18 A23 L24 I25 Q89A17-E21 WeakPolarHBondContact O-CB 3.44Å; A17-E21 PolarHBondContact O-N 2.83Å; L18-E21 PolarHBondContact O-N 3.16Å; E21-A23 VanDerWaalsContact C-N 3.29Å; E21-A23 PolarHBondContact O-N 3.35Å; E21-L24 PolarHBondContact O-N 2.95Å; E21-L24 VanDerWaalsContact O-N 3.16Å; E21-I25 HydrophobicContact CG-CD1 4.1Å; E21-I25 VanDerWaalsContact O-CG1 3.27Å; E21-I25 WeakPolarHBondContact O-CG1 3.36Å; E21-I25 PolarHBondContact O-N 2.82Å; E21-Q89 PolarHBondContact OE1-NE2 3.01Å; E21-Q89 PolarHBondContact OE1-OE1 2.9Å; E21-Q89 PolarHBondContact OE2-OE1 3.47Å
22A93.5Very high85.6Confident48 Ų4875.2 Ų75.240%0.39739%0.391SS..Hα-helixtrans-59.6-40.1176.500000112L18 L20 L26L18-A22 WeakPolarHBondContact O-CB 3.26Å; L18-A22 PolarHBondContact O-N 3.44Å; L20-A22 PolarHBondContact O-N 2.94Å; A22-L26 WeakPolarHBondContact O-CG 3.47Å; A22-L26 PolarHBondContact O-N 3.49Å; A22-L26 VanDerWaalsContact O-N 3.07Å
23A92.8Very high86.7Confident43 Ų4375.4 Ų75.436%0.35538%0.384SS..Hα-helixtrans-65-43.1174.900000112T19 L20 E21 L26 L27T19-A23 WeakPolarHBondContact O-CB 3.27Å; T19-A23 PolarHBondContact O-N 3.21Å; L20-A23 WeakPolarHBondContact O-CB 3.38Å; L20-A23 PolarHBondContact O-N 2.77Å; E21-A23 VanDerWaalsContact C-N 3.29Å; E21-A23 PolarHBondContact O-N 3.35Å; A23-L26 PolarHBondContact O-N 3.5Å; A23-L27 WeakPolarHBondContact O-CB 3.34Å; A23-L27 VanDerWaalsContact O-CG 3.28Å; A23-L27 WeakPolarHBondContact O-CG 3.26Å; A23-L27 PolarHBondContact O-N 3.49Å
24L92.6Very high87.4Confident3 Ų382 Ų822%0.01641%0.407CS..Hα-helixtrans-64.1-41.3177-69.8170.5000111.8L20 E21 L26 L27 L28 L86 Q89 W90 L93L20-L24 HydrophobicContact CG-CD1 4.27Å; L20-L24 WeakPolarHBondContact O-CG 3.49Å; L20-L24 PolarHBondContact O-N 3.4Å; E21-L24 PolarHBondContact O-N 2.95Å; E21-L24 VanDerWaalsContact O-N 3.16Å; L24-L26 PolarHBondContact O-N 3.11Å; L24-L27 PolarHBondContact O-N 2.87Å; L24-L28 WeakPolarHBondContact O-CB 3.41Å; L24-L28 VanDerWaalsContact O-CG 3.29Å; L24-L28 WeakPolarHBondContact O-CG 3.24Å; L24-L28 PolarHBondContact O-N 3.42Å; L24-L86 HydrophobicContact CD1-CD1 3.54Å; L24-Q89 HydrophobicContact CD1-CB 4.28Å; L24-W90 HydrophobicContact CD2-CE3 3.92Å; L24-L93 HydrophobicContact CD2-CD1 3.52Å
25I92.9Very high87.6Confident98 Ų9882.6 Ų82.650%0.50341%0.407SS..Hα-helixtrans-59-47.7174.5-68.8167.2000110.5E21 L28 Y29E21-I25 HydrophobicContact CG-CD1 4.1Å; E21-I25 VanDerWaalsContact O-CG1 3.27Å; E21-I25 WeakPolarHBondContact O-CG1 3.36Å; E21-I25 PolarHBondContact O-N 2.82Å; I25-L28 PolarHBondContact O-N 2.87Å; I25-Y29 WeakPolarHBondContact O-CB 3.48Å; I25-Y29 PolarHBondContact O-N 3.48Å
26L92.8Very high87.3Confident101 Ų10182.2 Ų82.253%0.52942%0.42SS..Hα-helixtrans-62.7-45.6178.6-72.5171.2000111.5A22 A23 L24 Y29 F30A22-L26 WeakPolarHBondContact O-CG 3.47Å; A22-L26 PolarHBondContact O-N 3.49Å; A22-L26 VanDerWaalsContact O-N 3.07Å; A23-L26 PolarHBondContact O-N 3.5Å; L24-L26 PolarHBondContact O-N 3.11Å; L26-Y29 PolarHBondContact O-N 3.34Å; L26-F30 HydrophobicContact CD2-CE2 4.45Å; L26-F30 WeakPolarHBondContact O-CD2 3.31Å; L26-F30 PolarHBondContact O-N 2.79Å; L26-F30 VanDerWaalsContact O-N 3.09Å
27L90.1Very high86.7Confident55 Ų5577 Ų7729%0.28841%0.41SS..Hα-helixtrans-61.5-46.4177.4-71172000111.4A23 L24 Y29 F30 F31 L93A23-L27 WeakPolarHBondContact O-CB 3.34Å; A23-L27 VanDerWaalsContact O-CG 3.28Å; A23-L27 WeakPolarHBondContact O-CG 3.26Å; A23-L27 PolarHBondContact O-N 3.49Å; L24-L27 PolarHBondContact O-N 2.87Å; L27-Y29 VanDerWaalsContact C-N 3.33Å; L27-Y29 PolarHBondContact O-N 3.02Å; L27-F30 PolarHBondContact O-N 2.95Å; L27-F31 HydrophobicContact CD2-CD2 4.06Å; L27-F31 HydrophobicContact CD2-CE2 3.86Å; L27-F31 WeakPolarHBondContact O-CB 3.49Å; L27-F31 VanDerWaalsContact O-CD2 3.29Å; L27-F31 WeakPolarHBondContact O-CD2 3.45Å; L27-F31 PolarHBondContact O-N 2.81Å; L27-L93 HydrophobicContact CB-CD1 3.82Å; L27-L93 HydrophobicContact CB-CD2 4.02Å; L27-L93 HydrophobicContact CD1-CD1 4.1Å
28L88.8Confident85.5Confident38 Ų3884.3 Ų84.320%0.19945%0.445CS..Hα-helixtrans-61.8-41.8177.3-73.7168.1000111.3L24 I25 F30 T32 I92 L93L24-L28 WeakPolarHBondContact O-CB 3.41Å; L24-L28 VanDerWaalsContact O-CG 3.29Å; L24-L28 WeakPolarHBondContact O-CG 3.24Å; L24-L28 PolarHBondContact O-N 3.42Å; I25-L28 PolarHBondContact O-N 2.87Å; L28-F30 PolarHBondContact O-N 3.27Å; L28-T32 HydrophobicContact CD2-CG2 3.59Å; L28-T32 WeakPolarHBondContact O-CB 3.31Å; L28-T32 PolarHBondContact O-N 3.02Å; L28-T32 PolarHBondContact O-OG1 3.48Å; L28-I92 HydrophobicContact CD2-CG2 4.36Å; L28-L93 HydrophobicContact CD2-CD1 4.49Å; L28-L93 HydrophobicContact CD2-CD2 3.62Å; L28-L93 HydrophobicContact CD2-CG 3.85Å; L28-L93 HydrophobicContact CG-CD1 4.32Å; L28-L93 HydrophobicContact CG-CD2 3.99Å; L28-L93 HydrophobicContact CG-CG 4.2Å
29Y89.3Confident84.4Confident173 Ų17382.4 Ų82.468%0.67843%0.432SS*.Hα-helixtrans-59.1-44.2177.3174.6-99.5000112.8I25 L26 L27I25-Y29 WeakPolarHBondContact O-CB 3.48Å; I25-Y29 PolarHBondContact O-N 3.48Å; L26-Y29 PolarHBondContact O-N 3.34Å; L27-Y29 VanDerWaalsContact C-N 3.33Å; L27-Y29 PolarHBondContact O-N 3.02Å
30F87.1Confident83.5Confident127 Ų12784.1 Ų84.156%0.55744%0.438SS*.Hα-helixtrans-80-37.3-177.8-74.3-66000113.3L26 L27 L28L26-F30 HydrophobicContact CD2-CE2 4.45Å; L26-F30 WeakPolarHBondContact O-CD2 3.31Å; L26-F30 PolarHBondContact O-N 2.79Å; L26-F30 VanDerWaalsContact O-N 3.09Å; L27-F30 PolarHBondContact O-N 2.95Å; L28-F30 PolarHBondContact O-N 3.27Å
31F85.1Confident82.7Confident68 Ų6889.9 Ų89.930%0.29846%0.464SS..Hα-helixtrans-104.5-6.2-168.2-66.6-75.7000114.6L27 F97 K105 V106L27-F31 HydrophobicContact CD2-CD2 4.06Å; L27-F31 HydrophobicContact CD2-CE2 3.86Å; L27-F31 WeakPolarHBondContact O-CB 3.49Å; L27-F31 VanDerWaalsContact O-CD2 3.29Å; L27-F31 WeakPolarHBondContact O-CD2 3.45Å; L27-F31 PolarHBondContact O-N 2.81Å; F31-F97 HydrophobicContact CB-CE1 4.33Å; F31-F97 HydrophobicContact CB-CZ 4.34Å; F31-F97 AromaticContact CD1-CE1 3.71Å; F31-F97 HydrophobicContact CD1-CE1 3.71Å; F31-F97 HydrophobicContact CD1-CZ 4.24Å; F31-F97 HydrophobicContact CD2-CE1 4.15Å; F31-F97 AromaticContact CD2-CZ 3.85Å; F31-F97 HydrophobicContact CD2-CZ 3.85Å; F31-F97 AromaticContact CE1-CE1 3.98Å; F31-F97 HydrophobicContact CE1-CE1 3.98Å; F31-F97 HydrophobicContact CE2-CE1 4.42Å; F31-F97 HydrophobicContact CE2-CZ 4.2Å; F31-F97 AromaticContact CG-CE1 3.8Å; F31-F97 HydrophobicContact CG-CE1 3.8Å; F31-F97 AromaticContact CG-CZ 3.88Å; F31-F97 HydrophobicContact CG-CZ 3.88Å; F31-F97 HydrophobicContact CZ-CE1 4.34Å; F31-K105 CarbonylContact O-C 3.57Å; F31-K105 WeakPolarHBondContact O-CA 3.35Å; F31-V106 WeakPolarHBondContact O-CG2 3.45Å; F31-V106 PolarHBondContact O-N 3.39Å
32T85.9Confident81.7Confident21 Ų2194.8 Ų94.813%0.12949%0.485CS..EExtended strand (participates in β ladder)trans-124.2154.7-177.674.30000113.7L28 L93 V106 I108L28-T32 HydrophobicContact CD2-CG2 3.59Å; L28-T32 WeakPolarHBondContact O-CB 3.31Å; L28-T32 PolarHBondContact O-N 3.02Å; L28-T32 PolarHBondContact O-OG1 3.48Å; T32-L93 HydrophobicContact CG2-CD2 4.27Å; T32-V106 WeakPolarHBondContact CA-O 3.48Å; T32-V106 HydrophobicContact CG2-CB 4.11Å; T32-V106 HydrophobicContact CG2-CG2 4.48Å; T32-I108 HydrophobicContact CG2-CD1 4.2Å; T32-I108 HydrophobicContact CG2-CG1 4.45Å
33H86.8Confident80.7Confident80 Ų8094 Ų9437%0.3748%0.482SS..EExtended strand (participates in β ladder)trans-148.8157.4168.767-60.3000109.9K105 V106 V107 I108H33-K105 PolarHBondContact CE1-O 3.27Å; H33-K105 WeakPolarHBondContact ND1-CB 3.39Å; H33-V106 PolarHBondContact N-O 2.81Å; H33-V106 PolarHBondContact ND1-O 3.21Å; H33-V107 WeakPolarHBondContact CE1-CG2 3.42Å; H33-V107 WeakPolarHBondContact O-CA 3.32Å; H33-I108 PolarHBondContact O-N 3.49Å
34Y83.6Confident79.9Confident186 Ų18695.8 Ų95.873%0.72949%0.485SS*.EExtended strand (participates in β ladder)trans-78.7146.3175.6-67-66.6000111.2A36 I108Y34-A36 PolarHBondContact O-N 3.33Å; Y34-I108 HydrophobicContact CD1-CB 4.09Å; Y34-I108 HydrophobicContact CD1-CG2 4.25Å; Y34-I108 HydrophobicContact CE1-CB 4.33Å; Y34-I108 HydrophobicContact CE1-CD1 4.41Å; Y34-I108 HydrophobicContact CE1-CG2 4.16Å
35D77.2Confident79.4Confident72 Ų7299.1 Ų99.139%0.38551%0.505SS..  trans-62.5130.1167-165.5-1.4000109.6S37 V107 I108 T109D35-S37 VanDerWaalsContact C-N 3.31Å; D35-S37 WeakPolarHBondContact OD1-CB 3.41Å; D35-S37 PolarHBondContact OD1-N 3.25Å; D35-S37 PolarHBondContact OD1-OG 2.97Å; D35-S37 PolarHBondContact OD2-OG 2.85Å; D35-V107 HydrophobicContact CB-CG1 3.58Å; D35-I108 PolarHBondContact N-O 3.12Å; D35-T109 HydrophobicContact CB-CG2 4.2Å
36A70.6Confident78.6Confident102 Ų10296.3 Ų96.384%0.84350%0.497SS*.  trans-89.2-1.8176.400000112.1Y34Y34-A36 PolarHBondContact O-N 3.33Å
37S68.6Low77.8Confident68 Ų6892.8 Ų92.848%0.47648%0.48SS..  trans-68.9133.3-178.980.10000112.1D35 E39D35-S37 VanDerWaalsContact C-N 3.31Å; D35-S37 WeakPolarHBondContact OD1-CB 3.41Å; D35-S37 PolarHBondContact OD1-N 3.25Å; D35-S37 PolarHBondContact OD1-OG 2.97Å; D35-S37 PolarHBondContact OD2-OG 2.85Å; S37-E39 PolarHBondContact O-N 3.27Å; S37-E39 VanDerWaalsContact O-N 3.11Å
38L58.8Low77.4Confident180 Ų18096.5 Ų96.594%0.94249%0.491SS*.  trans-75.592.6170.5-98.8150.5000108.2
39E62.8Low77.3Confident83 Ų8399.7 Ų99.739%0.38851%0.505SS..  trans-62.7140.9170.6-78.8-170.7168.400110.7S37 Q41 L44S37-E39 PolarHBondContact O-N 3.27Å; S37-E39 VanDerWaalsContact O-N 3.11Å; E39-Q41 PolarHBondContact O-N 3.16Å; E39-L44 HydrophobicContact CB-CB 4.49Å; E39-L44 HydrophobicContact CB-CD1 4.44Å; E39-L44 VanDerWaalsContact OE2-CD1 3.31Å; E39-L44 WeakPolarHBondContact OE2-CD1 3.29Å
40D70.9Confident77Confident112 Ų11292.2 Ų92.260%0.59948%0.478SS*.  trans-54.2131.5170.3173.239.1000110.3K42 G43 L44D40-K42 PolarHBondContact O-N 3.04Å; D40-K42 VanDerWaalsContact O-N 3.1Å; D40-G43 WeakPolarHBondContact O-CA 3.48Å; D40-G43 PolarHBondContact O-N 3.37Å; D40-L44 PolarHBondContact O-N 3.32Å
41Q72.9Confident76.9Confident159 Ų15986.9 Ų86.974%0.74346%0.459SS*.Hα-helixtrans-56.7-34.6-172.5-170.4179.3-3.500112.3E39 V45E39-Q41 PolarHBondContact O-N 3.16Å; Q41-V45 WeakPolarHBondContact O-CG2 3.19Å; Q41-V45 PolarHBondContact O-N 3Å; Q41-V45 VanDerWaalsContact O-N 3.11Å
42K72.8Confident77.1Confident173 Ų17387.6 Ų87.675%0.75246%0.463SS*.Hα-helixtrans-70.4-41176.3-67179.8-179.31750112D40 L44 V45 A46D40-K42 PolarHBondContact O-N 3.04Å; D40-K42 VanDerWaalsContact O-N 3.1Å; K42-L44 VanDerWaalsContact C-N 3.33Å; K42-V45 PolarHBondContact O-N 3.44Å; K42-A46 PolarHBondContact O-N 2.98Å; K42-A46 VanDerWaalsContact O-N 3.15Å
43G72.8Confident77.3Confident33 Ų3388.2 Ų88.234%0.3447%0.465SS..Hα-helixtrans-62.7-38.917500000112.7D40 S47D40-G43 WeakPolarHBondContact O-CA 3.48Å; D40-G43 PolarHBondContact O-N 3.37Å; G43-S47 VanDerWaalsContact O-CA 3.32Å; G43-S47 WeakPolarHBondContact O-CA 3.46Å; G43-S47 WeakPolarHBondContact O-CB 3.33Å; G43-S47 PolarHBondContact O-N 3.27Å; G43-S47 PolarHBondContact O-OG 2.95Å
44L75.9Confident77.5Confident79 Ų7984.4 Ų84.441%0.41445%0.448SS..Hα-helixtrans-67.9-42177-172.376.9000112.4E39 D40 K42 S47 Y48 L110E39-L44 HydrophobicContact CB-CB 4.49Å; E39-L44 HydrophobicContact CB-CD1 4.44Å; E39-L44 VanDerWaalsContact OE2-CD1 3.31Å; E39-L44 WeakPolarHBondContact OE2-CD1 3.29Å; D40-L44 PolarHBondContact O-N 3.32Å; K42-L44 VanDerWaalsContact C-N 3.33Å; L44-S47 CarbonylContact O-C 3.36Å; L44-S47 WeakPolarHBondContact O-CA 3.3Å; L44-S47 PolarHBondContact O-N 2.81Å; L44-Y48 WeakPolarHBondContact O-CB 3.32Å; L44-Y48 PolarHBondContact O-N 2.88Å; L44-L110 HydrophobicContact CD1-CD1 3.51Å; L44-L110 HydrophobicContact CD1-CG 4.47Å; L44-L110 HydrophobicContact CG-CD1 4.36Å
45V81.2Confident77.8Confident73 Ų7378.6 Ų78.644%0.44243%0.432SS..Hα-helixtrans-66-46.2177.8170.90000111.1Q41 K42 S47 Y48 Q49Q41-V45 WeakPolarHBondContact O-CG2 3.19Å; Q41-V45 PolarHBondContact O-N 3Å; Q41-V45 VanDerWaalsContact O-N 3.11Å; K42-V45 PolarHBondContact O-N 3.44Å; V45-S47 VanDerWaalsContact C-N 3.32Å; V45-Y48 PolarHBondContact O-N 3.48Å; V45-Q49 WeakPolarHBondContact O-CG 3.48Å; V45-Q49 PolarHBondContact O-N 3.46Å
46A76.3Confident78.6Confident40 Ų4077.1 Ų77.133%0.33143%0.425SS..Hα-helixtrans-63.7-42174.200000111.2K42 Y48 V50 R114K42-A46 PolarHBondContact O-N 2.98Å; K42-A46 VanDerWaalsContact O-N 3.15Å; A46-Y48 PolarHBondContact O-N 3.36Å; A46-V50 PolarHBondContact O-N 3.5Å; A46-R114 PolarHBondContact O-NH2 2.54Å
47S76Confident79.6Confident26 Ų2672.6 Ų72.618%0.18239%0.387CS..Hα-helixtrans-23.2-69.3155.1-11.30000114.8G43 L44 V45 R114G43-S47 VanDerWaalsContact O-CA 3.32Å; G43-S47 WeakPolarHBondContact O-CA 3.46Å; G43-S47 WeakPolarHBondContact O-CB 3.33Å; G43-S47 PolarHBondContact O-N 3.27Å; G43-S47 PolarHBondContact O-OG 2.95Å; L44-S47 CarbonylContact O-C 3.36Å; L44-S47 WeakPolarHBondContact O-CA 3.3Å; L44-S47 PolarHBondContact O-N 2.81Å; V45-S47 VanDerWaalsContact C-N 3.32Å; S47-R114 PolarHBondContact O-NE 3Å; S47-R114 PolarHBondContact O-NH2 2.98Å; S47-R114 VanDerWaalsContact OG-CZ 3.3Å; S47-R114 PolarHBondContact OG-NH1 2.89Å; S47-R114 PolarHBondContact OG-NH2 2.9Å
48Y81.8Confident80.6Confident133 Ų13369.3 Ų69.352%0.52236%0.364SS..Hα-helixtrans-73.9-44.2-171-179.2-108.2000112.6L44 V45 A46 V50 G51 Q52L44-Y48 WeakPolarHBondContact O-CB 3.32Å; L44-Y48 PolarHBondContact O-N 2.88Å; V45-Y48 PolarHBondContact O-N 3.48Å; A46-Y48 PolarHBondContact O-N 3.36Å; Y48-V50 PolarHBondContact O-N 3.28Å; Y48-G51 CarbonylContact O-C 3.55Å; Y48-G51 WeakPolarHBondContact O-CA 3.36Å; Y48-G51 PolarHBondContact O-N 3.45Å; Y48-Q52 HydrophobicContact CD1-CG 4.14Å; Y48-Q52 HydrophobicContact CE1-CG 3.79Å; Y48-Q52 HydrophobicContact CE2-CG 4.24Å; Y48-Q52 PolarHBondContact O-N 3.3Å; Y48-Q52 PolarHBondContact OH-NE2 2.98Å
49Q86.2Confident82.2Confident105 Ų10561.6 Ų61.649%0.49133%0.326SS..Hα-helixtrans-55.8-49.3-178.3-75.6173.7-15.900112.6V45 G51 Q52 D53V45-Q49 WeakPolarHBondContact O-CG 3.48Å; V45-Q49 PolarHBondContact O-N 3.46Å; Q49-G51 VanDerWaalsContact C-N 3.26Å; Q49-G51 PolarHBondContact O-N 3.41Å; Q49-Q52 WeakPolarHBondContact O-CB 3.42Å; Q49-Q52 PolarHBondContact O-N 3.48Å; Q49-Q52 VanDerWaalsContact O-N 3.13Å; Q49-D53 VanDerWaalsContact O-CG 3.31Å; Q49-D53 PolarHBondContact O-N 2.97Å
50V83.6Confident83.6Confident17 Ų1760.8 Ų60.810%0.10332%0.324CS..Hα-helixtrans-63.7-34.9177.9178.60000111.4A46 Y48 D53 L54 P226A46-V50 PolarHBondContact O-N 3.5Å; Y48-V50 PolarHBondContact O-N 3.28Å; V50-D53 PolarHBondContact O-N 3.02Å; V50-L54 VanDerWaalsContact O-CG 3.31Å; V50-L54 WeakPolarHBondContact O-CG 3.48Å; V50-L54 PolarHBondContact O-N 3.26Å; V50-L54 VanDerWaalsContact O-N 3.1Å; V50-P226 HydrophobicContact CG1-CB 3.55Å
51G84.7Confident84.5Confident15 Ų1555.4 Ų55.416%0.15530%0.295CS..Hα-helixtrans-65.4-39.4174.800000112.7Y48 Q49 T55Y48-G51 CarbonylContact O-C 3.55Å; Y48-G51 WeakPolarHBondContact O-CA 3.36Å; Y48-G51 PolarHBondContact O-N 3.45Å; Q49-G51 VanDerWaalsContact C-N 3.26Å; Q49-G51 PolarHBondContact O-N 3.41Å; G51-T55 WeakPolarHBondContact O-CB 3.25Å; G51-T55 PolarHBondContact O-N 3.38Å; G51-T55 VanDerWaalsContact O-N 3.08Å; G51-T55 PolarHBondContact O-OG1 3.26Å
52Q89.6Confident85.2Confident83 Ų8348.4 Ų48.439%0.38826%0.263SS..Hα-helixtrans-63.2-47.4173.9-68.9-175.1-52.200111.3Y48 Q49 L54 T55 V56Y48-Q52 HydrophobicContact CD1-CG 4.14Å; Y48-Q52 HydrophobicContact CE1-CG 3.79Å; Y48-Q52 HydrophobicContact CE2-CG 4.24Å; Y48-Q52 PolarHBondContact O-N 3.3Å; Y48-Q52 PolarHBondContact OH-NE2 2.98Å; Q49-Q52 WeakPolarHBondContact O-CB 3.42Å; Q49-Q52 PolarHBondContact O-N 3.48Å; Q49-Q52 VanDerWaalsContact O-N 3.13Å; Q52-L54 VanDerWaalsContact C-N 3.33Å; Q52-L54 PolarHBondContact O-N 3.08Å; Q52-T55 PolarHBondContact O-N 2.93Å; Q52-T55 VanDerWaalsContact O-N 3.09Å; Q52-V56 WeakPolarHBondContact O-CG2 3.39Å; Q52-V56 PolarHBondContact O-N 3.3Å
53D90.9Very high85.9Confident33 Ų3340.1 Ų40.118%0.17623%0.227CC..Hα-helixtrans-57.2-46.3179.2-66.4-9.5000111.6Q49 V50 T55 V56 M57 F219 S222Q49-D53 VanDerWaalsContact O-CG 3.31Å; Q49-D53 PolarHBondContact O-N 2.97Å; V50-D53 PolarHBondContact O-N 3.02Å; D53-T55 VanDerWaalsContact C-N 3.33Å; D53-T55 PolarHBondContact O-N 2.91Å; D53-V56 PolarHBondContact O-N 3.47Å; D53-M57 VanDerWaalsContact O-CB 3.3Å; D53-M57 WeakPolarHBondContact O-CB 3.12Å; D53-M57 PolarHBondContact O-N 3.44Å; D53-F219 HydrophobicContact CB-CB 4.49Å; D53-F219 HydrophobicContact CB-CD1 3.67Å; D53-F219 HydrophobicContact CB-CE1 4.33Å; D53-F219 HydrophobicContact CB-CG 4.42Å; D53-F219 VanDerWaalsContact CG-CD1 3.49Å; D53-F219 WeakPolarHBondContact OD1-CD1 3.42Å; D53-F219 WeakPolarHBondContact OD1-CE1 3.37Å; D53-S222 VanDerWaalsContact OD2-CB 3.24Å; D53-S222 WeakPolarHBondContact OD2-CB 3.24Å; D53-S222 PolarHBondContact OD2-OG 2.94Å
54L89.9Confident86.6Confident0 Ų041 Ų410%022%0.221CC..Hα-helixtrans-60-43.2175.6-71.4175.3000111.9V50 Q52 M57 A58 R114 T117 M118 M121 V223 P226V50-L54 VanDerWaalsContact O-CG 3.31Å; V50-L54 WeakPolarHBondContact O-CG 3.48Å; V50-L54 PolarHBondContact O-N 3.26Å; V50-L54 VanDerWaalsContact O-N 3.1Å; Q52-L54 VanDerWaalsContact C-N 3.33Å; Q52-L54 PolarHBondContact O-N 3.08Å; L54-M57 PolarHBondContact O-N 3.34Å; L54-A58 WeakPolarHBondContact O-CB 3.3Å; L54-A58 PolarHBondContact O-N 3.29Å; L54-R114 HydrophobicContact CD1-CB 3.95Å; L54-R114 HydrophobicContact CD1-CG 4.12Å; L54-T117 HydrophobicContact CB-CG2 3.91Å; L54-M118 HydrophobicContact CD1-CG 4.12Å; L54-M118 HydrophobicContact CD2-CG 4.12Å; L54-M118 HydrophobicContact CD2-SD 4.35Å; L54-M121 HydrophobicContact CD2-CE 4.13Å; L54-M121 HydrophobicContact CD2-SD 4.07Å; L54-V223 HydrophobicContact CD2-CB 4.13Å; L54-V223 HydrophobicContact CD2-CG1 4.31Å; L54-V223 HydrophobicContact CD2-CG2 3.61Å; L54-P226 HydrophobicContact CD1-CB 4.26Å; L54-P226 HydrophobicContact CD2-CG 4.49Å
55T91.1Very high86.9Confident64 Ų6437.3 Ų37.339%0.39320%0.202SC..Hα-helixtrans-69-42.3-178.4-54.10000111.4G51 Q52 D53 M57 A58 A59G51-T55 WeakPolarHBondContact O-CB 3.25Å; G51-T55 PolarHBondContact O-N 3.38Å; G51-T55 VanDerWaalsContact O-N 3.08Å; G51-T55 PolarHBondContact O-OG1 3.26Å; Q52-T55 PolarHBondContact O-N 2.93Å; Q52-T55 VanDerWaalsContact O-N 3.09Å; D53-T55 VanDerWaalsContact C-N 3.33Å; D53-T55 PolarHBondContact O-N 2.91Å; T55-M57 VanDerWaalsContact C-N 3.35Å; T55-A58 PolarHBondContact O-N 3.21Å; T55-A59 VanDerWaalsContact O-CB 3.25Å; T55-A59 WeakPolarHBondContact O-CB 3.49Å; T55-A59 PolarHBondContact O-N 2.82Å
56V93.1Very high86.6Confident42 Ų4234.6 Ų34.626%0.25519%0.186SC..Hα-helixtrans-62.1-45.1175.1167.90000110.3Q52 D53 A58 L60 G61 F215 F219Q52-V56 WeakPolarHBondContact O-CG2 3.39Å; Q52-V56 PolarHBondContact O-N 3.3Å; D53-V56 PolarHBondContact O-N 3.47Å; V56-A58 PolarHBondContact O-N 3.23Å; V56-L60 HydrophobicContact CG1-CD1 4.28Å; V56-L60 WeakPolarHBondContact O-CA 3.47Å; V56-L60 WeakPolarHBondContact O-CB 3.48Å; V56-L60 PolarHBondContact O-N 3.35Å; V56-G61 PolarHBondContact O-N 2.97Å; V56-F215 HydrophobicContact CG1-CD1 3.68Å; V56-F215 HydrophobicContact CG1-CE1 4.08Å; V56-F219 HydrophobicContact CB-CE2 4.5Å; V56-F219 HydrophobicContact CG1-CD2 3.78Å; V56-F219 HydrophobicContact CG1-CE2 3.59Å; V56-F219 HydrophobicContact CG1-CZ 4.24Å
57M90.9Very high86.5Confident6 Ų632.7 Ų32.73%0.0317%0.17CC..Iπ-helixtrans-61.3-44.4176.9-170-166.466.700111.6D53 L54 T55 G61 L62 M121 L216 F219 V223D53-M57 VanDerWaalsContact O-CB 3.3Å; D53-M57 WeakPolarHBondContact O-CB 3.12Å; D53-M57 PolarHBondContact O-N 3.44Å; L54-M57 PolarHBondContact O-N 3.34Å; T55-M57 VanDerWaalsContact C-N 3.35Å; M57-G61 CarbonylContact O-C 3.57Å; M57-G61 WeakPolarHBondContact O-CA 3.32Å; M57-G61 PolarHBondContact O-N 3.19Å; M57-L62 PolarHBondContact O-N 2.92Å; M57-M121 HydrophobicContact CE-CE 3.47Å; M57-M121 VanDerWaalsContact CE-CE 3.47Å; M57-M121 HydrophobicContact CE-CG 4.32Å; M57-M121 HydrophobicContact CE-SD 3.37Å; M57-M121 WeakPolarHBondContact CE-SD 3.39Å; M57-L216 HydrophobicContact CG-CD2 3.23Å; M57-L216 HydrophobicContact CG-CG 4.44Å; M57-L216 HydrophobicContact SD-CD2 3.84Å; M57-F219 HydrophobicContact CB-CB 4.3Å; M57-V223 HydrophobicContact CB-CG2 4.46Å; M57-V223 HydrophobicContact CE-CB 4.16Å; M57-V223 HydrophobicContact CE-CG1 3.77Å; M57-V223 HydrophobicContact CE-CG2 3.4Å; M57-V223 HydrophobicContact CG-CG2 4.38Å; M57-V223 HydrophobicContact SD-CB 4.05Å; M57-V223 HydrophobicContact SD-CG1 4.15Å; M57-V223 HydrophobicContact SD-CG2 3.17Å; M57-V223 WeakPolarHBondContact SD-CG2 3.47Å
58A91.6Very high86Confident0 Ų033 Ų330%017%0.169CC..Iπ-helixtrans-68.7-50.4-18000000112.3L54 T55 V56 L84 M121 L124L54-A58 WeakPolarHBondContact O-CB 3.3Å; L54-A58 PolarHBondContact O-N 3.29Å; T55-A58 PolarHBondContact O-N 3.21Å; V56-A58 PolarHBondContact O-N 3.23Å; A58-L84 HydrophobicContact CB-CD1 3.77Å; A58-L84 HydrophobicContact CB-CD2 3.64Å; A58-L84 HydrophobicContact CB-CG 4.33Å; A58-M121 HydrophobicContact CB-CG 3.64Å; A58-M121 HydrophobicContact CB-SD 4.24Å; A58-L124 HydrophobicContact CB-CD1 4.13Å
59A91.8Very high85.2Confident18 Ų1830.4 Ų30.415%0.14916%0.161CC..Iπ-helixtrans-75.5-50.2-173.700000112.7T55 G63 L81 L84T55-A59 VanDerWaalsContact O-CB 3.25Å; T55-A59 WeakPolarHBondContact O-CB 3.49Å; T55-A59 PolarHBondContact O-N 2.82Å; A59-G63 WeakPolarHBondContact O-CA 3.43Å; A59-L81 HydrophobicContact CB-CD1 4.2Å; A59-L84 HydrophobicContact CB-CD2 3.9Å
60L91.3Very high84Confident65 Ų6532.4 Ų32.434%0.3416%0.164SC..Iπ-helixtrans-90.6-46.3-177.6-58.6-178.5000111.1V56 F64 F215V56-L60 HydrophobicContact CG1-CD1 4.28Å; V56-L60 WeakPolarHBondContact O-CA 3.47Å; V56-L60 WeakPolarHBondContact O-CB 3.48Å; V56-L60 PolarHBondContact O-N 3.35Å; L60-F64 HydrophobicContact CB-CD2 4.42Å; L60-F64 HydrophobicContact CD2-CD2 4.34Å; L60-F64 HydrophobicContact CD2-CE2 3.94Å; L60-F64 VanDerWaalsContact O-CB 3.25Å; L60-F64 WeakPolarHBondContact O-CB 3.32Å; L60-F64 WeakPolarHBondContact O-CD2 3.27Å; L60-F64 PolarHBondContact O-N 2.72Å; L60-F215 HydrophobicContact CB-CD2 3.91Å; L60-F215 HydrophobicContact CB-CE2 4.19Å; L60-F215 HydrophobicContact CB-CG 4.1Å; L60-F215 HydrophobicContact CD1-CD1 4.44Å; L60-F215 HydrophobicContact CD1-CE1 3.99Å; L60-F215 HydrophobicContact CD1-CE2 4.05Å; L60-F215 HydrophobicContact CD1-CZ 3.78Å
61G90.1Very high83.3Confident0 Ų036.8 Ų36.80%018%0.179CC..Iπ-helixtrans-61.3-68.9-177.700000112.9V56 M57 G63 L65 G212V56-G61 PolarHBondContact O-N 2.97Å; M57-G61 CarbonylContact O-C 3.57Å; M57-G61 WeakPolarHBondContact O-CA 3.32Å; M57-G61 PolarHBondContact O-N 3.19Å; G61-G63 VanDerWaalsContact C-N 3.33Å; G61-G63 PolarHBondContact O-N 2.92Å; G61-L65 WeakPolarHBondContact O-CB 3.38Å; G61-L65 PolarHBondContact O-N 3.08Å; G61-G212 WeakPolarHBondContact CA-O 3.46Å; G61-G212 WeakPolarHBondContact O-CA 3.3Å
62L88.3Confident82.7Confident11 Ų1136.2 Ų36.26%0.05817%0.172CC..Iπ-helixtrans-67.1-34.9-179.6-64174.3000112.4M57 T66 M121 L124 I125 L216M57-L62 PolarHBondContact O-N 2.92Å; L62-T66 PolarHBondContact O-N 3.02Å; L62-T66 PolarHBondContact O-OG1 2.99Å; L62-M121 HydrophobicContact CD1-CG 4.5Å; L62-L124 HydrophobicContact CB-CB 4.18Å; L62-L124 HydrophobicContact CB-CD2 4.12Å; L62-L124 HydrophobicContact CD1-CB 3.5Å; L62-L124 HydrophobicContact CD1-CD1 4.45Å; L62-L124 HydrophobicContact CD1-CG 4.41Å; L62-L124 HydrophobicContact CG-CB 4.45Å; L62-I125 HydrophobicContact CD1-CG1 4.15Å; L62-I125 HydrophobicContact CD2-CG1 4.33Å; L62-L216 HydrophobicContact CD2-CD1 4.23Å; L62-L216 HydrophobicContact CD2-CD2 4.03Å; L62-L216 HydrophobicContact CG-CD2 4.08Å
63G86.3Confident82.2Confident0 Ų033.7 Ų33.70%016%0.164CC..Hα-helixtrans-55.2-55.6174.700000112.4A59 G61 T66 S76A59-G63 WeakPolarHBondContact O-CA 3.43Å; G61-G63 VanDerWaalsContact C-N 3.33Å; G61-G63 PolarHBondContact O-N 2.92Å; G63-T66 PolarHBondContact O-OG1 3.07Å; G63-S76 PolarHBondContact O-OG 3.5Å
64F87.4Confident81.7Confident51 Ų5139.7 Ų39.722%0.22418%0.184CC..Hα-helixtrans-78.4-29.6-180-80.4-73.7000113.4L60 T66 S67 V77 S208 A209L60-F64 HydrophobicContact CB-CD2 4.42Å; L60-F64 HydrophobicContact CD2-CD2 4.34Å; L60-F64 HydrophobicContact CD2-CE2 3.94Å; L60-F64 VanDerWaalsContact O-CB 3.25Å; L60-F64 WeakPolarHBondContact O-CB 3.32Å; L60-F64 WeakPolarHBondContact O-CD2 3.27Å; L60-F64 PolarHBondContact O-N 2.72Å; F64-T66 PolarHBondContact O-N 3.27Å; F64-S67 WeakPolarHBondContact O-CB 3.42Å; F64-S67 PolarHBondContact O-N 3.15Å; F64-S67 PolarHBondContact O-OG 2.94Å; F64-V77 HydrophobicContact CD1-CG2 3.74Å; F64-V77 HydrophobicContact CE1-CG2 3.75Å; F64-V77 HydrophobicContact CE2-CG2 4.5Å; F64-V77 HydrophobicContact CG-CG2 4.15Å; F64-V77 HydrophobicContact CZ-CG1 4.48Å; F64-V77 HydrophobicContact CZ-CG2 4.14Å; F64-S208 WeakPolarHBondContact CB-O 3.35Å; F64-A209 WeakPolarHBondContact O-CA 3.4Å
65L82.9Confident81.5Confident1 Ų139.7 Ų39.71%0.00518%0.184CC..Hα-helixtrans-57.2-37.1179.9-174.873.5000112.2G61 S67 N68 A213 L216 L275 M328 F332G61-L65 WeakPolarHBondContact O-CB 3.38Å; G61-L65 PolarHBondContact O-N 3.08Å; L65-S67 PolarHBondContact O-N 2.75Å; L65-N68 PolarHBondContact O-ND2 2.87Å; L65-N68 VanDerWaalsContact O-ND2 3.11Å; L65-A213 HydrophobicContact CD1-CB 4Å; L65-L216 HydrophobicContact CB-CD1 4Å; L65-L216 HydrophobicContact CD1-CD1 4.14Å; L65-L216 HydrophobicContact CD2-CD1 3.52Å; L65-L216 HydrophobicContact CG-CD1 4.08Å; L65-L275 HydrophobicContact CD1-CD1 4.15Å; L65-L275 HydrophobicContact CD2-CD1 4.31Å; L65-M328 HydrophobicContact CD1-SD 4.06Å; L65-M328 HydrophobicContact CD2-CE 3.23Å; L65-M328 HydrophobicContact CD2-SD 3.63Å; L65-M328 HydrophobicContact CG-CE 3.64Å; L65-M328 HydrophobicContact CG-SD 3.72Å; L65-F332 HydrophobicContact CD2-CZ 4.41Å
66T75.6Confident81.1Confident17 Ų1736.6 Ų36.610%0.10417%0.165CC..G310 helixtrans-80.7-0.8179.458.30000113.8L62 G63 F64 N68 S76 N80 L131L62-T66 PolarHBondContact O-N 3.02Å; L62-T66 PolarHBondContact O-OG1 2.99Å; G63-T66 PolarHBondContact O-OG1 3.07Å; F64-T66 PolarHBondContact O-N 3.27Å; T66-N68 PolarHBondContact O-N 3.25Å; T66-S76 PolarHBondContact O-OG 2.97Å; T66-S76 PolarHBondContact OG1-OG 2.74Å; T66-N80 PolarHBondContact OG1-ND2 3.13Å; T66-L131 HydrophobicContact CG2-CD1 3.86Å
67S73.6Confident80.9Confident0 Ų036.5 Ų36.50%017%0.165CC..G310 helixtrans-83.815.7-177.576.20000114.6F64 L65 F69 S73 S76 S206 S208F64-S67 WeakPolarHBondContact O-CB 3.42Å; F64-S67 PolarHBondContact O-N 3.15Å; F64-S67 PolarHBondContact O-OG 2.94Å; L65-S67 PolarHBondContact O-N 2.75Å; S67-F69 PolarHBondContact O-N 3.5Å; S67-S73 PolarHBondContact O-OG 2.69Å; S67-S76 WeakPolarHBondContact CA-OG 3.43Å; S67-S76 PolarHBondContact N-OG 3.23Å; S67-S76 VanDerWaalsContact N-OG 3.12Å; S67-S206 PolarHBondContact O-OG 2.61Å; S67-S206 VanDerWaalsContact O-OG 3.12Å; S67-S208 PolarHBondContact OG-OG 3.41Å
68N65.6Low80.9Confident31 Ų3137.9 Ų37.917%0.16618%0.177CC..G310 helixtrans-58-18.6-179.8-78.7-50.7000114.4L65 T66 A209 H271L65-N68 PolarHBondContact O-ND2 2.87Å; L65-N68 VanDerWaalsContact O-ND2 3.11Å; T66-N68 PolarHBondContact O-N 3.25Å; N68-A209 HydrophobicContact CB-CB 4.43Å; N68-A209 WeakPolarHBondContact OD1-CB 3.3Å; N68-H271 PolarHBondContact OD1-CE1 2.98Å; N68-H271 PolarHBondContact OD1-ND1 2.88Å; N68-H271 VanDerWaalsContact OD1-ND1 3.16Å
69F64.5Low80.8Confident79 Ų7938.6 Ų38.635%0.34618%0.18SC..SBendtrans-93123.1-178.6-61.4-75.2000111.4S67 R71 H72 S73 F402S67-F69 PolarHBondContact O-N 3.5Å; F69-R71 PolarHBondContact O-N 3.36Å; F69-H72 HydrophobicContact CB-CB 3.93Å; F69-H72 PolarHBondContact O-N 3.32Å; F69-S73 PolarHBondContact O-N 2.88Å; F69-S73 PolarHBondContact O-OG 3.4Å; F69-F402 HydrophobicContact CD1-CD1 4.16Å; F69-F402 HydrophobicContact CD1-CG 4.37Å; F69-F402 AromaticContact CD2-CD1 3.64Å; F69-F402 HydrophobicContact CD2-CD1 3.64Å; F69-F402 HydrophobicContact CD2-CE1 4.05Å; F69-F402 HydrophobicContact CE1-CD1 4.16Å; F69-F402 HydrophobicContact CE1-CE1 4.27Å; F69-F402 AromaticContact CE2-CD1 3.64Å; F69-F402 HydrophobicContact CE2-CD1 3.64Å; F69-F402 AromaticContact CE2-CE1 3.54Å; F69-F402 HydrophobicContact CE2-CE1 3.54Å; F69-F402 HydrophobicContact CG-CB 4.42Å; F69-F402 AromaticContact CG-CD1 3.91Å; F69-F402 HydrophobicContact CG-CD1 3.91Å; F69-F402 HydrophobicContact CG-CG 4.38Å; F69-F402 AromaticContact CZ-CD1 3.91Å; F69-F402 HydrophobicContact CZ-CD1 3.91Å; F69-F402 AromaticContact CZ-CE1 3.67Å; F69-F402 HydrophobicContact CZ-CE1 3.67Å; F69-F402 HydrophobicContact CZ-CZ 4.24Å
70R61.5Low80.8Confident148 Ų14837.7 Ų37.756%0.55817%0.173SC*.THydrogen-bonded Turntrans-53-32.5-175.6-169.9178.3-179.9-162.9-1.2114.5
71R68Low81Confident109 Ų10939.2 Ų39.241%0.41118%0.181SC..THydrogen-bonded Turntrans-106.88.2-178.6-65.5-172.9-178.8178.54.2113.9F69 F402 D403 D404F69-R71 PolarHBondContact O-N 3.36Å; R71-F402 CarbonylContact C-O 3.59Å; R71-F402 WeakPolarHBondContact CB-O 3.45Å; R71-D403 CarbonylContact O-C 3.48Å; R71-D404 WeakPolarHBondContact O-CA 3.46Å; R71-D404 WeakPolarHBondContact O-CB 3.31Å; R71-D404 PolarHBondContact O-N 3.11Å
72H73.5Confident81.2Confident2 Ų242.4 Ų42.41%0.00919%0.194CC..SBendtrans-126.711.6-178.8-167.5-98.3000113.6F69 W74 S75 S76 G132 F402 D404F69-H72 HydrophobicContact CB-CB 3.93Å; F69-H72 PolarHBondContact O-N 3.32Å; H72-W74 VanDerWaalsContact C-N 3.33Å; H72-W74 PolarHBondContact O-N 3.38Å; H72-S75 WeakPolarHBondContact NE2-CB 3.38Å; H72-S76 WeakPolarHBondContact O-CB 3.34Å; H72-S76 PolarHBondContact O-N 2.89Å; H72-G132 PolarHBondContact CE1-N 2.95Å; H72-G132 VanDerWaalsContact CE1-N 3.32Å; H72-G132 VanDerWaalsContact NE2-CA 3.33Å; H72-G132 WeakPolarHBondContact NE2-CA 3.24Å; H72-G132 PolarHBondContact NE2-N 3.17Å; H72-F402 HydrophobicContact CB-CB 4.3Å; H72-D404 VanDerWaalsContact CA-CG 3.42Å; H72-D404 WeakPolarHBondContact CA-OD1 3.39Å; H72-D404 VanDerWaalsContact CA-OD2 3.24Å; H72-D404 WeakPolarHBondContact CA-OD2 3.38Å; H72-D404 IonicContact CD2-OD1 3.28Å
73S77.5Confident81.5Confident30 Ų3041.9 Ų41.921%0.2119%0.192CC..Hα-helixtrans-66.8-31.9-174.1-51.50000113S67 F69 V77 D404S67-S73 PolarHBondContact O-OG 2.69Å; F69-S73 PolarHBondContact O-N 2.88Å; F69-S73 PolarHBondContact O-OG 3.4Å; S73-V77 PolarHBondContact O-N 3.49Å; S73-D404 PolarHBondContact N-OD2 3.2Å; S73-D404 VanDerWaalsContact N-OD2 3.11Å
74W81.9Confident81.9Confident159 Ų15942.4 Ų42.460%0.60220%0.195SC*.Hα-helixtrans-72.6-48.8-179.8-70.770.9000111.4H72 S76 V77 A78 D404 W408H72-W74 VanDerWaalsContact C-N 3.33Å; H72-W74 PolarHBondContact O-N 3.38Å; W74-S76 VanDerWaalsContact C-N 3.3Å; W74-S76 PolarHBondContact O-N 2.71Å; W74-V77 PolarHBondContact O-N 3.11Å; W74-A78 VanDerWaalsContact O-CB 3.29Å; W74-A78 WeakPolarHBondContact O-CB 3.33Å; W74-A78 PolarHBondContact O-N 3.01Å; W74-D404 WeakPolarHBondContact CB-OD2 3.4Å; W74-D404 PolarHBondContact N-OD2 3.3Å; W74-W408 HydrophobicContact CB-CD2 4.07Å; W74-W408 HydrophobicContact CB-CG 4.21Å; W74-W408 HydrophobicContact CB-CZ2 4.42Å; W74-W408 HydrophobicContact CE3-CD2 4.5Å; W74-W408 HydrophobicContact CE3-CE3 4.07Å; W74-W408 HydrophobicContact CE3-CZ3 4.24Å
75S84.5Confident82.3Confident0 Ų042.6 Ų42.60%021%0.205CC..Hα-helixtrans-63.3-38.3176.4-60.10000111.4H72 F79 D404 W408H72-S75 WeakPolarHBondContact NE2-CB 3.38Å; S75-F79 WeakPolarHBondContact O-CB 3.47Å; S75-F79 WeakPolarHBondContact O-CG 3.29Å; S75-F79 PolarHBondContact O-N 3Å; S75-D404 WeakPolarHBondContact CB-OD1 3.45Å; S75-D404 PolarHBondContact N-OD1 3.2Å; S75-D404 PolarHBondContact OG-OD1 2.96Å; S75-W408 PolarHBondContact OG-NE1 3.45Å
76S83.4Confident82.9Confident0 Ų042.9 Ų42.90%021%0.207CC..Hα-helixtrans-55.7-54.7175.4164.40000111.9G63 T66 S67 H72 W74 N80G63-S76 PolarHBondContact O-OG 3.5Å; T66-S76 PolarHBondContact O-OG 2.97Å; T66-S76 PolarHBondContact OG1-OG 2.74Å; S67-S76 WeakPolarHBondContact CA-OG 3.43Å; S67-S76 PolarHBondContact N-OG 3.23Å; S67-S76 VanDerWaalsContact N-OG 3.12Å; H72-S76 WeakPolarHBondContact O-CB 3.34Å; H72-S76 PolarHBondContact O-N 2.89Å; W74-S76 VanDerWaalsContact C-N 3.3Å; W74-S76 PolarHBondContact O-N 2.71Å; S76-N80 VanDerWaalsContact O-CB 3.24Å; S76-N80 WeakPolarHBondContact O-CB 3.24Å; S76-N80 VanDerWaalsContact O-CG 3.25Å; S76-N80 PolarHBondContact O-N 3.3Å; S76-N80 PolarHBondContact O-ND2 3.42Å
77V88.2Confident83.9Confident40 Ų4042 Ų4224%0.24220%0.202CC..Hα-helixtrans-69.7-48.3-177.8178.10000111.5F64 S73 W74 N80 L81F64-V77 HydrophobicContact CD1-CG2 3.74Å; F64-V77 HydrophobicContact CE1-CG2 3.75Å; F64-V77 HydrophobicContact CE2-CG2 4.5Å; F64-V77 HydrophobicContact CG-CG2 4.15Å; F64-V77 HydrophobicContact CZ-CG1 4.48Å; F64-V77 HydrophobicContact CZ-CG2 4.14Å; S73-V77 PolarHBondContact O-N 3.49Å; W74-V77 PolarHBondContact O-N 3.11Å; V77-N80 PolarHBondContact O-N 2.7Å; V77-L81 PolarHBondContact O-N 3.42Å
78A90.6Very high84.9Confident34 Ų3443.3 Ų43.328%0.28121%0.209SC..Hα-helixtrans-69.7-41-174.100000113.1W74 L81 F82 W408W74-A78 VanDerWaalsContact O-CB 3.29Å; W74-A78 WeakPolarHBondContact O-CB 3.33Å; W74-A78 PolarHBondContact O-N 3.01Å; A78-L81 PolarHBondContact O-N 3.17Å; A78-F82 WeakPolarHBondContact O-CB 3.27Å; A78-F82 PolarHBondContact O-N 3.07Å; A78-W408 HydrophobicContact CB-CH2 3.6Å; A78-W408 HydrophobicContact CB-CZ2 3.47Å; A78-W408 VanDerWaalsContact CB-CZ2 3.47Å
79F91Very high86.3Confident15 Ų1544.1 Ų44.17%0.06621%0.212CC..Hα-helixtrans-70.8-35.8179.3-61.9-8.3000111S75 F82 M83 L136 L139 F407 W408S75-F79 WeakPolarHBondContact O-CB 3.47Å; S75-F79 WeakPolarHBondContact O-CG 3.29Å; S75-F79 PolarHBondContact O-N 3Å; F79-F82 PolarHBondContact O-N 3.37Å; F79-M83 WeakPolarHBondContact O-CB 3.47Å; F79-M83 VanDerWaalsContact O-CG 3.28Å; F79-M83 WeakPolarHBondContact O-CG 3.29Å; F79-M83 PolarHBondContact O-N 2.94Å; F79-L136 HydrophobicContact CB-CD1 4.15Å; F79-L136 HydrophobicContact CD1-CD1 3.69Å; F79-L136 HydrophobicContact CE1-CB 4.3Å; F79-L136 HydrophobicContact CE1-CD1 4.21Å; F79-L136 HydrophobicContact CG-CD1 3.89Å; F79-L136 HydrophobicContact CZ-CB 4.36Å; F79-L139 HydrophobicContact CB-CD1 3.77Å; F79-L139 HydrophobicContact CD2-CD1 3.7Å; F79-L139 HydrophobicContact CG-CD1 4.06Å; F79-F407 HydrophobicContact CE2-CD2 4.18Å; F79-F407 HydrophobicContact CE2-CE2 4.27Å; F79-F407 HydrophobicContact CZ-CB 4.25Å; F79-F407 HydrophobicContact CZ-CD1 4.41Å; F79-F407 AromaticContact CZ-CD2 3.96Å; F79-F407 HydrophobicContact CZ-CD2 3.96Å; F79-F407 HydrophobicContact CZ-CE2 4.43Å; F79-F407 AromaticContact CZ-CG 3.95Å; F79-F407 HydrophobicContact CZ-CG 3.95Å; F79-W408 HydrophobicContact CE1-CZ2 4.46Å
80N92Very high87.8Confident0 Ų042.8 Ų42.80%021%0.205CC..Hα-helixtrans-61.7-45.3172.7-81.8-42.7000112T66 S76 V77 F82 M83 L84 L124T66-N80 PolarHBondContact OG1-ND2 3.13Å; S76-N80 VanDerWaalsContact O-CB 3.24Å; S76-N80 WeakPolarHBondContact O-CB 3.24Å; S76-N80 VanDerWaalsContact O-CG 3.25Å; S76-N80 PolarHBondContact O-N 3.3Å; S76-N80 PolarHBondContact O-ND2 3.42Å; V77-N80 PolarHBondContact O-N 2.7Å; N80-F82 VanDerWaalsContact C-N 3.32Å; N80-F82 PolarHBondContact O-N 3.5Å; N80-M83 HydrophobicContact CB-CE 4.44Å; N80-M83 PolarHBondContact O-N 3.25Å; N80-M83 WeakPolarHBondContact OD1-CE 3.42Å; N80-L84 WeakPolarHBondContact O-CB 3.39Å; N80-L84 PolarHBondContact O-N 3.04Å; N80-L124 HydrophobicContact CB-CD2 3.54Å; N80-L124 WeakPolarHBondContact OD1-CD2 3.04Å
81L94Very high89.3Confident97 Ų9735.7 Ų35.751%0.50818%0.178SC..Hα-helixtrans-61.2-41.8175.1-178.262.8000112.1A59 V77 A78 L84 A85A59-L81 HydrophobicContact CB-CD1 4.2Å; V77-L81 PolarHBondContact O-N 3.42Å; A78-L81 PolarHBondContact O-N 3.17Å; L81-L84 WeakPolarHBondContact O-CB 3.3Å; L81-L84 PolarHBondContact O-N 3.14Å; L81-A85 PolarHBondContact O-N 3.35Å
82F94Very high90.4Very high66 Ų6631.4 Ų31.429%0.28916%0.163SC..Hα-helixtrans-63.3-46.5177-179.1-85.2000112.1A17 A78 F79 N80 L84 A85 L86 L136 V140A17-F82 HydrophobicContact CB-CZ 4.4Å; A78-F82 WeakPolarHBondContact O-CB 3.27Å; A78-F82 PolarHBondContact O-N 3.07Å; F79-F82 PolarHBondContact O-N 3.37Å; N80-F82 VanDerWaalsContact C-N 3.32Å; N80-F82 PolarHBondContact O-N 3.5Å; F82-L84 VanDerWaalsContact C-N 3.31Å; F82-L84 PolarHBondContact O-N 2.92Å; F82-A85 PolarHBondContact O-N 2.92Å; F82-L86 HydrophobicContact CE1-CD2 4.19Å; F82-L86 WeakPolarHBondContact O-CB 3.17Å; F82-L86 PolarHBondContact O-N 3.09Å; F82-L136 HydrophobicContact CB-CD1 4.31Å; F82-L136 HydrophobicContact CD1-CD1 3.61Å; F82-L136 HydrophobicContact CD1-CD2 4.37Å; F82-L136 HydrophobicContact CD1-CG 4.23Å; F82-L136 HydrophobicContact CD2-CD2 4.47Å; F82-L136 HydrophobicContact CE1-CD1 4.15Å; F82-L136 HydrophobicContact CE1-CD2 4.39Å; F82-L136 HydrophobicContact CE1-CG 4.3Å; F82-L136 HydrophobicContact CE2-CD2 4.48Å; F82-L136 HydrophobicContact CG-CD1 4Å; F82-L136 HydrophobicContact CG-CD2 4.41Å; F82-L136 HydrophobicContact CZ-CD2 4.45Å; F82-V140 HydrophobicContact CE1-CG2 3.56Å; F82-V140 HydrophobicContact CZ-CG2 4.1Å
83M94.6Very high91.2Very high1 Ų131.3 Ų31.31%0.00516%0.163CC..Hα-helixtrans-62.1-38.4176.2-72.3-175.3-64.900112F79 N80 G87 V123 A127 L139 V143F79-M83 WeakPolarHBondContact O-CB 3.47Å; F79-M83 VanDerWaalsContact O-CG 3.28Å; F79-M83 WeakPolarHBondContact O-CG 3.29Å; F79-M83 PolarHBondContact O-N 2.94Å; N80-M83 HydrophobicContact CB-CE 4.44Å; N80-M83 PolarHBondContact O-N 3.25Å; N80-M83 WeakPolarHBondContact OD1-CE 3.42Å; M83-G87 WeakPolarHBondContact O-CA 3.45Å; M83-G87 PolarHBondContact O-N 3.49Å; M83-V123 HydrophobicContact SD-CG1 4.43Å; M83-A127 HydrophobicContact CE-CB 3.57Å; M83-A127 HydrophobicContact SD-CB 3.83Å; M83-L139 HydrophobicContact CE-CD1 4.35Å; M83-L139 HydrophobicContact CG-CB 4.16Å; M83-L139 HydrophobicContact SD-CB 3.84Å; M83-L139 HydrophobicContact SD-CD1 4.04Å; M83-L139 HydrophobicContact SD-CD2 3.7Å; M83-L139 HydrophobicContact SD-CG 4.06Å; M83-V143 HydrophobicContact CB-CG2 3.75Å; M83-V143 HydrophobicContact CG-CG2 3.63Å; M83-V143 HydrophobicContact SD-CG2 4.29Å
84L95.8Very high91.7Very high11 Ų1130.5 Ų30.56%0.05816%0.156CC..Hα-helixtrans-60.7-52.1175.2178.857.2000111.2A58 A59 N80 L81 F82 L86 G87 V88 T117 A120 L124A58-L84 HydrophobicContact CB-CD1 3.77Å; A58-L84 HydrophobicContact CB-CD2 3.64Å; A58-L84 HydrophobicContact CB-CG 4.33Å; A59-L84 HydrophobicContact CB-CD2 3.9Å; N80-L84 WeakPolarHBondContact O-CB 3.39Å; N80-L84 PolarHBondContact O-N 3.04Å; L81-L84 WeakPolarHBondContact O-CB 3.3Å; L81-L84 PolarHBondContact O-N 3.14Å; F82-L84 VanDerWaalsContact C-N 3.31Å; F82-L84 PolarHBondContact O-N 2.92Å; L84-L86 PolarHBondContact O-N 3.31Å; L84-G87 PolarHBondContact O-N 3.32Å; L84-V88 HydrophobicContact CD1-CG2 4.01Å; L84-V88 VanDerWaalsContact O-CG2 3.29Å; L84-V88 WeakPolarHBondContact O-CG2 3.45Å; L84-V88 PolarHBondContact O-N 2.86Å; L84-T117 HydrophobicContact CD1-CG2 4.4Å; L84-A120 HydrophobicContact CD1-CB 3.85Å; L84-L124 HydrophobicContact CB-CD1 4.08Å; L84-L124 HydrophobicContact CD1-CD1 3.92Å; L84-L124 HydrophobicContact CG-CD1 4.49Å
85A95.4Very high91.8Very high54 Ų5423.5 Ų23.545%0.44613%0.13SC..Hα-helixtrans-59.5-48.9-178.900000111.7L81 F82 Q89L81-A85 PolarHBondContact O-N 3.35Å; F82-A85 PolarHBondContact O-N 2.92Å; A85-Q89 WeakPolarHBondContact O-CG 3.13Å; A85-Q89 PolarHBondContact O-N 3.22Å
86L95.5Very high91.6Very high7 Ų723.8 Ų23.84%0.03713%0.133CC..Hα-helixtrans-64.1-45178.1179.764.8000111.9L20 L24 F82 L84 V88 Q89 W90 V140 V143L20-L86 HydrophobicContact CD2-CD1 3.57Å; L20-L86 HydrophobicContact CD2-CD2 3.94Å; L20-L86 HydrophobicContact CD2-CG 4.41Å; L20-L86 HydrophobicContact CG-CD1 4.12Å; L24-L86 HydrophobicContact CD1-CD1 3.54Å; F82-L86 HydrophobicContact CE1-CD2 4.19Å; F82-L86 WeakPolarHBondContact O-CB 3.17Å; F82-L86 PolarHBondContact O-N 3.09Å; L84-L86 PolarHBondContact O-N 3.31Å; L86-V88 PolarHBondContact O-N 3.07Å; L86-Q89 PolarHBondContact O-N 3.35Å; L86-W90 WeakPolarHBondContact O-CB 3.29Å; L86-W90 PolarHBondContact O-N 3.49Å; L86-V140 HydrophobicContact CD2-CB 4.31Å; L86-V140 HydrophobicContact CD2-CG1 4.01Å; L86-V140 HydrophobicContact CD2-CG2 4.19Å; L86-V143 HydrophobicContact CB-CG1 4.41Å; L86-V143 HydrophobicContact CD2-CB 4.17Å; L86-V143 HydrophobicContact CD2-CG1 4.04Å; L86-V143 HydrophobicContact CD2-CG2 4.49Å; L86-V143 HydrophobicContact CG-CG1 4.01Å
87G96.1Very high91.6Very high0 Ų026.2 Ų26.20%014%0.144CC..Hα-helixtrans-63.2-39.2-177.800000112.6M83 L84 A91M83-G87 WeakPolarHBondContact O-CA 3.45Å; M83-G87 PolarHBondContact O-N 3.49Å; L84-G87 PolarHBondContact O-N 3.32Å; G87-A91 WeakPolarHBondContact O-CB 3.28Å; G87-A91 PolarHBondContact O-N 3.16Å
88V95.1Very high91.3Very high26 Ų2625.7 Ų25.716%0.15814%0.139CC..Hα-helixtrans-64.3-49.5176.9170.10000110.9L84 L86 W90 A91 I92 A116 A120L84-V88 HydrophobicContact CD1-CG2 4.01Å; L84-V88 VanDerWaalsContact O-CG2 3.29Å; L84-V88 WeakPolarHBondContact O-CG2 3.45Å; L84-V88 PolarHBondContact O-N 2.86Å; L86-V88 PolarHBondContact O-N 3.07Å; V88-W90 VanDerWaalsContact C-N 3.32Å; V88-W90 PolarHBondContact O-N 2.91Å; V88-A91 PolarHBondContact O-N 3.4Å; V88-I92 HydrophobicContact CG1-CD1 4.08Å; V88-I92 WeakPolarHBondContact O-CG1 3.08Å; V88-I92 PolarHBondContact O-N 2.92Å; V88-I92 VanDerWaalsContact O-N 3.07Å; V88-A116 HydrophobicContact CG1-CB 4.19Å; V88-A120 HydrophobicContact CG2-CB 3.9Å
89Q95Very high90.4Very high48 Ų4826.4 Ų26.422%0.22414%0.142CC..Hα-helixtrans-59.7-45.1179.2-68.3178.9-4.300111.4E21 L24 A85 L86 L93E21-Q89 PolarHBondContact OE1-NE2 3.01Å; E21-Q89 PolarHBondContact OE1-OE1 2.9Å; E21-Q89 PolarHBondContact OE2-OE1 3.47Å; L24-Q89 HydrophobicContact CD1-CB 4.28Å; A85-Q89 WeakPolarHBondContact O-CG 3.13Å; A85-Q89 PolarHBondContact O-N 3.22Å; L86-Q89 PolarHBondContact O-N 3.35Å; Q89-L93 PolarHBondContact O-N 3.24Å
90W95.3Very high89.2Confident51 Ų5130.4 Ų30.419%0.19316%0.161CC..Hα-helixtrans-67.7-39.7179.5-175.5-127.5000112.7L24 L86 V88 I92 L93 L94 L144 T148L24-W90 HydrophobicContact CD2-CE3 3.92Å; L86-W90 WeakPolarHBondContact O-CB 3.29Å; L86-W90 PolarHBondContact O-N 3.49Å; V88-W90 VanDerWaalsContact C-N 3.32Å; V88-W90 PolarHBondContact O-N 2.91Å; W90-I92 PolarHBondContact O-N 2.61Å; W90-L93 HydrophobicContact CE3-CD1 4.32Å; W90-L93 PolarHBondContact O-N 3.31Å; W90-L94 HydrophobicContact CD2-CD1 4.11Å; W90-L94 HydrophobicContact CD2-CG 4.14Å; W90-L94 HydrophobicContact CG-CD1 4.14Å; W90-L94 HydrophobicContact CH2-CD2 4.28Å; W90-L94 HydrophobicContact CH2-CG 4.46Å; W90-L94 HydrophobicContact CZ2-CD1 4.03Å; W90-L94 HydrophobicContact CZ2-CD2 3.79Å; W90-L94 HydrophobicContact CZ2-CG 3.89Å; W90-L94 WeakPolarHBondContact O-CB 3.33Å; W90-L94 WeakPolarHBondContact O-CG 3.33Å; W90-L94 PolarHBondContact O-N 3.42Å; W90-L144 HydrophobicContact CB-CD2 4.45Å; W90-L144 HydrophobicContact CD2-CD2 3.84Å; W90-L144 HydrophobicContact CE3-CD2 4.47Å; W90-L144 HydrophobicContact CG-CD2 3.79Å; W90-L144 PolarHBondContact NE1-O 3.32Å; W90-L144 VanDerWaalsContact NE1-O 3.16Å; W90-T148 PolarHBondContact NE1-OG1 3.01Å
91A93Very high87.6Confident0 Ų038.1 Ų38.10%020%0.195CC..Hα-helixtrans-64.7-38.4177.900000112.7G87 V88 L94 D95 A116 V147G87-A91 WeakPolarHBondContact O-CB 3.28Å; G87-A91 PolarHBondContact O-N 3.16Å; V88-A91 PolarHBondContact O-N 3.4Å; A91-L94 PolarHBondContact O-N 3.32Å; A91-D95 WeakPolarHBondContact O-CB 3.48Å; A91-D95 PolarHBondContact O-N 3.47Å; A91-A116 HydrophobicContact CB-CB 3.77Å; A91-V147 HydrophobicContact CB-CG1 3.65Å
92I91.4Very high85.9Confident19 Ų1938.9 Ų38.910%0.09721%0.206CC..Hα-helixtrans-60.7-46.6175.7-69.2170.1000110.6L28 V88 W90 G96 I108 I113 A116L28-I92 HydrophobicContact CD2-CG2 4.36Å; V88-I92 HydrophobicContact CG1-CD1 4.08Å; V88-I92 WeakPolarHBondContact O-CG1 3.08Å; V88-I92 PolarHBondContact O-N 2.92Å; V88-I92 VanDerWaalsContact O-N 3.07Å; W90-I92 PolarHBondContact O-N 2.61Å; I92-G96 PolarHBondContact O-N 3.1Å; I92-G96 VanDerWaalsContact O-N 3.14Å; I92-I108 HydrophobicContact CG2-CG1 4.38Å; I92-I113 HydrophobicContact CD1-CG1 4.49Å; I92-A116 HydrophobicContact CD1-CB 4.31Å; I92-A116 HydrophobicContact CG1-CB 3.51Å
93L90.1Very high84.3Confident0 Ų039.2 Ų39.20%021%0.214CC..Hα-helixtrans-63.6-47.3178.5-72.3172.8000111.6L24 L27 L28 T32 Q89 W90 G96 F97L24-L93 HydrophobicContact CD2-CD1 3.52Å; L27-L93 HydrophobicContact CB-CD1 3.82Å; L27-L93 HydrophobicContact CB-CD2 4.02Å; L27-L93 HydrophobicContact CD1-CD1 4.1Å; L28-L93 HydrophobicContact CD2-CD1 4.49Å; L28-L93 HydrophobicContact CD2-CD2 3.62Å; L28-L93 HydrophobicContact CD2-CG 3.85Å; L28-L93 HydrophobicContact CG-CD1 4.32Å; L28-L93 HydrophobicContact CG-CD2 3.99Å; L28-L93 HydrophobicContact CG-CG 4.2Å; T32-L93 HydrophobicContact CG2-CD2 4.27Å; Q89-L93 PolarHBondContact O-N 3.24Å; W90-L93 HydrophobicContact CE3-CD1 4.32Å; W90-L93 PolarHBondContact O-N 3.31Å; L93-G96 WeakPolarHBondContact O-CA 3.46Å; L93-G96 PolarHBondContact O-N 3.31Å; L93-F97 HydrophobicContact CB-CE2 4.13Å; L93-F97 WeakPolarHBondContact O-CD2 3.44Å; L93-F97 WeakPolarHBondContact O-CG 3.39Å; L93-F97 PolarHBondContact O-N 2.88Å
94L89.1Confident83Confident12 Ų1240.8 Ų40.86%0.06323%0.231CC..Hα-helixtrans-62.2-44.2178.8-80.1173.4000112.6W90 A91 G96 F97 L98 V147 T148W90-L94 HydrophobicContact CD2-CD1 4.11Å; W90-L94 HydrophobicContact CD2-CG 4.14Å; W90-L94 HydrophobicContact CG-CD1 4.14Å; W90-L94 HydrophobicContact CH2-CD2 4.28Å; W90-L94 HydrophobicContact CH2-CG 4.46Å; W90-L94 HydrophobicContact CZ2-CD1 4.03Å; W90-L94 HydrophobicContact CZ2-CD2 3.79Å; W90-L94 HydrophobicContact CZ2-CG 3.89Å; W90-L94 WeakPolarHBondContact O-CB 3.33Å; W90-L94 WeakPolarHBondContact O-CG 3.33Å; W90-L94 PolarHBondContact O-N 3.42Å; A91-L94 PolarHBondContact O-N 3.32Å; L94-G96 PolarHBondContact O-N 2.86Å; L94-F97 PolarHBondContact O-N 2.86Å; L94-F97 VanDerWaalsContact O-N 3.17Å; L94-L98 HydrophobicContact CB-CD1 4.46Å; L94-L98 HydrophobicContact CD2-CD1 4.44Å; L94-L98 VanDerWaalsContact O-CB 3.26Å; L94-L98 WeakPolarHBondContact O-CB 3.36Å; L94-L98 VanDerWaalsContact O-CG 3.24Å; L94-L98 WeakPolarHBondContact O-CG 3.47Å; L94-L98 PolarHBondContact O-N 3.27Å; L94-V147 HydrophobicContact CD1-CB 4.3Å; L94-V147 HydrophobicContact CD1-CG1 3.71Å; L94-T148 HydrophobicContact CD2-CG2 4.31Å
95D84.4Confident81.9Confident13 Ų1346.3 Ų46.37%0.0726%0.255CS..Hα-helixtrans-61.1-36.4177.2-83.8-16.2000111.2A91 S99 L115 R154 Y165A91-D95 WeakPolarHBondContact O-CB 3.48Å; A91-D95 PolarHBondContact O-N 3.47Å; D95-S99 WeakPolarHBondContact O-CB 3.24Å; D95-S99 PolarHBondContact O-N 3.44Å; D95-S99 PolarHBondContact O-OG 2.89Å; D95-L115 WeakPolarHBondContact OD2-CD2 3.25Å; D95-R154 VanDerWaalsContact CG-NH2 3.33Å; D95-R154 IonicContact OD1-CZ 3.53Å; D95-R154 IonicContact OD1-NE 3.78Å; D95-R154 IonicContact OD1-NH1 2.91Å; D95-R154 PolarHBondContact OD1-NH1 3.16Å; D95-R154 VanDerWaalsContact OD1-NH1 3.14Å; D95-R154 IonicContact OD1-NH2 2.73Å; D95-R154 PolarHBondContact OD1-NH2 3.46Å; D95-R154 IonicContact OD2-CZ 3.15Å; D95-R154 IonicContact OD2-NH1 3.14Å; D95-R154 PolarHBondContact OD2-NH1 2.9Å; D95-R154 IonicContact OD2-NH2 3.86Å; D95-R154 PolarHBondContact OD2-NH2 3.35Å; D95-Y165 HydrophobicContact CB-CE1 4.46Å; D95-Y165 WeakPolarHBondContact OD1-CE1 3.11Å; D95-Y165 PolarHBondContact OD1-OH 3.27Å
96G80.6Confident81.1Confident5 Ų544.6 Ų44.65%0.05224%0.238CC..Hα-helixtrans-57.7-54.2169.300000114.6I92 L93 L94I92-G96 PolarHBondContact O-N 3.1Å; I92-G96 VanDerWaalsContact O-N 3.14Å; L93-G96 WeakPolarHBondContact O-CA 3.46Å; L93-G96 PolarHBondContact O-N 3.31Å; L94-G96 PolarHBondContact O-N 2.86Å
97F83.5Confident80.4Confident52 Ų5247 Ų4723%0.22825%0.253CS..Hα-helixtrans-69.8-32.4-176.6-64.6-47.9000113.7F31 L93 L94 F101 P103F31-F97 HydrophobicContact CB-CE1 4.33Å; F31-F97 HydrophobicContact CB-CZ 4.34Å; F31-F97 AromaticContact CD1-CE1 3.71Å; F31-F97 HydrophobicContact CD1-CE1 3.71Å; F31-F97 HydrophobicContact CD1-CZ 4.24Å; F31-F97 HydrophobicContact CD2-CE1 4.15Å; F31-F97 AromaticContact CD2-CZ 3.85Å; F31-F97 HydrophobicContact CD2-CZ 3.85Å; F31-F97 AromaticContact CE1-CE1 3.98Å; F31-F97 HydrophobicContact CE1-CE1 3.98Å; F31-F97 HydrophobicContact CE2-CE1 4.42Å; F31-F97 HydrophobicContact CE2-CZ 4.2Å; F31-F97 AromaticContact CG-CE1 3.8Å; F31-F97 HydrophobicContact CG-CE1 3.8Å; F31-F97 AromaticContact CG-CZ 3.88Å; F31-F97 HydrophobicContact CG-CZ 3.88Å; F31-F97 HydrophobicContact CZ-CE1 4.34Å; L93-F97 HydrophobicContact CB-CE2 4.13Å; L93-F97 WeakPolarHBondContact O-CD2 3.44Å; L93-F97 WeakPolarHBondContact O-CG 3.39Å; L93-F97 PolarHBondContact O-N 2.88Å; L94-F97 PolarHBondContact O-N 2.86Å; L94-F97 VanDerWaalsContact O-N 3.17Å; F97-F101 VanDerWaalsContact O-CE2 3.24Å; F97-F101 WeakPolarHBondContact O-CE2 3.29Å; F97-P103 HydrophobicContact CD1-CB 4.33Å
98L81.6Confident79.9Confident29 Ų2948.1 Ų48.115%0.15226%0.259CS..Hα-helixtrans-89.7-24.2-174.8-63.9179.5000113.1L94 G151 M155L94-L98 HydrophobicContact CB-CD1 4.46Å; L94-L98 HydrophobicContact CD2-CD1 4.44Å; L94-L98 VanDerWaalsContact O-CB 3.26Å; L94-L98 WeakPolarHBondContact O-CB 3.36Å; L94-L98 VanDerWaalsContact O-CG 3.24Å; L94-L98 WeakPolarHBondContact O-CG 3.47Å; L94-L98 PolarHBondContact O-N 3.27Å; L98-G151 VanDerWaalsContact CD1-C 3.47Å; L98-M155 HydrophobicContact CB-CE 3.74Å; L98-M155 HydrophobicContact CD2-CE 3.36Å; L98-M155 HydrophobicContact CG-CE 4.1Å; L98-M155 VanDerWaalsContact O-CE 3.29Å; L98-M155 WeakPolarHBondContact O-CE 3.26Å
99S71.4Confident79.3Confident48 Ų4848.6 Ų48.634%0.33626%0.262SS..Hα-helixtrans-88-22.1-178.965.90000114.6D95D95-S99 WeakPolarHBondContact O-CB 3.24Å; D95-S99 PolarHBondContact O-N 3.44Å; D95-S99 PolarHBondContact O-OG 2.89Å
100Q66.6Low78.7Confident99 Ų9948.4 Ų48.446%0.46326%0.262SS..  trans-132.9112.1-176.5-63.1-177.3600111.4P102Q100-P102 CarbonylContact O-C 3.6Å
101F57.3Low78.1Confident162 Ų16248.8 Ų48.871%0.71127%0.265SS*.SBendtrans-115.9119.5167.9-87.8-83000109.5F97 M155F97-F101 VanDerWaalsContact O-CE2 3.24Å; F97-F101 WeakPolarHBondContact O-CE2 3.29Å; F101-M155 HydrophobicContact CE2-CE 3.89Å
102P58.6Low77.8Confident114 Ų11450 Ų5074%0.7427%0.274SS*.SBendcis-72154.63.229.6-34.6000113.7Q100 G104Q100-P102 CarbonylContact O-C 3.6Å; P102-G104 PolarHBondContact O-N 2.88Å
103P60.7Low77.6Confident72 Ų7252.2 Ų52.247%0.46829%0.285SS..  trans-67.3102.8-175.726.4-33.2000110.7F97F97-P103 HydrophobicContact CD1-CB 4.33Å
104G66.3Low77.5Confident35 Ų3552.7 Ų52.736%0.36129%0.287SS..  trans-76.1177.3164.900000111.5P102 V106P102-G104 PolarHBondContact O-N 2.88Å; G104-V106 PolarHBondContact O-N 3.48Å
105K72.2Confident77.4Confident127 Ų12752.2 Ų52.255%0.55229%0.285SS*.PPolyproline II helixtrans-69.8126.2166.6-72.8-169.4179.6-172.80109.3F31 H33 V107F31-K105 CarbonylContact O-C 3.57Å; F31-K105 WeakPolarHBondContact O-CA 3.35Å; H33-K105 PolarHBondContact CE1-O 3.27Å; H33-K105 WeakPolarHBondContact ND1-CB 3.39Å; K105-V107 PolarHBondContact O-N 3.43Å
106V78.6Confident77.7Confident17 Ų1751.6 Ų51.610%0.10328%0.281CS..EExtended strand (participates in β ladder)trans-69.2127.3176.5-168.10000109F31 T32 H33 G104F31-V106 WeakPolarHBondContact O-CG2 3.45Å; F31-V106 PolarHBondContact O-N 3.39Å; T32-V106 WeakPolarHBondContact CA-O 3.48Å; T32-V106 HydrophobicContact CG2-CB 4.11Å; T32-V106 HydrophobicContact CG2-CG2 4.48Å; H33-V106 PolarHBondContact N-O 2.81Å; H33-V106 PolarHBondContact ND1-O 3.21Å; G104-V106 PolarHBondContact O-N 3.48Å
107V82.6Confident78.3Confident57 Ų5751.6 Ų51.635%0.34528%0.28SS..EExtended strand (participates in β ladder)trans-83.2118.2173.4-1760000108.3H33 D35 K105 T109H33-V107 WeakPolarHBondContact CE1-CG2 3.42Å; H33-V107 WeakPolarHBondContact O-CA 3.32Å; D35-V107 HydrophobicContact CB-CG1 3.58Å; K105-V107 PolarHBondContact O-N 3.43Å; V107-T109 HydrophobicContact CG1-CG2 3.97Å; V107-T109 PolarHBondContact O-N 2.75Å
108I83.8Confident78.6Confident25 Ų2549.3 Ų49.313%0.12827%0.27CS..EExtended strand (participates in β ladder)trans-83.2112.2174.8-60.6177.8000108.8T32 H33 Y34 D35 I92 I113T32-I108 HydrophobicContact CG2-CD1 4.2Å; T32-I108 HydrophobicContact CG2-CG1 4.45Å; H33-I108 PolarHBondContact O-N 3.49Å; Y34-I108 HydrophobicContact CD1-CB 4.09Å; Y34-I108 HydrophobicContact CD1-CG2 4.25Å; Y34-I108 HydrophobicContact CE1-CB 4.33Å; Y34-I108 HydrophobicContact CE1-CD1 4.41Å; Y34-I108 HydrophobicContact CE1-CG2 4.16Å; D35-I108 PolarHBondContact N-O 3.12Å; I92-I108 HydrophobicContact CG2-CG1 4.38Å; I108-I113 HydrophobicContact CG2-CD1 4.49Å; I108-I113 HydrophobicContact CG2-CG1 4.42Å
109T83.6Confident79.1Confident35 Ų3547.9 Ų47.922%0.21526%0.263CS..  trans-114.9163.617361.80000111.2D35 V107 F111 S112 I113D35-T109 HydrophobicContact CB-CG2 4.2Å; V107-T109 HydrophobicContact CG1-CG2 3.97Å; V107-T109 PolarHBondContact O-N 2.75Å; T109-F111 PolarHBondContact O-N 3.35Å; T109-S112 WeakPolarHBondContact O-CB 3.45Å; T109-S112 PolarHBondContact O-N 3.19Å; T109-S112 PolarHBondContact OG1-N 3.42Å; T109-S112 PolarHBondContact OG1-OG 3.25Å; T109-I113 PolarHBondContact O-N 2.85Å
110L82.9Confident80.2Confident45 Ų4545.6 Ų45.624%0.23625%0.247CC..Hα-helixtrans-57.3-34.6171.9-74.7-179.9000112.3L44 I113 R114L44-L110 HydrophobicContact CD1-CD1 3.51Å; L44-L110 HydrophobicContact CD1-CG 4.47Å; L44-L110 HydrophobicContact CG-CD1 4.36Å; L110-I113 PolarHBondContact O-N 2.88Å; L110-R114 WeakPolarHBondContact O-CG 3.23Å; L110-R114 PolarHBondContact O-N 3.33Å; L110-R114 VanDerWaalsContact O-N 3.07Å
111F82.9Confident81.4Confident58 Ų5841 Ų4125%0.25423%0.225SC..Hα-helixtrans-63.7-41174.7-178.9-97.5000112.1T109 I113 R114 L115 H166 M167 L227T109-F111 PolarHBondContact O-N 3.35Å; F111-I113 VanDerWaalsContact C-N 3.32Å; F111-I113 PolarHBondContact O-N 3.35Å; F111-R114 PolarHBondContact O-N 2.85Å; F111-L115 HydrophobicContact CE1-CD2 4.45Å; F111-L115 WeakPolarHBondContact O-CB 3.28Å; F111-L115 PolarHBondContact O-N 3.11Å; F111-H166 HydrophobicContact CE1-CB 3.61Å; F111-H166 AromaticContact CE1-CG 3.78Å; F111-H166 HydrophobicContact CZ-CB 3.77Å; F111-M167 HydrophobicContact CE2-CE 4.14Å; F111-M167 HydrophobicContact CZ-CE 3.7Å; F111-L227 HydrophobicContact CE2-CD2 3.71Å; F111-L227 HydrophobicContact CZ-CD2 3.82Å
112S85.1Confident83.1Confident26 Ų2633.3 Ų33.318%0.18219%0.192CC..Hα-helixtrans-61.3-40.5176.4-55.20000111.8T109 L115 A116T109-S112 WeakPolarHBondContact O-CB 3.45Å; T109-S112 PolarHBondContact O-N 3.19Å; T109-S112 PolarHBondContact OG1-N 3.42Å; T109-S112 PolarHBondContact OG1-OG 3.25Å; S112-L115 PolarHBondContact O-N 2.87Å; S112-A116 VanDerWaalsContact O-CB 3.3Å; S112-A116 WeakPolarHBondContact O-CB 3.42Å; S112-A116 PolarHBondContact O-N 2.77Å
113I87.4Confident84.8Confident65 Ų6527.9 Ų27.933%0.33316%0.157SC..Hα-helixtrans-64.4-47175.6-63.4174.4000110.8I92 I108 T109 L110 F111 L115 A116 T117I92-I113 HydrophobicContact CD1-CG1 4.49Å; I108-I113 HydrophobicContact CG2-CD1 4.49Å; I108-I113 HydrophobicContact CG2-CG1 4.42Å; T109-I113 PolarHBondContact O-N 2.85Å; L110-I113 PolarHBondContact O-N 2.88Å; F111-I113 VanDerWaalsContact C-N 3.32Å; F111-I113 PolarHBondContact O-N 3.35Å; I113-L115 VanDerWaalsContact C-N 3.3Å; I113-L115 PolarHBondContact O-N 3.28Å; I113-A116 PolarHBondContact O-N 2.97Å; I113-T117 WeakPolarHBondContact O-CB 3.37Å; I113-T117 PolarHBondContact O-N 2.75Å; I113-T117 PolarHBondContact O-OG1 3.08Å
114R87.6Confident86.3Confident11 Ų1124.5 Ų24.54%0.04214%0.135CC..Hα-helixtrans-57.6-45177.1-70.3169.2173.5172.3-13.1111.6A46 S47 L54 L110 F111 T117 M118A46-R114 PolarHBondContact O-NH2 2.54Å; S47-R114 PolarHBondContact O-NE 3Å; S47-R114 PolarHBondContact O-NH2 2.98Å; S47-R114 VanDerWaalsContact OG-CZ 3.3Å; S47-R114 PolarHBondContact OG-NH1 2.89Å; S47-R114 PolarHBondContact OG-NH2 2.9Å; L54-R114 HydrophobicContact CD1-CB 3.95Å; L54-R114 HydrophobicContact CD1-CG 4.12Å; L110-R114 WeakPolarHBondContact O-CG 3.23Å; L110-R114 PolarHBondContact O-N 3.33Å; L110-R114 VanDerWaalsContact O-N 3.07Å; F111-R114 PolarHBondContact O-N 2.85Å; R114-T117 PolarHBondContact O-N 3.36Å; R114-M118 WeakPolarHBondContact O-CG 3.44Å; R114-M118 PolarHBondContact O-N 3.44Å
115L87.9Confident87.5Confident2 Ų223.6 Ų23.61%0.0112%0.121CC..Hα-helixtrans-61.5-47.6179.1-170.169.2000111.2D95 F111 S112 I113 T117 M118 S119 H166 L169 L227D95-L115 WeakPolarHBondContact OD2-CD2 3.25Å; F111-L115 HydrophobicContact CE1-CD2 4.45Å; F111-L115 WeakPolarHBondContact O-CB 3.28Å; F111-L115 PolarHBondContact O-N 3.11Å; S112-L115 PolarHBondContact O-N 2.87Å; I113-L115 VanDerWaalsContact C-N 3.3Å; I113-L115 PolarHBondContact O-N 3.28Å; L115-T117 PolarHBondContact O-N 2.94Å; L115-M118 PolarHBondContact O-N 2.53Å; L115-S119 PolarHBondContact O-N 3.21Å; L115-H166 WeakPolarHBondContact CD1-O 3.5Å; L115-H166 HydrophobicContact CD2-CB 4.22Å; L115-H166 WeakPolarHBondContact CD2-ND1 3.44Å; L115-L169 HydrophobicContact CD1-CD1 3.19Å; L115-L169 HydrophobicContact CG-CD1 4.25Å; L115-L227 HydrophobicContact CD1-CD1 4.38Å; L115-L227 HydrophobicContact CD1-CD2 3.91Å
116A91.4Very high88.4Confident0 Ų017.5 Ų17.50%010%0.095CC..Hα-helixtrans-62.4-41.2176.800000112.8V88 A91 I92 S112 I113 M118 S119 A120V88-A116 HydrophobicContact CG1-CB 4.19Å; A91-A116 HydrophobicContact CB-CB 3.77Å; I92-A116 HydrophobicContact CD1-CB 4.31Å; I92-A116 HydrophobicContact CG1-CB 3.51Å; S112-A116 VanDerWaalsContact O-CB 3.3Å; S112-A116 WeakPolarHBondContact O-CB 3.42Å; S112-A116 PolarHBondContact O-N 2.77Å; I113-A116 PolarHBondContact O-N 2.97Å; A116-M118 VanDerWaalsContact C-N 3.29Å; A116-M118 PolarHBondContact O-N 3.22Å; A116-S119 PolarHBondContact O-N 3.04Å; A116-A120 PolarHBondContact O-N 3.31Å
117T92.2Very high89Confident4 Ų416.7 Ų16.73%0.0259%0.09CC..Hα-helixtrans-60.4-39.5174-600000111.3L54 L84 I113 R114 L115 A120 M121L54-T117 HydrophobicContact CB-CG2 3.91Å; L84-T117 HydrophobicContact CD1-CG2 4.4Å; I113-T117 WeakPolarHBondContact O-CB 3.37Å; I113-T117 PolarHBondContact O-N 2.75Å; I113-T117 PolarHBondContact O-OG1 3.08Å; R114-T117 PolarHBondContact O-N 3.36Å; L115-T117 PolarHBondContact O-N 2.94Å; T117-A120 PolarHBondContact O-N 3.32Å; T117-M121 HydrophobicContact CG2-SD 4.25Å; T117-M121 WeakPolarHBondContact O-CB 3.13Å; T117-M121 VanDerWaalsContact O-CG 3.27Å; T117-M121 WeakPolarHBondContact O-CG 3.46Å; T117-M121 PolarHBondContact O-N 2.81Å
118M90.3Very high89.1Confident4 Ų414.5 Ų14.52%0.028%0.078CC..Hα-helixtrans-70-36.7176.2-65.8-150.2-5800113.4L54 R114 L115 A116 A120 M121 S122 L169 P226 L227L54-M118 HydrophobicContact CD1-CG 4.12Å; L54-M118 HydrophobicContact CD2-CG 4.12Å; L54-M118 HydrophobicContact CD2-SD 4.35Å; R114-M118 WeakPolarHBondContact O-CG 3.44Å; R114-M118 PolarHBondContact O-N 3.44Å; L115-M118 PolarHBondContact O-N 2.53Å; A116-M118 VanDerWaalsContact C-N 3.29Å; A116-M118 PolarHBondContact O-N 3.22Å; M118-A120 VanDerWaalsContact C-N 3.34Å; M118-M121 HydrophobicContact CB-CE 4.16Å; M118-M121 HydrophobicContact CG-CE 3.82Å; M118-M121 WeakPolarHBondContact O-CB 3.24Å; M118-M121 PolarHBondContact O-N 3.07Å; M118-M121 HydrophobicContact SD-CE 4.39Å; M118-S122 PolarHBondContact O-N 3.02Å; M118-L169 HydrophobicContact CB-CD2 3.94Å; M118-L169 HydrophobicContact CE-CB 4.4Å; M118-L169 HydrophobicContact CE-CD1 4.18Å; M118-L169 HydrophobicContact CE-CD2 4.32Å; M118-P226 HydrophobicContact CE-CG 4.08Å; M118-P226 HydrophobicContact SD-CG 3.58Å; M118-P226 VanDerWaalsContact SD-CG 3.58Å; M118-L227 HydrophobicContact CE-CD1 3.2Å; M118-L227 HydrophobicContact CE-CD2 3.74Å; M118-L227 HydrophobicContact CE-CG 3.29Å
119S92.5Very high89.1Confident0 Ų013.5 Ų13.50%07%0.074CC..Hα-helixtrans-61.2-43.2169.8-67.70000111.5L115 A116 S122 R154L115-S119 PolarHBondContact O-N 3.21Å; A116-S119 PolarHBondContact O-N 3.04Å; S119-S122 WeakPolarHBondContact O-CB 3.37Å; S119-S122 PolarHBondContact O-N 3.07Å; S119-S122 PolarHBondContact O-OG 3.5Å; S119-R154 PolarHBondContact OG-NH2 3.43Å
120A94.5Very high89.1Confident0 Ų011.8 Ų11.80%06%0.064CC..Hα-helixtrans-64.6-39.7175.600000112.2L84 V88 A116 T117 M118 S122 V123 L124L84-A120 HydrophobicContact CD1-CB 3.85Å; V88-A120 HydrophobicContact CG2-CB 3.9Å; A116-A120 PolarHBondContact O-N 3.31Å; T117-A120 PolarHBondContact O-N 3.32Å; M118-A120 VanDerWaalsContact C-N 3.34Å; A120-S122 PolarHBondContact O-N 3.15Å; A120-V123 WeakPolarHBondContact O-CA 3.13Å; A120-V123 VanDerWaalsContact O-CB 3.32Å; A120-V123 WeakPolarHBondContact O-CB 3.07Å; A120-V123 PolarHBondContact O-N 3.49Å; A120-L124 WeakPolarHBondContact O-CD1 3.44Å; A120-L124 PolarHBondContact O-N 3.43Å
121M91.9Very high89Confident2 Ų210.2 Ų10.21%0.016%0.055CC..Hα-helixtrans-56.7-34.6174.6-79.4168.410.500113L54 M57 A58 L62 T117 M118 V123 L124 I125 F172 V223L54-M121 HydrophobicContact CD2-CE 4.13Å; L54-M121 HydrophobicContact CD2-SD 4.07Å; M57-M121 HydrophobicContact CE-CE 3.47Å; M57-M121 VanDerWaalsContact CE-CE 3.47Å; M57-M121 HydrophobicContact CE-CG 4.32Å; M57-M121 HydrophobicContact CE-SD 3.37Å; M57-M121 WeakPolarHBondContact CE-SD 3.39Å; A58-M121 HydrophobicContact CB-CG 3.64Å; A58-M121 HydrophobicContact CB-SD 4.24Å; L62-M121 HydrophobicContact CD1-CG 4.5Å; T117-M121 HydrophobicContact CG2-SD 4.25Å; T117-M121 WeakPolarHBondContact O-CB 3.13Å; T117-M121 VanDerWaalsContact O-CG 3.27Å; T117-M121 WeakPolarHBondContact O-CG 3.46Å; T117-M121 PolarHBondContact O-N 2.81Å; M118-M121 HydrophobicContact CB-CE 4.16Å; M118-M121 HydrophobicContact CG-CE 3.82Å; M118-M121 WeakPolarHBondContact O-CB 3.24Å; M118-M121 PolarHBondContact O-N 3.07Å; M118-M121 HydrophobicContact SD-CE 4.39Å; M121-V123 VanDerWaalsContact C-N 3.26Å; M121-V123 PolarHBondContact O-N 2.92Å; M121-L124 HydrophobicContact CG-CD1 4.5Å; M121-L124 WeakPolarHBondContact O-CB 3.37Å; M121-L124 PolarHBondContact O-N 3.35Å; M121-I125 WeakPolarHBondContact O-CG1 3.13Å; M121-I125 PolarHBondContact O-N 3.47Å; M121-F172 HydrophobicContact CE-CE2 4.5Å; M121-V223 HydrophobicContact CE-CG1 3.87Å
122S92.5Very high88.7Confident0 Ų07.7 Ų7.70%05%0.046CC..Hα-helixtrans-56.8-43.5173.576.80000111.3M118 S119 A120 L124 I125 S126 E146 L150 A176M118-S122 PolarHBondContact O-N 3.02Å; S119-S122 WeakPolarHBondContact O-CB 3.37Å; S119-S122 PolarHBondContact O-N 3.07Å; S119-S122 PolarHBondContact O-OG 3.5Å; A120-S122 PolarHBondContact O-N 3.15Å; S122-L124 PolarHBondContact O-N 3.01Å; S122-I125 WeakPolarHBondContact O-CB 3.17Å; S122-I125 PolarHBondContact O-N 3.38Å; S122-S126 PolarHBondContact O-N 2.92Å; S122-S126 PolarHBondContact O-OG 2.83Å; S122-E146 VanDerWaalsContact C-OE1 3.29Å; S122-L150 WeakPolarHBondContact OG-CD2 3.27Å; S122-A176 WeakPolarHBondContact O-CB 3.44Å
123V94.2Very high88.4Confident1 Ų17.1 Ų7.11%0.0064%0.04CC..Hα-helixtrans-64.8-40.9177.4-170.90000112M83 A120 M121 I125 S126 A127 V143 E146 V147M83-V123 HydrophobicContact SD-CG1 4.43Å; A120-V123 WeakPolarHBondContact O-CA 3.13Å; A120-V123 VanDerWaalsContact O-CB 3.32Å; A120-V123 WeakPolarHBondContact O-CB 3.07Å; A120-V123 PolarHBondContact O-N 3.49Å; M121-V123 VanDerWaalsContact C-N 3.26Å; M121-V123 PolarHBondContact O-N 2.92Å; V123-I125 VanDerWaalsContact C-N 3.3Å; V123-I125 PolarHBondContact O-N 2.95Å; V123-S126 PolarHBondContact O-N 3.45Å; V123-A127 WeakPolarHBondContact O-CB 3.4Å; V123-A127 PolarHBondContact O-N 2.93Å; V123-V143 HydrophobicContact CG1-CB 4.32Å; V123-V143 HydrophobicContact CG1-CG2 3.69Å; V123-E146 WeakPolarHBondContact CA-OE1 3.11Å; V123-E146 HydrophobicContact CG2-CB 4.1Å; V123-E146 HydrophobicContact CG2-CG 4.14Å; V123-E146 PolarHBondContact N-OE1 3.29Å; V123-V147 HydrophobicContact CG2-CG2 3.54Å
124L92.6Very high88.3Confident1 Ų14.1 Ų4.11%0.0052%0.024CC..Hα-helixtrans-61.1-40.1175.8-75.5129.1000111.7A58 L62 N80 L84 A120 M121 S122 G128A58-L124 HydrophobicContact CB-CD1 4.13Å; L62-L124 HydrophobicContact CB-CB 4.18Å; L62-L124 HydrophobicContact CB-CD2 4.12Å; L62-L124 HydrophobicContact CD1-CB 3.5Å; L62-L124 HydrophobicContact CD1-CD1 4.45Å; L62-L124 HydrophobicContact CD1-CG 4.41Å; L62-L124 HydrophobicContact CG-CB 4.45Å; N80-L124 HydrophobicContact CB-CD2 3.54Å; N80-L124 WeakPolarHBondContact OD1-CD2 3.04Å; L84-L124 HydrophobicContact CB-CD1 4.08Å; L84-L124 HydrophobicContact CD1-CD1 3.92Å; L84-L124 HydrophobicContact CG-CD1 4.49Å; A120-L124 WeakPolarHBondContact O-CD1 3.44Å; A120-L124 PolarHBondContact O-N 3.43Å; M121-L124 HydrophobicContact CG-CD1 4.5Å; M121-L124 WeakPolarHBondContact O-CB 3.37Å; M121-L124 PolarHBondContact O-N 3.35Å; S122-L124 PolarHBondContact O-N 3.01Å; L124-G128 PolarHBondContact O-N 3Å
125I90.5Very high88.3Confident15 Ų154.3 Ų4.38%0.0773%0.027CC..Hα-helixtrans-63.3-53.2174.8-65.7165.5000109.3L62 M121 S122 V123 A127 G128 F172 Y173 A176 H329L62-I125 HydrophobicContact CD1-CG1 4.15Å; L62-I125 HydrophobicContact CD2-CG1 4.33Å; M121-I125 WeakPolarHBondContact O-CG1 3.13Å; M121-I125 PolarHBondContact O-N 3.47Å; S122-I125 WeakPolarHBondContact O-CB 3.17Å; S122-I125 PolarHBondContact O-N 3.38Å; V123-I125 VanDerWaalsContact C-N 3.3Å; V123-I125 PolarHBondContact O-N 2.95Å; I125-A127 VanDerWaalsContact C-N 3.32Å; I125-A127 PolarHBondContact O-N 3.41Å; I125-G128 PolarHBondContact O-N 3.28Å; I125-F172 HydrophobicContact CD1-CE2 4.1Å; I125-Y173 HydrophobicContact CD1-CD1 3.99Å; I125-Y173 HydrophobicContact CD1-CE1 4.07Å; I125-A176 HydrophobicContact CB-CB 4.02Å; I125-A176 HydrophobicContact CG2-CB 3.94Å; I125-H329 PolarHBondContact O-CE1 2.89Å; I125-H329 PolarHBondContact O-ND1 3.45Å; I125-H329 VanDerWaalsContact O-ND1 3.11Å
126S92.1Very high88.2Confident0 Ų05.2 Ų5.20%03%0.031CC..Hα-helixtrans-57.5-41.5178.3-64.70000113.4S122 V123 G128 A129 M142 E146 A176S122-S126 PolarHBondContact O-N 2.92Å; S122-S126 PolarHBondContact O-OG 2.83Å; V123-S126 PolarHBondContact O-N 3.45Å; S126-G128 PolarHBondContact O-N 3.44Å; S126-A129 WeakPolarHBondContact O-CB 3.4Å; S126-A129 PolarHBondContact O-N 3.45Å; S126-A129 VanDerWaalsContact O-N 3.08Å; S126-M142 VanDerWaalsContact C-CE 3.45Å; S126-E146 WeakPolarHBondContact CB-OE1 3.42Å; S126-E146 WeakPolarHBondContact CB-OE2 3.47Å; S126-E146 VanDerWaalsContact OG-CD 3.24Å; S126-E146 PolarHBondContact OG-OE1 3.44Å; S126-E146 PolarHBondContact OG-OE2 2.95Å; S126-A176 VanDerWaalsContact OG-C 3.31Å; S126-A176 VanDerWaalsContact OG-CA 3.24Å; S126-A176 WeakPolarHBondContact OG-CA 3.24Å; S126-A176 PolarHBondContact OG-O 3.04Å
127A89.8Confident88Confident0 Ų06.4 Ų6.40%04%0.041CC..Hα-helixtrans-61.8-27.2178.500000111.6M83 V123 I125 A129 V130 L131 L139 M142M83-A127 HydrophobicContact CE-CB 3.57Å; M83-A127 HydrophobicContact SD-CB 3.83Å; V123-A127 WeakPolarHBondContact O-CB 3.4Å; V123-A127 PolarHBondContact O-N 2.93Å; I125-A127 VanDerWaalsContact C-N 3.32Å; I125-A127 PolarHBondContact O-N 3.41Å; A127-A129 PolarHBondContact O-N 3.43Å; A127-A129 VanDerWaalsContact O-N 3.07Å; A127-V130 WeakPolarHBondContact O-CG2 3.14Å; A127-V130 PolarHBondContact O-N 2.79Å; A127-L131 HydrophobicContact CB-CD1 4.18Å; A127-L131 HydrophobicContact CB-CG 4.3Å; A127-L131 WeakPolarHBondContact O-CB 3.42Å; A127-L131 VanDerWaalsContact O-CG 3.24Å; A127-L131 WeakPolarHBondContact O-CG 3.2Å; A127-L131 PolarHBondContact O-N 3.07Å; A127-L139 HydrophobicContact CB-CD2 4.5Å; A127-M142 HydrophobicContact CB-CE 4.3Å
128G84.7Confident87.9Confident10 Ų106.3 Ų6.310%0.1034%0.041CC..THydrogen-bonded Turntrans-53.6-24.8172.400000114.6L124 I125 S126 S326L124-G128 PolarHBondContact O-N 3Å; I125-G128 PolarHBondContact O-N 3.28Å; S126-G128 PolarHBondContact O-N 3.44Å; G128-S326 VanDerWaalsContact O-CB 3.26Å; G128-S326 WeakPolarHBondContact O-CB 3.34Å
129A84Confident88Confident4 Ų46.1 Ų6.13%0.0334%0.04CC..THydrogen-bonded Turntrans-82.1-24.3176.300000114.3S126 A127 G180 A184 H329S126-A129 WeakPolarHBondContact O-CB 3.4Å; S126-A129 PolarHBondContact O-N 3.45Å; S126-A129 VanDerWaalsContact O-N 3.08Å; A127-A129 PolarHBondContact O-N 3.43Å; A127-A129 VanDerWaalsContact O-N 3.07Å; A129-G180 WeakPolarHBondContact CB-O 3.48Å; A129-A184 HydrophobicContact CB-CB 3.94Å; A129-H329 HydrophobicContact CB-CB 4.29Å
130V84.5Confident88Confident0 Ų07.4 Ų7.40%05%0.047CC..THydrogen-bonded Turntrans-117.6-18.2-169.6-61.10000114A127 G132 K133 V134 L139 M142 V183 A184 L187A127-V130 WeakPolarHBondContact O-CG2 3.14Å; A127-V130 PolarHBondContact O-N 2.79Å; V130-G132 PolarHBondContact O-N 2.72Å; V130-K133 WeakPolarHBondContact O-CB 3.15Å; V130-K133 PolarHBondContact O-N 2.8Å; V130-V134 HydrophobicContact CB-CG1 4.17Å; V130-V134 HydrophobicContact CB-CG2 4.2Å; V130-V134 HydrophobicContact CG2-CG2 3.99Å; V130-L139 HydrophobicContact CG2-CD2 4.35Å; V130-M142 HydrophobicContact CG2-CE 4.24Å; V130-M142 HydrophobicContact CG2-SD 3.78Å; V130-V183 HydrophobicContact CG1-CB 4.26Å; V130-V183 HydrophobicContact CG1-CG1 3.85Å; V130-A184 HydrophobicContact CG1-CB 3.86Å; V130-L187 HydrophobicContact CB-CD1 4.06Å; V130-L187 HydrophobicContact CG1-CD1 3.79Å
131L80.4Confident88Confident12 Ų128.3 Ų8.36%0.0635%0.053CC..THydrogen-bonded Turntrans-50.7132.7176.7-86.9161.1000110.7T66 A127 L139 F402T66-L131 HydrophobicContact CG2-CD1 3.86Å; A127-L131 HydrophobicContact CB-CD1 4.18Å; A127-L131 HydrophobicContact CB-CG 4.3Å; A127-L131 WeakPolarHBondContact O-CB 3.42Å; A127-L131 VanDerWaalsContact O-CG 3.24Å; A127-L131 WeakPolarHBondContact O-CG 3.2Å; A127-L131 PolarHBondContact O-N 3.07Å; L131-L139 HydrophobicContact CD2-CD1 4.41Å; L131-F402 VanDerWaalsContact O-CE1 3.23Å; L131-F402 WeakPolarHBondContact O-CE1 3.2Å
132G76.6Confident88.1Confident5 Ų58.2 Ų8.25%0.0525%0.052CC..THydrogen-bonded Turntrans91.7-14.6-174.100000115.3H72 V130 Y401 F402H72-G132 PolarHBondContact CE1-N 2.95Å; H72-G132 VanDerWaalsContact CE1-N 3.32Å; H72-G132 VanDerWaalsContact NE2-CA 3.33Å; H72-G132 WeakPolarHBondContact NE2-CA 3.24Å; H72-G132 PolarHBondContact NE2-N 3.17Å; V130-G132 PolarHBondContact O-N 2.72Å; G132-Y401 CarbonylContact O-C 3.5Å; G132-Y401 VanDerWaalsContact O-CA 3.31Å; G132-Y401 WeakPolarHBondContact O-CA 3.43Å; G132-F402 PolarHBondContact O-N 3.04Å
133K79.3Confident88.3Confident13 Ų138.2 Ų8.26%0.0575%0.052CC..THydrogen-bonded Turntrans-110-19.4176.7-54.3179.8-171.6160.20113.8V130 L187 H324 P396 Y401 F402V130-K133 WeakPolarHBondContact O-CB 3.15Å; V130-K133 PolarHBondContact O-N 2.8Å; K133-L187 HydrophobicContact CB-CD1 4.4Å; K133-H324 WeakPolarHBondContact CE-O 3.24Å; K133-H324 PolarHBondContact NZ-O 2.82Å; K133-P396 VanDerWaalsContact O-CG 3.26Å; K133-P396 WeakPolarHBondContact O-CG 3.43Å; K133-Y401 HydrophobicContact CB-CD1 4.45Å; K133-Y401 HydrophobicContact CB-CD2 4.22Å; K133-Y401 HydrophobicContact CB-CE1 4.2Å; K133-Y401 HydrophobicContact CB-CE2 3.97Å; K133-Y401 HydrophobicContact CB-CG 4.45Å; K133-Y401 HydrophobicContact CD-CD2 4.38Å; K133-Y401 HydrophobicContact CD-CE2 4.15Å; K133-Y401 HydrophobicContact CG-CD2 3.75Å; K133-Y401 HydrophobicContact CG-CE2 3.82Å; K133-Y401 HydrophobicContact CG-CG 4.2Å; K133-F402 HydrophobicContact CG-CZ 4.22Å
134V84.9Confident88.4Confident2 Ų210.2 Ų10.21%0.0126%0.063CC..SBendtrans-114.6152.2-175.9-62.30000111V130 Q138 L139 L187V130-V134 HydrophobicContact CB-CG1 4.17Å; V130-V134 HydrophobicContact CB-CG2 4.2Å; V130-V134 HydrophobicContact CG2-CG2 3.99Å; V134-Q138 HydrophobicContact CB-CB 3.98Å; V134-Q138 HydrophobicContact CG1-CB 4.47Å; V134-L139 HydrophobicContact CG2-CD1 4.39Å; V134-L139 HydrophobicContact CG2-CD2 3.42Å; V134-L139 VanDerWaalsContact CG2-CD2 3.42Å; V134-L139 HydrophobicContact CG2-CG 3.76Å; V134-L187 HydrophobicContact CG1-CD1 3.6Å; V134-L187 HydrophobicContact CG1-CD2 4.21Å
135N86.7Confident88.5Confident16 Ų1612 Ų129%0.0867%0.074CC..  trans-91.7171.9173.666.828.5000111.9A137 Q138 L139 W393 K394 F407N135-A137 VanDerWaalsContact C-N 3.29Å; N135-A137 PolarHBondContact O-N 3.31Å; N135-A137 PolarHBondContact OD1-N 3.44Å; N135-Q138 WeakPolarHBondContact O-CB 3.23Å; N135-Q138 PolarHBondContact O-N 3.13Å; N135-Q138 WeakPolarHBondContact OD1-CG 3.39Å; N135-Q138 PolarHBondContact OD1-N 2.9Å; N135-Q138 PolarHBondContact OD1-OE1 2.95Å; N135-L139 PolarHBondContact O-N 3.43Å; N135-L139 VanDerWaalsContact O-N 3.08Å; N135-W393 PolarHBondContact ND2-O 2.86Å; N135-K394 PolarHBondContact ND2-O 3.21Å; N135-F407 HydrophobicContact CB-CE1 3.75Å; N135-F407 HydrophobicContact CB-CZ 3.8Å
136L86.9Confident88.8Confident20 Ų2011.3 Ų11.311%0.1057%0.07CC..Hα-helixtrans-61.3-33.6-178-171.271000113.3L13 F79 F82 L139 V140L13-L136 HydrophobicContact CD1-CB 3.88Å; L13-L136 HydrophobicContact CD1-CD2 4.4Å; L13-L136 HydrophobicContact CD1-CG 4.46Å; L13-L136 HydrophobicContact CD2-CB 4.3Å; L13-L136 HydrophobicContact CD2-CD2 3.63Å; L13-L136 HydrophobicContact CD2-CG 4.5Å; L13-L136 HydrophobicContact CG-CD2 4.28Å; F79-L136 HydrophobicContact CB-CD1 4.15Å; F79-L136 HydrophobicContact CD1-CD1 3.69Å; F79-L136 HydrophobicContact CE1-CB 4.3Å; F79-L136 HydrophobicContact CE1-CD1 4.21Å; F79-L136 HydrophobicContact CG-CD1 3.89Å; F79-L136 HydrophobicContact CZ-CB 4.36Å; F82-L136 HydrophobicContact CB-CD1 4.31Å; F82-L136 HydrophobicContact CD1-CD1 3.61Å; F82-L136 HydrophobicContact CD1-CD2 4.37Å; F82-L136 HydrophobicContact CD1-CG 4.23Å; F82-L136 HydrophobicContact CD2-CD2 4.47Å; F82-L136 HydrophobicContact CE1-CD1 4.15Å; F82-L136 HydrophobicContact CE1-CD2 4.39Å; F82-L136 HydrophobicContact CE1-CG 4.3Å; F82-L136 HydrophobicContact CE2-CD2 4.48Å; F82-L136 HydrophobicContact CG-CD1 4Å; F82-L136 HydrophobicContact CG-CD2 4.41Å; F82-L136 HydrophobicContact CZ-CD2 4.45Å; L136-L139 PolarHBondContact O-N 3.42Å; L136-V140 WeakPolarHBondContact O-CG2 3.41Å; L136-V140 PolarHBondContact O-N 2.9Å
137A87.5Confident89Confident26 Ų2611.3 Ų11.322%0.2157%0.07CC..Hα-helixtrans-65.9-40177.200000112.1L13 N135 L139 V140 V141 W393L13-A137 HydrophobicContact CD1-CB 4.04Å; N135-A137 VanDerWaalsContact C-N 3.29Å; N135-A137 PolarHBondContact O-N 3.31Å; N135-A137 PolarHBondContact OD1-N 3.44Å; A137-L139 VanDerWaalsContact C-N 3.32Å; A137-V140 WeakPolarHBondContact O-CB 3.24Å; A137-V140 PolarHBondContact O-N 2.61Å; A137-V141 WeakPolarHBondContact O-CG2 3.27Å; A137-V141 PolarHBondContact O-N 3.4Å; A137-W393 HydrophobicContact CB-CE3 4.16Å
138Q90.4Very high89.2Confident2 Ų213.5 Ų13.51%0.0098%0.084CC..Hα-helixtrans-64.4-38.5173.1-72.1171.2-5100111.4V134 N135 V141 M142 L388 W393V134-Q138 HydrophobicContact CB-CB 3.98Å; V134-Q138 HydrophobicContact CG1-CB 4.47Å; N135-Q138 WeakPolarHBondContact O-CB 3.23Å; N135-Q138 PolarHBondContact O-N 3.13Å; N135-Q138 WeakPolarHBondContact OD1-CG 3.39Å; N135-Q138 PolarHBondContact OD1-N 2.9Å; N135-Q138 PolarHBondContact OD1-OE1 2.95Å; Q138-V141 PolarHBondContact O-N 2.76Å; Q138-M142 WeakPolarHBondContact O-CB 3.27Å; Q138-M142 PolarHBondContact O-N 2.83Å; Q138-L388 HydrophobicContact CB-CD1 4.4Å; Q138-L388 HydrophobicContact CB-CD2 3.83Å; Q138-L388 HydrophobicContact CG-CD2 4.15Å; Q138-L388 PolarHBondContact NE2-O 3.45Å; Q138-L388 VanDerWaalsContact O-CD2 3.27Å; Q138-L388 WeakPolarHBondContact O-CD2 3.49Å; Q138-W393 HydrophobicContact CG-CB 3.71Å; Q138-W393 HydrophobicContact CG-CG 3.94Å
139L92.3Very high89.7Confident0 Ų013.5 Ų13.50%08%0.082CC..Hα-helixtrans-65.8-38.3175.8-67.9176000112.6F79 M83 A127 V130 L131 V134 N135 L136 A137 V141 M142 V143F79-L139 HydrophobicContact CB-CD1 3.77Å; F79-L139 HydrophobicContact CD2-CD1 3.7Å; F79-L139 HydrophobicContact CG-CD1 4.06Å; M83-L139 HydrophobicContact CE-CD1 4.35Å; M83-L139 HydrophobicContact CG-CB 4.16Å; M83-L139 HydrophobicContact SD-CB 3.84Å; M83-L139 HydrophobicContact SD-CD1 4.04Å; M83-L139 HydrophobicContact SD-CD2 3.7Å; M83-L139 HydrophobicContact SD-CG 4.06Å; A127-L139 HydrophobicContact CB-CD2 4.5Å; V130-L139 HydrophobicContact CG2-CD2 4.35Å; L131-L139 HydrophobicContact CD2-CD1 4.41Å; V134-L139 HydrophobicContact CG2-CD1 4.39Å; V134-L139 HydrophobicContact CG2-CD2 3.42Å; V134-L139 VanDerWaalsContact CG2-CD2 3.42Å; V134-L139 HydrophobicContact CG2-CG 3.76Å; N135-L139 PolarHBondContact O-N 3.43Å; N135-L139 VanDerWaalsContact O-N 3.08Å; L136-L139 PolarHBondContact O-N 3.42Å; A137-L139 VanDerWaalsContact C-N 3.32Å; L139-V141 VanDerWaalsContact C-N 3.33Å; L139-V141 PolarHBondContact O-N 3.45Å; L139-M142 HydrophobicContact CD2-SD 4.46Å; L139-M142 WeakPolarHBondContact O-CB 3.18Å; L139-M142 PolarHBondContact O-N 3.33Å; L139-V143 VanDerWaalsContact O-CG2 3.25Å; L139-V143 WeakPolarHBondContact O-CG2 3.37Å; L139-V143 PolarHBondContact O-N 3.43Å
140V92.7Very high90.2Very high26 Ų2613.4 Ų13.416%0.1588%0.081CC..Hα-helixtrans-56-49172.5168.10000110.8L20 F82 L86 L136 A137 M142 V143 L144L20-V140 HydrophobicContact CD2-CG1 3.61Å; F82-V140 HydrophobicContact CE1-CG2 3.56Å; F82-V140 HydrophobicContact CZ-CG2 4.1Å; L86-V140 HydrophobicContact CD2-CB 4.31Å; L86-V140 HydrophobicContact CD2-CG1 4.01Å; L86-V140 HydrophobicContact CD2-CG2 4.19Å; L136-V140 WeakPolarHBondContact O-CG2 3.41Å; L136-V140 PolarHBondContact O-N 2.9Å; A137-V140 WeakPolarHBondContact O-CB 3.24Å; A137-V140 PolarHBondContact O-N 2.61Å; V140-M142 VanDerWaalsContact C-N 3.33Å; V140-M142 PolarHBondContact O-N 2.83Å; V140-V143 PolarHBondContact O-N 3.42Å; V140-L144 HydrophobicContact CG1-CD1 4.27Å; V140-L144 WeakPolarHBondContact O-CG 3.28Å; V140-L144 PolarHBondContact O-N 2.96Å; V140-L144 VanDerWaalsContact O-N 3.08Å
141V93Very high90.5Very high20 Ų2013.4 Ų13.412%0.1218%0.081CC..Hα-helixtrans-63.1-42.6179.61740000111A137 Q138 L139 V143 L144 V145 L387 L388 W393A137-V141 WeakPolarHBondContact O-CG2 3.27Å; A137-V141 PolarHBondContact O-N 3.4Å; Q138-V141 PolarHBondContact O-N 2.76Å; L139-V141 VanDerWaalsContact C-N 3.33Å; L139-V141 PolarHBondContact O-N 3.45Å; V141-V143 PolarHBondContact O-N 2.88Å; V141-L144 PolarHBondContact O-N 3.07Å; V141-V145 HydrophobicContact CG1-CG2 4.39Å; V141-V145 WeakPolarHBondContact O-CG2 3.45Å; V141-V145 PolarHBondContact O-N 3.21Å; V141-L387 HydrophobicContact CG1-CD2 3.33Å; V141-L387 HydrophobicContact CG1-CG 4.16Å; V141-L388 HydrophobicContact CB-CD2 3.93Å; V141-L388 HydrophobicContact CG1-CD2 3.92Å; V141-W393 HydrophobicContact CG2-CH2 3.47Å; V141-W393 VanDerWaalsContact CG2-CH2 3.47Å; V141-W393 HydrophobicContact CG2-CZ2 3.77Å; V141-W393 HydrophobicContact CG2-CZ3 3.93Å
142M94.9Very high90.9Very high0 Ų015.1 Ų15.10%09%0.093CC..Hα-helixtrans-58.6-46.1175.9-177171.5164.100111.8S126 A127 V130 Q138 L139 V140 L144 V145 E146 F179 T384 L388S126-M142 VanDerWaalsContact C-CE 3.45Å; A127-M142 HydrophobicContact CB-CE 4.3Å; V130-M142 HydrophobicContact CG2-CE 4.24Å; V130-M142 HydrophobicContact CG2-SD 3.78Å; Q138-M142 WeakPolarHBondContact O-CB 3.27Å; Q138-M142 PolarHBondContact O-N 2.83Å; L139-M142 HydrophobicContact CD2-SD 4.46Å; L139-M142 WeakPolarHBondContact O-CB 3.18Å; L139-M142 PolarHBondContact O-N 3.33Å; V140-M142 VanDerWaalsContact C-N 3.33Å; V140-M142 PolarHBondContact O-N 2.83Å; M142-L144 PolarHBondContact O-N 3Å; M142-V145 PolarHBondContact O-N 3.14Å; M142-E146 WeakPolarHBondContact CE-OE2 3.14Å; M142-E146 WeakPolarHBondContact O-CB 3.33Å; M142-E146 PolarHBondContact O-N 2.87Å; M142-F179 HydrophobicContact CE-CD1 4.31Å; M142-F179 HydrophobicContact CE-CE1 4.02Å; M142-F179 HydrophobicContact CG-CE1 4.04Å; M142-T384 HydrophobicContact CB-CG2 4.36Å; M142-T384 HydrophobicContact CG-CG2 4.36Å; M142-L388 HydrophobicContact CB-CD1 4.39Å
143V96.4Very high91.6Very high0 Ų015 Ų150%09%0.091CC..Hα-helixtrans-56.8-50175.8173.10000110.9M83 L86 V123 L139 V140 V141 V145 V147M83-V143 HydrophobicContact CB-CG2 3.75Å; M83-V143 HydrophobicContact CG-CG2 3.63Å; M83-V143 HydrophobicContact SD-CG2 4.29Å; L86-V143 HydrophobicContact CB-CG1 4.41Å; L86-V143 HydrophobicContact CD2-CB 4.17Å; L86-V143 HydrophobicContact CD2-CG1 4.04Å; L86-V143 HydrophobicContact CD2-CG2 4.49Å; L86-V143 HydrophobicContact CG-CG1 4.01Å; V123-V143 HydrophobicContact CG1-CB 4.32Å; V123-V143 HydrophobicContact CG1-CG2 3.69Å; L139-V143 VanDerWaalsContact O-CG2 3.25Å; L139-V143 WeakPolarHBondContact O-CG2 3.37Å; L139-V143 PolarHBondContact O-N 3.43Å; V140-V143 PolarHBondContact O-N 3.42Å; V141-V143 PolarHBondContact O-N 2.88Å; V143-V145 PolarHBondContact O-N 2.6Å; V143-V147 HydrophobicContact CG1-CG2 4.3Å; V143-V147 WeakPolarHBondContact O-CB 3.31Å; V143-V147 VanDerWaalsContact O-CG2 3.23Å; V143-V147 WeakPolarHBondContact O-CG2 3.26Å; V143-V147 PolarHBondContact O-N 3.17Å; V143-V147 VanDerWaalsContact O-N 3.1Å
144L95.4Very high92.1Very high43 Ų4314.4 Ų14.423%0.2259%0.088CC..Hα-helixtrans-62.4-44.7-177-67175.3000111.7L20 W90 V140 V141 M142 T148L20-L144 HydrophobicContact CD1-CD1 4.41Å; W90-L144 HydrophobicContact CB-CD2 4.45Å; W90-L144 HydrophobicContact CD2-CD2 3.84Å; W90-L144 HydrophobicContact CE3-CD2 4.47Å; W90-L144 HydrophobicContact CG-CD2 3.79Å; W90-L144 PolarHBondContact NE1-O 3.32Å; W90-L144 VanDerWaalsContact NE1-O 3.16Å; V140-L144 HydrophobicContact CG1-CD1 4.27Å; V140-L144 WeakPolarHBondContact O-CG 3.28Å; V140-L144 PolarHBondContact O-N 2.96Å; V140-L144 VanDerWaalsContact O-N 3.08Å; V141-L144 PolarHBondContact O-N 3.07Å; M142-L144 PolarHBondContact O-N 3Å; L144-T148 WeakPolarHBondContact O-CB 3.34Å; L144-T148 PolarHBondContact O-N 3.49Å; L144-T148 PolarHBondContact O-OG1 3.4Å
145V96.3Very high92.2Very high38 Ų3816 Ų1623%0.2310%0.096CC..Hα-helixtrans-71.8-46.2-178.5179.40000111.6V141 M142 V143 T148 A149 T384V141-V145 HydrophobicContact CG1-CG2 4.39Å; V141-V145 WeakPolarHBondContact O-CG2 3.45Å; V141-V145 PolarHBondContact O-N 3.21Å; M142-V145 PolarHBondContact O-N 3.14Å; V143-V145 PolarHBondContact O-N 2.6Å; V145-T148 PolarHBondContact O-N 3.07Å; V145-A149 WeakPolarHBondContact O-CB 3.38Å; V145-A149 PolarHBondContact O-N 3.35Å; V145-T384 WeakPolarHBondContact CG1-OG1 3.08Å
146E96.1Very high92.3Very high0 Ų017.4 Ų17.40%011%0.105CC..Hα-helixtrans-66.6-45.3-174.9-172174.6165.600112.4S122 V123 S126 M142 T148 A149 L150 F175 F179S122-E146 VanDerWaalsContact C-OE1 3.29Å; V123-E146 WeakPolarHBondContact CA-OE1 3.11Å; V123-E146 HydrophobicContact CG2-CB 4.1Å; V123-E146 HydrophobicContact CG2-CG 4.14Å; V123-E146 PolarHBondContact N-OE1 3.29Å; S126-E146 WeakPolarHBondContact CB-OE1 3.42Å; S126-E146 WeakPolarHBondContact CB-OE2 3.47Å; S126-E146 VanDerWaalsContact OG-CD 3.24Å; S126-E146 PolarHBondContact OG-OE1 3.44Å; S126-E146 PolarHBondContact OG-OE2 2.95Å; M142-E146 WeakPolarHBondContact CE-OE2 3.14Å; M142-E146 WeakPolarHBondContact O-CB 3.33Å; M142-E146 PolarHBondContact O-N 2.87Å; E146-T148 VanDerWaalsContact C-N 3.29Å; E146-T148 PolarHBondContact O-N 2.85Å; E146-A149 PolarHBondContact O-N 3.45Å; E146-L150 WeakPolarHBondContact O-CB 3.26Å; E146-L150 PolarHBondContact O-N 3.48Å; E146-F175 HydrophobicContact CG-CE1 3.97Å; E146-F179 HydrophobicContact CB-CD1 4.24Å; E146-F179 HydrophobicContact CB-CE1 3.64Å; E146-F179 HydrophobicContact CB-CE2 4.2Å; E146-F179 HydrophobicContact CB-CZ 3.6Å; E146-F179 HydrophobicContact CG-CD1 3.75Å; E146-F179 HydrophobicContact CG-CD2 4.35Å; E146-F179 HydrophobicContact CG-CE1 3.68Å; E146-F179 HydrophobicContact CG-CE2 4.27Å; E146-F179 HydrophobicContact CG-CG 4.1Å; E146-F179 HydrophobicContact CG-CZ 3.95Å; E146-F179 VanDerWaalsContact OE2-CD1 3.24Å; E146-F179 WeakPolarHBondContact OE2-CD1 3.41Å; E146-F179 WeakPolarHBondContact OE2-CE1 3.41Å
147V95.8Very high92.3Very high0 Ų016.5 Ų16.50%010%0.1CC..Hα-helixtrans-64.4-37.7177178.80000110.6A91 L94 V123 V143 L150 G151A91-V147 HydrophobicContact CB-CG1 3.65Å; L94-V147 HydrophobicContact CD1-CB 4.3Å; L94-V147 HydrophobicContact CD1-CG1 3.71Å; V123-V147 HydrophobicContact CG2-CG2 3.54Å; V143-V147 HydrophobicContact CG1-CG2 4.3Å; V143-V147 WeakPolarHBondContact O-CB 3.31Å; V143-V147 VanDerWaalsContact O-CG2 3.23Å; V143-V147 WeakPolarHBondContact O-CG2 3.26Å; V143-V147 PolarHBondContact O-N 3.17Å; V143-V147 VanDerWaalsContact O-N 3.1Å; V147-L150 PolarHBondContact O-N 3.35Å; V147-G151 PolarHBondContact O-N 3.37Å
148T95.2Very high92.1Very high47 Ų4716.3 Ų16.329%0.28810%0.097SC..Hα-helixtrans-63.4-47.6174.3-53.90000110.9W90 L94 L144 V145 E146 L150 G151 T152W90-T148 PolarHBondContact NE1-OG1 3.01Å; L94-T148 HydrophobicContact CD2-CG2 4.31Å; L144-T148 WeakPolarHBondContact O-CB 3.34Å; L144-T148 PolarHBondContact O-N 3.49Å; L144-T148 PolarHBondContact O-OG1 3.4Å; V145-T148 PolarHBondContact O-N 3.07Å; E146-T148 VanDerWaalsContact C-N 3.29Å; E146-T148 PolarHBondContact O-N 2.85Å; T148-L150 VanDerWaalsContact C-N 3.34Å; T148-L150 PolarHBondContact O-N 3.33Å; T148-G151 PolarHBondContact O-N 3.42Å; T148-T152 HydrophobicContact CG2-CG2 4.46Å; T148-T152 WeakPolarHBondContact O-CG2 3.43Å; T148-T152 PolarHBondContact O-N 3.02Å; T148-T152 PolarHBondContact O-OG1 3.2Å
149A95.4Very high91.9Very high9 Ų921.6 Ų21.67%0.07413%0.125CC..Hα-helixtrans-60.4-43.1178.700000111.5V145 E146 T152 L153 F175 I376V145-A149 WeakPolarHBondContact O-CB 3.38Å; V145-A149 PolarHBondContact O-N 3.35Å; E146-A149 PolarHBondContact O-N 3.45Å; A149-T152 WeakPolarHBondContact CA-OG1 3.29Å; A149-T152 PolarHBondContact O-N 2.63Å; A149-T152 PolarHBondContact O-OG1 2.98Å; A149-L153 WeakPolarHBondContact O-CB 3.34Å; A149-L153 PolarHBondContact O-N 3.35Å; A149-F175 HydrophobicContact CB-CE2 4.48Å; A149-F175 HydrophobicContact CB-CZ 3.84Å; A149-I376 HydrophobicContact CB-CG2 4.45Å
150L93Very high91.5Very high2 Ų226.7 Ų26.71%0.0115%0.152CC..Hα-helixtrans-65.5-39.5175.3-175.959.5000112.5S122 E146 V147 T148 L153 R154 L169 F175S122-L150 WeakPolarHBondContact OG-CD2 3.27Å; E146-L150 WeakPolarHBondContact O-CB 3.26Å; E146-L150 PolarHBondContact O-N 3.48Å; V147-L150 PolarHBondContact O-N 3.35Å; T148-L150 VanDerWaalsContact C-N 3.34Å; T148-L150 PolarHBondContact O-N 3.33Å; L150-L153 HydrophobicContact CD1-CD2 4.22Å; L150-L153 PolarHBondContact O-N 2.81Å; L150-R154 WeakPolarHBondContact O-CG 3.24Å; L150-R154 PolarHBondContact O-N 3.01Å; L150-R154 VanDerWaalsContact O-N 3.07Å; L150-L169 HydrophobicContact CD2-CD2 4.43Å; L150-F175 HydrophobicContact CB-CD1 4.37Å; L150-F175 HydrophobicContact CB-CE1 3.86Å; L150-F175 HydrophobicContact CB-CZ 4.22Å; L150-F175 HydrophobicContact CD1-CD1 3.92Å; L150-F175 HydrophobicContact CD1-CE1 4.25Å; L150-F175 HydrophobicContact CD1-CG 4.17Å
151G91.2Very high90.9Very high0 Ų027.6 Ų27.60%015%0.153CC..Hα-helixtrans-60.3-47172.300000112.1L98 V147 T148 L153 R154 M155L98-G151 VanDerWaalsContact CD1-C 3.47Å; V147-G151 PolarHBondContact O-N 3.37Å; T148-G151 PolarHBondContact O-N 3.42Å; G151-L153 PolarHBondContact O-N 3.35Å; G151-R154 PolarHBondContact O-N 3.44Å; G151-M155 PolarHBondContact O-N 2.98Å
152T90.1Very high90.1Very high49 Ų4933.8 Ų33.830%0.30119%0.186SC..Hα-helixtrans-64.4-39.217760.20000112.4T148 A149 R154 M155 V156T148-T152 HydrophobicContact CG2-CG2 4.46Å; T148-T152 WeakPolarHBondContact O-CG2 3.43Å; T148-T152 PolarHBondContact O-N 3.02Å; T148-T152 PolarHBondContact O-OG1 3.2Å; A149-T152 WeakPolarHBondContact CA-OG1 3.29Å; A149-T152 PolarHBondContact O-N 2.63Å; A149-T152 PolarHBondContact O-OG1 2.98Å; T152-R154 VanDerWaalsContact C-N 3.34Å; T152-R154 PolarHBondContact O-N 3.14Å; T152-M155 PolarHBondContact O-N 2.64Å; T152-V156 WeakPolarHBondContact O-CB 3.37Å; T152-V156 VanDerWaalsContact O-CG2 3.25Å; T152-V156 WeakPolarHBondContact O-CG2 3.49Å; T152-V156 PolarHBondContact O-N 3.28Å
153L91.1Very high88.9Confident2 Ų235.8 Ų35.81%0.0120%0.198CC..Hα-helixtrans-57.1-47.8173.217465.3000110.8A149 L150 G151 M155 V156 I157 F175 L372 A373 I376A149-L153 WeakPolarHBondContact O-CB 3.34Å; A149-L153 PolarHBondContact O-N 3.35Å; L150-L153 HydrophobicContact CD1-CD2 4.22Å; L150-L153 PolarHBondContact O-N 2.81Å; G151-L153 PolarHBondContact O-N 3.35Å; L153-M155 PolarHBondContact O-N 3.42Å; L153-V156 PolarHBondContact O-N 3.06Å; L153-I157 HydrophobicContact CD1-CD1 3.66Å; L153-I157 HydrophobicContact CD1-CG1 4.07Å; L153-I157 HydrophobicContact CG-CD1 3.89Å; L153-I157 WeakPolarHBondContact O-CB 3.35Å; L153-I157 VanDerWaalsContact O-CG1 3.29Å; L153-I157 WeakPolarHBondContact O-CG1 3.49Å; L153-I157 PolarHBondContact O-N 3.45Å; L153-F175 HydrophobicContact CD2-CB 4.49Å; L153-F175 HydrophobicContact CD2-CD2 3.73Å; L153-F175 HydrophobicContact CD2-CE2 4.32Å; L153-F175 HydrophobicContact CD2-CG 4.27Å; L153-L372 HydrophobicContact CD1-CD2 4.27Å; L153-L372 HydrophobicContact CD1-CG 4.05Å; L153-A373 HydrophobicContact CD1-CB 4.12Å; L153-A373 HydrophobicContact CD2-CB 3.82Å; L153-I376 HydrophobicContact CB-CD1 4.24Å; L153-I376 HydrophobicContact CD1-CD1 3.77Å
154R89.1Confident87.5Confident0 Ų039.5 Ų39.50%022%0.218CC..Hα-helixtrans-61.6-42.4178-73-174.9-70.4170.1-5.5112.4D95 S119 L150 G151 T152 S158 Y165 N168D95-R154 VanDerWaalsContact CG-NH2 3.33Å; D95-R154 IonicContact OD1-CZ 3.53Å; D95-R154 IonicContact OD1-NE 3.78Å; D95-R154 IonicContact OD1-NH1 2.91Å; D95-R154 PolarHBondContact OD1-NH1 3.16Å; D95-R154 VanDerWaalsContact OD1-NH1 3.14Å; D95-R154 IonicContact OD1-NH2 2.73Å; D95-R154 PolarHBondContact OD1-NH2 3.46Å; D95-R154 IonicContact OD2-CZ 3.15Å; D95-R154 IonicContact OD2-NH1 3.14Å; D95-R154 PolarHBondContact OD2-NH1 2.9Å; D95-R154 IonicContact OD2-NH2 3.86Å; D95-R154 PolarHBondContact OD2-NH2 3.35Å; S119-R154 PolarHBondContact OG-NH2 3.43Å; L150-R154 WeakPolarHBondContact O-CG 3.24Å; L150-R154 PolarHBondContact O-N 3.01Å; L150-R154 VanDerWaalsContact O-N 3.07Å; G151-R154 PolarHBondContact O-N 3.44Å; T152-R154 VanDerWaalsContact C-N 3.34Å; T152-R154 PolarHBondContact O-N 3.14Å; R154-S158 VanDerWaalsContact O-CB 3.31Å; R154-S158 WeakPolarHBondContact O-CB 3.13Å; R154-S158 PolarHBondContact O-N 3.41Å; R154-Y165 HydrophobicContact CB-CD2 4.1Å; R154-Y165 HydrophobicContact CB-CE2 3.74Å; R154-N168 HydrophobicContact CB-CB 4.21Å; R154-N168 HydrophobicContact CG-CB 3.98Å; R154-N168 PolarHBondContact O-ND2 3.38Å
155M87.6Confident86Confident36 Ų3638.4 Ų38.418%0.17721%0.211CC..Hα-helixtrans-62.4-50.3177-176.9-151.2-95.300111L98 F101 G151 T152 L153 I157 S158 N159 Y165L98-M155 HydrophobicContact CB-CE 3.74Å; L98-M155 HydrophobicContact CD2-CE 3.36Å; L98-M155 HydrophobicContact CG-CE 4.1Å; L98-M155 VanDerWaalsContact O-CE 3.29Å; L98-M155 WeakPolarHBondContact O-CE 3.26Å; F101-M155 HydrophobicContact CE2-CE 3.89Å; G151-M155 PolarHBondContact O-N 2.98Å; T152-M155 PolarHBondContact O-N 2.64Å; L153-M155 PolarHBondContact O-N 3.42Å; M155-I157 PolarHBondContact O-N 3.4Å; M155-S158 PolarHBondContact O-N 2.9Å; M155-N159 WeakPolarHBondContact O-CB 3.43Å; M155-N159 VanDerWaalsContact O-CG 3.3Å; M155-N159 PolarHBondContact O-N 3.21Å; M155-Y165 HydrophobicContact CB-CE2 4.02Å
156V88.5Confident84.1Confident46 Ų4639.6 Ų39.628%0.27921%0.214SC..Hα-helixtrans-62.8-43.7-178.9174.30000110.6T152 L153 S158 N159 I160 L372T152-V156 WeakPolarHBondContact O-CB 3.37Å; T152-V156 VanDerWaalsContact O-CG2 3.25Å; T152-V156 WeakPolarHBondContact O-CG2 3.49Å; T152-V156 PolarHBondContact O-N 3.28Å; L153-V156 PolarHBondContact O-N 3.06Å; V156-S158 PolarHBondContact O-N 2.95Å; V156-N159 PolarHBondContact O-N 2.94Å; V156-I160 HydrophobicContact CG1-CD1 3.49Å; V156-I160 VanDerWaalsContact CG1-CD1 3.49Å; V156-I160 HydrophobicContact CG1-CG1 4.23Å; V156-I160 WeakPolarHBondContact O-CB 3.46Å; V156-I160 VanDerWaalsContact O-CG1 3.3Å; V156-I160 WeakPolarHBondContact O-CG1 3.46Å; V156-I160 PolarHBondContact O-N 3.47Å; V156-L372 HydrophobicContact CB-CD2 4.46Å; V156-L372 HydrophobicContact CG1-CD2 3.7Å
157I86Confident82.3Confident0 Ų041.8 Ų41.80%023%0.225CC..Hα-helixtrans-60.8-46.4175.3-69.5173.6000110.3L153 M155 N159 I160 F161 N168 E369 L372L153-I157 HydrophobicContact CD1-CD1 3.66Å; L153-I157 HydrophobicContact CD1-CG1 4.07Å; L153-I157 HydrophobicContact CG-CD1 3.89Å; L153-I157 WeakPolarHBondContact O-CB 3.35Å; L153-I157 VanDerWaalsContact O-CG1 3.29Å; L153-I157 WeakPolarHBondContact O-CG1 3.49Å; L153-I157 PolarHBondContact O-N 3.45Å; M155-I157 PolarHBondContact O-N 3.4Å; I157-N159 VanDerWaalsContact C-N 3.34Å; I157-N159 PolarHBondContact O-N 3.33Å; I157-I160 PolarHBondContact O-N 2.91Å; I157-F161 HydrophobicContact CB-CD2 4.44Å; I157-F161 HydrophobicContact CG2-CD2 4.07Å; I157-F161 WeakPolarHBondContact O-CB 3.36Å; I157-F161 WeakPolarHBondContact O-CD2 3.14Å; I157-F161 PolarHBondContact O-N 3.39Å; I157-N168 HydrophobicContact CG2-CB 4.32Å; I157-N168 WeakPolarHBondContact CG2-ND2 3.29Å; I157-E369 HydrophobicContact CG2-CG 4.17Å; I157-L372 HydrophobicContact CG1-CD2 3.94Å
158S84.8Confident80.8Confident22 Ų2242.1 Ų42.115%0.15423%0.227CC..Hα-helixtrans-60.7-43.9-179.9-169.40000111.9R154 M155 V156 N162 T163 Y165 N168R154-S158 VanDerWaalsContact O-CB 3.31Å; R154-S158 WeakPolarHBondContact O-CB 3.13Å; R154-S158 PolarHBondContact O-N 3.41Å; M155-S158 PolarHBondContact O-N 2.9Å; V156-S158 PolarHBondContact O-N 2.95Å; S158-N162 WeakPolarHBondContact O-CA 3.42Å; S158-N162 PolarHBondContact O-N 3.47Å; S158-T163 WeakPolarHBondContact CB-O 3.29Å; S158-T163 PolarHBondContact OG-O 3.34Å; S158-Y165 PolarHBondContact OG-N 2.59Å; S158-N168 PolarHBondContact N-ND2 3.49Å
159N84.6Confident79.6Confident113 Ų11340.1 Ų40.160%0.60421%0.214SC*.Hα-helixtrans-71.6-37.2-178.5-70.8-12.6000113.4M155 V156 I157M155-N159 WeakPolarHBondContact O-CB 3.43Å; M155-N159 VanDerWaalsContact O-CG 3.3Å; M155-N159 PolarHBondContact O-N 3.21Å; V156-N159 PolarHBondContact O-N 2.94Å; I157-N159 VanDerWaalsContact C-N 3.34Å; I157-N159 PolarHBondContact O-N 3.33Å
160I84.2Confident78.6Confident108 Ų10842 Ų4255%0.55422%0.219SC*.Hα-helixtrans-80.3-42.9-178.5-66.2177000111.1V156 I157V156-I160 HydrophobicContact CG1-CD1 3.49Å; V156-I160 VanDerWaalsContact CG1-CD1 3.49Å; V156-I160 HydrophobicContact CG1-CG1 4.23Å; V156-I160 WeakPolarHBondContact O-CB 3.46Å; V156-I160 VanDerWaalsContact O-CG1 3.3Å; V156-I160 WeakPolarHBondContact O-CG1 3.46Å; V156-I160 PolarHBondContact O-N 3.47Å; I157-I160 PolarHBondContact O-N 2.91Å
161F79.6Confident78.1Confident44 Ų4442 Ų4219%0.19322%0.219CC..Hα-helixtrans-101.1-0.7-170.5-61.8-87.9000113.4I157 T163 L365 E369I157-F161 HydrophobicContact CB-CD2 4.44Å; I157-F161 HydrophobicContact CG2-CD2 4.07Å; I157-F161 WeakPolarHBondContact O-CB 3.36Å; I157-F161 WeakPolarHBondContact O-CD2 3.14Å; I157-F161 PolarHBondContact O-N 3.39Å; F161-T163 HydrophobicContact CB-CG2 3.93Å; F161-T163 PolarHBondContact O-N 2.99Å; F161-L365 HydrophobicContact CD1-CB 4Å; F161-L365 HydrophobicContact CD1-CD1 4.35Å; F161-L365 HydrophobicContact CD1-CD2 3.65Å; F161-L365 HydrophobicContact CD1-CG 4.18Å; F161-L365 HydrophobicContact CE1-CB 3.96Å; F161-L365 HydrophobicContact CE1-CD2 3.55Å; F161-L365 HydrophobicContact CE1-CG 4.26Å; F161-E369 HydrophobicContact CD1-CG 4.07Å; F161-E369 HydrophobicContact CD2-CG 3.77Å; F161-E369 HydrophobicContact CE1-CG 3.97Å; F161-E369 HydrophobicContact CE2-CG 3.65Å; F161-E369 HydrophobicContact CG-CG 4Å; F161-E369 HydrophobicContact CZ-CG 3.76Å
162N76.4Confident77.8Confident151 Ų15142.7 Ų42.781%0.80722%0.222SC*.  trans52.236.6-175.7-68.1-42.3000112.9S158S158-N162 WeakPolarHBondContact O-CA 3.42Å; S158-N162 PolarHBondContact O-N 3.47Å
163T71.3Confident77.6Confident42 Ų4240.8 Ų40.826%0.25821%0.21SC..  trans-95.8155.7179.351.80000111S158 F161 Y165 N168S158-T163 WeakPolarHBondContact CB-O 3.29Å; S158-T163 PolarHBondContact OG-O 3.34Å; F161-T163 HydrophobicContact CB-CG2 3.93Å; F161-T163 PolarHBondContact O-N 2.99Å; T163-Y165 PolarHBondContact O-N 3.23Å; T163-Y165 VanDerWaalsContact O-N 3.09Å; T163-N168 PolarHBondContact OG1-ND2 3.45Å; T163-N168 VanDerWaalsContact OG1-ND2 3.13Å; T163-N168 PolarHBondContact OG1-OD1 3.22Å; T163-N168 VanDerWaalsContact OG1-OD1 3.13Å
164D66.9Low77.5Confident78 Ų7840.7 Ų40.742%0.41721%0.209SC..  trans-58.1112.3176-83.9-61.2000111.3H166 M167 N168 R229D164-H166 PolarHBondContact O-N 3.2Å; D164-H166 VanDerWaalsContact O-N 3.1Å; D164-M167 HydrophobicContact CB-CB 3.86Å; D164-M167 HydrophobicContact CB-CG 3.51Å; D164-M167 WeakPolarHBondContact O-CB 3.49Å; D164-M167 PolarHBondContact O-N 3.07Å; D164-N168 PolarHBondContact O-N 3.19Å; D164-N168 PolarHBondContact O-OD1 2.99Å; D164-R229 IonicContact OD1-CZ 3.35Å; D164-R229 IonicContact OD1-NH1 2.85Å; D164-R229 PolarHBondContact OD1-NH1 3.39Å; D164-R229 IonicContact OD1-NH2 2.64Å; D164-R229 PolarHBondContact OD1-NH2 2.88Å; D164-R229 IonicContact OD2-CZ 3.55Å; D164-R229 IonicContact OD2-NH1 3.33Å; D164-R229 PolarHBondContact OD2-NH1 3.47Å; D164-R229 IonicContact OD2-NH2 4Å; D164-R229 PolarHBondContact OD2-NH2 3.09Å
165Y62Low77.7Confident19 Ų1940.7 Ų40.78%0.07521%0.209CC..G310 helixtrans-46.2-45.2179175.4-94.4000113.1D95 R154 M155 S158 T163 M167 N168D95-Y165 HydrophobicContact CB-CE1 4.46Å; D95-Y165 WeakPolarHBondContact OD1-CE1 3.11Å; D95-Y165 PolarHBondContact OD1-OH 3.27Å; R154-Y165 HydrophobicContact CB-CD2 4.1Å; R154-Y165 HydrophobicContact CB-CE2 3.74Å; M155-Y165 HydrophobicContact CB-CE2 4.02Å; S158-Y165 PolarHBondContact OG-N 2.59Å; T163-Y165 PolarHBondContact O-N 3.23Å; T163-Y165 VanDerWaalsContact O-N 3.09Å; Y165-M167 VanDerWaalsContact C-N 3.26Å; Y165-M167 PolarHBondContact O-N 3.27Å; Y165-N168 PolarHBondContact O-N 3.31Å
166H57.1Low77.9Confident63 Ų6339 Ų3929%0.29220%0.201SC..G310 helixtrans-73.4-14.3-177.4-59.3-68.7000114.3F111 L115 D164F111-H166 HydrophobicContact CE1-CB 3.61Å; F111-H166 AromaticContact CE1-CG 3.78Å; F111-H166 HydrophobicContact CZ-CB 3.77Å; L115-H166 WeakPolarHBondContact CD1-O 3.5Å; L115-H166 HydrophobicContact CD2-CB 4.22Å; L115-H166 WeakPolarHBondContact CD2-ND1 3.44Å; D164-H166 PolarHBondContact O-N 3.2Å; D164-H166 VanDerWaalsContact O-N 3.1Å
167M59.1Low77.9Confident46 Ų4636.8 Ų36.823%0.22719%0.188CC..G310 helixtrans-95.3-8.6178.4-59.3-67.597.700112.6F111 D164 Y165 L169 L227F111-M167 HydrophobicContact CE2-CE 4.14Å; F111-M167 HydrophobicContact CZ-CE 3.7Å; D164-M167 HydrophobicContact CB-CB 3.86Å; D164-M167 HydrophobicContact CB-CG 3.51Å; D164-M167 WeakPolarHBondContact O-CB 3.49Å; D164-M167 PolarHBondContact O-N 3.07Å; Y165-M167 VanDerWaalsContact C-N 3.26Å; Y165-M167 PolarHBondContact O-N 3.27Å; M167-L169 PolarHBondContact O-N 2.9Å; M167-L227 HydrophobicContact CE-CB 3.73Å; M167-L227 HydrophobicContact CE-CD2 4.14Å; M167-L227 HydrophobicContact CE-CG 4.36Å; M167-L227 WeakPolarHBondContact CE-O 3.38Å; M167-L227 HydrophobicContact SD-CB 4.13Å
168N63Low78.2Confident7 Ų739.1 Ų39.14%0.03720%0.197CC..THydrogen-bonded Turntrans-77.422.7-173.3-69.2-19.3000114.8R154 I157 S158 T163 D164 Y165 R170R154-N168 HydrophobicContact CB-CB 4.21Å; R154-N168 HydrophobicContact CG-CB 3.98Å; R154-N168 PolarHBondContact O-ND2 3.38Å; I157-N168 HydrophobicContact CG2-CB 4.32Å; I157-N168 WeakPolarHBondContact CG2-ND2 3.29Å; S158-N168 PolarHBondContact N-ND2 3.49Å; T163-N168 PolarHBondContact OG1-ND2 3.45Å; T163-N168 VanDerWaalsContact OG1-ND2 3.13Å; T163-N168 PolarHBondContact OG1-OD1 3.22Å; T163-N168 VanDerWaalsContact OG1-OD1 3.13Å; D164-N168 PolarHBondContact O-N 3.19Å; D164-N168 PolarHBondContact O-OD1 2.99Å; Y165-N168 PolarHBondContact O-N 3.31Å; N168-R170 VanDerWaalsContact C-N 3.3Å
169L70.4Confident78.6Confident5 Ų538.1 Ų38.13%0.02619%0.189CC..THydrogen-bonded Turntrans-85.13.4170.3-87.8118.2000113.6L115 M118 L150 M167 H171 F172 L227L115-L169 HydrophobicContact CD1-CD1 3.19Å; L115-L169 HydrophobicContact CG-CD1 4.25Å; M118-L169 HydrophobicContact CB-CD2 3.94Å; M118-L169 HydrophobicContact CE-CB 4.4Å; M118-L169 HydrophobicContact CE-CD1 4.18Å; M118-L169 HydrophobicContact CE-CD2 4.32Å; L150-L169 HydrophobicContact CD2-CD2 4.43Å; M167-L169 PolarHBondContact O-N 2.9Å; L169-H171 PolarHBondContact O-N 3.49Å; L169-H171 VanDerWaalsContact O-N 3.07Å; L169-F172 HydrophobicContact CB-CB 4.49Å; L169-F172 HydrophobicContact CD2-CB 3.96Å; L169-F172 HydrophobicContact CD2-CG 4.31Å; L169-F172 VanDerWaalsContact O-CB 3.29Å; L169-F172 WeakPolarHBondContact O-CB 3.44Å; L169-F172 WeakPolarHBondContact O-CD1 3.39Å; L169-F172 PolarHBondContact O-N 3Å; L169-L227 HydrophobicContact CB-CD1 3.9Å; L169-L227 HydrophobicContact CD1-CD1 3.94Å
170R74.8Confident78.9Confident49 Ų4932.7 Ų32.719%0.18516%0.161CC..THydrogen-bonded Turntrans-46.2-45.3178.8-178.8166.514.4102.23.8112.6N168 F172 T283 E369N168-R170 VanDerWaalsContact C-N 3.3Å; R170-F172 VanDerWaalsContact C-N 3.31Å; R170-F172 PolarHBondContact O-N 3.43Å; R170-T283 HydrophobicContact CG-CG2 3.87Å; R170-T283 WeakPolarHBondContact O-CG2 3.41Å; R170-E369 IonicContact CZ-OE2 3.66Å; R170-E369 IonicContact NH1-OE2 3.3Å; R170-E369 PolarHBondContact NH1-OE2 3.09Å; R170-E369 IonicContact NH2-OE1 2.66Å; R170-E369 IonicContact NH2-OE2 3.05Å; R170-E369 PolarHBondContact NH2-OE2 2.75Å
171H82.4Confident79.1Confident2 Ų229.6 Ų29.61%0.00915%0.145CC..THydrogen-bonded Turntrans-85.19.8-175.9-54.2-53.2000115.4L169 Y173 V174 F175 E340 E369 A373L169-H171 PolarHBondContact O-N 3.49Å; L169-H171 VanDerWaalsContact O-N 3.07Å; H171-Y173 PolarHBondContact O-N 3.27Å; H171-V174 PolarHBondContact O-N 3.4Å; H171-F175 WeakPolarHBondContact O-CB 3.29Å; H171-F175 PolarHBondContact O-N 2.91Å; H171-E340 WeakPolarHBondContact CA-OE1 3.48Å; H171-E340 IonicContact CE1-OE1 3.67Å; H171-E340 IonicContact CE1-OE2 3.64Å; H171-E340 PolarHBondContact CE1-OE2 3.01Å; H171-E340 VanDerWaalsContact CE1-OE2 3.3Å; H171-E340 IonicContact CG-OE1 2.75Å; H171-E340 IonicContact ND1-OE1 3.32Å; H171-E340 PolarHBondContact ND1-OE1 2.72Å; H171-E340 IonicContact ND1-OE2 2.73Å; H171-E340 PolarHBondContact ND1-OE2 3.35Å; H171-E369 WeakPolarHBondContact NE2-CB 3.39Å; H171-E369 IonicContact NE2-OE2 3.2Å; H171-A373 HydrophobicContact CB-CB 3.69Å
172F84.9Confident79.6Confident14 Ų1428 Ų286%0.06114%0.139CC..Hα-helixtrans-65.4-37-168.987.3-82000113.9M121 I125 L169 R170 F175 A176M121-F172 HydrophobicContact CE-CE2 4.5Å; I125-F172 HydrophobicContact CD1-CE2 4.1Å; L169-F172 HydrophobicContact CB-CB 4.49Å; L169-F172 HydrophobicContact CD2-CB 3.96Å; L169-F172 HydrophobicContact CD2-CG 4.31Å; L169-F172 VanDerWaalsContact O-CB 3.29Å; L169-F172 WeakPolarHBondContact O-CB 3.44Å; L169-F172 WeakPolarHBondContact O-CD1 3.39Å; L169-F172 PolarHBondContact O-N 3Å; R170-F172 VanDerWaalsContact C-N 3.31Å; R170-F172 PolarHBondContact O-N 3.43Å; F172-F175 PolarHBondContact O-N 3.24Å; F172-A176 VanDerWaalsContact O-CB 3.29Å; F172-A176 WeakPolarHBondContact O-CB 3.3Å; F172-A176 PolarHBondContact O-N 3.17Å
173Y86.4Confident80.3Confident10 Ų1020.9 Ų20.94%0.03910%0.101CC..Hα-helixtrans-62.6-45.6177.3-75-67.2000111.6I125 H171 A177 W220 N224 V279I125-Y173 HydrophobicContact CD1-CD1 3.99Å; I125-Y173 HydrophobicContact CD1-CE1 4.07Å; H171-Y173 PolarHBondContact O-N 3.27Å; Y173-A177 VanDerWaalsContact O-CB 3.23Å; Y173-A177 WeakPolarHBondContact O-CB 3.46Å; Y173-A177 PolarHBondContact O-N 3.11Å; Y173-W220 AromaticContact CE1-CZ2 4Å; Y173-W220 HydrophobicContact CE1-CZ2 4Å; Y173-W220 PolarHBondContact OH-NE1 2.96Å; Y173-W220 VanDerWaalsContact OH-NE1 3.09Å; Y173-N224 PolarHBondContact OH-OD1 3.5Å; Y173-V279 HydrophobicContact CD1-CG1 4.23Å; Y173-V279 HydrophobicContact CG-CG1 4.33Å
174V89.4Confident81Confident0 Ų019.1 Ų19.10%09%0.091CC..Hα-helixtrans-65.5-49.2177.6173.90000109.7H171 A176 A177 Y178 G336 L337 E340 L370 I374H171-V174 PolarHBondContact O-N 3.4Å; V174-A176 PolarHBondContact O-N 3.01Å; V174-A177 PolarHBondContact O-N 2.91Å; V174-Y178 HydrophobicContact CG1-CD2 3.61Å; V174-Y178 HydrophobicContact CG1-CE2 3.79Å; V174-Y178 VanDerWaalsContact O-CD2 3.28Å; V174-Y178 WeakPolarHBondContact O-CD2 3.31Å; V174-Y178 PolarHBondContact O-N 3.1Å; V174-G336 VanDerWaalsContact CG2-C 3.45Å; V174-L337 HydrophobicContact CG1-CD2 4.31Å; V174-L337 HydrophobicContact CG2-CD2 4.47Å; V174-E340 HydrophobicContact CG2-CG 3.77Å; V174-L370 HydrophobicContact CG1-CD1 4.07Å; V174-L370 HydrophobicContact CG2-CD1 4.49Å; V174-I374 HydrophobicContact CG1-CD1 4.31Å; V174-I374 HydrophobicContact CG1-CG1 3.77Å
175F92.1Very high81.9Confident0 Ų022.4 Ų22.40%010%0.097CC..Hα-helixtrans-53.1-54.6177.9176.5-90.3000111.9E146 A149 L150 L153 H171 F172 A177 Y178 F179 I376 A377E146-F175 HydrophobicContact CG-CE1 3.97Å; A149-F175 HydrophobicContact CB-CE2 4.48Å; A149-F175 HydrophobicContact CB-CZ 3.84Å; L150-F175 HydrophobicContact CB-CD1 4.37Å; L150-F175 HydrophobicContact CB-CE1 3.86Å; L150-F175 HydrophobicContact CB-CZ 4.22Å; L150-F175 HydrophobicContact CD1-CD1 3.92Å; L150-F175 HydrophobicContact CD1-CE1 4.25Å; L150-F175 HydrophobicContact CD1-CG 4.17Å; L153-F175 HydrophobicContact CD2-CB 4.49Å; L153-F175 HydrophobicContact CD2-CD2 3.73Å; L153-F175 HydrophobicContact CD2-CE2 4.32Å; L153-F175 HydrophobicContact CD2-CG 4.27Å; H171-F175 WeakPolarHBondContact O-CB 3.29Å; H171-F175 PolarHBondContact O-N 2.91Å; F172-F175 PolarHBondContact O-N 3.24Å; F175-A177 PolarHBondContact O-N 3.42Å; F175-Y178 PolarHBondContact O-N 3.46Å; F175-F179 HydrophobicContact CZ-CD2 4.44Å; F175-F179 WeakPolarHBondContact O-CB 3.49Å; F175-F179 PolarHBondContact O-N 2.94Å; F175-I376 HydrophobicContact CE2-CG2 4.01Å; F175-A377 HydrophobicContact CD2-CB 3.63Å; F175-A377 HydrophobicContact CE2-CB 3.96Å; F175-A377 HydrophobicContact CG-CB 4.22Å; F175-A377 WeakPolarHBondContact O-CB 3.47Å
176A91.6Very high83Confident0 Ų022.6 Ų22.60%010%0.101CC..Hα-helixtrans-61.1-45-18000000112.1S122 I125 S126 F172 V174 Y178 F179 G180S122-A176 WeakPolarHBondContact O-CB 3.44Å; I125-A176 HydrophobicContact CB-CB 4.02Å; I125-A176 HydrophobicContact CG2-CB 3.94Å; S126-A176 VanDerWaalsContact OG-C 3.31Å; S126-A176 VanDerWaalsContact OG-CA 3.24Å; S126-A176 WeakPolarHBondContact OG-CA 3.24Å; S126-A176 PolarHBondContact OG-O 3.04Å; F172-A176 VanDerWaalsContact O-CB 3.29Å; F172-A176 WeakPolarHBondContact O-CB 3.3Å; F172-A176 PolarHBondContact O-N 3.17Å; V174-A176 PolarHBondContact O-N 3.01Å; A176-Y178 PolarHBondContact O-N 3.32Å; A176-F179 PolarHBondContact O-N 2.74Å; A176-G180 PolarHBondContact O-N 3.45Å
177A89.6Confident84.3Confident0 Ų020.1 Ų20.10%09%0.09CC..Hα-helixtrans-60.4-49.1-178.900000111.8Y173 V174 F175 L181 H329Y173-A177 VanDerWaalsContact O-CB 3.23Å; Y173-A177 WeakPolarHBondContact O-CB 3.46Å; Y173-A177 PolarHBondContact O-N 3.11Å; V174-A177 PolarHBondContact O-N 2.91Å; F175-A177 PolarHBondContact O-N 3.42Å; A177-L181 VanDerWaalsContact O-CB 3.27Å; A177-L181 WeakPolarHBondContact O-CB 3.41Å; A177-L181 PolarHBondContact O-N 3.12Å; A177-H329 WeakPolarHBondContact CA-NE2 3.34Å; A177-H329 PolarHBondContact O-NE2 2.9Å
178Y90.8Very high85Confident49 Ų4920.5 Ų20.519%0.19210%0.096CC..Hα-helixtrans-70.1-37.4179.4-81.2-79.1000113.1V174 F175 A176 T182 S333 L337 I374 L378V174-Y178 HydrophobicContact CG1-CD2 3.61Å; V174-Y178 HydrophobicContact CG1-CE2 3.79Å; V174-Y178 VanDerWaalsContact O-CD2 3.28Å; V174-Y178 WeakPolarHBondContact O-CD2 3.31Å; V174-Y178 PolarHBondContact O-N 3.1Å; F175-Y178 PolarHBondContact O-N 3.46Å; A176-Y178 PolarHBondContact O-N 3.32Å; Y178-T182 WeakPolarHBondContact O-CB 3.45Å; Y178-T182 PolarHBondContact O-N 2.57Å; Y178-T182 PolarHBondContact O-OG1 3.23Å; Y178-S333 WeakPolarHBondContact CE2-OG 3.37Å; Y178-L337 HydrophobicContact CE2-CD1 4.32Å; Y178-L337 HydrophobicContact CE2-CD2 4.23Å; Y178-L337 HydrophobicContact CE2-CG 4.17Å; Y178-L337 WeakPolarHBondContact OH-CD1 3.32Å; Y178-I374 HydrophobicContact CD2-CG1 4.47Å; Y178-L378 HydrophobicContact CD1-CD2 4.08Å
179F93.6Very high85.3Confident0 Ų025.5 Ų25.50%012%0.117CC..Hα-helixtrans-59.8-56.8174.9-179-87.8000110.6M142 E146 F175 A176 L181 T182 V183 A377 S380 T384M142-F179 HydrophobicContact CE-CD1 4.31Å; M142-F179 HydrophobicContact CE-CE1 4.02Å; M142-F179 HydrophobicContact CG-CE1 4.04Å; E146-F179 HydrophobicContact CB-CD1 4.24Å; E146-F179 HydrophobicContact CB-CE1 3.64Å; E146-F179 HydrophobicContact CB-CE2 4.2Å; E146-F179 HydrophobicContact CB-CZ 3.6Å; E146-F179 HydrophobicContact CG-CD1 3.75Å; E146-F179 HydrophobicContact CG-CD2 4.35Å; E146-F179 HydrophobicContact CG-CE1 3.68Å; E146-F179 HydrophobicContact CG-CE2 4.27Å; E146-F179 HydrophobicContact CG-CG 4.1Å; E146-F179 HydrophobicContact CG-CZ 3.95Å; E146-F179 VanDerWaalsContact OE2-CD1 3.24Å; E146-F179 WeakPolarHBondContact OE2-CD1 3.41Å; E146-F179 WeakPolarHBondContact OE2-CE1 3.41Å; F175-F179 HydrophobicContact CZ-CD2 4.44Å; F175-F179 WeakPolarHBondContact O-CB 3.49Å; F175-F179 PolarHBondContact O-N 2.94Å; A176-F179 PolarHBondContact O-N 2.74Å; F179-L181 VanDerWaalsContact C-N 3.3Å; F179-L181 PolarHBondContact O-N 3.27Å; F179-T182 PolarHBondContact O-N 2.76Å; F179-T182 VanDerWaalsContact O-N 3.11Å; F179-V183 HydrophobicContact CD1-CG2 4.04Å; F179-V183 HydrophobicContact CE1-CG2 3.72Å; F179-V183 HydrophobicContact CZ-CG2 4.09Å; F179-V183 WeakPolarHBondContact O-CG2 3.49Å; F179-V183 PolarHBondContact O-N 3.25Å; F179-A377 HydrophobicContact CB-CB 4.35Å; F179-S380 VanDerWaalsContact CD2-OG 3.3Å; F179-S380 WeakPolarHBondContact CD2-OG 3.44Å; F179-S380 VanDerWaalsContact CE2-C 3.47Å; F179-S380 WeakPolarHBondContact CE2-OG 3.22Å; F179-T384 HydrophobicContact CE1-CG2 4.44Å; F179-T384 HydrophobicContact CZ-CG2 3.93Å; F179-T384 WeakPolarHBondContact CZ-OG1 3.39Å
180G90.9Very high84.8Confident0 Ų027.4 Ų27.40%013%0.13CC..Hα-helixtrans-59.4-38.5179.900000113.3A129 A176 V183 A184A129-G180 WeakPolarHBondContact CB-O 3.48Å; A176-G180 PolarHBondContact O-N 3.45Å; G180-V183 PolarHBondContact O-N 3.12Å; G180-A184 VanDerWaalsContact O-CB 3.3Å; G180-A184 WeakPolarHBondContact O-CB 3.43Å; G180-A184 PolarHBondContact O-N 3.2Å
181L87.9Confident83.7Confident42 Ų4232 Ų3222%0.2216%0.157CC..Hα-helixtrans-63.1-42.9176.2-174.866000111.9A177 F179 A184 W185 I325A177-L181 VanDerWaalsContact O-CB 3.27Å; A177-L181 WeakPolarHBondContact O-CB 3.41Å; A177-L181 PolarHBondContact O-N 3.12Å; F179-L181 VanDerWaalsContact C-N 3.3Å; F179-L181 PolarHBondContact O-N 3.27Å; L181-A184 PolarHBondContact O-N 3.42Å; L181-W185 PolarHBondContact O-N 2.95Å; L181-I325 HydrophobicContact CD1-CB 4.42Å; L181-I325 HydrophobicContact CD1-CD1 3.39Å; L181-I325 HydrophobicContact CD1-CG1 3.82Å; L181-I325 HydrophobicContact CD1-CG2 3.72Å
182T90.7Very high82.2Confident12 Ų1237.6 Ų37.67%0.07419%0.194CC..Hα-helixtrans-68.7-41.8-179.8-51.80000111.4Y178 F179 A184 W185 C186 L378 L382Y178-T182 WeakPolarHBondContact O-CB 3.45Å; Y178-T182 PolarHBondContact O-N 2.57Å; Y178-T182 PolarHBondContact O-OG1 3.23Å; F179-T182 PolarHBondContact O-N 2.76Å; F179-T182 VanDerWaalsContact O-N 3.11Å; T182-A184 VanDerWaalsContact C-N 3.35Å; T182-A184 PolarHBondContact O-N 2.94Å; T182-W185 WeakPolarHBondContact O-CB 3.24Å; T182-W185 PolarHBondContact O-N 3.37Å; T182-C186 PolarHBondContact O-N 3.49Å; T182-C186 PolarHBondContact O-SG 2.86Å; T182-L378 VanDerWaalsContact OG1-CD2 3.24Å; T182-L378 WeakPolarHBondContact OG1-CD2 3.38Å; T182-L382 HydrophobicContact CG2-CB 3.95Å
183V91.3Very high80.1Confident0 Ų045.5 Ų45.50%023%0.228CC..Hα-helixtrans-59.5-48.1173.1179.30000110.1V130 F179 G180 W185 C186 G381 T384 L388V130-V183 HydrophobicContact CG1-CB 4.26Å; V130-V183 HydrophobicContact CG1-CG1 3.85Å; F179-V183 HydrophobicContact CD1-CG2 4.04Å; F179-V183 HydrophobicContact CE1-CG2 3.72Å; F179-V183 HydrophobicContact CZ-CG2 4.09Å; F179-V183 WeakPolarHBondContact O-CG2 3.49Å; F179-V183 PolarHBondContact O-N 3.25Å; G180-V183 PolarHBondContact O-N 3.12Å; V183-W185 PolarHBondContact O-N 3.06Å; V183-C186 PolarHBondContact O-N 3.36Å; V183-C186 VanDerWaalsContact O-N 3.12Å; V183-G381 WeakPolarHBondContact CG2-O 3.31Å; V183-T384 HydrophobicContact CG2-CG2 3.95Å; V183-L388 HydrophobicContact CG1-CD1 3.78Å
184A86.8Confident77.7Confident6 Ų648 Ų485%0.0526%0.257CS..Hα-helixtrans-61.3-30.6179.700000113.1A129 V130 G180 L181 T182A129-A184 HydrophobicContact CB-CB 3.94Å; V130-A184 HydrophobicContact CG1-CB 3.86Å; G180-A184 VanDerWaalsContact O-CB 3.3Å; G180-A184 WeakPolarHBondContact O-CB 3.43Å; G180-A184 PolarHBondContact O-N 3.2Å; L181-A184 PolarHBondContact O-N 3.42Å; T182-A184 VanDerWaalsContact C-N 3.35Å; T182-A184 PolarHBondContact O-N 2.94Å
185W84.8Confident75.4Confident147 Ų14754.2 Ų54.256%0.55730%0.295SS*.Hα-helixtrans-70.1-31.2177.3-171.325000113.1L181 T182 V183 I322L181-W185 PolarHBondContact O-N 2.95Å; T182-W185 WeakPolarHBondContact O-CB 3.24Å; T182-W185 PolarHBondContact O-N 3.37Å; V183-W185 PolarHBondContact O-N 3.06Å; W185-I322 HydrophobicContact CG-CD1 4.44Å
186C86.4Confident72.8Confident23 Ų2363.2 Ų63.216%0.15534%0.337CS..Hα-helixtrans-78.6-17.8179.9-60.80000113.9T182 V183 N389T182-C186 PolarHBondContact O-N 3.49Å; T182-C186 PolarHBondContact O-SG 2.86Å; V183-C186 PolarHBondContact O-N 3.36Å; V183-C186 VanDerWaalsContact O-N 3.12Å; C186-N389 PolarHBondContact O-ND2 3.36Å
187L82.6Confident70.1Confident11 Ų1167.1 Ų67.16%0.05836%0.358CS..SBendtrans-76.2152-175.9-68.5175.4000112.5V130 K133 V134 K189 L388V130-L187 HydrophobicContact CB-CD1 4.06Å; V130-L187 HydrophobicContact CG1-CD1 3.79Å; K133-L187 HydrophobicContact CB-CD1 4.4Å; V134-L187 HydrophobicContact CG1-CD1 3.6Å; V134-L187 HydrophobicContact CG1-CD2 4.21Å; L187-K189 PolarHBondContact O-N 3.13Å; L187-L388 HydrophobicContact CD2-CB 4.3Å
188P74.2Confident67.5Low54 Ų5473.7 Ų73.735%0.35139%0.393SS..PPolyproline II helixtrans-56.2134.4178.9-24.834.1000113N389 V398P188-N389 WeakPolarHBondContact CD-OD1 3.23Å; P188-N389 WeakPolarHBondContact CG-OD1 3.23Å; P188-V398 HydrophobicContact CB-CG2 4.34Å
189K68.9Low64.9Low112 Ų11275.8 Ų75.849%0.48741%0.408SS..PPolyproline II helixtrans-82.9142.5178-61.2-177.4-177-174.10110.7L187 G321L187-K189 PolarHBondContact O-N 3.13Å; K189-G321 WeakPolarHBondContact CE-O 3.4Å; K189-G321 PolarHBondContact NZ-O 3.45Å
190P59.8Low62.3Low44 Ų4481.8 Ų81.829%0.28644%0.436SS..PPolyproline II helixtrans-60138.8168-20.333.3000112.5V398 Y401P190-V398 HydrophobicContact CB-CG1 3.72Å; P190-V398 HydrophobicContact CG-CG1 3.85Å; P190-Y401 HydrophobicContact CG-CD2 4.27Å; P190-Y401 HydrophobicContact CG-CE2 4.45Å
191L53.4Low59.7Low145 Ų14591 Ų9176%0.75947%0.471SS*.PPolyproline II helixtrans-60.6135168.4-112.479.2000108.3K193L191-K193 VanDerWaalsContact C-N 3.27Å; L191-K193 PolarHBondContact O-N 2.93Å
192P50.5Low57.3Low121 Ų12190.8 Ų90.879%0.78648%0.475SS*.  trans-6890.517028-31.3000108G194P192-G194 PolarHBondContact O-N 2.87Å
193K41Very low55.3Low180 Ų18094 Ų9478%0.78350%0.495SS*.  trans-77121.7167.4-82.4-173.3172.2-172.60108.2L191L191-K193 VanDerWaalsContact C-N 3.27Å; L191-K193 PolarHBondContact O-N 2.93Å
194G35.7Very low53.2Low63 Ų6399.2 Ų99.265%0.64952%0.522SS*.  trans-54.9142.5165.500000110P192P192-G194 PolarHBondContact O-N 2.87Å
195T41.2Very low51.6Low130 Ų130101.2 Ų101.280%0.79853%0.534SS*.SBendtrans24.898.9158.650.10000115.5
196E37.6Very low50.7Low188 Ų18895.5 Ų95.588%0.87952%0.517SS*.  trans149.486.6149.7-82.1165.4-162.500111.3
197D34.8Very low50.2Low83 Ų83101.8 Ų101.844%0.44455%0.548SS..  trans177.280.7131.5-120.81.4000106.9D199 Q200D197-D199 PolarHBondContact O-N 2.89Å; D197-D199 VanDerWaalsContact O-N 3.17Å; D197-Q200 HydrophobicContact CB-CB 4.46Å; D197-Q200 HydrophobicContact CB-CG 4.27Å; D197-Q200 PolarHBondContact O-N 3.27Å; D197-Q200 PolarHBondContact OD2-NE2 3.3Å
198N34.3Very low50.1Low137 Ų137102.6 Ų102.673%0.73356%0.555SS**Hα-helixtrans-63.6-12.7170.9-77-29.8000111.5R201 A202N198-R201 PolarHBondContact O-N 3.36Å; N198-A202 PolarHBondContact O-N 3.27Å
199D35.6Very low50.5Low93 Ų93100 Ų10050%0.49754%0.538SS..Hα-helixtrans-82.6-23.9179.3-71.8-27.6000114.9D197 R201D197-D199 PolarHBondContact O-N 2.89Å; D197-D199 VanDerWaalsContact O-N 3.17Å; D199-R201 VanDerWaalsContact C-N 3.27Å
200Q39.4Very low51.3Low127 Ų12797.1 Ų97.159%0.59353%0.527SS*.Hα-helixtrans-76.6-21.4168-71.7-18029.900112D197D197-Q200 HydrophobicContact CB-CB 4.46Å; D197-Q200 HydrophobicContact CB-CG 4.27Å; D197-Q200 PolarHBondContact O-N 3.27Å; D197-Q200 PolarHBondContact OD2-NE2 3.3Å
201R37.4Very low52.7Low192 Ų19298.3 Ų98.373%0.72553%0.53SS*.Hα-helixtrans-97.2-9.8-176.4-133.9179.6-91.6-169.4-6.1113.2N198 D199 T203N198-R201 PolarHBondContact O-N 3.36Å; D199-R201 VanDerWaalsContact C-N 3.27Å; R201-T203 PolarHBondContact O-N 3.44Å; R201-T203 PolarHBondContact O-OG1 3.16Å
202A37.3Very low54.4Low39 Ų3991.4 Ų91.432%0.32249%0.494SS..  trans-65.978.9171.600000109.5N198 I204N198-A202 PolarHBondContact O-N 3.27Å; A202-I204 PolarHBondContact O-N 3Å
203T48.3Very low56.2Low78 Ų7885.7 Ų85.748%0.47946%0.457SS..  trans-68.375.3168.9-46.30000105.8R201 P205R201-T203 PolarHBondContact O-N 3.44Å; R201-T203 PolarHBondContact O-OG1 3.16Å; T203-P205 WeakPolarHBondContact O-CD 3.34Å
204I46.7Very low58.6Low111 Ų11181 Ų8157%0.56944%0.44SS*.  trans-67.8113.2158.7-59178.2000103.2A202 S206A202-I204 PolarHBondContact O-N 3Å; I204-S206 PolarHBondContact O-N 3.11Å
205P53.7Low61.3Low48 Ų4880.2 Ų80.231%0.31242%0.419SS..  trans-58.7109.2174.8-10.825.1000105.9T203 L207 M267T203-P205 WeakPolarHBondContact O-CD 3.34Å; P205-L207 PolarHBondContact O-N 2.88Å; P205-M267 HydrophobicContact CB-CB 3.59Å; P205-M267 HydrophobicContact CB-CG 3.48Å; P205-M267 VanDerWaalsContact CB-CG 3.48Å; P205-M267 HydrophobicContact CG-CB 3.3Å; P205-M267 HydrophobicContact CG-CG 3.81Å
206S64.8Low63.7Low27 Ų2774.1 Ų74.119%0.18938%0.381CS..  trans-66135.6179.851.30000107.2S67 I204 S208 A209 M210S67-S206 PolarHBondContact O-OG 2.61Å; S67-S206 VanDerWaalsContact O-OG 3.12Å; I204-S206 PolarHBondContact O-N 3.11Å; S206-S208 WeakPolarHBondContact CB-OG 3.37Å; S206-S208 PolarHBondContact O-N 2.86Å; S206-S208 PolarHBondContact OG-OG 3.49Å; S206-A209 PolarHBondContact O-N 3.16Å; S206-A209 PolarHBondContact OG-N 3.47Å; S206-M210 PolarHBondContact O-N 3.42Å
207L76.7Confident66.4Low154 Ų15467.8 Ų67.881%0.80635%0.35SS*.Hα-helixtrans-49.5-26.1169.4-160.5147.1000110.8P205 M210 L211P205-L207 PolarHBondContact O-N 2.88Å; L207-M210 PolarHBondContact O-N 3.09Å; L207-L211 WeakPolarHBondContact O-CB 3.21Å; L207-L211 PolarHBondContact O-N 3.42Å
208S81Confident69.2Low29 Ų2968.7 Ų68.720%0.20335%0.352CS..Hα-helixtrans-60.6-45.517173.60000113.7F64 S67 S206 M210 L211 G212F64-S208 WeakPolarHBondContact CB-O 3.35Å; S67-S208 PolarHBondContact OG-OG 3.41Å; S206-S208 WeakPolarHBondContact CB-OG 3.37Å; S206-S208 PolarHBondContact O-N 2.86Å; S206-S208 PolarHBondContact OG-OG 3.49Å; S208-M210 VanDerWaalsContact C-N 3.34Å; S208-M210 PolarHBondContact O-N 2.7Å; S208-L211 VanDerWaalsContact O-CB 3.3Å; S208-L211 WeakPolarHBondContact O-CB 3.29Å; S208-L211 PolarHBondContact O-N 3.14Å; S208-G212 PolarHBondContact O-N 3.3Å
209A82.4Confident72Confident0 Ų064.5 Ų64.50%033%0.328CS..Hα-helixtrans-69.1-33.717900000113F64 N68 S206 L211 G212 A213F64-A209 WeakPolarHBondContact O-CA 3.4Å; N68-A209 HydrophobicContact CB-CB 4.43Å; N68-A209 WeakPolarHBondContact OD1-CB 3.3Å; S206-A209 PolarHBondContact O-N 3.16Å; S206-A209 PolarHBondContact OG-N 3.47Å; A209-L211 VanDerWaalsContact C-N 3.34Å; A209-G212 PolarHBondContact O-N 3.24Å; A209-A213 PolarHBondContact O-N 3.29Å
210M85.9Confident74.6Confident51 Ų5160.3 Ų60.325%0.25131%0.305SS..Hα-helixtrans-66.5-38171.2-173.454.3165.100111.7S206 L207 S208 G212 A213 L214 M267 H271S206-M210 PolarHBondContact O-N 3.42Å; L207-M210 PolarHBondContact O-N 3.09Å; S208-M210 VanDerWaalsContact C-N 3.34Å; S208-M210 PolarHBondContact O-N 2.7Å; M210-G212 VanDerWaalsContact C-N 3.29Å; M210-G212 PolarHBondContact O-N 2.97Å; M210-A213 PolarHBondContact O-N 3.24Å; M210-A213 VanDerWaalsContact O-N 3.15Å; M210-A213 HydrophobicContact SD-CB 4.22Å; M210-L214 HydrophobicContact CE-CD2 4.44Å; M210-L214 HydrophobicContact CG-CD1 4.46Å; M210-L214 WeakPolarHBondContact O-CG 3.37Å; M210-L214 PolarHBondContact O-N 3.14Å; M210-M267 HydrophobicContact CB-CE 3.64Å; M210-M267 HydrophobicContact CE-CE 3.82Å; M210-M267 HydrophobicContact CG-CE 3.44Å; M210-M267 VanDerWaalsContact CG-CE 3.44Å; M210-M267 HydrophobicContact SD-CE 3.25Å; M210-M267 WeakPolarHBondContact SD-CE 3.42Å; M210-H271 WeakPolarHBondContact CA-NE2 3.44Å; M210-H271 PolarHBondContact N-NE2 2.89Å
211L88.6Confident77Confident68 Ų6855 Ų5536%0.35628%0.282SS..Hα-helixtrans-57.8-44173.1-175.267.1000111L207 S208 A209 L214 F215L207-L211 WeakPolarHBondContact O-CB 3.21Å; L207-L211 PolarHBondContact O-N 3.42Å; S208-L211 VanDerWaalsContact O-CB 3.3Å; S208-L211 WeakPolarHBondContact O-CB 3.29Å; S208-L211 PolarHBondContact O-N 3.14Å; A209-L211 VanDerWaalsContact C-N 3.34Å; L211-L214 PolarHBondContact O-N 2.97Å; L211-F215 HydrophobicContact CD1-CD2 4.24Å; L211-F215 HydrophobicContact CD1-CE2 3.75Å; L211-F215 HydrophobicContact CD2-CE2 4.32Å; L211-F215 HydrophobicContact CG-CD2 4.04Å; L211-F215 HydrophobicContact CG-CE2 3.77Å; L211-F215 VanDerWaalsContact O-CD2 3.24Å; L211-F215 WeakPolarHBondContact O-CD2 3.39Å; L211-F215 PolarHBondContact O-N 2.83Å
212G88.9Confident79.3Confident0 Ų046.9 Ų46.90%025%0.254CS..Hα-helixtrans-58.4-47.4172.300000112.8G61 S208 A209 M210 L214 F215 L216G61-G212 WeakPolarHBondContact CA-O 3.46Å; G61-G212 WeakPolarHBondContact O-CA 3.3Å; S208-G212 PolarHBondContact O-N 3.3Å; A209-G212 PolarHBondContact O-N 3.24Å; M210-G212 VanDerWaalsContact C-N 3.29Å; M210-G212 PolarHBondContact O-N 2.97Å; G212-L214 VanDerWaalsContact C-N 3.31Å; G212-L214 PolarHBondContact O-N 3.39Å; G212-F215 PolarHBondContact O-N 2.83Å; G212-L216 VanDerWaalsContact O-CG 3.3Å; G212-L216 WeakPolarHBondContact O-CG 3.23Å; G212-L216 PolarHBondContact O-N 2.84Å
213A89.5Confident81.3Confident2 Ų245.1 Ų45.12%0.01724%0.239CC..Hα-helixtrans-60.6-37.2176.600000113L65 A209 M210 L216 W217 V274 L275L65-A213 HydrophobicContact CD1-CB 4Å; A209-A213 PolarHBondContact O-N 3.29Å; M210-A213 PolarHBondContact O-N 3.24Å; M210-A213 VanDerWaalsContact O-N 3.15Å; M210-A213 HydrophobicContact SD-CB 4.22Å; A213-L216 PolarHBondContact O-N 2.78Å; A213-W217 WeakPolarHBondContact O-CB 3.38Å; A213-W217 PolarHBondContact O-N 3.13Å; A213-V274 HydrophobicContact CB-CG1 4.23Å; A213-L275 HydrophobicContact CB-CD1 4.41Å
214L91.4Very high83Confident81 Ų8142.2 Ų42.242%0.42422%0.221SC..Hα-helixtrans-66.8-45.6176.5-71.6171.4000112.1M210 L211 G212 L216 W217 M218M210-L214 HydrophobicContact CE-CD2 4.44Å; M210-L214 HydrophobicContact CG-CD1 4.46Å; M210-L214 WeakPolarHBondContact O-CG 3.37Å; M210-L214 PolarHBondContact O-N 3.14Å; L211-L214 PolarHBondContact O-N 2.97Å; G212-L214 VanDerWaalsContact C-N 3.31Å; G212-L214 PolarHBondContact O-N 3.39Å; L214-L216 VanDerWaalsContact C-N 3.31Å; L214-L216 PolarHBondContact O-N 3.47Å; L214-W217 PolarHBondContact O-N 3.49Å; L214-M218 WeakPolarHBondContact O-CG 2.89Å; L214-M218 PolarHBondContact O-N 3.17Å
215F92.5Very high84.7Confident47 Ų4737 Ų3721%0.20619%0.194CC..Hα-helixtrans-59.3-44.4174.9-83.2-67.3000111.5V56 L60 L211 G212 W217 M218 F219V56-F215 HydrophobicContact CG1-CD1 3.68Å; V56-F215 HydrophobicContact CG1-CE1 4.08Å; L60-F215 HydrophobicContact CB-CD2 3.91Å; L60-F215 HydrophobicContact CB-CE2 4.19Å; L60-F215 HydrophobicContact CB-CG 4.1Å; L60-F215 HydrophobicContact CD1-CD1 4.44Å; L60-F215 HydrophobicContact CD1-CE1 3.99Å; L60-F215 HydrophobicContact CD1-CE2 4.05Å; L60-F215 HydrophobicContact CD1-CZ 3.78Å; L211-F215 HydrophobicContact CD1-CD2 4.24Å; L211-F215 HydrophobicContact CD1-CE2 3.75Å; L211-F215 HydrophobicContact CD2-CE2 4.32Å; L211-F215 HydrophobicContact CG-CD2 4.04Å; L211-F215 HydrophobicContact CG-CE2 3.77Å; L211-F215 VanDerWaalsContact O-CD2 3.24Å; L211-F215 WeakPolarHBondContact O-CD2 3.39Å; L211-F215 PolarHBondContact O-N 2.83Å; G212-F215 PolarHBondContact O-N 2.83Å; F215-W217 PolarHBondContact O-N 3.29Å; F215-M218 HydrophobicContact CD1-CE 3.87Å; F215-M218 HydrophobicContact CE1-CE 4.22Å; F215-M218 HydrophobicContact CG-CE 4.37Å; F215-M218 PolarHBondContact O-N 3.17Å; F215-F219 HydrophobicContact CD1-CD2 4.26Å; F215-F219 AromaticContact CD1-CE2 3.93Å; F215-F219 HydrophobicContact CD1-CE2 3.93Å; F215-F219 HydrophobicContact CE1-CE2 4.45Å; F215-F219 VanDerWaalsContact O-CD2 3.3Å; F215-F219 WeakPolarHBondContact O-CD2 3.47Å; F215-F219 PolarHBondContact O-N 3.34Å
216L91.7Very high85.7Confident1 Ų135 Ų351%0.00518%0.181CC..Hα-helixtrans-58.8-48.8174.7-70.8173.8000111.5M57 L62 L65 G212 A213 L214 M218 F219 W220 L275M57-L216 HydrophobicContact CG-CD2 3.23Å; M57-L216 HydrophobicContact CG-CG 4.44Å; M57-L216 HydrophobicContact SD-CD2 3.84Å; L62-L216 HydrophobicContact CD2-CD1 4.23Å; L62-L216 HydrophobicContact CD2-CD2 4.03Å; L62-L216 HydrophobicContact CG-CD2 4.08Å; L65-L216 HydrophobicContact CB-CD1 4Å; L65-L216 HydrophobicContact CD1-CD1 4.14Å; L65-L216 HydrophobicContact CD2-CD1 3.52Å; L65-L216 HydrophobicContact CG-CD1 4.08Å; G212-L216 VanDerWaalsContact O-CG 3.3Å; G212-L216 WeakPolarHBondContact O-CG 3.23Å; G212-L216 PolarHBondContact O-N 2.84Å; A213-L216 PolarHBondContact O-N 2.78Å; L214-L216 VanDerWaalsContact C-N 3.31Å; L214-L216 PolarHBondContact O-N 3.47Å; L216-M218 PolarHBondContact O-N 3.45Å; L216-F219 PolarHBondContact O-N 2.85Å; L216-W220 HydrophobicContact CB-CE3 3.85Å; L216-W220 HydrophobicContact CB-CZ3 3.79Å; L216-W220 HydrophobicContact CD1-CZ3 4.35Å; L216-W220 HydrophobicContact CD2-CZ3 4.28Å; L216-W220 HydrophobicContact CG-CZ3 4.35Å; L216-W220 WeakPolarHBondContact O-CB 3.28Å; L216-W220 PolarHBondContact O-N 3.31Å; L216-L275 HydrophobicContact CB-CD1 4Å; L216-L275 HydrophobicContact CB-CD2 3.75Å; L216-L275 HydrophobicContact CD1-CD1 3.56Å; L216-L275 HydrophobicContact CG-CD1 4.42Å
217W93.8Very high86Confident56 Ų5634.7 Ų34.721%0.21218%0.177CC..Hα-helixtrans-60.8-44-178.4-171.295.3000112.5A213 L214 F215 Y242 L245 V249 L275A213-W217 WeakPolarHBondContact O-CB 3.38Å; A213-W217 PolarHBondContact O-N 3.13Å; L214-W217 PolarHBondContact O-N 3.49Å; F215-W217 PolarHBondContact O-N 3.29Å; W217-Y242 AromaticContact CH2-CE2 3.79Å; W217-Y242 HydrophobicContact CH2-CE2 3.79Å; W217-Y242 HydrophobicContact CZ3-CE2 4.27Å; W217-L245 HydrophobicContact CZ2-CB 4.49Å; W217-L245 PolarHBondContact NE1-O 3.47Å; W217-V249 HydrophobicContact CZ2-CG2 4.33Å; W217-L275 HydrophobicContact CB-CD2 3.96Å
218M93.3Very high86.2Confident101 Ų10128.6 Ų28.650%0.49815%0.145SC..Hα-helixtrans-65.8-41.1-179.3-70.5-175.7-62.900112.7L214 F215 L216L214-M218 WeakPolarHBondContact O-CG 2.89Å; L214-M218 PolarHBondContact O-N 3.17Å; F215-M218 HydrophobicContact CD1-CE 3.87Å; F215-M218 HydrophobicContact CE1-CE 4.22Å; F215-M218 HydrophobicContact CG-CE 4.37Å; F215-M218 PolarHBondContact O-N 3.17Å; L216-M218 PolarHBondContact O-N 3.45Å
219F92.1Very high85.8Confident50 Ų5034.6 Ų34.622%0.21916%0.164CC..Hα-helixtrans-99.8-5.6-171.2-68-72.3000114.4D53 V56 M57 F215 L216 P221 S222 V223D53-F219 HydrophobicContact CB-CB 4.49Å; D53-F219 HydrophobicContact CB-CD1 3.67Å; D53-F219 HydrophobicContact CB-CE1 4.33Å; D53-F219 HydrophobicContact CB-CG 4.42Å; D53-F219 VanDerWaalsContact CG-CD1 3.49Å; D53-F219 WeakPolarHBondContact OD1-CD1 3.42Å; D53-F219 WeakPolarHBondContact OD1-CE1 3.37Å; V56-F219 HydrophobicContact CB-CE2 4.5Å; V56-F219 HydrophobicContact CG1-CD2 3.78Å; V56-F219 HydrophobicContact CG1-CE2 3.59Å; V56-F219 HydrophobicContact CG1-CZ 4.24Å; M57-F219 HydrophobicContact CB-CB 4.3Å; F215-F219 HydrophobicContact CD1-CD2 4.26Å; F215-F219 AromaticContact CD1-CE2 3.93Å; F215-F219 HydrophobicContact CD1-CE2 3.93Å; F215-F219 HydrophobicContact CE1-CE2 4.45Å; F215-F219 VanDerWaalsContact O-CD2 3.3Å; F215-F219 WeakPolarHBondContact O-CD2 3.47Å; F215-F219 PolarHBondContact O-N 3.34Å; L216-F219 PolarHBondContact O-N 2.85Å; F219-P221 VanDerWaalsContact C-CD 3.43Å; F219-S222 WeakPolarHBondContact O-CB 3.49Å; F219-S222 PolarHBondContact O-N 3.49Å; F219-V223 WeakPolarHBondContact O-CG2 3.29Å
220W90.4Very high85.7Confident5 Ų536.5 Ų36.52%0.01918%0.177CC..Hα-helixtrans-54.4-39.6178.5-141.2-66.7000114.9Y173 L216 S222 V223 N224 T241 L245 L275 G278 V279 F332Y173-W220 AromaticContact CE1-CZ2 4Å; Y173-W220 HydrophobicContact CE1-CZ2 4Å; Y173-W220 PolarHBondContact OH-NE1 2.96Å; Y173-W220 VanDerWaalsContact OH-NE1 3.09Å; L216-W220 HydrophobicContact CB-CE3 3.85Å; L216-W220 HydrophobicContact CB-CZ3 3.79Å; L216-W220 HydrophobicContact CD1-CZ3 4.35Å; L216-W220 HydrophobicContact CD2-CZ3 4.28Å; L216-W220 HydrophobicContact CG-CZ3 4.35Å; L216-W220 WeakPolarHBondContact O-CB 3.28Å; L216-W220 PolarHBondContact O-N 3.31Å; W220-S222 PolarHBondContact O-N 2.91Å; W220-V223 WeakPolarHBondContact O-CB 3.16Å; W220-V223 PolarHBondContact O-N 3.28Å; W220-N224 PolarHBondContact O-N 3.18Å; W220-T241 HydrophobicContact CB-CG2 4.22Å; W220-T241 HydrophobicContact CG-CG2 4.39Å; W220-L245 HydrophobicContact CB-CD1 3.53Å; W220-L245 HydrophobicContact CG-CD1 4.14Å; W220-L275 HydrophobicContact CE3-CB 4.46Å; W220-L275 HydrophobicContact CE3-CD2 3.86Å; W220-L275 HydrophobicContact CH2-CB 4.24Å; W220-L275 HydrophobicContact CZ3-CB 3.82Å; W220-L275 HydrophobicContact CZ3-CD1 3.92Å; W220-L275 HydrophobicContact CZ3-CD2 3.76Å; W220-L275 HydrophobicContact CZ3-CG 4Å; W220-G278 PolarHBondContact NE1-O 3.07Å; W220-G278 VanDerWaalsContact NE1-O 3.08Å; W220-V279 HydrophobicContact CH2-CG2 3.6Å; W220-V279 HydrophobicContact CZ2-CB 4.28Å; W220-V279 HydrophobicContact CZ2-CG2 3.34Å; W220-F332 AromaticContact CH2-CE1 3.95Å; W220-F332 HydrophobicContact CH2-CE1 3.95Å; W220-F332 HydrophobicContact CH2-CZ 4.2Å
221P90.1Very high85.6Confident16 Ų1638.8 Ų38.810%0.10420%0.195CC..Hα-helixtrans-57.6-33.6176.4-27.237000113.6F219 V223 S225 M238 T241F219-P221 VanDerWaalsContact C-CD 3.43Å; P221-V223 VanDerWaalsContact C-N 3.26Å; P221-V223 PolarHBondContact O-N 3.02Å; P221-S225 WeakPolarHBondContact O-CB 3.18Å; P221-S225 PolarHBondContact O-OG 3.42Å; P221-M238 HydrophobicContact CB-CB 4.32Å; P221-T241 HydrophobicContact CB-CG2 4.4Å; P221-T241 HydrophobicContact CG-CG2 4.14Å
222S85.7Confident85.5Confident20 Ų2040.7 Ų40.714%0.1421%0.205CC..Hα-helixtrans-72.4-19.1176-59.50000113.1D53 F219 W220 P226D53-S222 VanDerWaalsContact OD2-CB 3.24Å; D53-S222 WeakPolarHBondContact OD2-CB 3.24Å; D53-S222 PolarHBondContact OD2-OG 2.94Å; F219-S222 WeakPolarHBondContact O-CB 3.49Å; F219-S222 PolarHBondContact O-N 3.49Å; W220-S222 PolarHBondContact O-N 2.91Å; S222-P226 VanDerWaalsContact O-CD 3.22Å; S222-P226 WeakPolarHBondContact O-CD 3.42Å
223V79.9Confident85.3Confident3 Ų344.6 Ų44.62%0.01822%0.223CC..Hα-helixtrans-89.1-32.5-177.1173.60000112.4L54 M57 M121 F219 W220 P221 S225 P226L54-V223 HydrophobicContact CD2-CB 4.13Å; L54-V223 HydrophobicContact CD2-CG1 4.31Å; L54-V223 HydrophobicContact CD2-CG2 3.61Å; M57-V223 HydrophobicContact CB-CG2 4.46Å; M57-V223 HydrophobicContact CE-CB 4.16Å; M57-V223 HydrophobicContact CE-CG1 3.77Å; M57-V223 HydrophobicContact CE-CG2 3.4Å; M57-V223 HydrophobicContact CG-CG2 4.38Å; M57-V223 HydrophobicContact SD-CB 4.05Å; M57-V223 HydrophobicContact SD-CG1 4.15Å; M57-V223 HydrophobicContact SD-CG2 3.17Å; M57-V223 WeakPolarHBondContact SD-CG2 3.47Å; M121-V223 HydrophobicContact CE-CG1 3.87Å; F219-V223 WeakPolarHBondContact O-CG2 3.29Å; W220-V223 WeakPolarHBondContact O-CB 3.16Å; W220-V223 PolarHBondContact O-N 3.28Å; P221-V223 VanDerWaalsContact C-N 3.26Å; P221-V223 PolarHBondContact O-N 3.02Å; V223-S225 VanDerWaalsContact C-N 3.32Å; V223-P226 WeakPolarHBondContact O-CD 3.42Å; V223-P226 WeakPolarHBondContact O-CG 3.46Å
224N83.8Confident85.2Confident16 Ų1647.9 Ų47.99%0.08624%0.235CC..Hα-helixtrans-82-14.3176.1-72.7-11.1000112.8Y173 W220 P226 T241 G278Y173-N224 PolarHBondContact OH-OD1 3.5Å; W220-N224 PolarHBondContact O-N 3.18Å; N224-P226 VanDerWaalsContact C-CD 3.45Å; N224-T241 VanDerWaalsContact ND2-CG2 3.29Å; N224-T241 WeakPolarHBondContact ND2-CG2 3.37Å; N224-T241 PolarHBondContact ND2-OG1 3.19Å; N224-G278 PolarHBondContact ND2-O 3.49Å; N224-G278 VanDerWaalsContact ND2-O 3.14Å
225S81.8Confident85Confident1 Ų149 Ų491%0.00724%0.237CC..SBendtrans-109.4-5.2-175.968.50000118P221 V223 L227 L228 R234P221-S225 WeakPolarHBondContact O-CB 3.18Å; P221-S225 PolarHBondContact O-OG 3.42Å; V223-S225 VanDerWaalsContact C-N 3.32Å; S225-L227 VanDerWaalsContact C-N 3.33Å; S225-L227 PolarHBondContact O-N 3Å; S225-L228 PolarHBondContact O-N 3.39Å; S225-R234 WeakPolarHBondContact O-CG 3.49Å
226P74.6Confident84.9Confident7 Ų749 Ų495%0.04524%0.239CC..THydrogen-bonded Turntrans-73.3-26.3-163.732.1-34.6000112.8V50 L54 M118 S222 V223 N224V50-P226 HydrophobicContact CG1-CB 3.55Å; L54-P226 HydrophobicContact CD1-CB 4.26Å; L54-P226 HydrophobicContact CD2-CG 4.49Å; M118-P226 HydrophobicContact CE-CG 4.08Å; M118-P226 HydrophobicContact SD-CG 3.58Å; M118-P226 VanDerWaalsContact SD-CG 3.58Å; S222-P226 VanDerWaalsContact O-CD 3.22Å; S222-P226 WeakPolarHBondContact O-CD 3.42Å; V223-P226 WeakPolarHBondContact O-CD 3.42Å; V223-P226 WeakPolarHBondContact O-CG 3.46Å; N224-P226 VanDerWaalsContact C-CD 3.45Å
227L72.8Confident84.9Confident21 Ų2149 Ų4911%0.1124%0.238CC..THydrogen-bonded Turntrans-91.9-13.3-179.5-63.4-175.6000113.4F111 L115 M118 M167 L169 S225 R229F111-L227 HydrophobicContact CE2-CD2 3.71Å; F111-L227 HydrophobicContact CZ-CD2 3.82Å; L115-L227 HydrophobicContact CD1-CD1 4.38Å; L115-L227 HydrophobicContact CD1-CD2 3.91Å; M118-L227 HydrophobicContact CE-CD1 3.2Å; M118-L227 HydrophobicContact CE-CD2 3.74Å; M118-L227 HydrophobicContact CE-CG 3.29Å; M167-L227 HydrophobicContact CE-CB 3.73Å; M167-L227 HydrophobicContact CE-CD2 4.14Å; M167-L227 HydrophobicContact CE-CG 4.36Å; M167-L227 WeakPolarHBondContact CE-O 3.38Å; M167-L227 HydrophobicContact SD-CB 4.13Å; L169-L227 HydrophobicContact CB-CD1 3.9Å; L169-L227 HydrophobicContact CD1-CD1 3.94Å; S225-L227 VanDerWaalsContact C-N 3.33Å; S225-L227 PolarHBondContact O-N 3Å; L227-R229 PolarHBondContact O-N 3.41Å
228L79Confident84.8Confident25 Ų2549.5 Ų49.513%0.13124%0.244CC..  trans-70.9119.5-175.6-64.8170.8000110.6S225 Q233 R234 A237 H286S225-L228 PolarHBondContact O-N 3.39Å; L228-Q233 HydrophobicContact CD1-CB 4.44Å; L228-R234 HydrophobicContact CB-CB 4.23Å; L228-R234 PolarHBondContact O-NE 2.85Å; L228-R234 PolarHBondContact O-NH2 3.24Å; L228-A237 HydrophobicContact CD1-CB 3.42Å; L228-A237 VanDerWaalsContact CD1-CB 3.42Å; L228-H286 HydrophobicContact CD1-CB 3.72Å; L228-H286 HydrophobicContact CD2-CB 4.02Å
229R73.7Confident84.8Confident156 Ų15649.8 Ų49.859%0.58924%0.243SC*.  trans-72-39.5180-67.2-176.6-180155.32.8112.6D164 L227D164-R229 IonicContact OD1-CZ 3.35Å; D164-R229 IonicContact OD1-NH1 2.85Å; D164-R229 PolarHBondContact OD1-NH1 3.39Å; D164-R229 IonicContact OD1-NH2 2.64Å; D164-R229 PolarHBondContact OD1-NH2 2.88Å; D164-R229 IonicContact OD2-CZ 3.55Å; D164-R229 IonicContact OD2-NH1 3.33Å; D164-R229 PolarHBondContact OD2-NH1 3.47Å; D164-R229 IonicContact OD2-NH2 4Å; D164-R229 PolarHBondContact OD2-NH2 3.09Å; L227-R229 PolarHBondContact O-N 3.41Å
230S81.1Confident85Confident39 Ų3947.6 Ų47.627%0.27323%0.233SC..SBendtrans-75.9128.5-178.9170.10000111.3I232 Q233 R234S230-I232 PolarHBondContact O-N 2.72Å; S230-I232 PolarHBondContact OG-N 2.96Å; S230-Q233 PolarHBondContact O-N 3.47Å; S230-R234 WeakPolarHBondContact O-CB 3.33Å; S230-R234 PolarHBondContact O-N 3.24Å
231P83.1Confident85.2Confident99 Ų9947.3 Ų47.364%0.64323%0.232SC*.Hα-helixtrans-63.6-32.7179.725.6-33.6000112.1K235P231-K235 WeakPolarHBondContact O-CB 3.3Å; P231-K235 PolarHBondContact O-N 2.9Å
232I85.8Confident85.4Confident109 Ų10952.3 Ų52.356%0.55925%0.25SC*.Hα-helixtrans-69.8-46.5178.3-64.7160.2000110.2S230 R234 K235 N236S230-I232 PolarHBondContact O-N 2.72Å; S230-I232 PolarHBondContact OG-N 2.96Å; I232-R234 VanDerWaalsContact C-N 3.3Å; I232-R234 PolarHBondContact O-N 3.32Å; I232-K235 PolarHBondContact O-N 2.84Å; I232-N236 WeakPolarHBondContact O-CB 3.36Å; I232-N236 PolarHBondContact O-N 3.13Å; I232-N236 PolarHBondContact O-OD1 3.1Å
233Q86.1Confident86Confident81 Ų8156 Ų5638%0.37926%0.262SS..Hα-helixtrans-62.1-41.3176.2-71.2176.7-3.600111.2L228 S230 N236 A237 H286L228-Q233 HydrophobicContact CD1-CB 4.44Å; S230-Q233 PolarHBondContact O-N 3.47Å; Q233-N236 PolarHBondContact O-N 3.35Å; Q233-A237 VanDerWaalsContact O-CB 3.3Å; Q233-A237 WeakPolarHBondContact O-CB 3.18Å; Q233-A237 PolarHBondContact O-N 3.42Å; Q233-H286 HydrophobicContact CB-CB 4.21Å
234R85.8Confident86.8Confident71 Ų7155.9 Ų55.927%0.26826%0.261SS..Hα-helixtrans-59.9-49176.3-163.2-177.3-66.71740.7111.6S225 L228 S230 I232 N236 A237 M238S225-R234 WeakPolarHBondContact O-CG 3.49Å; L228-R234 HydrophobicContact CB-CB 4.23Å; L228-R234 PolarHBondContact O-NE 2.85Å; L228-R234 PolarHBondContact O-NH2 3.24Å; S230-R234 WeakPolarHBondContact O-CB 3.33Å; S230-R234 PolarHBondContact O-N 3.24Å; I232-R234 VanDerWaalsContact C-N 3.3Å; I232-R234 PolarHBondContact O-N 3.32Å; R234-N236 PolarHBondContact O-N 3.34Å; R234-A237 PolarHBondContact O-N 2.85Å; R234-M238 HydrophobicContact CG-CE 3.84Å; R234-M238 WeakPolarHBondContact O-CG 3.22Å; R234-M238 PolarHBondContact O-N 3.47Å
235K88.9Confident87.4Confident106 Ų10655.2 Ų55.246%0.46126%0.257SS..Hα-helixtrans-58.5-48176.1-175.6-167.266155.60111.6P231 I232 A237 M238 F239P231-K235 WeakPolarHBondContact O-CB 3.3Å; P231-K235 PolarHBondContact O-N 2.9Å; I232-K235 PolarHBondContact O-N 2.84Å; K235-A237 VanDerWaalsContact C-N 3.35Å; K235-A237 PolarHBondContact O-N 3.07Å; K235-M238 PolarHBondContact O-N 2.95Å; K235-F239 HydrophobicContact CD-CE2 3.71Å; K235-F239 HydrophobicContact CD-CZ 4.12Å; K235-F239 HydrophobicContact CG-CD2 4.06Å; K235-F239 HydrophobicContact CG-CE1 4.5Å; K235-F239 HydrophobicContact CG-CE2 3.52Å; K235-F239 HydrophobicContact CG-CZ 3.77Å; K235-F239 WeakPolarHBondContact O-CG 3.43Å; K235-F239 PolarHBondContact O-N 3.06Å
236N90.3Very high88.1Confident46 Ų4656.7 Ų56.725%0.24627%0.269CS..Hα-helixtrans-63.4-42.3-179.8-68.3-1.6000111.3I232 Q233 R234 M238 F239 N240I232-N236 WeakPolarHBondContact O-CB 3.36Å; I232-N236 PolarHBondContact O-N 3.13Å; I232-N236 PolarHBondContact O-OD1 3.1Å; Q233-N236 PolarHBondContact O-N 3.35Å; R234-N236 PolarHBondContact O-N 3.34Å; N236-M238 VanDerWaalsContact C-N 3.33Å; N236-M238 PolarHBondContact O-N 2.98Å; N236-F239 PolarHBondContact O-N 2.95Å; N236-N240 VanDerWaalsContact O-CB 3.28Å; N236-N240 WeakPolarHBondContact O-CB 3.48Å; N236-N240 VanDerWaalsContact O-CG 3.22Å; N236-N240 PolarHBondContact O-N 2.73Å; N236-N240 PolarHBondContact O-ND2 3.13Å; N236-N240 VanDerWaalsContact O-ND2 3.12Å
237A91.3Very high89.2Confident0 Ų057.5 Ų57.50%027%0.274CS..Hα-helixtrans-58.4-43.1175.400000112.4L228 Q233 R234 K235 T241 C285 H286L228-A237 HydrophobicContact CD1-CB 3.42Å; L228-A237 VanDerWaalsContact CD1-CB 3.42Å; Q233-A237 VanDerWaalsContact O-CB 3.3Å; Q233-A237 WeakPolarHBondContact O-CB 3.18Å; Q233-A237 PolarHBondContact O-N 3.42Å; R234-A237 PolarHBondContact O-N 2.85Å; K235-A237 VanDerWaalsContact C-N 3.35Å; K235-A237 PolarHBondContact O-N 3.07Å; A237-T241 VanDerWaalsContact O-CB 3.25Å; A237-T241 WeakPolarHBondContact O-CB 3.2Å; A237-T241 PolarHBondContact O-N 3.31Å; A237-T241 PolarHBondContact O-OG1 3.46Å; A237-C285 HydrophobicContact CB-CB 4.06Å; A237-C285 VanDerWaalsContact CB-SG 3.51Å; A237-H286 HydrophobicContact CB-CB 4.33Å
238M91.8Very high90.3Very high67 Ų6756.5 Ų56.533%0.3327%0.269SS..Hα-helixtrans-62-50.5175.9-67.1-176.9-162.800111.7P221 R234 K235 N236 T241 Y242P221-M238 HydrophobicContact CB-CB 4.32Å; R234-M238 HydrophobicContact CG-CE 3.84Å; R234-M238 WeakPolarHBondContact O-CG 3.22Å; R234-M238 PolarHBondContact O-N 3.47Å; K235-M238 PolarHBondContact O-N 2.95Å; N236-M238 VanDerWaalsContact C-N 3.33Å; N236-M238 PolarHBondContact O-N 2.98Å; M238-T241 PolarHBondContact O-N 2.9Å; M238-Y242 WeakPolarHBondContact O-CB 3.25Å; M238-Y242 PolarHBondContact O-N 2.73Å
239F93.3Very high91.1Very high107 Ų10757.2 Ų57.247%0.46927%0.274SS..Hα-helixtrans-62.6-48.7-179.1-66.4-20.7000112.1K235 N236 T241 Y242 Y243K235-F239 HydrophobicContact CD-CE2 3.71Å; K235-F239 HydrophobicContact CD-CZ 4.12Å; K235-F239 HydrophobicContact CG-CD2 4.06Å; K235-F239 HydrophobicContact CG-CE1 4.5Å; K235-F239 HydrophobicContact CG-CE2 3.52Å; K235-F239 HydrophobicContact CG-CZ 3.77Å; K235-F239 WeakPolarHBondContact O-CG 3.43Å; K235-F239 PolarHBondContact O-N 3.06Å; N236-F239 PolarHBondContact O-N 2.95Å; F239-T241 VanDerWaalsContact C-N 3.29Å; F239-T241 PolarHBondContact O-N 2.97Å; F239-Y242 PolarHBondContact O-N 2.96Å; F239-Y243 HydrophobicContact CB-CD2 4.43Å; F239-Y243 HydrophobicContact CB-CE2 4.34Å; F239-Y243 WeakPolarHBondContact O-CD2 3.48Å; F239-Y243 PolarHBondContact O-N 3.24Å
240N95.4Very high92.1Very high4 Ų454.5 Ų54.52%0.02128%0.275CS..Hα-helixtrans-61.4-40179.1-69.7-31.3000111.2N236 A244 C285 I288 A294N236-N240 VanDerWaalsContact O-CB 3.28Å; N236-N240 WeakPolarHBondContact O-CB 3.48Å; N236-N240 VanDerWaalsContact O-CG 3.22Å; N236-N240 PolarHBondContact O-N 2.73Å; N236-N240 PolarHBondContact O-ND2 3.13Å; N236-N240 VanDerWaalsContact O-ND2 3.12Å; N240-A244 WeakPolarHBondContact O-CB 3.32Å; N240-A244 PolarHBondContact O-N 3.41Å; N240-C285 PolarHBondContact ND2-O 3.05Å; N240-I288 HydrophobicContact CB-CB 4.5Å; N240-I288 WeakPolarHBondContact ND2-CB 3.33Å; N240-I288 PolarHBondContact ND2-O 3.09Å; N240-A294 HydrophobicContact CB-CB 3.81Å; N240-A294 WeakPolarHBondContact O-CB 3.47Å
241T94.8Very high92.8Very high0 Ų052.9 Ų52.90%026%0.263CS..Hα-helixtrans-63.2-45.4175.4-570000112W220 P221 N224 A237 M238 F239 A244 L245 V281W220-T241 HydrophobicContact CB-CG2 4.22Å; W220-T241 HydrophobicContact CG-CG2 4.39Å; P221-T241 HydrophobicContact CB-CG2 4.4Å; P221-T241 HydrophobicContact CG-CG2 4.14Å; N224-T241 VanDerWaalsContact ND2-CG2 3.29Å; N224-T241 WeakPolarHBondContact ND2-CG2 3.37Å; N224-T241 PolarHBondContact ND2-OG1 3.19Å; A237-T241 VanDerWaalsContact O-CB 3.25Å; A237-T241 WeakPolarHBondContact O-CB 3.2Å; A237-T241 PolarHBondContact O-N 3.31Å; A237-T241 PolarHBondContact O-OG1 3.46Å; M238-T241 PolarHBondContact O-N 2.9Å; F239-T241 VanDerWaalsContact C-N 3.29Å; F239-T241 PolarHBondContact O-N 2.97Å; T241-A244 PolarHBondContact O-N 3.11Å; T241-L245 HydrophobicContact CG2-CD1 4.11Å; T241-L245 WeakPolarHBondContact O-CB 3.5Å; T241-L245 WeakPolarHBondContact O-CG 3.33Å; T241-L245 PolarHBondContact O-N 3.06Å; T241-V281 HydrophobicContact CG2-CG2 4.21Å
242Y95.5Very high93.3Very high121 Ų12148.1 Ų48.148%0.47523%0.232SC..Hα-helixtrans-62.2-47.4178.9-175.5-95.5000112.2W217 M238 F239 A244 L245 A246W217-Y242 AromaticContact CH2-CE2 3.79Å; W217-Y242 HydrophobicContact CH2-CE2 3.79Å; W217-Y242 HydrophobicContact CZ3-CE2 4.27Å; M238-Y242 WeakPolarHBondContact O-CB 3.25Å; M238-Y242 PolarHBondContact O-N 2.73Å; F239-Y242 PolarHBondContact O-N 2.96Å; Y242-A244 PolarHBondContact O-N 2.66Å; Y242-L245 PolarHBondContact O-N 3.46Å; Y242-A246 WeakPolarHBondContact O-CB 3.11Å; Y242-A246 PolarHBondContact O-N 3.39Å
243Y97Very high93.6Very high98 Ų9846.7 Ų46.738%0.38423%0.225SC..Hα-helixtrans-64.5-40.6179.1-75.7-61.6000112.6F239 A246 V247 P291 M295F239-Y243 HydrophobicContact CB-CD2 4.43Å; F239-Y243 HydrophobicContact CB-CE2 4.34Å; F239-Y243 WeakPolarHBondContact O-CD2 3.48Å; F239-Y243 PolarHBondContact O-N 3.24Å; Y243-A246 PolarHBondContact O-N 3.2Å; Y243-V247 WeakPolarHBondContact O-CG2 3.45Å; Y243-V247 PolarHBondContact O-N 3.04Å; Y243-V247 VanDerWaalsContact O-N 3.15Å; Y243-P291 HydrophobicContact CD2-CB 3.73Å; Y243-P291 HydrophobicContact CD2-CG 4.39Å; Y243-P291 HydrophobicContact CE2-CB 3.84Å; Y243-P291 HydrophobicContact CE2-CG 4.14Å; Y243-P291 HydrophobicContact CG-CB 4.31Å; Y243-M295 HydrophobicContact CD1-SD 4.5Å; Y243-M295 HydrophobicContact CG-CG 4.49Å
244A97.1Very high94Very high0 Ų046 Ų460%023%0.229CC..Hα-helixtrans-62.4-44.6175.900000111.7N240 T241 Y242 V247 S248 V281 A294N240-A244 WeakPolarHBondContact O-CB 3.32Å; N240-A244 PolarHBondContact O-N 3.41Å; T241-A244 PolarHBondContact O-N 3.11Å; Y242-A244 PolarHBondContact O-N 2.66Å; A244-V247 PolarHBondContact O-N 3.3Å; A244-S248 WeakPolarHBondContact O-CB 3.48Å; A244-S248 PolarHBondContact O-N 3.2Å; A244-S248 PolarHBondContact O-OG 2.73Å; A244-S248 VanDerWaalsContact O-OG 3.09Å; A244-V281 HydrophobicContact CB-CB 4.47Å; A244-V281 HydrophobicContact CB-CG1 3.42Å; A244-V281 VanDerWaalsContact CB-CG1 3.42Å; A244-V281 HydrophobicContact CB-CG2 4.25Å; A244-A294 WeakPolarHBondContact CA-O 3.27Å; A244-A294 HydrophobicContact CB-CB 4.5Å; A244-A294 WeakPolarHBondContact CB-O 3.44Å
245L95.9Very high94.2Very high1 Ų143.1 Ų43.11%0.00522%0.221CC..Hα-helixtrans-63.7-41.5177-83.7176.4000113.1W217 W220 T241 Y242 V247 S248 V249W217-L245 HydrophobicContact CZ2-CB 4.49Å; W217-L245 PolarHBondContact NE1-O 3.47Å; W220-L245 HydrophobicContact CB-CD1 3.53Å; W220-L245 HydrophobicContact CG-CD1 4.14Å; T241-L245 HydrophobicContact CG2-CD1 4.11Å; T241-L245 WeakPolarHBondContact O-CB 3.5Å; T241-L245 WeakPolarHBondContact O-CG 3.33Å; T241-L245 PolarHBondContact O-N 3.06Å; Y242-L245 PolarHBondContact O-N 3.46Å; L245-V247 VanDerWaalsContact C-N 3.34Å; L245-V247 PolarHBondContact O-N 3.45Å; L245-S248 PolarHBondContact O-N 3.01Å; L245-V249 WeakPolarHBondContact O-CG2 3.08Å; L245-V249 PolarHBondContact O-N 2.85Å
246A96.8Very high94.3Very high32 Ų3238 Ų3826%0.26420%0.199SC..Hα-helixtrans-59.3-46.3176.600000111.3Y242 Y243 V249 V250Y242-A246 WeakPolarHBondContact O-CB 3.11Å; Y242-A246 PolarHBondContact O-N 3.39Å; Y243-A246 PolarHBondContact O-N 3.2Å; A246-V249 PolarHBondContact O-N 2.92Å; A246-V250 PolarHBondContact O-N 3.42Å
247V97.3Very high94.3Very high25 Ų2537.8 Ų37.815%0.15220%0.201CC..Hα-helixtrans-68.6-37.5177.7177.90000111.7Y243 A244 L245 V249 V250 T251 M295 L299Y243-V247 WeakPolarHBondContact O-CG2 3.45Å; Y243-V247 PolarHBondContact O-N 3.04Å; Y243-V247 VanDerWaalsContact O-N 3.15Å; A244-V247 PolarHBondContact O-N 3.3Å; L245-V247 VanDerWaalsContact C-N 3.34Å; L245-V247 PolarHBondContact O-N 3.45Å; V247-V249 VanDerWaalsContact C-N 3.29Å; V247-V249 PolarHBondContact O-N 3.3Å; V247-V250 PolarHBondContact O-N 3.02Å; V247-T251 WeakPolarHBondContact O-CB 3.29Å; V247-T251 PolarHBondContact O-N 3.42Å; V247-T251 PolarHBondContact O-OG1 2.94Å; V247-M295 WeakPolarHBondContact CG1-O 3.14Å; V247-M295 HydrophobicContact CG2-CB 3.74Å; V247-M295 HydrophobicContact CG2-CE 3.72Å; V247-M295 HydrophobicContact CG2-CG 3.77Å; V247-L299 HydrophobicContact CG1-CB 3.71Å
248S95.8Very high94.2Very high0 Ų045 Ų450%024%0.238CC..Hα-helixtrans-60.2-36.2174.4-69.20000112.8A244 L245 T251 A252 G277 G298A244-S248 WeakPolarHBondContact O-CB 3.48Å; A244-S248 PolarHBondContact O-N 3.2Å; A244-S248 PolarHBondContact O-OG 2.73Å; A244-S248 VanDerWaalsContact O-OG 3.09Å; L245-S248 PolarHBondContact O-N 3.01Å; S248-T251 PolarHBondContact O-N 3.19Å; S248-A252 WeakPolarHBondContact O-CB 3.19Å; S248-A252 PolarHBondContact O-N 2.92Å; S248-G277 WeakPolarHBondContact OG-CA 3.45Å; S248-G277 PolarHBondContact OG-N 3.17Å; S248-G298 PolarHBondContact OG-O 3.44Å
249V95.6Very high93.9Very high39 Ų3942.6 Ų42.624%0.23623%0.23CC..Hα-helixtrans-64.5-48.6175.1-1790000111.4W217 L245 A246 V247 T251 A252 I253 V274W217-V249 HydrophobicContact CZ2-CG2 4.33Å; L245-V249 WeakPolarHBondContact O-CG2 3.08Å; L245-V249 PolarHBondContact O-N 2.85Å; A246-V249 PolarHBondContact O-N 2.92Å; V247-V249 VanDerWaalsContact C-N 3.29Å; V247-V249 PolarHBondContact O-N 3.3Å; V249-T251 VanDerWaalsContact C-N 3.26Å; V249-T251 PolarHBondContact O-N 2.93Å; V249-A252 WeakPolarHBondContact O-CB 3.4Å; V249-A252 PolarHBondContact O-N 3Å; V249-A252 VanDerWaalsContact O-N 3.16Å; V249-I253 HydrophobicContact CG1-CD1 4.16Å; V249-I253 PolarHBondContact O-N 3.42Å; V249-V274 HydrophobicContact CB-CG2 4.13Å; V249-V274 HydrophobicContact CG1-CG2 4.2Å; V249-V274 HydrophobicContact CG2-CG2 3.45Å; V249-V274 VanDerWaalsContact CG2-CG2 3.45Å
250V96.4Very high93.4Very high100 Ų10040 Ų4061%0.60622%0.219SC*.Hα-helixtrans-59.8-43.5178.4176.20000109.9A246 V247 I253 S254A246-V250 PolarHBondContact O-N 3.42Å; V247-V250 PolarHBondContact O-N 3.02Å; V250-I253 PolarHBondContact O-N 3.23Å; V250-S254 VanDerWaalsContact O-CB 3.32Å; V250-S254 WeakPolarHBondContact O-CB 3.3Å; V250-S254 PolarHBondContact O-N 2.99Å; V250-S254 PolarHBondContact O-OG 3.45Å
251T95.1Very high92.8Very high4 Ų445.6 Ų45.63%0.02526%0.256CS..Hα-helixtrans-64.1-40.6176.3-51.40000111.8V247 S248 V249 S254 G255 L299 L303 I306V247-T251 WeakPolarHBondContact O-CB 3.29Å; V247-T251 PolarHBondContact O-N 3.42Å; V247-T251 PolarHBondContact O-OG1 2.94Å; S248-T251 PolarHBondContact O-N 3.19Å; V249-T251 VanDerWaalsContact C-N 3.26Å; V249-T251 PolarHBondContact O-N 2.93Å; T251-S254 PolarHBondContact O-OG 3.49Å; T251-G255 VanDerWaalsContact O-CA 3.27Å; T251-G255 WeakPolarHBondContact O-CA 3.33Å; T251-G255 PolarHBondContact O-N 3.35Å; T251-L299 HydrophobicContact CG2-CD1 3.87Å; T251-L299 VanDerWaalsContact OG1-CD1 3.22Å; T251-L299 WeakPolarHBondContact OG1-CD1 3.41Å; T251-L303 HydrophobicContact CG2-CD2 3.86Å; T251-L303 HydrophobicContact CG2-CG 3.85Å; T251-I306 WeakPolarHBondContact O-CD1 3.37Å
252A92.7Very high92.3Very high0 Ų051.8 Ų51.80%028%0.284CS..Hα-helixtrans-60.8-48178.500000111.5S248 V249 S256 A273 V274S248-A252 WeakPolarHBondContact O-CB 3.19Å; S248-A252 PolarHBondContact O-N 2.92Å; V249-A252 WeakPolarHBondContact O-CB 3.4Å; V249-A252 PolarHBondContact O-N 3Å; V249-A252 VanDerWaalsContact O-N 3.16Å; A252-S256 WeakPolarHBondContact O-CA 3.25Å; A252-S256 WeakPolarHBondContact O-CB 3.37Å; A252-S256 PolarHBondContact O-N 3.22Å; A252-A273 HydrophobicContact CB-CB 3.57Å; A252-V274 HydrophobicContact CB-CB 4.49Å
253I93.2Very high91.7Very high79 Ų7955.9 Ų55.941%0.40530%0.299SS..Hα-helixtrans-70.4-52-178.7-65.2173.3000110.8V249 V250 S256 S257 I265V249-I253 HydrophobicContact CG1-CD1 4.16Å; V249-I253 PolarHBondContact O-N 3.42Å; V250-I253 PolarHBondContact O-N 3.23Å; I253-S256 PolarHBondContact O-N 3.48Å; I253-S257 PolarHBondContact O-N 3.22Å; I253-S257 VanDerWaalsContact O-N 3.09Å; I253-I265 HydrophobicContact CG2-CD1 3.83Å; I253-I265 HydrophobicContact CG2-CG1 4.37Å
254S94.5Very high91.2Very high67 Ų6757.3 Ų57.347%0.46931%0.307SS..Hα-helixtrans-65.4-49-178.157.50000112V250 T251 S256 S257 L258V250-S254 VanDerWaalsContact O-CB 3.32Å; V250-S254 WeakPolarHBondContact O-CB 3.3Å; V250-S254 PolarHBondContact O-N 2.99Å; V250-S254 PolarHBondContact O-OG 3.45Å; T251-S254 PolarHBondContact O-OG 3.49Å; S254-S256 VanDerWaalsContact C-N 3.34Å; S254-S256 PolarHBondContact O-N 3.46Å; S254-S257 WeakPolarHBondContact O-CB 3.18Å; S254-S257 PolarHBondContact O-N 2.96Å; S254-L258 PolarHBondContact O-N 3.08Å
255G90.3Very high90.7Very high9 Ų962.3 Ų62.39%0.09333%0.333CS..Hα-helixtrans-66.8-33.7178.200000112.5T251 L258 A259T251-G255 VanDerWaalsContact O-CA 3.27Å; T251-G255 WeakPolarHBondContact O-CA 3.33Å; T251-G255 PolarHBondContact O-N 3.35Å; G255-L258 PolarHBondContact O-N 3.17Å; G255-A259 WeakPolarHBondContact O-CB 3.42Å; G255-A259 PolarHBondContact O-N 3.01Å
256S89.4Confident90.1Very high0 Ų063.5 Ų63.50%034%0.342CS..Hα-helixtrans-62.5-44.7171.9173.90000111.5A252 I253 S254 L258 A259 H260 S266A252-S256 WeakPolarHBondContact O-CA 3.25Å; A252-S256 WeakPolarHBondContact O-CB 3.37Å; A252-S256 PolarHBondContact O-N 3.22Å; I253-S256 PolarHBondContact O-N 3.48Å; S254-S256 VanDerWaalsContact C-N 3.34Å; S254-S256 PolarHBondContact O-N 3.46Å; S256-L258 VanDerWaalsContact C-N 3.32Å; S256-A259 PolarHBondContact O-N 3.28Å; S256-H260 WeakPolarHBondContact O-CB 3.39Å; S256-H260 PolarHBondContact O-N 2.71Å; S256-H260 VanDerWaalsContact O-N 3.17Å; S256-S266 PolarHBondContact OG-N 3.45Å; S256-S266 PolarHBondContact OG-O 2.96Å
257S91.3Very high89.4Confident41 Ų4164.5 Ų64.529%0.28734%0.341SS..Hα-helixtrans-62.3-43.8177.9-177.90000110.5I253 S254 A259 R263I253-S257 PolarHBondContact O-N 3.22Å; I253-S257 VanDerWaalsContact O-N 3.09Å; S254-S257 WeakPolarHBondContact O-CB 3.18Å; S254-S257 PolarHBondContact O-N 2.96Å; S257-A259 PolarHBondContact O-N 3.26Å; S257-R263 WeakPolarHBondContact O-CA 3.38Å; S257-R263 PolarHBondContact OG-O 3.31Å
258L89.7Confident88.5Confident150 Ų15066.7 Ų66.779%0.78536%0.355SS*.Hα-helixtrans-66.5-38.1179-172.763000113.2S254 G255 S256S254-L258 PolarHBondContact O-N 3.08Å; G255-L258 PolarHBondContact O-N 3.17Å; S256-L258 VanDerWaalsContact C-N 3.32Å
259A84.3Confident87.9Confident18 Ų1868.2 Ų68.215%0.14936%0.361CS..Hα-helixtrans-78.5-21.7-176.200000113.8G255 S256 S257 Y269 I306G255-A259 WeakPolarHBondContact O-CB 3.42Å; G255-A259 PolarHBondContact O-N 3.01Å; S256-A259 PolarHBondContact O-N 3.28Å; S257-A259 PolarHBondContact O-N 3.26Å; A259-Y269 HydrophobicContact CB-CE2 4.34Å; A259-I306 HydrophobicContact CB-CG2 3.78Å
260H83.4Confident87.5Confident51 Ų5166.9 Ų66.924%0.23635%0.352CS..SBendtrans-81.8132.3-177.1-166.1-87.6000111.7S256 Q262 R263 K264S256-H260 WeakPolarHBondContact O-CB 3.39Å; S256-H260 PolarHBondContact O-N 2.71Å; S256-H260 VanDerWaalsContact O-N 3.17Å; H260-Q262 PolarHBondContact ND1-N 2.81Å; H260-Q262 PolarHBondContact O-N 3.36Å; H260-Q262 VanDerWaalsContact O-N 3.07Å; H260-R263 PolarHBondContact O-N 3.31Å; H260-K264 WeakPolarHBondContact CB-O 3.18Å
261P81.9Confident86.8Confident123 Ų12362.4 Ų62.480%0.79933%0.325SS*.THydrogen-bonded Turntrans-55.4-33.4-176.7-26.834.2000114.6
262Q84.3Confident86.1Confident129 Ų12962.5 Ų62.560%0.60333%0.326SS*.THydrogen-bonded Turntrans-93.68.6179.3-59.6-178.6-6.200114.4H260 K264H260-Q262 PolarHBondContact ND1-N 2.81Å; H260-Q262 PolarHBondContact O-N 3.36Å; H260-Q262 VanDerWaalsContact O-N 3.07Å; Q262-K264 HydrophobicContact CB-CD 4.39Å; Q262-K264 HydrophobicContact CB-CG 4.27Å; Q262-K264 PolarHBondContact O-N 3.26Å
263R83.6Confident86Confident207 Ų20762.5 Ų62.578%0.78133%0.326SS*.SBendtrans53.933.7-173.4-57.8-173.7-179173.20.4115S257 H260S257-R263 WeakPolarHBondContact O-CA 3.38Å; S257-R263 PolarHBondContact OG-O 3.31Å; H260-R263 PolarHBondContact O-N 3.31Å
264K86.6Confident86Confident128 Ų12859.2 Ų59.256%0.55731%0.31SS*.  trans-103.8152176.4-69-178.4-179.51720109.9H260 Q262 S266H260-K264 WeakPolarHBondContact CB-O 3.18Å; Q262-K264 HydrophobicContact CB-CD 4.39Å; Q262-K264 HydrophobicContact CB-CG 4.27Å; Q262-K264 PolarHBondContact O-N 3.26Å; K264-S266 PolarHBondContact O-N 2.72Å
265I86.7Confident85.9Confident105 Ų10556 Ų5654%0.53829%0.287SS..  trans-75.8124.8175.7-58.7164.1000108.5I253 V270I253-I265 HydrophobicContact CG2-CD1 3.83Å; I253-I265 HydrophobicContact CG2-CG1 4.37Å; I265-V270 HydrophobicContact CG2-CG2 3.58Å
266S83.9Confident86Confident27 Ų2755.7 Ų55.719%0.18928%0.283CS..  trans-104.3124.7176.4176.70000109.3S256 K264 T268 Y269 V270S256-S266 PolarHBondContact OG-N 3.45Å; S256-S266 PolarHBondContact OG-O 2.96Å; K264-S266 PolarHBondContact O-N 2.72Å; S266-T268 PolarHBondContact O-N 3.32Å; S266-Y269 PolarHBondContact O-N 3.34Å; S266-Y269 VanDerWaalsContact O-N 3.16Å; S266-V270 WeakPolarHBondContact O-CG2 3.04Å; S266-V270 PolarHBondContact O-N 2.92Å; S266-V270 VanDerWaalsContact O-N 3.12Å
267M81.3Confident86.2Confident52 Ų5255.7 Ų55.726%0.25628%0.283SS..Hα-helixtrans-64.5-26.1-178.7-154.966.1177.700113.2P205 M210 Y269 V270 H271P205-M267 HydrophobicContact CB-CB 3.59Å; P205-M267 HydrophobicContact CB-CG 3.48Å; P205-M267 VanDerWaalsContact CB-CG 3.48Å; P205-M267 HydrophobicContact CG-CB 3.3Å; P205-M267 HydrophobicContact CG-CG 3.81Å; M210-M267 HydrophobicContact CB-CE 3.64Å; M210-M267 HydrophobicContact CE-CE 3.82Å; M210-M267 HydrophobicContact CG-CE 3.44Å; M210-M267 VanDerWaalsContact CG-CE 3.44Å; M210-M267 HydrophobicContact SD-CE 3.25Å; M210-M267 WeakPolarHBondContact SD-CE 3.42Å; M267-Y269 VanDerWaalsContact C-N 3.32Å; M267-Y269 PolarHBondContact O-N 2.98Å; M267-V270 PolarHBondContact O-N 3.04Å; M267-V270 HydrophobicContact SD-CB 4.2Å; M267-V270 HydrophobicContact SD-CG1 4.28Å; M267-H271 WeakPolarHBondContact CE-NE2 3.34Å; M267-H271 WeakPolarHBondContact O-CB 3.47Å; M267-H271 PolarHBondContact O-N 3.33Å
268T77.9Confident86.2Confident71 Ų7153.7 Ų53.744%0.43627%0.27SS..Hα-helixtrans-61.8-42.1176-50.90000111.4S266 S272S266-T268 PolarHBondContact O-N 3.32Å; T268-S272 WeakPolarHBondContact O-CB 3.25Å; T268-S272 PolarHBondContact O-N 3.45Å; T268-S272 PolarHBondContact O-OG 3.22Å
269Y84.1Confident86.3Confident33 Ų3346.7 Ų46.713%0.12923%0.233CC..Hα-helixtrans-70.9-40.9175-61-37.3000111.1A259 S266 M267 S272 A273 A309 K310A259-Y269 HydrophobicContact CB-CE2 4.34Å; S266-Y269 PolarHBondContact O-N 3.34Å; S266-Y269 VanDerWaalsContact O-N 3.16Å; M267-Y269 VanDerWaalsContact C-N 3.32Å; M267-Y269 PolarHBondContact O-N 2.98Å; Y269-S272 PolarHBondContact O-N 3.42Å; Y269-A273 VanDerWaalsContact O-CB 3.28Å; Y269-A273 WeakPolarHBondContact O-CB 3.31Å; Y269-A273 PolarHBondContact O-N 3.41Å; Y269-A309 HydrophobicContact CD1-CB 3.64Å; Y269-A309 HydrophobicContact CE1-CB 3.87Å; Y269-K310 HydrophobicContact CE1-CB 4.43Å
270V87.1Confident86.7Confident10 Ų1045.8 Ų45.86%0.06123%0.226CC..Hα-helixtrans-61.5-52178.1175.90000111.5I265 S266 M267 S272 A273 V274I265-V270 HydrophobicContact CG2-CG2 3.58Å; S266-V270 WeakPolarHBondContact O-CG2 3.04Å; S266-V270 PolarHBondContact O-N 2.92Å; S266-V270 VanDerWaalsContact O-N 3.12Å; M267-V270 PolarHBondContact O-N 3.04Å; M267-V270 HydrophobicContact SD-CB 4.2Å; M267-V270 HydrophobicContact SD-CG1 4.28Å; V270-S272 PolarHBondContact O-N 3.12Å; V270-A273 PolarHBondContact O-N 3.47Å; V270-V274 VanDerWaalsContact O-CB 3.23Å; V270-V274 WeakPolarHBondContact O-CB 3.48Å; V270-V274 WeakPolarHBondContact O-CG1 3.42Å; V270-V274 PolarHBondContact O-N 2.89Å
271H81.8Confident87Confident6 Ų643.4 Ų43.43%0.02822%0.215CC..Hα-helixtrans-57.2-38178.3-76.8179.4000112.6N68 M210 M267N68-H271 PolarHBondContact OD1-CE1 2.98Å; N68-H271 PolarHBondContact OD1-ND1 2.88Å; N68-H271 VanDerWaalsContact OD1-ND1 3.16Å; M210-H271 WeakPolarHBondContact CA-NE2 3.44Å; M210-H271 PolarHBondContact N-NE2 2.89Å; M267-H271 WeakPolarHBondContact CE-NE2 3.34Å; M267-H271 WeakPolarHBondContact O-CB 3.47Å; M267-H271 PolarHBondContact O-N 3.33Å
272S81Confident87.3Confident7 Ų738.1 Ų38.15%0.04918%0.182CC..Hα-helixtrans-75.6-36.2-179.1-54.80000112.5T268 Y269 V270 S305T268-S272 WeakPolarHBondContact O-CB 3.25Å; T268-S272 PolarHBondContact O-N 3.45Å; T268-S272 PolarHBondContact O-OG 3.22Å; Y269-S272 PolarHBondContact O-N 3.42Å; V270-S272 PolarHBondContact O-N 3.12Å; S272-S305 WeakPolarHBondContact CB-OG 3.41Å; S272-S305 PolarHBondContact O-OG 3.16Å
273A90.4Very high87.4Confident0 Ų032.5 Ų32.50%016%0.157CC..Hα-helixtrans-96.8-25.2-17000000114.1A252 Y269 V270 L275 A276 S305 I306A252-A273 HydrophobicContact CB-CB 3.57Å; Y269-A273 VanDerWaalsContact O-CB 3.28Å; Y269-A273 WeakPolarHBondContact O-CB 3.31Å; Y269-A273 PolarHBondContact O-N 3.41Å; V270-A273 PolarHBondContact O-N 3.47Å; A273-L275 PolarHBondContact O-N 3.48Å; A273-A276 VanDerWaalsContact O-CB 3.25Å; A273-A276 WeakPolarHBondContact O-CB 3.3Å; A273-A276 PolarHBondContact O-N 2.91Å; A273-S305 WeakPolarHBondContact CA-OG 3.3Å; A273-S305 PolarHBondContact N-OG 2.86Å; A273-I306 HydrophobicContact CB-CD1 4.31Å; A273-I306 HydrophobicContact CB-CG1 3.78Å
274V92.7Very high87.7Confident10 Ų1022.7 Ų22.76%0.06112%0.12CC..THydrogen-bonded Turntrans-62.2-29-175.873.50000113.1A213 V249 A252 V270A213-V274 HydrophobicContact CB-CG1 4.23Å; V249-V274 HydrophobicContact CB-CG2 4.13Å; V249-V274 HydrophobicContact CG1-CG2 4.2Å; V249-V274 HydrophobicContact CG2-CG2 3.45Å; V249-V274 VanDerWaalsContact CG2-CG2 3.45Å; A252-V274 HydrophobicContact CB-CB 4.49Å; V270-V274 VanDerWaalsContact O-CB 3.23Å; V270-V274 WeakPolarHBondContact O-CB 3.48Å; V270-V274 WeakPolarHBondContact O-CG1 3.42Å; V270-V274 PolarHBondContact O-N 2.89Å
275L92Very high87.8Confident0 Ų016.6 Ų16.60%09%0.094CC..THydrogen-bonded Turntrans-98.2-2.7179.5-58.8172.3000113.2L65 A213 L216 W217 W220 A273 G277 G278 V279 F332L65-L275 HydrophobicContact CD1-CD1 4.15Å; L65-L275 HydrophobicContact CD2-CD1 4.31Å; A213-L275 HydrophobicContact CB-CD1 4.41Å; L216-L275 HydrophobicContact CB-CD1 4Å; L216-L275 HydrophobicContact CB-CD2 3.75Å; L216-L275 HydrophobicContact CD1-CD1 3.56Å; L216-L275 HydrophobicContact CG-CD1 4.42Å; W217-L275 HydrophobicContact CB-CD2 3.96Å; W220-L275 HydrophobicContact CE3-CB 4.46Å; W220-L275 HydrophobicContact CE3-CD2 3.86Å; W220-L275 HydrophobicContact CH2-CB 4.24Å; W220-L275 HydrophobicContact CZ3-CB 3.82Å; W220-L275 HydrophobicContact CZ3-CD1 3.92Å; W220-L275 HydrophobicContact CZ3-CD2 3.76Å; W220-L275 HydrophobicContact CZ3-CG 4Å; A273-L275 PolarHBondContact O-N 3.48Å; L275-G277 PolarHBondContact O-N 3.46Å; L275-G278 PolarHBondContact O-N 3.22Å; L275-G278 VanDerWaalsContact O-N 3.13Å; L275-V279 PolarHBondContact O-N 3.36Å; L275-F332 HydrophobicContact CD1-CZ 4.44Å
276A92.9Very high87.8Confident1 Ų113.6 Ų13.61%0.0088%0.077CC..Hα-helixtrans-63-42.1-165.300000112.9A273 G278 V279 A280 A301 L335A273-A276 VanDerWaalsContact O-CB 3.25Å; A273-A276 WeakPolarHBondContact O-CB 3.3Å; A273-A276 PolarHBondContact O-N 2.91Å; A276-G278 VanDerWaalsContact C-N 3.34Å; A276-G278 PolarHBondContact O-N 2.92Å; A276-V279 PolarHBondContact O-N 3.48Å; A276-A280 WeakPolarHBondContact O-CB 3.49Å; A276-A280 PolarHBondContact O-N 2.84Å; A276-A301 HydrophobicContact CB-CB 4.05Å; A276-L335 HydrophobicContact CB-CD1 3.63Å; A276-L335 HydrophobicContact CB-CD2 3.96Å; A276-L335 HydrophobicContact CB-CG 4.45Å
277G93.5Very high88Confident0 Ų014.6 Ų14.60%08%0.08CC..Hα-helixtrans-63.4-37.7177.300000112.9S248 L275 V279 A280 V281S248-G277 WeakPolarHBondContact OG-CA 3.45Å; S248-G277 PolarHBondContact OG-N 3.17Å; L275-G277 PolarHBondContact O-N 3.46Å; G277-V279 PolarHBondContact O-N 3.41Å; G277-A280 PolarHBondContact O-N 3.41Å; G277-V281 WeakPolarHBondContact O-CG1 3.35Å; G277-V281 WeakPolarHBondContact O-CG2 3.47Å; G277-V281 PolarHBondContact O-N 3.39Å
278G91.6Very high88.5Confident0 Ų012.3 Ų12.30%07%0.069CC..Hα-helixtrans-62.6-42.2178.900000112.6W220 N224 L275 A276 G282W220-G278 PolarHBondContact NE1-O 3.07Å; W220-G278 VanDerWaalsContact NE1-O 3.08Å; N224-G278 PolarHBondContact ND2-O 3.49Å; N224-G278 VanDerWaalsContact ND2-O 3.14Å; L275-G278 PolarHBondContact O-N 3.22Å; L275-G278 VanDerWaalsContact O-N 3.13Å; A276-G278 VanDerWaalsContact C-N 3.34Å; A276-G278 PolarHBondContact O-N 2.92Å; G278-G282 PolarHBondContact O-N 2.88Å
279V90.5Very high89Confident2 Ų213.7 Ų13.71%0.0128%0.079CC..Hα-helixtrans-67-48.9173.6-175.70000110.5Y173 W220 L275 A276 G277 V281 G282 F332 L335Y173-V279 HydrophobicContact CD1-CG1 4.23Å; Y173-V279 HydrophobicContact CG-CG1 4.33Å; W220-V279 HydrophobicContact CH2-CG2 3.6Å; W220-V279 HydrophobicContact CZ2-CB 4.28Å; W220-V279 HydrophobicContact CZ2-CG2 3.34Å; L275-V279 PolarHBondContact O-N 3.36Å; A276-V279 PolarHBondContact O-N 3.48Å; G277-V279 PolarHBondContact O-N 3.41Å; V279-V281 VanDerWaalsContact C-N 3.32Å; V279-V281 PolarHBondContact O-N 3.17Å; V279-G282 PolarHBondContact O-N 3.19Å; V279-F332 HydrophobicContact CG2-CD1 3.94Å; V279-F332 HydrophobicContact CG2-CE1 3.82Å; V279-F332 HydrophobicContact CG2-CG 4.47Å; V279-F332 HydrophobicContact CG2-CZ 4.25Å; V279-L335 HydrophobicContact CB-CB 4Å; V279-L335 HydrophobicContact CB-CD1 4.38Å; V279-L335 HydrophobicContact CG1-CB 3.73Å
280A92.4Very high89.3Confident0 Ų013.5 Ų13.50%08%0.083CC..Hα-helixtrans-65.4-30.6-174.100000113.7A276 G277 L297 A301 L335 L338 G339A276-A280 WeakPolarHBondContact O-CB 3.49Å; A276-A280 PolarHBondContact O-N 2.84Å; G277-A280 PolarHBondContact O-N 3.41Å; A280-L297 HydrophobicContact CB-CG 4.42Å; A280-A301 HydrophobicContact CB-CB 3.6Å; A280-L335 HydrophobicContact CB-CD2 4.5Å; A280-L338 HydrophobicContact CB-CD2 4.05Å; A280-G339 WeakPolarHBondContact O-CA 3.15Å
281V91.8Very high89.6Confident0 Ų015.9 Ų15.90%010%0.098CC..THydrogen-bonded Turntrans-87.8-5.6175.1-53.80000112.9T241 A244 G277 V279 T283 S284 C285 I288 L297T241-V281 HydrophobicContact CG2-CG2 4.21Å; A244-V281 HydrophobicContact CB-CB 4.47Å; A244-V281 HydrophobicContact CB-CG1 3.42Å; A244-V281 VanDerWaalsContact CB-CG1 3.42Å; A244-V281 HydrophobicContact CB-CG2 4.25Å; G277-V281 WeakPolarHBondContact O-CG1 3.35Å; G277-V281 WeakPolarHBondContact O-CG2 3.47Å; G277-V281 PolarHBondContact O-N 3.39Å; V279-V281 VanDerWaalsContact C-N 3.32Å; V279-V281 PolarHBondContact O-N 3.17Å; V281-T283 PolarHBondContact O-N 3.07Å; V281-S284 PolarHBondContact O-N 3.37Å; V281-S284 VanDerWaalsContact O-N 3.11Å; V281-C285 HydrophobicContact CB-CB 4.34Å; V281-C285 HydrophobicContact CG2-CB 4.34Å; V281-C285 WeakPolarHBondContact O-CA 3.15Å; V281-C285 WeakPolarHBondContact O-CB 3.39Å; V281-C285 PolarHBondContact O-N 3.43Å; V281-I288 HydrophobicContact CG1-CD1 4.43Å; V281-L297 HydrophobicContact CB-CD2 4.39Å; V281-L297 HydrophobicContact CG1-CB 4.42Å; V281-L297 HydrophobicContact CG1-CD2 3.59Å; V281-L297 HydrophobicContact CG1-CG 4Å
282G87.4Confident90.3Very high12 Ų1223.1 Ų23.112%0.12413%0.125CC..THydrogen-bonded Turntrans-49-53.8-168.600000113.9G278 V279 C285G278-G282 PolarHBondContact O-N 2.88Å; V279-G282 PolarHBondContact O-N 3.19Å; G282-C285 PolarHBondContact O-SG 3.02Å
283T86.3Confident90.9Very high12 Ų1225.3 Ų25.37%0.07414%0.137CC..THydrogen-bonded Turntrans-76.2-32.8-178.755.50000113.4R170 V281 H286 G339 E340 Y343R170-T283 HydrophobicContact CG-CG2 3.87Å; R170-T283 WeakPolarHBondContact O-CG2 3.41Å; V281-T283 PolarHBondContact O-N 3.07Å; T283-H286 PolarHBondContact O-CE1 2.95Å; T283-H286 PolarHBondContact O-ND1 3.25Å; T283-G339 PolarHBondContact OG1-O 3.22Å; T283-E340 HydrophobicContact CG2-CG 4.32Å; T283-E340 WeakPolarHBondContact CG2-OE1 3.19Å; T283-E340 PolarHBondContact OG1-N 3.47Å; T283-Y343 WeakPolarHBondContact O-CD2 3.37Å
284S89.1Confident91.2Very high0 Ų025.3 Ų25.30%014%0.137CC..THydrogen-bonded Turntrans-99.9-8.6-169.265.20000114.7V281 H286 L287 I288V281-S284 PolarHBondContact O-N 3.37Å; V281-S284 VanDerWaalsContact O-N 3.11Å; S284-H286 PolarHBondContact O-N 2.78Å; S284-H286 VanDerWaalsContact O-N 3.08Å; S284-L287 PolarHBondContact O-N 3.08Å; S284-I288 PolarHBondContact O-N 3.26Å
285C88.4Confident91.4Very high1 Ų128.7 Ų28.71%0.00715%0.153CC..THydrogen-bonded Turntrans-54.6-34.5-169.757.60000114.4A237 N240 V281 G282A237-C285 HydrophobicContact CB-CB 4.06Å; A237-C285 VanDerWaalsContact CB-SG 3.51Å; N240-C285 PolarHBondContact ND2-O 3.05Å; V281-C285 HydrophobicContact CB-CB 4.34Å; V281-C285 HydrophobicContact CG2-CB 4.34Å; V281-C285 WeakPolarHBondContact O-CA 3.15Å; V281-C285 WeakPolarHBondContact O-CB 3.39Å; V281-C285 PolarHBondContact O-N 3.43Å; G282-C285 PolarHBondContact O-SG 3.02Å
286H87.6Confident91.6Very high41 Ų4132 Ų3219%0.1917%0.173CC..THydrogen-bonded Turntrans-80.8-19.2-179.269.3-78.3000113.8L228 Q233 A237 T283 S284 Y343L228-H286 HydrophobicContact CD1-CB 3.72Å; L228-H286 HydrophobicContact CD2-CB 4.02Å; Q233-H286 HydrophobicContact CB-CB 4.21Å; A237-H286 HydrophobicContact CB-CB 4.33Å; T283-H286 PolarHBondContact O-CE1 2.95Å; T283-H286 PolarHBondContact O-ND1 3.25Å; S284-H286 PolarHBondContact O-N 2.78Å; S284-H286 VanDerWaalsContact O-N 3.08Å; H286-Y343 AromaticContact CE1-CE2 3.94Å
287L88.4Confident91.8Very high48 Ų4832.7 Ų32.725%0.25118%0.176SC..THydrogen-bonded Turntrans-93.5-16.3179.5-65.1-175.7000113.1S284 P289 Y343 L346S284-L287 PolarHBondContact O-N 3.08Å; L287-P289 VanDerWaalsContact O-CD 3.23Å; L287-P289 WeakPolarHBondContact O-CD 3.28Å; L287-Y343 HydrophobicContact CD1-CD2 3.55Å; L287-Y343 HydrophobicContact CD1-CE2 3.36Å; L287-Y343 HydrophobicContact CG-CD2 4.47Å; L287-Y343 HydrophobicContact CG-CE2 4.28Å; L287-L346 HydrophobicContact CB-CB 4.23Å; L287-L346 HydrophobicContact CB-CD1 4.26Å; L287-L346 HydrophobicContact CD1-CB 4.47Å
288I90.9Very high91.9Very high4 Ų432.7 Ų32.72%0.02118%0.176CC..  trans-68.4116179.6-67.5166.4000109.1N240 V281 S284 S290 L293 A294 L297 L346N240-I288 HydrophobicContact CB-CB 4.5Å; N240-I288 WeakPolarHBondContact ND2-CB 3.33Å; N240-I288 PolarHBondContact ND2-O 3.09Å; V281-I288 HydrophobicContact CG1-CD1 4.43Å; S284-I288 PolarHBondContact O-N 3.26Å; I288-S290 VanDerWaalsContact CG2-O 3.23Å; I288-S290 WeakPolarHBondContact CG2-O 3.39Å; I288-L293 HydrophobicContact CG2-CB 3.77Å; I288-A294 HydrophobicContact CD1-CB 4.21Å; I288-A294 HydrophobicContact CG2-CB 4.21Å; I288-L297 HydrophobicContact CD1-CD2 4.2Å; I288-L346 HydrophobicContact CG1-CD1 3.53Å
289P88.7Confident92.2Very high101 Ų10136.3 Ų36.366%0.65620%0.195SC*.  trans-78.9-25.5-172.430.7-35.7000113.1L287 L293L287-P289 VanDerWaalsContact O-CD 3.23Å; L287-P289 WeakPolarHBondContact O-CD 3.28Å; P289-L293 HydrophobicContact CG-CD1 3.85Å
290S91.2Very high92.4Very high28 Ų2839 Ų3920%0.19621%0.212CC..SBendtrans-134.3142-173.361.10000112.5I288 W292 L293I288-S290 VanDerWaalsContact CG2-O 3.23Å; I288-S290 WeakPolarHBondContact CG2-O 3.39Å; S290-W292 VanDerWaalsContact C-N 3.28Å; S290-W292 PolarHBondContact O-N 2.75Å; S290-W292 PolarHBondContact OG-NE1 3.44Å; S290-L293 PolarHBondContact O-N 3.33Å; S290-L293 VanDerWaalsContact OG-CD1 3.31Å; S290-L293 WeakPolarHBondContact OG-CD1 3.48Å; S290-L293 WeakPolarHBondContact OG-CG 3.29Å
291P93.4Very high92.5Very high60 Ų6039 Ų3939%0.3921%0.212SC..Hα-helixtrans-57.7-35.9-178.5-29.236.3000114.7Y243 L293 A294 M295Y243-P291 HydrophobicContact CD2-CB 3.73Å; Y243-P291 HydrophobicContact CD2-CG 4.39Å; Y243-P291 HydrophobicContact CE2-CB 3.84Å; Y243-P291 HydrophobicContact CE2-CG 4.14Å; Y243-P291 HydrophobicContact CG-CB 4.31Å; P291-L293 VanDerWaalsContact C-N 3.25Å; P291-L293 PolarHBondContact O-N 3.38Å; P291-A294 WeakPolarHBondContact O-CB 3.18Å; P291-A294 PolarHBondContact O-N 3.35Å; P291-A294 VanDerWaalsContact O-N 3.11Å; P291-M295 WeakPolarHBondContact O-CG 3.37Å; P291-M295 PolarHBondContact O-N 3.44Å
292W95.2Very high92.7Very high158 Ų15839 Ų3960%0.59821%0.212SC*.Hα-helixtrans-64.4-30.8-177.475.4-98.6000112.4S290 M295 V296S290-W292 VanDerWaalsContact C-N 3.28Å; S290-W292 PolarHBondContact O-N 2.75Å; S290-W292 PolarHBondContact OG-NE1 3.44Å; W292-M295 WeakPolarHBondContact O-CB 3.38Å; W292-M295 PolarHBondContact O-N 3.1Å; W292-V296 HydrophobicContact CE3-CG2 3.92Å; W292-V296 HydrophobicContact CZ3-CG2 4.15Å; W292-V296 WeakPolarHBondContact O-CG2 3.48Å; W292-V296 PolarHBondContact O-N 2.91Å
293L94.9Very high92.9Very high54 Ų5442.9 Ų42.928%0.28323%0.229SC..Hα-helixtrans-66.7-41.3174.8-73.3171.4000110.8I288 P289 S290 P291 M295 V296 L297I288-L293 HydrophobicContact CG2-CB 3.77Å; P289-L293 HydrophobicContact CG-CD1 3.85Å; S290-L293 PolarHBondContact O-N 3.33Å; S290-L293 VanDerWaalsContact OG-CD1 3.31Å; S290-L293 WeakPolarHBondContact OG-CD1 3.48Å; S290-L293 WeakPolarHBondContact OG-CG 3.29Å; P291-L293 VanDerWaalsContact C-N 3.25Å; P291-L293 PolarHBondContact O-N 3.38Å; L293-M295 VanDerWaalsContact C-N 3.32Å; L293-M295 PolarHBondContact O-N 2.86Å; L293-V296 PolarHBondContact O-N 2.91Å; L293-L297 WeakPolarHBondContact O-CB 3.35Å; L293-L297 PolarHBondContact O-N 3.48Å
294A95.9Very high93.2Very high0 Ų045.4 Ų45.40%024%0.241CC..Hα-helixtrans-64.3-38.4174.300000111.7N240 A244 I288 P291 L297 G298N240-A294 HydrophobicContact CB-CB 3.81Å; N240-A294 WeakPolarHBondContact O-CB 3.47Å; A244-A294 WeakPolarHBondContact CA-O 3.27Å; A244-A294 HydrophobicContact CB-CB 4.5Å; A244-A294 WeakPolarHBondContact CB-O 3.44Å; I288-A294 HydrophobicContact CD1-CB 4.21Å; I288-A294 HydrophobicContact CG2-CB 4.21Å; P291-A294 WeakPolarHBondContact O-CB 3.18Å; P291-A294 PolarHBondContact O-N 3.35Å; P291-A294 VanDerWaalsContact O-N 3.11Å; A294-L297 PolarHBondContact O-N 3.44Å; A294-G298 PolarHBondContact O-N 3.43Å
295M97.5Very high93.3Very high80 Ų8045.4 Ų45.439%0.39424%0.241SC..Hα-helixtrans-61.2-47.2174-69.9177.67500112.1Y243 V247 P291 W292 L293 L297 G298 L299Y243-M295 HydrophobicContact CD1-SD 4.5Å; Y243-M295 HydrophobicContact CG-CG 4.49Å; V247-M295 WeakPolarHBondContact CG1-O 3.14Å; V247-M295 HydrophobicContact CG2-CB 3.74Å; V247-M295 HydrophobicContact CG2-CE 3.72Å; V247-M295 HydrophobicContact CG2-CG 3.77Å; P291-M295 WeakPolarHBondContact O-CG 3.37Å; P291-M295 PolarHBondContact O-N 3.44Å; W292-M295 WeakPolarHBondContact O-CB 3.38Å; W292-M295 PolarHBondContact O-N 3.1Å; L293-M295 VanDerWaalsContact C-N 3.32Å; L293-M295 PolarHBondContact O-N 2.86Å; M295-L297 VanDerWaalsContact C-N 3.33Å; M295-L297 PolarHBondContact O-N 3.19Å; M295-G298 PolarHBondContact O-N 3.45Å; M295-L299 PolarHBondContact O-N 3.47Å
296V96.8Very high93.4Very high70 Ų7045.8 Ų45.842%0.42424%0.243SC..Hα-helixtrans-61.1-43.9176.41700000110.8W292 L293 G298 L299 V300W292-V296 HydrophobicContact CE3-CG2 3.92Å; W292-V296 HydrophobicContact CZ3-CG2 4.15Å; W292-V296 WeakPolarHBondContact O-CG2 3.48Å; W292-V296 PolarHBondContact O-N 2.91Å; L293-V296 PolarHBondContact O-N 2.91Å; V296-G298 VanDerWaalsContact C-N 3.32Å; V296-G298 PolarHBondContact O-N 3Å; V296-L299 WeakPolarHBondContact O-CB 3.48Å; V296-L299 PolarHBondContact O-N 3.48Å; V296-V300 HydrophobicContact CG1-CG2 4.41Å; V296-V300 WeakPolarHBondContact O-CG2 3.41Å; V296-V300 PolarHBondContact O-N 3.49Å
297L95.7Very high93.3Very high15 Ų1545.4 Ų45.48%0.07925%0.251CS..Hα-helixtrans-61.9-40.4176.8-174.654.9000111.7A280 V281 I288 L293 A294 M295 V300 A301 L338 T342A280-L297 HydrophobicContact CB-CG 4.42Å; V281-L297 HydrophobicContact CB-CD2 4.39Å; V281-L297 HydrophobicContact CG1-CB 4.42Å; V281-L297 HydrophobicContact CG1-CD2 3.59Å; V281-L297 HydrophobicContact CG1-CG 4Å; I288-L297 HydrophobicContact CD1-CD2 4.2Å; L293-L297 WeakPolarHBondContact O-CB 3.35Å; L293-L297 PolarHBondContact O-N 3.48Å; A294-L297 PolarHBondContact O-N 3.44Å; M295-L297 VanDerWaalsContact C-N 3.33Å; M295-L297 PolarHBondContact O-N 3.19Å; L297-V300 PolarHBondContact O-N 2.93Å; L297-A301 WeakPolarHBondContact O-CB 3.4Å; L297-A301 PolarHBondContact O-N 3.31Å; L297-L338 HydrophobicContact CD1-CD2 4.11Å; L297-L338 HydrophobicContact CD1-CG 4.12Å; L297-T342 HydrophobicContact CD1-CG2 4.48Å; L297-T342 HydrophobicContact CD2-CG2 3.76Å
298G96.4Very high93.1Very high0 Ų043.5 Ų43.50%024%0.242CC..Hα-helixtrans-63.2-37.2173.800000114.1S248 A294 M295 V296 G302S248-G298 PolarHBondContact OG-O 3.44Å; A294-G298 PolarHBondContact O-N 3.43Å; M295-G298 PolarHBondContact O-N 3.45Å; V296-G298 VanDerWaalsContact C-N 3.32Å; V296-G298 PolarHBondContact O-N 3Å; G298-G302 PolarHBondContact O-N 3.41Å
299L96.7Very high92.6Very high77 Ų7743.8 Ų43.840%0.40325%0.245SC..Hα-helixtrans-65.1-51.4173.717765.1000111V247 T251 M295 V296 A301 G302 L303V247-L299 HydrophobicContact CG1-CB 3.71Å; T251-L299 HydrophobicContact CG2-CD1 3.87Å; T251-L299 VanDerWaalsContact OG1-CD1 3.22Å; T251-L299 WeakPolarHBondContact OG1-CD1 3.41Å; M295-L299 PolarHBondContact O-N 3.47Å; V296-L299 WeakPolarHBondContact O-CB 3.48Å; V296-L299 PolarHBondContact O-N 3.48Å; L299-A301 VanDerWaalsContact C-N 3.35Å; L299-A301 PolarHBondContact O-N 3.07Å; L299-G302 PolarHBondContact O-N 3.29Å; L299-L303 HydrophobicContact CD1-CD1 4.37Å; L299-L303 HydrophobicContact CG-CD1 4.34Å; L299-L303 WeakPolarHBondContact O-CG 3.48Å; L299-L303 PolarHBondContact O-N 3.43Å
300V95.7Very high92.2Very high59 Ų5944.3 Ų44.336%0.35824%0.237SC..Hα-helixtrans-60.4-46.1179.6172.30000110.5V296 L297 G302 L303 I304 L338V296-V300 HydrophobicContact CG1-CG2 4.41Å; V296-V300 WeakPolarHBondContact O-CG2 3.41Å; V296-V300 PolarHBondContact O-N 3.49Å; L297-V300 PolarHBondContact O-N 2.93Å; V300-G302 PolarHBondContact O-N 3.28Å; V300-L303 PolarHBondContact O-N 3.17Å; V300-I304 HydrophobicContact CG1-CD1 3.65Å; V300-I304 HydrophobicContact CG1-CG1 4.4Å; V300-I304 WeakPolarHBondContact O-CB 3.19Å; V300-I304 VanDerWaalsContact O-CG1 3.29Å; V300-I304 WeakPolarHBondContact O-CG1 3.33Å; V300-I304 PolarHBondContact O-N 3.49Å; V300-L338 HydrophobicContact CG1-CD2 4.39Å
301A95.3Very high91.6Very high0 Ų046.3 Ų46.30%025%0.251CS..Hα-helixtrans-58.6-45175.500000112.3A276 A280 L297 L299 I304 S305 L335 L338A276-A301 HydrophobicContact CB-CB 4.05Å; A280-A301 HydrophobicContact CB-CB 3.6Å; L297-A301 WeakPolarHBondContact O-CB 3.4Å; L297-A301 PolarHBondContact O-N 3.31Å; L299-A301 VanDerWaalsContact C-N 3.35Å; L299-A301 PolarHBondContact O-N 3.07Å; A301-I304 PolarHBondContact O-N 3.37Å; A301-S305 WeakPolarHBondContact O-CB 3.31Å; A301-S305 PolarHBondContact O-N 3.11Å; A301-L335 HydrophobicContact CB-CD2 3.77Å; A301-L338 HydrophobicContact CB-CD2 4.13Å
302G94.3Very high90.6Very high0 Ų045.2 Ų45.20%024%0.241CC..Hα-helixtrans-60.9-44.8176.600000112.6G298 L299 V300 S305 I306G298-G302 PolarHBondContact O-N 3.41Å; L299-G302 PolarHBondContact O-N 3.29Å; V300-G302 PolarHBondContact O-N 3.28Å; G302-S305 PolarHBondContact O-N 3.22Å; G302-I306 VanDerWaalsContact O-CG1 3.3Å; G302-I306 WeakPolarHBondContact O-CG1 3.48Å; G302-I306 PolarHBondContact O-N 3.44Å
303L93.1Very high89.2Confident93 Ų9339.7 Ų39.749%0.48723%0.226SC..Hα-helixtrans-65.9-42.6177.4-68.8175.1000112.4T251 L299 V300 S305 I306 G307T251-L303 HydrophobicContact CG2-CD2 3.86Å; T251-L303 HydrophobicContact CG2-CG 3.85Å; L299-L303 HydrophobicContact CD1-CD1 4.37Å; L299-L303 HydrophobicContact CG-CD1 4.34Å; L299-L303 WeakPolarHBondContact O-CG 3.48Å; L299-L303 PolarHBondContact O-N 3.43Å; V300-L303 PolarHBondContact O-N 3.17Å; L303-S305 VanDerWaalsContact C-N 3.29Å; L303-S305 PolarHBondContact O-N 3.26Å; L303-I306 PolarHBondContact O-N 2.75Å; L303-G307 PolarHBondContact O-N 3.47Å
304I92.5Very high87.9Confident64 Ų6441.8 Ų41.833%0.32824%0.24SC..Hα-helixtrans-60.6-42175-71.4167000110.3V300 A301 G307 G308 L338V300-I304 HydrophobicContact CG1-CD1 3.65Å; V300-I304 HydrophobicContact CG1-CG1 4.4Å; V300-I304 WeakPolarHBondContact O-CB 3.19Å; V300-I304 VanDerWaalsContact O-CG1 3.29Å; V300-I304 WeakPolarHBondContact O-CG1 3.33Å; V300-I304 PolarHBondContact O-N 3.49Å; A301-I304 PolarHBondContact O-N 3.37Å; I304-G307 PolarHBondContact O-N 3.43Å; I304-G308 PolarHBondContact O-N 3.49Å; I304-L338 HydrophobicContact CD1-CD1 4.38Å; I304-L338 HydrophobicContact CD1-CD2 3.82Å
305S91.1Very high86.2Confident0 Ų045.3 Ų45.30%026%0.264CS..Hα-helixtrans-62.5-45177.1177.20000112.5S272 A273 A301 G302 L303 G308 A309 I331S272-S305 WeakPolarHBondContact CB-OG 3.41Å; S272-S305 PolarHBondContact O-OG 3.16Å; A273-S305 WeakPolarHBondContact CA-OG 3.3Å; A273-S305 PolarHBondContact N-OG 2.86Å; A301-S305 WeakPolarHBondContact O-CB 3.31Å; A301-S305 PolarHBondContact O-N 3.11Å; G302-S305 PolarHBondContact O-N 3.22Å; L303-S305 VanDerWaalsContact C-N 3.29Å; L303-S305 PolarHBondContact O-N 3.26Å; S305-G308 PolarHBondContact O-N 3.04Å; S305-A309 WeakPolarHBondContact O-CB 3.47Å; S305-A309 PolarHBondContact O-N 2.94Å; S305-I331 WeakPolarHBondContact O-CD1 3.3Å; S305-I331 WeakPolarHBondContact OG-CG2 3.23Å
306I89.3Confident84.4Confident9 Ų942.6 Ų42.65%0.04625%0.253CS..Hα-helixtrans-65.3-45.6177.4-63.8167000111.2T251 A259 A273 G302 L303 G308 A309 K310T251-I306 WeakPolarHBondContact O-CD1 3.37Å; A259-I306 HydrophobicContact CB-CG2 3.78Å; A273-I306 HydrophobicContact CB-CD1 4.31Å; A273-I306 HydrophobicContact CB-CG1 3.78Å; G302-I306 VanDerWaalsContact O-CG1 3.3Å; G302-I306 WeakPolarHBondContact O-CG1 3.48Å; G302-I306 PolarHBondContact O-N 3.44Å; L303-I306 PolarHBondContact O-N 2.75Å; I306-G308 VanDerWaalsContact C-N 3.31Å; I306-G308 PolarHBondContact O-N 3.09Å; I306-A309 PolarHBondContact O-N 3.44Å; I306-K310 PolarHBondContact O-N 3.35Å; I306-K310 VanDerWaalsContact O-N 3.13Å
307G86.9Confident82.6Confident34 Ų3442 Ų4235%0.35125%0.247SC..Hα-helixtrans-60.3-42.8175.200000111.7L303 I304 K310 C311L303-G307 PolarHBondContact O-N 3.47Å; I304-G307 PolarHBondContact O-N 3.43Å; G307-K310 PolarHBondContact O-N 3.36Å; G307-C311 VanDerWaalsContact O-CB 3.31Å; G307-C311 WeakPolarHBondContact O-CB 3.17Å; G307-C311 PolarHBondContact O-N 3.08Å; G307-C311 PolarHBondContact O-SG 3.14Å
308G83.4Confident80.6Confident7 Ų752 Ų527%0.07228%0.284CS..Hα-helixtrans-59.6-50.6174.300000111.9I304 S305 I306 K310 C311 L312I304-G308 PolarHBondContact O-N 3.49Å; S305-G308 PolarHBondContact O-N 3.04Å; I306-G308 VanDerWaalsContact C-N 3.31Å; I306-G308 PolarHBondContact O-N 3.09Å; G308-K310 PolarHBondContact O-N 2.89Å; G308-K310 VanDerWaalsContact O-N 3.17Å; G308-C311 PolarHBondContact O-N 2.87Å; G308-L312 WeakPolarHBondContact O-CB 3.36Å; G308-L312 WeakPolarHBondContact O-CD1 3.3Å; G308-L312 WeakPolarHBondContact O-CG 3.32Å; G308-L312 PolarHBondContact O-N 3.15Å
309A80.3Confident78.4Confident10 Ų1057.8 Ų57.88%0.08332%0.319CS..Hα-helixtrans-59.7-30179.700000113Y269 S305 I306 P313 V327 I331Y269-A309 HydrophobicContact CD1-CB 3.64Å; Y269-A309 HydrophobicContact CE1-CB 3.87Å; S305-A309 WeakPolarHBondContact O-CB 3.47Å; S305-A309 PolarHBondContact O-N 2.94Å; I306-A309 PolarHBondContact O-N 3.44Å; A309-P313 WeakPolarHBondContact O-CD 3.48Å; A309-P313 WeakPolarHBondContact O-CG 3.3Å; A309-V327 HydrophobicContact CB-CG1 4.36Å; A309-I331 HydrophobicContact CB-CD1 3.85Å
310K80.9Confident76.1Confident112 Ų11258.6 Ų58.649%0.48732%0.323SS..Hα-helixtrans-82.5-45.4176.6-172.1173.4-180172.20113Y269 I306 G307 G308Y269-K310 HydrophobicContact CE1-CB 4.43Å; I306-K310 PolarHBondContact O-N 3.35Å; I306-K310 VanDerWaalsContact O-N 3.13Å; G307-K310 PolarHBondContact O-N 3.36Å; G308-K310 PolarHBondContact O-N 2.89Å; G308-K310 VanDerWaalsContact O-N 3.17Å
311C77.3Confident73.8Confident71 Ų7157.1 Ų57.148%0.4832%0.32SS..Hα-helixtrans-93.6-37.4-169.2-63.70000113.8G307 G308 V314 C315G307-C311 VanDerWaalsContact O-CB 3.31Å; G307-C311 WeakPolarHBondContact O-CB 3.17Å; G307-C311 PolarHBondContact O-N 3.08Å; G307-C311 PolarHBondContact O-SG 3.14Å; G308-C311 PolarHBondContact O-N 2.87Å; C311-V314 PolarHBondContact O-N 3.16Å; C311-V314 VanDerWaalsContact O-N 3.13Å; C311-C315 PolarHBondContact O-N 3.28Å; C311-C315 PolarHBondContact O-SG 3.43Å
312L72.3Confident71.7Confident37 Ų3758.1 Ų58.119%0.19433%0.325CS..Hα-helixtrans-57.8-44.2-177.1-78.4153.4000113.1G308 V314 C315 C316 I331 L334G308-L312 WeakPolarHBondContact O-CB 3.36Å; G308-L312 WeakPolarHBondContact O-CD1 3.3Å; G308-L312 WeakPolarHBondContact O-CG 3.32Å; G308-L312 PolarHBondContact O-N 3.15Å; L312-V314 VanDerWaalsContact C-N 3.25Å; L312-V314 PolarHBondContact O-N 3.17Å; L312-C315 PolarHBondContact O-N 3.22Å; L312-C316 WeakPolarHBondContact O-CB 3.24Å; L312-C316 PolarHBondContact O-N 2.85Å; L312-I331 HydrophobicContact CD1-CG1 4.02Å; L312-L334 HydrophobicContact CD1-CD1 3.89Å
313P66.6Low69.4Low42 Ų4263.5 Ų63.527%0.27335%0.35SS..Hα-helixtrans-60.1-37.3178-23.133.6000112.3A309 N317 V327A309-P313 WeakPolarHBondContact O-CD 3.48Å; A309-P313 WeakPolarHBondContact O-CG 3.3Å; P313-N317 WeakPolarHBondContact O-CB 3.47Å; P313-N317 PolarHBondContact O-N 3.25Å; P313-N317 PolarHBondContact O-ND2 2.84Å; P313-N317 VanDerWaalsContact O-ND2 3.14Å; P313-V327 HydrophobicContact CG-CG1 4.29Å; P313-V327 HydrophobicContact CG-CG2 3.84Å
314V66.8Low67.5Low97 Ų9762.8 Ų62.859%0.58834%0.344SS*.Hα-helixtrans-74.4-47.3-179.2-176.80000110.7C311 L312 R318C311-V314 PolarHBondContact O-N 3.16Å; C311-V314 VanDerWaalsContact O-N 3.13Å; L312-V314 VanDerWaalsContact C-N 3.25Å; L312-V314 PolarHBondContact O-N 3.17Å; V314-R318 WeakPolarHBondContact O-CB 3.46Å; V314-R318 PolarHBondContact O-N 2.94Å
315C62.3Low65.6Low75 Ų7560.8 Ų60.851%0.50733%0.334SS..Hα-helixtrans-71.3-46.7-177.7-65.10000112.5C311 L312 N317 R318 V319C311-C315 PolarHBondContact O-N 3.28Å; C311-C315 PolarHBondContact O-SG 3.43Å; L312-C315 PolarHBondContact O-N 3.22Å; C315-N317 PolarHBondContact O-N 3.42Å; C315-R318 PolarHBondContact O-N 3.19Å; C315-V319 WeakPolarHBondContact O-CB 3.11Å; C315-V319 WeakPolarHBondContact O-CG2 3.35Å; C315-V319 PolarHBondContact O-N 3.33Å
316C58.7Low64.3Low23 Ų2362.5 Ų62.516%0.15535%0.346CS..Hα-helixtrans-68.8-33.9-179.9-70.10000112.3L312 L320 G321L312-C316 WeakPolarHBondContact O-CB 3.24Å; L312-C316 PolarHBondContact O-N 2.85Å; C316-L320 HydrophobicContact CB-CD1 4.42Å; C316-L320 CarbonylContact O-C 3.4Å; C316-L320 WeakPolarHBondContact O-CA 3.32Å; C316-L320 WeakPolarHBondContact O-CB 3.25Å; C316-L320 PolarHBondContact O-N 2.95Å; C316-G321 PolarHBondContact O-N 3.3Å; C316-G321 VanDerWaalsContact O-N 3.16Å
317N59Low62.9Low57 Ų5764.3 Ų64.331%0.30536%0.357SS..Hα-helixtrans-67.9-38.8175.8-75.3-5.9000111.9P313 C315 I322 H323P313-N317 WeakPolarHBondContact O-CB 3.47Å; P313-N317 PolarHBondContact O-N 3.25Å; P313-N317 PolarHBondContact O-ND2 2.84Å; P313-N317 VanDerWaalsContact O-ND2 3.14Å; C315-N317 PolarHBondContact O-N 3.42Å; N317-I322 PolarHBondContact OD1-O 3.47Å; N317-I322 VanDerWaalsContact OD1-O 3.04Å; N317-H323 WeakPolarHBondContact OD1-CA 3.49Å
318R53.4Low61.7Low226 Ų22663.8 Ų63.885%0.85335%0.346SS*.Hα-helixtrans-79-37.1-176.6-160.1178.4-137.5-179.24.3113.3V314 C315V314-R318 WeakPolarHBondContact O-CB 3.46Å; V314-R318 PolarHBondContact O-N 2.94Å; C315-R318 PolarHBondContact O-N 3.19Å
319V51.1Low61Low120 Ų12063.7 Ų63.773%0.72734%0.343SS*.Hα-helixtrans-100.1-42.3-172-1780000112.7C315C315-V319 WeakPolarHBondContact O-CB 3.11Å; C315-V319 WeakPolarHBondContact O-CG2 3.35Å; C315-V319 PolarHBondContact O-N 3.33Å
320L47.5Very low60.4Low94 Ų9464 Ų6449%0.49235%0.345SS..THydrogen-bonded Turntrans-99.7-10.5-174.7-64.5165.1000112.7C316 I322C316-L320 HydrophobicContact CB-CD1 4.42Å; C316-L320 CarbonylContact O-C 3.4Å; C316-L320 WeakPolarHBondContact O-CA 3.32Å; C316-L320 WeakPolarHBondContact O-CB 3.25Å; C316-L320 PolarHBondContact O-N 2.95Å; L320-I322 HydrophobicContact CB-CD1 3.71Å; L320-I322 HydrophobicContact CB-CG1 3.71Å; L320-I322 HydrophobicContact CD1-CD1 4.32Å; L320-I322 VanDerWaalsContact O-CG1 3.31Å; L320-I322 WeakPolarHBondContact O-CG1 3.36Å; L320-I322 PolarHBondContact O-N 2.99Å
321G46.8Very low60.1Low28 Ų2858.7 Ų58.729%0.28932%0.322SS..  trans59.831.2-177.800000112.6K189 C316K189-G321 WeakPolarHBondContact CE-O 3.4Å; K189-G321 PolarHBondContact NZ-O 3.45Å; C316-G321 PolarHBondContact O-N 3.3Å; C316-G321 VanDerWaalsContact O-N 3.16Å
322I52Low60.1Low21 Ų2155.8 Ų55.811%0.10830%0.301CS..  trans-105.884.6-176.6-43.8172.8000109.8W185 N317 L320 H324 I325W185-I322 HydrophobicContact CG-CD1 4.44Å; N317-I322 PolarHBondContact OD1-O 3.47Å; N317-I322 VanDerWaalsContact OD1-O 3.04Å; L320-I322 HydrophobicContact CB-CD1 3.71Å; L320-I322 HydrophobicContact CB-CG1 3.71Å; L320-I322 HydrophobicContact CD1-CD1 4.32Å; L320-I322 VanDerWaalsContact O-CG1 3.31Å; L320-I322 WeakPolarHBondContact O-CG1 3.36Å; L320-I322 PolarHBondContact O-N 2.99Å; I322-H324 PolarHBondContact O-N 3.13Å; I322-H324 VanDerWaalsContact O-N 3.13Å; I322-I325 HydrophobicContact CB-CD1 3.77Å; I322-I325 HydrophobicContact CB-CG1 4.39Å; I322-I325 HydrophobicContact CD1-CD1 3.57Å; I322-I325 HydrophobicContact CG1-CD1 4.25Å; I322-I325 HydrophobicContact CG2-CB 4.44Å; I322-I325 HydrophobicContact CG2-CD1 3.28Å; I322-I325 HydrophobicContact CG2-CG1 3.42Å; I322-I325 VanDerWaalsContact CG2-CG1 3.42Å
323H46.9Very low60.5Low114 Ų11454.4 Ų54.453%0.52829%0.294SS..THydrogen-bonded Turntrans-66.9-12.6-172.2-86.849.5000115.6N317N317-H323 WeakPolarHBondContact OD1-CA 3.49Å
324H52.3Low61.4Low78 Ų7855.9 Ų55.936%0.36130%0.3SS..THydrogen-bonded Turntrans-15040.6-168.3-61.1-72000114.5K133 I322K133-H324 WeakPolarHBondContact CE-O 3.24Å; K133-H324 PolarHBondContact NZ-O 2.82Å; I322-H324 PolarHBondContact O-N 3.13Å; I322-H324 VanDerWaalsContact O-N 3.13Å
325I53.3Low62.5Low21 Ų2151.3 Ų51.311%0.10827%0.272CS..SBendtrans-72.5139.1158.7-69.9150.9000107.2L181 I322 V327 S330L181-I325 HydrophobicContact CD1-CB 4.42Å; L181-I325 HydrophobicContact CD1-CD1 3.39Å; L181-I325 HydrophobicContact CD1-CG1 3.82Å; L181-I325 HydrophobicContact CD1-CG2 3.72Å; I322-I325 HydrophobicContact CB-CD1 3.77Å; I322-I325 HydrophobicContact CB-CG1 4.39Å; I322-I325 HydrophobicContact CD1-CD1 3.57Å; I322-I325 HydrophobicContact CG1-CD1 4.25Å; I322-I325 HydrophobicContact CG2-CB 4.44Å; I322-I325 HydrophobicContact CG2-CD1 3.28Å; I322-I325 HydrophobicContact CG2-CG1 3.42Å; I322-I325 VanDerWaalsContact CG2-CG1 3.42Å; I325-V327 PolarHBondContact O-N 3.06Å; I325-S330 VanDerWaalsContact CG2-OG 3.26Å; I325-S330 WeakPolarHBondContact CG2-OG 3.15Å
326S62.9Low63.7Low36 Ų3647.8 Ų47.825%0.25225%0.249SC..  trans-56.1110.3169.1177.20000108.2G128 M328 H329 S330G128-S326 VanDerWaalsContact O-CB 3.26Å; G128-S326 WeakPolarHBondContact O-CB 3.34Å; S326-M328 PolarHBondContact O-N 3.32Å; S326-H329 WeakPolarHBondContact O-CA 3.32Å; S326-H329 VanDerWaalsContact O-CB 3.27Å; S326-H329 WeakPolarHBondContact O-CB 3.21Å; S326-H329 PolarHBondContact O-N 2.86Å; S326-S330 PolarHBondContact O-N 2.96Å
327V59.9Low65.2Low47 Ų4748.6 Ų48.629%0.28525%0.251SS..Hα-helixtrans-51.5-35.2-179.3174.30000110.8A309 P313 I325 H329 S330 I331A309-V327 HydrophobicContact CB-CG1 4.36Å; P313-V327 HydrophobicContact CG-CG1 4.29Å; P313-V327 HydrophobicContact CG-CG2 3.84Å; I325-V327 PolarHBondContact O-N 3.06Å; V327-H329 PolarHBondContact O-N 3.2Å; V327-S330 PolarHBondContact O-N 3.35Å; V327-I331 HydrophobicContact CG1-CD1 3.96Å; V327-I331 WeakPolarHBondContact O-CD1 2.92Å; V327-I331 VanDerWaalsContact O-CG1 3.29Å; V327-I331 WeakPolarHBondContact O-CG1 3.48Å; V327-I331 PolarHBondContact O-N 3.5Å; V327-I331 VanDerWaalsContact O-N 3.14Å
328M62Low66.8Low23 Ų2347.4 Ų47.411%0.11325%0.245CC..Hα-helixtrans-59.8-43.1173.8-165.3-179.483.700112.3L65 S326 I331 F332L65-M328 HydrophobicContact CD1-SD 4.06Å; L65-M328 HydrophobicContact CD2-CE 3.23Å; L65-M328 HydrophobicContact CD2-SD 3.63Å; L65-M328 HydrophobicContact CG-CE 3.64Å; L65-M328 HydrophobicContact CG-SD 3.72Å; S326-M328 PolarHBondContact O-N 3.32Å; M328-I331 WeakPolarHBondContact O-CB 3.25Å; M328-I331 PolarHBondContact O-N 2.94Å; M328-F332 HydrophobicContact CG-CD2 4.17Å; M328-F332 HydrophobicContact CG-CE2 3.85Å; M328-F332 WeakPolarHBondContact O-CD2 3.35Å; M328-F332 PolarHBondContact O-N 2.87Å
329H69.2Low68.6Low5 Ų536.6 Ų36.62%0.02320%0.204CC..Hα-helixtrans-65.1-42.3179.4-162.977.5000112.7I125 A129 A177 S326 V327 I331 F332 S333I125-H329 PolarHBondContact O-CE1 2.89Å; I125-H329 PolarHBondContact O-ND1 3.45Å; I125-H329 VanDerWaalsContact O-ND1 3.11Å; A129-H329 HydrophobicContact CB-CB 4.29Å; A177-H329 WeakPolarHBondContact CA-NE2 3.34Å; A177-H329 PolarHBondContact O-NE2 2.9Å; S326-H329 WeakPolarHBondContact O-CA 3.32Å; S326-H329 VanDerWaalsContact O-CB 3.27Å; S326-H329 WeakPolarHBondContact O-CB 3.21Å; S326-H329 PolarHBondContact O-N 2.86Å; V327-H329 PolarHBondContact O-N 3.2Å; H329-I331 VanDerWaalsContact C-N 3.27Å; H329-I331 PolarHBondContact O-N 3.41Å; H329-F332 PolarHBondContact O-N 3.46Å; H329-S333 PolarHBondContact O-N 3.23Å; H329-S333 VanDerWaalsContact O-N 3.09Å
330S66.9Low70.5Confident17 Ų1731 Ų3112%0.11917%0.17CC..Hα-helixtrans-64-34.2175.2-60.70000112.3I325 S326 V327 S333 L334I325-S330 VanDerWaalsContact CG2-OG 3.26Å; I325-S330 WeakPolarHBondContact CG2-OG 3.15Å; S326-S330 PolarHBondContact O-N 2.96Å; V327-S330 PolarHBondContact O-N 3.35Å; S330-S333 WeakPolarHBondContact O-CB 3.34Å; S330-S333 PolarHBondContact O-N 3.46Å; S330-L334 PolarHBondContact O-N 3.16Å
331I75.6Confident72.6Confident1 Ų131.2 Ų31.21%0.00517%0.17CC..Hα-helixtrans-68.5-42.9174.8-70.4166000110.7S305 A309 L312 V327 M328 H329 S333 L334 L335S305-I331 WeakPolarHBondContact O-CD1 3.3Å; S305-I331 WeakPolarHBondContact OG-CG2 3.23Å; A309-I331 HydrophobicContact CB-CD1 3.85Å; L312-I331 HydrophobicContact CD1-CG1 4.02Å; V327-I331 HydrophobicContact CG1-CD1 3.96Å; V327-I331 WeakPolarHBondContact O-CD1 2.92Å; V327-I331 VanDerWaalsContact O-CG1 3.29Å; V327-I331 WeakPolarHBondContact O-CG1 3.48Å; V327-I331 PolarHBondContact O-N 3.5Å; V327-I331 VanDerWaalsContact O-N 3.14Å; M328-I331 WeakPolarHBondContact O-CB 3.25Å; M328-I331 PolarHBondContact O-N 2.94Å; H329-I331 VanDerWaalsContact C-N 3.27Å; H329-I331 PolarHBondContact O-N 3.41Å; I331-S333 PolarHBondContact O-N 2.81Å; I331-L334 PolarHBondContact O-N 3.44Å; I331-L334 VanDerWaalsContact O-N 3.14Å; I331-L335 HydrophobicContact CG2-CD1 3.68Å; I331-L335 HydrophobicContact CG2-CG 4.17Å; I331-L335 VanDerWaalsContact O-CG 3.24Å; I331-L335 WeakPolarHBondContact O-CG 3.32Å; I331-L335 PolarHBondContact O-N 2.96Å
332F77.3Confident74.7Confident10 Ų1031.1 Ų31.14%0.04416%0.164CC..Hα-helixtrans-58.2-36.9174.9-87.4-123.8000112L65 W220 L275 V279 M328 H329 L335 G336L65-F332 HydrophobicContact CD2-CZ 4.41Å; W220-F332 AromaticContact CH2-CE1 3.95Å; W220-F332 HydrophobicContact CH2-CE1 3.95Å; W220-F332 HydrophobicContact CH2-CZ 4.2Å; L275-F332 HydrophobicContact CD1-CZ 4.44Å; V279-F332 HydrophobicContact CG2-CD1 3.94Å; V279-F332 HydrophobicContact CG2-CE1 3.82Å; V279-F332 HydrophobicContact CG2-CG 4.47Å; V279-F332 HydrophobicContact CG2-CZ 4.25Å; M328-F332 HydrophobicContact CG-CD2 4.17Å; M328-F332 HydrophobicContact CG-CE2 3.85Å; M328-F332 WeakPolarHBondContact O-CD2 3.35Å; M328-F332 PolarHBondContact O-N 2.87Å; H329-F332 PolarHBondContact O-N 3.46Å; F332-L335 PolarHBondContact O-N 3.43Å; F332-G336 PolarHBondContact O-N 2.98Å
333S79.9Confident76.6Confident7 Ų731.5 Ų31.55%0.04917%0.165CC..Hα-helixtrans-61-46.5174-166.30000112.8Y178 H329 S330 I331 L335 G336 L337Y178-S333 WeakPolarHBondContact CE2-OG 3.37Å; H329-S333 PolarHBondContact O-N 3.23Å; H329-S333 VanDerWaalsContact O-N 3.09Å; S330-S333 WeakPolarHBondContact O-CB 3.34Å; S330-S333 PolarHBondContact O-N 3.46Å; I331-S333 PolarHBondContact O-N 2.81Å; S333-L335 VanDerWaalsContact C-N 3.34Å; S333-G336 PolarHBondContact O-N 2.94Å; S333-L337 PolarHBondContact O-N 2.77Å; S333-L337 VanDerWaalsContact O-N 3.16Å
334L85.8Confident78.6Confident74 Ų7427.3 Ų27.339%0.38715%0.146SC..Hα-helixtrans-66.2-38.9179.2-70.4171.3000111.7L312 S330 I331 L337 L338L312-L334 HydrophobicContact CD1-CD1 3.89Å; S330-L334 PolarHBondContact O-N 3.16Å; I331-L334 PolarHBondContact O-N 3.44Å; I331-L334 VanDerWaalsContact O-N 3.14Å; L334-L337 PolarHBondContact O-N 3.3Å; L334-L338 PolarHBondContact O-N 2.95Å
335L89.6Confident80.5Confident0 Ų027.9 Ų27.90%016%0.155CC..Hα-helixtrans-70.5-38.2178.8-65.5171.5000112.4A276 V279 A280 A301 I331 F332 S333 L338 G339A276-L335 HydrophobicContact CB-CD1 3.63Å; A276-L335 HydrophobicContact CB-CD2 3.96Å; A276-L335 HydrophobicContact CB-CG 4.45Å; V279-L335 HydrophobicContact CB-CB 4Å; V279-L335 HydrophobicContact CB-CD1 4.38Å; V279-L335 HydrophobicContact CG1-CB 3.73Å; A280-L335 HydrophobicContact CB-CD2 4.5Å; A301-L335 HydrophobicContact CB-CD2 3.77Å; I331-L335 HydrophobicContact CG2-CD1 3.68Å; I331-L335 HydrophobicContact CG2-CG 4.17Å; I331-L335 VanDerWaalsContact O-CG 3.24Å; I331-L335 WeakPolarHBondContact O-CG 3.32Å; I331-L335 PolarHBondContact O-N 2.96Å; F332-L335 PolarHBondContact O-N 3.43Å; S333-L335 VanDerWaalsContact C-N 3.34Å; L335-L338 WeakPolarHBondContact O-CB 3.38Å; L335-L338 PolarHBondContact O-N 3.04Å; L335-G339 PolarHBondContact O-N 2.85Å
336G87.5Confident82.2Confident2 Ų227.9 Ų27.92%0.02116%0.155CC..Hα-helixtrans-59.5-46.9172.800000111.4V174 F332 S333 L338 G339 E340V174-G336 VanDerWaalsContact CG2-C 3.45Å; F332-G336 PolarHBondContact O-N 2.98Å; S333-G336 PolarHBondContact O-N 2.94Å; G336-L338 PolarHBondContact O-N 3.5Å; G336-G339 PolarHBondContact O-N 2.78Å; G336-E340 WeakPolarHBondContact O-CG 2.94Å; G336-E340 PolarHBondContact O-N 3.47Å; G336-E340 VanDerWaalsContact O-N 3.08Å
337L90.3Very high83.4Confident39 Ų3927.4 Ų27.420%0.20415%0.149CC..Hα-helixtrans-60.8-42.1174.5-75.5178.9000112.7V174 Y178 S333 L334 G339 E340 I341 I374V174-L337 HydrophobicContact CG1-CD2 4.31Å; V174-L337 HydrophobicContact CG2-CD2 4.47Å; Y178-L337 HydrophobicContact CE2-CD1 4.32Å; Y178-L337 HydrophobicContact CE2-CD2 4.23Å; Y178-L337 HydrophobicContact CE2-CG 4.17Å; Y178-L337 WeakPolarHBondContact OH-CD1 3.32Å; S333-L337 PolarHBondContact O-N 2.77Å; S333-L337 VanDerWaalsContact O-N 3.16Å; L334-L337 PolarHBondContact O-N 3.3Å; L337-G339 PolarHBondContact O-N 3.43Å; L337-E340 PolarHBondContact O-N 2.99Å; L337-I341 VanDerWaalsContact O-CG1 3.3Å; L337-I341 WeakPolarHBondContact O-CG1 3.32Å; L337-I341 PolarHBondContact O-N 3.35Å; L337-I374 HydrophobicContact CD2-CD1 4.31Å
338L92.7Very high84.7Confident32 Ų3227.4 Ų27.417%0.16815%0.149CC..Hα-helixtrans-57.9-40.4176-179.365.7000111.3A280 L297 V300 A301 I304 L334 L335 G336 T342A280-L338 HydrophobicContact CB-CD2 4.05Å; L297-L338 HydrophobicContact CD1-CD2 4.11Å; L297-L338 HydrophobicContact CD1-CG 4.12Å; V300-L338 HydrophobicContact CG1-CD2 4.39Å; A301-L338 HydrophobicContact CB-CD2 4.13Å; I304-L338 HydrophobicContact CD1-CD1 4.38Å; I304-L338 HydrophobicContact CD1-CD2 3.82Å; L334-L338 PolarHBondContact O-N 2.95Å; L335-L338 WeakPolarHBondContact O-CB 3.38Å; L335-L338 PolarHBondContact O-N 3.04Å; G336-L338 PolarHBondContact O-N 3.5Å; L338-T342 WeakPolarHBondContact O-CB 3.32Å; L338-T342 PolarHBondContact O-N 2.97Å; L338-T342 PolarHBondContact O-OG1 3.37Å
339G90.7Very high85.9Confident0 Ų031.6 Ų31.60%017%0.172CC..Hα-helixtrans-64-46175.500000113.2A280 T283 L335 G336 L337 I341 T342 Y343A280-G339 WeakPolarHBondContact O-CA 3.15Å; T283-G339 PolarHBondContact OG1-O 3.22Å; L335-G339 PolarHBondContact O-N 2.85Å; G336-G339 PolarHBondContact O-N 2.78Å; L337-G339 PolarHBondContact O-N 3.43Å; G339-I341 PolarHBondContact O-N 2.85Å; G339-T342 PolarHBondContact O-N 3.09Å; G339-Y343 PolarHBondContact O-N 3.05Å
340E90.5Very high86.6Confident2 Ų236.5 Ų36.51%0.00919%0.194CC..Hα-helixtrans-61.3-44176.6-65-67.8177.400112.6H171 V174 T283 G336 L337 T342 Y343 I344 L370H171-E340 WeakPolarHBondContact CA-OE1 3.48Å; H171-E340 IonicContact CE1-OE1 3.67Å; H171-E340 IonicContact CE1-OE2 3.64Å; H171-E340 PolarHBondContact CE1-OE2 3.01Å; H171-E340 VanDerWaalsContact CE1-OE2 3.3Å; H171-E340 IonicContact CG-OE1 2.75Å; H171-E340 IonicContact ND1-OE1 3.32Å; H171-E340 PolarHBondContact ND1-OE1 2.72Å; H171-E340 IonicContact ND1-OE2 2.73Å; H171-E340 PolarHBondContact ND1-OE2 3.35Å; V174-E340 HydrophobicContact CG2-CG 3.77Å; T283-E340 HydrophobicContact CG2-CG 4.32Å; T283-E340 WeakPolarHBondContact CG2-OE1 3.19Å; T283-E340 PolarHBondContact OG1-N 3.47Å; G336-E340 WeakPolarHBondContact O-CG 2.94Å; G336-E340 PolarHBondContact O-N 3.47Å; G336-E340 VanDerWaalsContact O-N 3.08Å; L337-E340 PolarHBondContact O-N 2.99Å; E340-T342 VanDerWaalsContact C-N 3.29Å; E340-T342 PolarHBondContact O-N 3.22Å; E340-Y343 WeakPolarHBondContact O-CB 3.3Å; E340-Y343 PolarHBondContact O-N 3.24Å; E340-I344 WeakPolarHBondContact O-CG1 3.42Å; E340-I344 PolarHBondContact O-N 2.99Å; E340-L370 HydrophobicContact CB-CD1 4.17Å; E340-L370 HydrophobicContact CB-CD2 4.01Å; E340-L370 HydrophobicContact CG-CD1 3.76Å
341I91.5Very high87.3Confident99 Ų9936 Ų3651%0.50819%0.191SC..Hα-helixtrans-60.7-44.2175.2-67165.3000109.8L337 G339 Y343 I344 V345L337-I341 VanDerWaalsContact O-CG1 3.3Å; L337-I341 WeakPolarHBondContact O-CG1 3.32Å; L337-I341 PolarHBondContact O-N 3.35Å; G339-I341 PolarHBondContact O-N 2.85Å; I341-Y343 VanDerWaalsContact C-N 3.31Å; I341-Y343 PolarHBondContact O-N 2.66Å; I341-I344 PolarHBondContact O-N 3.31Å; I341-V345 HydrophobicContact CG2-CG2 4.43Å; I341-V345 WeakPolarHBondContact O-CG2 3.36Å; I341-V345 PolarHBondContact O-N 3.01Å
342T91.9Very high87.7Confident26 Ų2640 Ų4016%0.1622%0.215CC..Hα-helixtrans-64.1-38178.7-53.10000111.8L297 L338 G339 E340 V345 L346L297-T342 HydrophobicContact CD1-CG2 4.48Å; L297-T342 HydrophobicContact CD2-CG2 3.76Å; L338-T342 WeakPolarHBondContact O-CB 3.32Å; L338-T342 PolarHBondContact O-N 2.97Å; L338-T342 PolarHBondContact O-OG1 3.37Å; G339-T342 PolarHBondContact O-N 3.09Å; E340-T342 VanDerWaalsContact C-N 3.29Å; E340-T342 PolarHBondContact O-N 3.22Å; T342-V345 PolarHBondContact O-N 3.38Å; T342-L346 HydrophobicContact CG2-CD1 3.93Å; T342-L346 HydrophobicContact CG2-CG 4.34Å; T342-L346 WeakPolarHBondContact O-CB 3.27Å; T342-L346 WeakPolarHBondContact O-CG 3.41Å; T342-L346 PolarHBondContact O-N 3.37Å
343Y90.9Very high87.8Confident29 Ų2950.2 Ų50.211%0.11425%0.253CS..Hα-helixtrans-59.8-48.9173.6174.4-93.8000111.4T283 H286 L287 G339 E340 I341 V345 L346 L347T283-Y343 WeakPolarHBondContact O-CD2 3.37Å; H286-Y343 AromaticContact CE1-CE2 3.94Å; L287-Y343 HydrophobicContact CD1-CD2 3.55Å; L287-Y343 HydrophobicContact CD1-CE2 3.36Å; L287-Y343 HydrophobicContact CG-CD2 4.47Å; L287-Y343 HydrophobicContact CG-CE2 4.28Å; G339-Y343 PolarHBondContact O-N 3.05Å; E340-Y343 WeakPolarHBondContact O-CB 3.3Å; E340-Y343 PolarHBondContact O-N 3.24Å; I341-Y343 VanDerWaalsContact C-N 3.31Å; I341-Y343 PolarHBondContact O-N 2.66Å; Y343-V345 VanDerWaalsContact C-N 3.34Å; Y343-V345 PolarHBondContact O-N 2.89Å; Y343-L346 PolarHBondContact O-N 2.91Å; Y343-L347 HydrophobicContact CE1-CD2 4.36Å; Y343-L347 VanDerWaalsContact O-CB 3.32Å; Y343-L347 WeakPolarHBondContact O-CB 3.5Å; Y343-L347 PolarHBondContact O-N 2.98Å
344I90Very high87.9Confident25 Ų2554.5 Ų54.513%0.12828%0.276CS..Hα-helixtrans-60.9-43.7178.3-64.5167.4000110.7E340 I341 L346 L347 V348 V363 I367E340-I344 WeakPolarHBondContact O-CG1 3.42Å; E340-I344 PolarHBondContact O-N 2.99Å; I341-I344 PolarHBondContact O-N 3.31Å; I344-L346 PolarHBondContact O-N 3.38Å; I344-L347 WeakPolarHBondContact O-CB 3.32Å; I344-L347 PolarHBondContact O-N 2.9Å; I344-V348 WeakPolarHBondContact O-CG2 3.42Å; I344-V348 PolarHBondContact O-N 3.28Å; I344-V363 HydrophobicContact CG2-CG1 4.19Å; I344-I367 HydrophobicContact CD1-CG1 3.86Å
345V91Very high87.4Confident91 Ų9154.2 Ų54.255%0.55229%0.291SS*.Hα-helixtrans-61.5-45.4177.8171.10000111.5I341 T342 Y343 V348 L349I341-V345 HydrophobicContact CG2-CG2 4.43Å; I341-V345 WeakPolarHBondContact O-CG2 3.36Å; I341-V345 PolarHBondContact O-N 3.01Å; T342-V345 PolarHBondContact O-N 3.38Å; Y343-V345 VanDerWaalsContact C-N 3.34Å; Y343-V345 PolarHBondContact O-N 2.89Å; V345-V348 PolarHBondContact O-N 3.28Å; V345-L349 PolarHBondContact O-N 2.62Å
346L89.7Confident86.7Confident21 Ų2157.7 Ų57.711%0.1131%0.309CS..Hα-helixtrans-68.1-36.1178.4-72.1169.6000112.3L287 I288 T342 Y343 I344 L349 H350L287-L346 HydrophobicContact CB-CB 4.23Å; L287-L346 HydrophobicContact CB-CD1 4.26Å; L287-L346 HydrophobicContact CD1-CB 4.47Å; I288-L346 HydrophobicContact CG1-CD1 3.53Å; T342-L346 HydrophobicContact CG2-CD1 3.93Å; T342-L346 HydrophobicContact CG2-CG 4.34Å; T342-L346 WeakPolarHBondContact O-CB 3.27Å; T342-L346 WeakPolarHBondContact O-CG 3.41Å; T342-L346 PolarHBondContact O-N 3.37Å; Y343-L346 PolarHBondContact O-N 2.91Å; I344-L346 PolarHBondContact O-N 3.38Å; L346-L349 PolarHBondContact O-N 2.83Å; L346-H350 WeakPolarHBondContact O-CB 3.43Å; L346-H350 PolarHBondContact O-N 3.13Å
347L88Confident85.9Confident25 Ų2561.4 Ų61.413%0.13135%0.348CS..Hα-helixtrans-60.8-46.4173.4-176.770.7000110.8Y343 I344 H350 T351 Q362 S366Y343-L347 HydrophobicContact CE1-CD2 4.36Å; Y343-L347 VanDerWaalsContact O-CB 3.32Å; Y343-L347 WeakPolarHBondContact O-CB 3.5Å; Y343-L347 PolarHBondContact O-N 2.98Å; I344-L347 WeakPolarHBondContact O-CB 3.32Å; I344-L347 PolarHBondContact O-N 2.9Å; L347-H350 PolarHBondContact O-N 2.96Å; L347-T351 HydrophobicContact CD1-CG2 4.47Å; L347-T351 WeakPolarHBondContact O-CB 2.89Å; L347-T351 WeakPolarHBondContact O-CG2 3.22Å; L347-T351 PolarHBondContact O-N 3.43Å; L347-T351 PolarHBondContact O-OG1 3.22Å; L347-Q362 HydrophobicContact CD2-CB 4.27Å; L347-S366 VanDerWaalsContact CD2-OG 3.25Å; L347-S366 WeakPolarHBondContact CD2-OG 3.44Å
348V87.7Confident85.2Confident48 Ų4864.2 Ų64.229%0.29136%0.361SS..Hα-helixtrans-60.1-47.9174.9172.40000110.8I344 V345 H350 T351 V352 I359 V363I344-V348 WeakPolarHBondContact O-CG2 3.42Å; I344-V348 PolarHBondContact O-N 3.28Å; V345-V348 PolarHBondContact O-N 3.28Å; V348-H350 VanDerWaalsContact C-N 3.35Å; V348-H350 PolarHBondContact O-N 3.46Å; V348-T351 WeakPolarHBondContact CA-OG1 3.37Å; V348-T351 PolarHBondContact O-N 2.96Å; V348-T351 PolarHBondContact O-OG1 3.23Å; V348-V352 HydrophobicContact CG1-CG2 4.2Å; V348-V352 WeakPolarHBondContact O-CB 3.46Å; V348-V352 VanDerWaalsContact O-CG2 3.24Å; V348-V352 WeakPolarHBondContact O-CG2 3.4Å; V348-V352 PolarHBondContact O-N 2.94Å; V348-I359 HydrophobicContact CG1-CG2 4.18Å; V348-I359 HydrophobicContact CG2-CG2 4.22Å; V348-V363 HydrophobicContact CG2-CG2 3.27Å
349L86.5Confident84.7Confident111 Ų11165 Ų6558%0.58137%0.365SS*.Hα-helixtrans-61-44.6-178.5-171.469.2000112V345 L346 T351 W353V345-L349 PolarHBondContact O-N 2.62Å; L346-L349 PolarHBondContact O-N 2.83Å; L349-T351 VanDerWaalsContact C-N 3.34Å; L349-T351 PolarHBondContact O-N 3.25Å; L349-W353 WeakPolarHBondContact O-CB 3.37Å; L349-W353 PolarHBondContact O-N 2.81Å
350H83.9Confident84.2Confident108 Ų10867.6 Ų67.650%0.539%0.392SS..Hα-helixtrans-66.3-36.1179.7-173.3-90000112.3L346 L347 V348 N354L346-H350 WeakPolarHBondContact O-CB 3.43Å; L346-H350 PolarHBondContact O-N 3.13Å; L347-H350 PolarHBondContact O-N 2.96Å; V348-H350 VanDerWaalsContact C-N 3.35Å; V348-H350 PolarHBondContact O-N 3.46Å; H350-N354 PolarHBondContact CE1-ND2 2.69Å; H350-N354 PolarHBondContact ND1-ND2 3.04Å; H350-N354 VanDerWaalsContact O-CG 3.31Å; H350-N354 PolarHBondContact O-N 3.21Å
351T82.4Confident83.8Confident7 Ų772.9 Ų72.94%0.04342%0.415CS..Hα-helixtrans-76.1-38-178.852.40000112.4L347 V348 L349 N354 G355 N356L347-T351 HydrophobicContact CD1-CG2 4.47Å; L347-T351 WeakPolarHBondContact O-CB 2.89Å; L347-T351 WeakPolarHBondContact O-CG2 3.22Å; L347-T351 PolarHBondContact O-N 3.43Å; L347-T351 PolarHBondContact O-OG1 3.22Å; V348-T351 WeakPolarHBondContact CA-OG1 3.37Å; V348-T351 PolarHBondContact O-N 2.96Å; V348-T351 PolarHBondContact O-OG1 3.23Å; L349-T351 VanDerWaalsContact C-N 3.34Å; L349-T351 PolarHBondContact O-N 3.25Å; T351-N354 PolarHBondContact O-N 3.05Å; T351-G355 PolarHBondContact O-N 2.95Å; T351-N356 PolarHBondContact O-N 3.37Å
352V83.4Confident83.4Confident85 Ų8570.8 Ų70.852%0.51540%0.403SS..Hα-helixtrans-60-47.8169.4172.40000110.7V348 N354 G355 I359V348-V352 HydrophobicContact CG1-CG2 4.2Å; V348-V352 WeakPolarHBondContact O-CB 3.46Å; V348-V352 VanDerWaalsContact O-CG2 3.24Å; V348-V352 WeakPolarHBondContact O-CG2 3.4Å; V348-V352 PolarHBondContact O-N 2.94Å; V352-N354 VanDerWaalsContact C-N 3.25Å; V352-N354 PolarHBondContact O-N 3.08Å; V352-G355 PolarHBondContact O-N 3.35Å; V352-I359 HydrophobicContact CB-CD1 4.38Å; V352-I359 HydrophobicContact CG2-CD1 3.48Å; V352-I359 VanDerWaalsContact CG2-CD1 3.48Å
353W80.9Confident83.1Confident223 Ų22371 Ų7185%0.84540%0.404SS*.Hα-helixtrans-60.2-36.4-178.9-173.3-95.5000112.8L349 G355L349-W353 WeakPolarHBondContact O-CB 3.37Å; L349-W353 PolarHBondContact O-N 2.81Å; W353-G355 PolarHBondContact O-N 2.98Å
354N81.3Confident83Confident98 Ų9875.2 Ų75.252%0.52443%0.428SS..THydrogen-bonded Turntrans-82.63.7179.1-67.9-6.7000113.7H350 T351 V352 N356H350-N354 PolarHBondContact CE1-ND2 2.69Å; H350-N354 PolarHBondContact ND1-ND2 3.04Å; H350-N354 VanDerWaalsContact O-CG 3.31Å; H350-N354 PolarHBondContact O-N 3.21Å; T351-N354 PolarHBondContact O-N 3.05Å; V352-N354 VanDerWaalsContact C-N 3.25Å; V352-N354 PolarHBondContact O-N 3.08Å; N354-N356 PolarHBondContact O-N 2.82Å
355G75.3Confident82.8Confident68 Ų6876.5 Ų76.570%0.70144%0.435SS*.THydrogen-bonded Turntrans64.922.117900000114.3T351 V352 W353T351-G355 PolarHBondContact O-N 2.95Å; V352-G355 PolarHBondContact O-N 3.35Å; W353-G355 PolarHBondContact O-N 2.98Å
356N74.6Confident82.6Confident72 Ų7272.7 Ų72.739%0.38541%0.412SS..  trans-83.9123.3-176-167.418.5000110.6T351 N354 M358 I359T351-N356 PolarHBondContact O-N 3.37Å; N354-N356 PolarHBondContact O-N 2.82Å; N356-M358 PolarHBondContact O-N 3.03Å; N356-I359 VanDerWaalsContact O-CG1 3.3Å; N356-I359 WeakPolarHBondContact O-CG1 3.37Å
357G69.8Low82.5Confident81 Ų8175.3 Ų75.384%0.83543%0.426SS*.THydrogen-bonded Turntrans-72.2-3.7-178.100000115.5I359G357-I359 PolarHBondContact O-N 2.82Å
358M77.3Confident82.6Confident97 Ų9775.4 Ų75.448%0.47843%0.433SS..THydrogen-bonded Turntrans-92.616.9-171.5-126.9166.169.200114.7N356 G360 F361 Q362N356-M358 PolarHBondContact O-N 3.03Å; M358-G360 PolarHBondContact O-N 3.48Å; M358-F361 HydrophobicContact CE-CD1 4.06Å; M358-F361 HydrophobicContact CG-CB 4.17Å; M358-F361 PolarHBondContact O-N 3.33Å; M358-Q362 PolarHBondContact O-N 3.27Å; M358-Q362 VanDerWaalsContact O-N 3.16Å
359I81.7Confident82.7Confident48 Ų4873.5 Ų73.525%0.24642%0.421CS..Hα-helixtrans-54.8-49.6-175-54.4168.1000111.2V348 V352 N356 G357 F361 Q362 V363V348-I359 HydrophobicContact CG1-CG2 4.18Å; V348-I359 HydrophobicContact CG2-CG2 4.22Å; V352-I359 HydrophobicContact CB-CD1 4.38Å; V352-I359 HydrophobicContact CG2-CD1 3.48Å; V352-I359 VanDerWaalsContact CG2-CD1 3.48Å; N356-I359 VanDerWaalsContact O-CG1 3.3Å; N356-I359 WeakPolarHBondContact O-CG1 3.37Å; G357-I359 PolarHBondContact O-N 2.82Å; I359-F361 VanDerWaalsContact C-N 3.27Å; I359-F361 PolarHBondContact O-N 2.92Å; I359-Q362 PolarHBondContact O-N 3.34Å; I359-V363 HydrophobicContact CG2-CG2 4.24Å; I359-V363 WeakPolarHBondContact O-CG2 3.24Å; I359-V363 PolarHBondContact O-N 3.46Å
360G79.9Confident82.9Confident56 Ų5669.2 Ų69.258%0.57740%0.398SS*.Hα-helixtrans-59.1-39.6-177.200000112.6M358 L364M358-G360 PolarHBondContact O-N 3.48Å; G360-L364 VanDerWaalsContact O-CB 3.31Å; G360-L364 WeakPolarHBondContact O-CB 3.21Å; G360-L364 PolarHBondContact O-N 3.46Å
361F82.9Confident83.2Confident113 Ų11366.8 Ų66.850%0.49639%0.394SS..Hα-helixtrans-67.3-47177.6-176.8-107.3000111.6M358 I359 V363 L364 L365M358-F361 HydrophobicContact CE-CD1 4.06Å; M358-F361 HydrophobicContact CG-CB 4.17Å; M358-F361 PolarHBondContact O-N 3.33Å; I359-F361 VanDerWaalsContact C-N 3.27Å; I359-F361 PolarHBondContact O-N 2.92Å; F361-V363 PolarHBondContact O-N 3.02Å; F361-L364 WeakPolarHBondContact O-CB 3.34Å; F361-L364 PolarHBondContact O-N 3.02Å; F361-L365 HydrophobicContact CD1-CD1 4Å; F361-L365 HydrophobicContact CD1-CG 4.35Å; F361-L365 HydrophobicContact CE1-CD1 3.49Å; F361-L365 VanDerWaalsContact CE1-CD1 3.49Å; F361-L365 HydrophobicContact CE1-CD2 4.39Å; F361-L365 HydrophobicContact CE1-CG 4.08Å; F361-L365 HydrophobicContact CE2-CD2 4.11Å; F361-L365 HydrophobicContact CE2-CG 4.45Å; F361-L365 HydrophobicContact CZ-CD1 3.85Å; F361-L365 HydrophobicContact CZ-CD2 3.94Å; F361-L365 HydrophobicContact CZ-CG 4.13Å; F361-L365 WeakPolarHBondContact O-CG 3.25Å; F361-L365 PolarHBondContact O-N 2.92Å
362Q82.2Confident83.7Confident54 Ų5468.4 Ų68.425%0.25240%0.402SS..Hα-helixtrans-64.9-37.1-179.7-71.6179.9-42.500113.3L347 M358 I359 S366L347-Q362 HydrophobicContact CD2-CB 4.27Å; M358-Q362 PolarHBondContact O-N 3.27Å; M358-Q362 VanDerWaalsContact O-N 3.16Å; I359-Q362 PolarHBondContact O-N 3.34Å; Q362-S366 PolarHBondContact O-N 3.34Å; Q362-S366 PolarHBondContact O-OG 3.29Å
363V86.4Confident84.1Confident31 Ų3164.3 Ų64.319%0.18838%0.377CS..Hα-helixtrans-64.9-45.4173172.90000110.6I344 V348 I359 F361 L365 S366 I367I344-V363 HydrophobicContact CG2-CG1 4.19Å; V348-V363 HydrophobicContact CG2-CG2 3.27Å; I359-V363 HydrophobicContact CG2-CG2 4.24Å; I359-V363 WeakPolarHBondContact O-CG2 3.24Å; I359-V363 PolarHBondContact O-N 3.46Å; F361-V363 PolarHBondContact O-N 3.02Å; V363-L365 VanDerWaalsContact C-N 3.32Å; V363-L365 PolarHBondContact O-N 3.29Å; V363-S366 PolarHBondContact O-N 3.33Å; V363-I367 HydrophobicContact CG1-CD1 3.62Å; V363-I367 HydrophobicContact CG1-CG1 4.31Å; V363-I367 WeakPolarHBondContact O-CG1 3.42Å; V363-I367 PolarHBondContact O-N 3.49Å
364L87.2Confident84.7Confident118 Ų11855.5 Ų55.562%0.61835%0.346SS*.Hα-helixtrans-59.8-43178.1-174.567.7000111.5G360 F361 G368G360-L364 VanDerWaalsContact O-CB 3.31Å; G360-L364 WeakPolarHBondContact O-CB 3.21Å; G360-L364 PolarHBondContact O-N 3.46Å; F361-L364 WeakPolarHBondContact O-CB 3.34Å; F361-L364 PolarHBondContact O-N 3.02Å; L364-G368 PolarHBondContact O-N 3.44Å
365L85.7Confident85.4Confident52 Ų5254.7 Ų54.727%0.27235%0.345SS..Hα-helixtrans-62.7-46.9175.7-62.6-175.8000111.5F161 F361 V363 I367 G368 E369F161-L365 HydrophobicContact CD1-CB 4Å; F161-L365 HydrophobicContact CD1-CD1 4.35Å; F161-L365 HydrophobicContact CD1-CD2 3.65Å; F161-L365 HydrophobicContact CD1-CG 4.18Å; F161-L365 HydrophobicContact CE1-CB 3.96Å; F161-L365 HydrophobicContact CE1-CD2 3.55Å; F161-L365 HydrophobicContact CE1-CG 4.26Å; F361-L365 HydrophobicContact CD1-CD1 4Å; F361-L365 HydrophobicContact CD1-CG 4.35Å; F361-L365 HydrophobicContact CE1-CD1 3.49Å; F361-L365 VanDerWaalsContact CE1-CD1 3.49Å; F361-L365 HydrophobicContact CE1-CD2 4.39Å; F361-L365 HydrophobicContact CE1-CG 4.08Å; F361-L365 HydrophobicContact CE2-CD2 4.11Å; F361-L365 HydrophobicContact CE2-CG 4.45Å; F361-L365 HydrophobicContact CZ-CD1 3.85Å; F361-L365 HydrophobicContact CZ-CD2 3.94Å; F361-L365 HydrophobicContact CZ-CG 4.13Å; F361-L365 WeakPolarHBondContact O-CG 3.25Å; F361-L365 PolarHBondContact O-N 2.92Å; V363-L365 VanDerWaalsContact C-N 3.32Å; V363-L365 PolarHBondContact O-N 3.29Å; L365-I367 VanDerWaalsContact C-N 3.35Å; L365-I367 PolarHBondContact O-N 3.47Å; L365-G368 WeakPolarHBondContact O-CA 3.09Å; L365-G368 PolarHBondContact O-N 3.04Å; L365-G368 VanDerWaalsContact O-N 3.11Å; L365-E369 WeakPolarHBondContact O-CG 3.29Å; L365-E369 PolarHBondContact O-N 2.91Å
366S86.7Confident86.3Confident10 Ų1052.9 Ų52.97%0.0732%0.318CS..Hα-helixtrans-62.3-41.4-179.2-59.50000112.4L347 Q362 V363 L370L347-S366 VanDerWaalsContact CD2-OG 3.25Å; L347-S366 WeakPolarHBondContact CD2-OG 3.44Å; Q362-S366 PolarHBondContact O-N 3.34Å; Q362-S366 PolarHBondContact O-OG 3.29Å; V363-S366 PolarHBondContact O-N 3.33Å; S366-L370 PolarHBondContact O-N 3.19Å; S366-L370 VanDerWaalsContact O-N 3.13Å
367I89.2Confident87.3Confident76 Ų7649.4 Ų49.439%0.3930%0.3SS..Hα-helixtrans-67.6-39174.5-66.5171.4000110.5I344 V363 L365 L370 S371I344-I367 HydrophobicContact CD1-CG1 3.86Å; V363-I367 HydrophobicContact CG1-CD1 3.62Å; V363-I367 HydrophobicContact CG1-CG1 4.31Å; V363-I367 WeakPolarHBondContact O-CG1 3.42Å; V363-I367 PolarHBondContact O-N 3.49Å; L365-I367 VanDerWaalsContact C-N 3.35Å; L365-I367 PolarHBondContact O-N 3.47Å; I367-L370 PolarHBondContact O-N 2.95Å; I367-S371 VanDerWaalsContact O-CB 3.28Å; I367-S371 WeakPolarHBondContact O-CB 3.34Å; I367-S371 PolarHBondContact O-N 2.87Å; I367-S371 PolarHBondContact O-OG 3.02Å
368G89.8Confident88.5Confident28 Ų2848.9 Ų48.929%0.28928%0.278SS..Hα-helixtrans-60.4-47176.200000112.6L364 L365 S371 L372L364-G368 PolarHBondContact O-N 3.44Å; L365-G368 WeakPolarHBondContact O-CA 3.09Å; L365-G368 PolarHBondContact O-N 3.04Å; L365-G368 VanDerWaalsContact O-N 3.11Å; G368-S371 PolarHBondContact O-N 3.43Å; G368-L372 WeakPolarHBondContact O-CB 3.36Å; G368-L372 PolarHBondContact O-N 3.4Å
369E89Confident89.4Confident8 Ų848.1 Ų48.14%0.03728%0.279CS..Hα-helixtrans-62.5-45.2176.5-68.6177.7161.500111.9I157 F161 R170 H171 L365 S371 L372 A373I157-E369 HydrophobicContact CG2-CG 4.17Å; F161-E369 HydrophobicContact CD1-CG 4.07Å; F161-E369 HydrophobicContact CD2-CG 3.77Å; F161-E369 HydrophobicContact CE1-CG 3.97Å; F161-E369 HydrophobicContact CE2-CG 3.65Å; F161-E369 HydrophobicContact CG-CG 4Å; F161-E369 HydrophobicContact CZ-CG 3.76Å; R170-E369 IonicContact CZ-OE2 3.66Å; R170-E369 IonicContact NH1-OE2 3.3Å; R170-E369 PolarHBondContact NH1-OE2 3.09Å; R170-E369 IonicContact NH2-OE1 2.66Å; R170-E369 IonicContact NH2-OE2 3.05Å; R170-E369 PolarHBondContact NH2-OE2 2.75Å; H171-E369 WeakPolarHBondContact NE2-CB 3.39Å; H171-E369 IonicContact NE2-OE2 3.2Å; L365-E369 WeakPolarHBondContact O-CG 3.29Å; L365-E369 PolarHBondContact O-N 2.91Å; E369-S371 PolarHBondContact O-N 3.41Å; E369-L372 PolarHBondContact O-N 2.96Å; E369-A373 WeakPolarHBondContact O-CB 3.32Å; E369-A373 PolarHBondContact O-N 3.4Å
370L90.4Very high90.1Very high20 Ų2046.4 Ų46.411%0.10527%0.271CS..Hα-helixtrans-60.8-45.3175.6176.960.7000111.8V174 E340 S366 I367 L372 A373 I374V174-L370 HydrophobicContact CG1-CD1 4.07Å; V174-L370 HydrophobicContact CG2-CD1 4.49Å; E340-L370 HydrophobicContact CB-CD1 4.17Å; E340-L370 HydrophobicContact CB-CD2 4.01Å; E340-L370 HydrophobicContact CG-CD1 3.76Å; S366-L370 PolarHBondContact O-N 3.19Å; S366-L370 VanDerWaalsContact O-N 3.13Å; I367-L370 PolarHBondContact O-N 2.95Å; L370-L372 VanDerWaalsContact C-N 3.34Å; L370-L372 PolarHBondContact O-N 3.49Å; L370-A373 PolarHBondContact O-N 2.97Å; L370-I374 HydrophobicContact CD1-CD1 4.1Å; L370-I374 HydrophobicContact CD1-CG1 4.41Å; L370-I374 HydrophobicContact CG-CD1 4.1Å; L370-I374 WeakPolarHBondContact O-CG1 3.45Å; L370-I374 PolarHBondContact O-N 3.37Å
371S91.8Very high90.8Very high57 Ų5743.8 Ų43.840%0.39924%0.243SC..Hα-helixtrans-63-43.6179.8-58.60000110.9I367 G368 E369 I374 V375I367-S371 VanDerWaalsContact O-CB 3.28Å; I367-S371 WeakPolarHBondContact O-CB 3.34Å; I367-S371 PolarHBondContact O-N 2.87Å; I367-S371 PolarHBondContact O-OG 3.02Å; G368-S371 PolarHBondContact O-N 3.43Å; E369-S371 PolarHBondContact O-N 3.41Å; S371-I374 PolarHBondContact O-N 2.96Å; S371-V375 VanDerWaalsContact O-CG2 3.29Å; S371-V375 WeakPolarHBondContact O-CG2 3.38Å; S371-V375 PolarHBondContact O-N 3.23Å
372L92.4Very high91.4Very high41 Ų4142.3 Ų42.322%0.21524%0.241CC..Hα-helixtrans-61.1-44.2175.2-178.665.9000111.6L153 V156 I157 G368 E369 L370 I374 V375 I376L153-L372 HydrophobicContact CD1-CD2 4.27Å; L153-L372 HydrophobicContact CD1-CG 4.05Å; V156-L372 HydrophobicContact CB-CD2 4.46Å; V156-L372 HydrophobicContact CG1-CD2 3.7Å; I157-L372 HydrophobicContact CG1-CD2 3.94Å; G368-L372 WeakPolarHBondContact O-CB 3.36Å; G368-L372 PolarHBondContact O-N 3.4Å; E369-L372 PolarHBondContact O-N 2.96Å; L370-L372 VanDerWaalsContact C-N 3.34Å; L370-L372 PolarHBondContact O-N 3.49Å; L372-I374 PolarHBondContact O-N 3.21Å; L372-V375 PolarHBondContact O-N 2.9Å; L372-I376 HydrophobicContact CD1-CD1 3.87Å; L372-I376 HydrophobicContact CD1-CG1 4.2Å; L372-I376 HydrophobicContact CG-CD1 4Å; L372-I376 WeakPolarHBondContact O-CG1 3.17Å; L372-I376 PolarHBondContact O-N 3.48Å
373A92.6Very high92Very high0 Ų045.1 Ų45.10%026%0.256CS..Hα-helixtrans-59.3-44.6177.200000112.1L153 H171 E369 L370 A377L153-A373 HydrophobicContact CD1-CB 4.12Å; L153-A373 HydrophobicContact CD2-CB 3.82Å; H171-A373 HydrophobicContact CB-CB 3.69Å; E369-A373 WeakPolarHBondContact O-CB 3.32Å; E369-A373 PolarHBondContact O-N 3.4Å; L370-A373 PolarHBondContact O-N 2.97Å; A373-A377 VanDerWaalsContact O-CB 3.24Å; A373-A377 WeakPolarHBondContact O-CB 3.47Å; A373-A377 PolarHBondContact O-N 3.29Å
374I93.1Very high92.4Very high37 Ų3743.6 Ų43.619%0.1925%0.247CC..Hα-helixtrans-64.9-45.3176.9-66.7168.2000110.7V174 Y178 L337 L370 S371 L372 I376 A377 L378V174-I374 HydrophobicContact CG1-CD1 4.31Å; V174-I374 HydrophobicContact CG1-CG1 3.77Å; Y178-I374 HydrophobicContact CD2-CG1 4.47Å; L337-I374 HydrophobicContact CD2-CD1 4.31Å; L370-I374 HydrophobicContact CD1-CD1 4.1Å; L370-I374 HydrophobicContact CD1-CG1 4.41Å; L370-I374 HydrophobicContact CG-CD1 4.1Å; L370-I374 WeakPolarHBondContact O-CG1 3.45Å; L370-I374 PolarHBondContact O-N 3.37Å; S371-I374 PolarHBondContact O-N 2.96Å; L372-I374 PolarHBondContact O-N 3.21Å; I374-I376 PolarHBondContact O-N 3.38Å; I374-A377 PolarHBondContact O-N 3.37Å; I374-L378 HydrophobicContact CG2-CD1 3.81Å; I374-L378 HydrophobicContact CG2-CG 4.18Å; I374-L378 WeakPolarHBondContact O-CB 3.24Å; I374-L378 VanDerWaalsContact O-CG 3.27Å; I374-L378 WeakPolarHBondContact O-CG 3.49Å; I374-L378 PolarHBondContact O-N 3.39Å
375V95.3Very high92.7Very high82 Ų8238 Ų3850%0.49722%0.218SC..Hα-helixtrans-61.4-46.5179.8169.70000111.3S371 L372 L378 T379S371-V375 VanDerWaalsContact O-CG2 3.29Å; S371-V375 WeakPolarHBondContact O-CG2 3.38Å; S371-V375 PolarHBondContact O-N 3.23Å; L372-V375 PolarHBondContact O-N 2.9Å; V375-L378 PolarHBondContact O-N 3.43Å; V375-T379 HydrophobicContact CG1-CG2 4.36Å; V375-T379 WeakPolarHBondContact O-CB 3.45Å; V375-T379 VanDerWaalsContact O-CG2 3.29Å; V375-T379 WeakPolarHBondContact O-CG2 3.37Å; V375-T379 PolarHBondContact O-N 3.32Å; V375-T379 PolarHBondContact O-OG1 3.32Å
376I94.6Very high93Very high29 Ų2940.3 Ų40.315%0.14923%0.23CC..Hα-helixtrans-65.6-40.9177.8-64.6179.2000110.2A149 L153 F175 L372 I374 L378 T379 S380A149-I376 HydrophobicContact CB-CG2 4.45Å; L153-I376 HydrophobicContact CB-CD1 4.24Å; L153-I376 HydrophobicContact CD1-CD1 3.77Å; F175-I376 HydrophobicContact CE2-CG2 4.01Å; L372-I376 HydrophobicContact CD1-CD1 3.87Å; L372-I376 HydrophobicContact CD1-CG1 4.2Å; L372-I376 HydrophobicContact CG-CD1 4Å; L372-I376 WeakPolarHBondContact O-CG1 3.17Å; L372-I376 PolarHBondContact O-N 3.48Å; I374-I376 PolarHBondContact O-N 3.38Å; I376-L378 PolarHBondContact O-N 2.93Å; I376-T379 WeakPolarHBondContact CA-OG1 3.35Å; I376-T379 PolarHBondContact O-OG1 2.65Å; I376-S380 VanDerWaalsContact O-CB 3.27Å; I376-S380 WeakPolarHBondContact O-CB 3.4Å; I376-S380 PolarHBondContact O-N 2.7Å; I376-S380 PolarHBondContact O-OG 2.88Å
377A94.6Very high93.3Very high0 Ų042.9 Ų42.90%024%0.243CC..Hα-helixtrans-60.5-46.1176.600000112.8F175 F179 A373 I374 G381F175-A377 HydrophobicContact CD2-CB 3.63Å; F175-A377 HydrophobicContact CE2-CB 3.96Å; F175-A377 HydrophobicContact CG-CB 4.22Å; F175-A377 WeakPolarHBondContact O-CB 3.47Å; F179-A377 HydrophobicContact CB-CB 4.35Å; A373-A377 VanDerWaalsContact O-CB 3.24Å; A373-A377 WeakPolarHBondContact O-CB 3.47Å; A373-A377 PolarHBondContact O-N 3.29Å; I374-A377 PolarHBondContact O-N 3.37Å; A377-G381 WeakPolarHBondContact O-CA 3.32Å; A377-G381 PolarHBondContact O-N 3Å
378L95.1Very high93.3Very high70 Ų7039.3 Ų39.337%0.36622%0.224SC..Hα-helixtrans-67.8-45.7179.5-68.3176.9000111.7Y178 T182 I374 V375 I376 L382Y178-L378 HydrophobicContact CD1-CD2 4.08Å; T182-L378 VanDerWaalsContact OG1-CD2 3.24Å; T182-L378 WeakPolarHBondContact OG1-CD2 3.38Å; I374-L378 HydrophobicContact CG2-CD1 3.81Å; I374-L378 HydrophobicContact CG2-CG 4.18Å; I374-L378 WeakPolarHBondContact O-CB 3.24Å; I374-L378 VanDerWaalsContact O-CG 3.27Å; I374-L378 WeakPolarHBondContact O-CG 3.49Å; I374-L378 PolarHBondContact O-N 3.39Å; V375-L378 PolarHBondContact O-N 3.43Å; I376-L378 PolarHBondContact O-N 2.93Å; L378-L382 VanDerWaalsContact O-CB 3.24Å; L378-L382 WeakPolarHBondContact O-CB 3.45Å; L378-L382 PolarHBondContact O-N 3.11Å
379T96.3Very high93.1Very high81 Ų8141.7 Ų41.750%0.49723%0.23SC..Hα-helixtrans-67.7-48.2-177.9510000112V375 I376 L382 L383V375-T379 HydrophobicContact CG1-CG2 4.36Å; V375-T379 WeakPolarHBondContact O-CB 3.45Å; V375-T379 VanDerWaalsContact O-CG2 3.29Å; V375-T379 WeakPolarHBondContact O-CG2 3.37Å; V375-T379 PolarHBondContact O-N 3.32Å; V375-T379 PolarHBondContact O-OG1 3.32Å; I376-T379 WeakPolarHBondContact CA-OG1 3.35Å; I376-T379 PolarHBondContact O-OG1 2.65Å; T379-L382 PolarHBondContact O-N 2.94Å; T379-L383 WeakPolarHBondContact O-CB 3.32Å; T379-L383 PolarHBondContact O-N 2.85Å
380S96.4Very high93Very high12 Ų1245 Ų458%0.08425%0.248CC..Hα-helixtrans-68.5-34.9176.563.40000112.2F179 I376 L383 T384F179-S380 VanDerWaalsContact CD2-OG 3.3Å; F179-S380 WeakPolarHBondContact CD2-OG 3.44Å; F179-S380 VanDerWaalsContact CE2-C 3.47Å; F179-S380 WeakPolarHBondContact CE2-OG 3.22Å; I376-S380 VanDerWaalsContact O-CB 3.27Å; I376-S380 WeakPolarHBondContact O-CB 3.4Å; I376-S380 PolarHBondContact O-N 2.7Å; I376-S380 PolarHBondContact O-OG 2.88Å; S380-L383 PolarHBondContact O-N 3.41Å; S380-T384 VanDerWaalsContact O-CB 3.3Å; S380-T384 WeakPolarHBondContact O-CB 3.2Å; S380-T384 PolarHBondContact O-N 3.11Å; S380-T384 PolarHBondContact O-OG1 3.06Å
381G95.4Very high92.4Very high0 Ų053.6 Ų53.60%029%0.285CS..Hα-helixtrans-66.5-39.4174.500000112.7V183 A377 T384 G385V183-G381 WeakPolarHBondContact CG2-O 3.31Å; A377-G381 WeakPolarHBondContact O-CA 3.32Å; A377-G381 PolarHBondContact O-N 3Å; G381-T384 PolarHBondContact O-N 3.36Å; G381-G385 PolarHBondContact O-N 3.29Å
382L95.2Very high91.9Very high83 Ų8357.1 Ų57.144%0.43530%0.298SS..Hα-helixtrans-64.6-48.3174.1179.866.1000110.8T182 L378 T379 T384 G385 L386T182-L382 HydrophobicContact CG2-CB 3.95Å; L378-L382 VanDerWaalsContact O-CB 3.24Å; L378-L382 WeakPolarHBondContact O-CB 3.45Å; L378-L382 PolarHBondContact O-N 3.11Å; T379-L382 PolarHBondContact O-N 2.94Å; L382-T384 VanDerWaalsContact C-N 3.32Å; L382-T384 PolarHBondContact O-N 3Å; L382-G385 PolarHBondContact O-N 3.2Å; L382-L386 HydrophobicContact CD1-CD1 4.49Å; L382-L386 HydrophobicContact CG-CD1 4.29Å; L382-L386 VanDerWaalsContact O-CG 3.31Å; L382-L386 WeakPolarHBondContact O-CG 3.39Å; L382-L386 PolarHBondContact O-N 2.78Å
383L95.4Very high91.2Very high112 Ų11258.2 Ų58.259%0.58630%0.299SS*.Hα-helixtrans-57.2-47.5176.4179.565.4000111.1T379 S380 L386 L387T379-L383 WeakPolarHBondContact O-CB 3.32Å; T379-L383 PolarHBondContact O-N 2.85Å; S380-L383 PolarHBondContact O-N 3.41Å; L383-L386 PolarHBondContact O-N 3.21Å; L383-L387 WeakPolarHBondContact O-CB 3.35Å; L383-L387 PolarHBondContact O-N 3.47Å
384T95.4Very high90.3Very high0 Ų065.5 Ų65.50%033%0.331CS..Hα-helixtrans-62.1-48177.8-570000110.6M142 V145 F179 V183 S380 G381 L382 L386 L387 L388M142-T384 HydrophobicContact CB-CG2 4.36Å; M142-T384 HydrophobicContact CG-CG2 4.36Å; V145-T384 WeakPolarHBondContact CG1-OG1 3.08Å; F179-T384 HydrophobicContact CE1-CG2 4.44Å; F179-T384 HydrophobicContact CZ-CG2 3.93Å; F179-T384 WeakPolarHBondContact CZ-OG1 3.39Å; V183-T384 HydrophobicContact CG2-CG2 3.95Å; S380-T384 VanDerWaalsContact O-CB 3.3Å; S380-T384 WeakPolarHBondContact O-CB 3.2Å; S380-T384 PolarHBondContact O-N 3.11Å; S380-T384 PolarHBondContact O-OG1 3.06Å; G381-T384 PolarHBondContact O-N 3.36Å; L382-T384 VanDerWaalsContact C-N 3.32Å; L382-T384 PolarHBondContact O-N 3Å; T384-L386 VanDerWaalsContact C-N 3.33Å; T384-L386 PolarHBondContact O-N 2.77Å; T384-L387 WeakPolarHBondContact O-CB 3.3Å; T384-L387 PolarHBondContact O-N 3.31Å; T384-L387 VanDerWaalsContact O-N 3.11Å; T384-L388 HydrophobicContact CG2-CD1 4.11Å; T384-L388 HydrophobicContact CG2-CG 4.08Å; T384-L388 VanDerWaalsContact O-CG 3.26Å; T384-L388 WeakPolarHBondContact O-CG 3.36Å; T384-L388 PolarHBondContact O-N 3.06Å
385G91.8Very high89.4Confident0 Ų066 Ų660%034%0.34CS..Hα-helixtrans-56.4-43.917800000113.2G381 L382 L388 N389G381-G385 PolarHBondContact O-N 3.29Å; L382-G385 PolarHBondContact O-N 3.2Å; G385-L388 PolarHBondContact O-N 3.35Å; G385-N389 WeakPolarHBondContact O-CB 3.46Å; G385-N389 PolarHBondContact O-N 2.86Å; G385-N389 VanDerWaalsContact O-N 3.09Å
386L92.4Very high88.3Confident101 Ų10162.8 Ų62.853%0.52932%0.321SS..Hα-helixtrans-64.4-43.7174.8-68.4173.3000111.8L382 L383 T384 L388 N389L382-L386 HydrophobicContact CD1-CD1 4.49Å; L382-L386 HydrophobicContact CG-CD1 4.29Å; L382-L386 VanDerWaalsContact O-CG 3.31Å; L382-L386 WeakPolarHBondContact O-CG 3.39Å; L382-L386 PolarHBondContact O-N 2.78Å; L383-L386 PolarHBondContact O-N 3.21Å; T384-L386 VanDerWaalsContact C-N 3.33Å; T384-L386 PolarHBondContact O-N 2.77Å; L386-L388 PolarHBondContact O-N 3.5Å; L386-N389 PolarHBondContact O-N 3.47Å
387L92.4Very high87.2Confident63 Ų6368.1 Ų68.133%0.3335%0.345SS..Hα-helixtrans-62.4-42.8178.1-172.670.2000111.6V141 L383 T384 N389 L390 W393V141-L387 HydrophobicContact CG1-CD2 3.33Å; V141-L387 HydrophobicContact CG1-CG 4.16Å; L383-L387 WeakPolarHBondContact O-CB 3.35Å; L383-L387 PolarHBondContact O-N 3.47Å; T384-L387 WeakPolarHBondContact O-CB 3.3Å; T384-L387 PolarHBondContact O-N 3.31Å; T384-L387 VanDerWaalsContact O-N 3.11Å; L387-N389 VanDerWaalsContact C-N 3.28Å; L387-N389 PolarHBondContact O-N 2.92Å; L387-L390 HydrophobicContact CD1-CD1 3.91Å; L387-L390 WeakPolarHBondContact O-CB 3.28Å; L387-L390 VanDerWaalsContact O-CG 3.3Å; L387-L390 WeakPolarHBondContact O-CG 3.42Å; L387-L390 PolarHBondContact O-N 2.95Å; L387-W393 PolarHBondContact O-NE1 3.33Å
388L89.3Confident86Confident1 Ų170.2 Ų70.21%0.00536%0.358CS..Hα-helixtrans-69.3-26.6178.1-63.6-168.3000112.3Q138 V141 M142 V183 L187 T384 G385 L386 L390Q138-L388 HydrophobicContact CB-CD1 4.4Å; Q138-L388 HydrophobicContact CB-CD2 3.83Å; Q138-L388 HydrophobicContact CG-CD2 4.15Å; Q138-L388 PolarHBondContact NE2-O 3.45Å; Q138-L388 VanDerWaalsContact O-CD2 3.27Å; Q138-L388 WeakPolarHBondContact O-CD2 3.49Å; V141-L388 HydrophobicContact CB-CD2 3.93Å; V141-L388 HydrophobicContact CG1-CD2 3.92Å; M142-L388 HydrophobicContact CB-CD1 4.39Å; V183-L388 HydrophobicContact CG1-CD1 3.78Å; L187-L388 HydrophobicContact CD2-CB 4.3Å; T384-L388 HydrophobicContact CG2-CD1 4.11Å; T384-L388 HydrophobicContact CG2-CG 4.08Å; T384-L388 VanDerWaalsContact O-CG 3.26Å; T384-L388 WeakPolarHBondContact O-CG 3.36Å; T384-L388 PolarHBondContact O-N 3.06Å; G385-L388 PolarHBondContact O-N 3.35Å; L386-L388 PolarHBondContact O-N 3.5Å; L388-L390 PolarHBondContact O-N 3.41Å
389N87.1Confident84.5Confident78 Ų7870.3 Ų70.342%0.41737%0.369SS..THydrogen-bonded Turntrans-77.5-5.6178.2-159.618.7000113.4C186 P188 G385 L386 L387C186-N389 PolarHBondContact O-ND2 3.36Å; P188-N389 WeakPolarHBondContact CD-OD1 3.23Å; P188-N389 WeakPolarHBondContact CG-OD1 3.23Å; G385-N389 WeakPolarHBondContact O-CB 3.46Å; G385-N389 PolarHBondContact O-N 2.86Å; G385-N389 VanDerWaalsContact O-N 3.09Å; L386-N389 PolarHBondContact O-N 3.47Å; L387-N389 VanDerWaalsContact C-N 3.28Å; L387-N389 PolarHBondContact O-N 2.92Å
390L86.1Confident83.2Confident78 Ų7869.6 Ų69.641%0.40836%0.359SS..SBendtrans-64.4136.5175.6-62.7178000111.5L387 L388 I392 W393L387-L390 HydrophobicContact CD1-CD1 3.91Å; L387-L390 WeakPolarHBondContact O-CB 3.28Å; L387-L390 VanDerWaalsContact O-CG 3.3Å; L387-L390 WeakPolarHBondContact O-CG 3.42Å; L387-L390 PolarHBondContact O-N 2.95Å; L388-L390 PolarHBondContact O-N 3.41Å; L390-I392 HydrophobicContact CD1-CD1 4.44Å; L390-I392 PolarHBondContact O-N 3.27Å; L390-W393 VanDerWaalsContact O-CD1 3.24Å; L390-W393 PolarHBondContact O-N 3.48Å
391K78.4Confident82.2Confident200 Ų20070 Ų7087%0.8736%0.359SS*.G310 helixtrans-63.1-14.6-178-67.9-176.1179.2177.60114.3W393 K394K391-W393 PolarHBondContact O-N 3.12Å; K391-K394 PolarHBondContact O-N 3.07Å
392I80.1Confident81.1Confident131 Ų13172.1 Ų72.167%0.67237%0.368SS*.G310 helixtrans-58.5-35-179.8-58165.9000110.9L390 K394L390-I392 HydrophobicContact CD1-CD1 4.44Å; L390-I392 PolarHBondContact O-N 3.27Å; I392-K394 VanDerWaalsContact C-N 3.26Å; I392-K394 PolarHBondContact O-N 2.95Å
393W77.6Confident80.2Confident64 Ų6469.5 Ų69.524%0.24235%0.354CS..G310 helixtrans-75.9-9.6-173.4-55.2114.8000114.6N135 A137 Q138 V141 L387 L390 K391 A395N135-W393 PolarHBondContact ND2-O 2.86Å; A137-W393 HydrophobicContact CB-CE3 4.16Å; Q138-W393 HydrophobicContact CG-CB 3.71Å; Q138-W393 HydrophobicContact CG-CG 3.94Å; V141-W393 HydrophobicContact CG2-CH2 3.47Å; V141-W393 VanDerWaalsContact CG2-CH2 3.47Å; V141-W393 HydrophobicContact CG2-CZ2 3.77Å; V141-W393 HydrophobicContact CG2-CZ3 3.93Å; L387-W393 PolarHBondContact O-NE1 3.33Å; L390-W393 VanDerWaalsContact O-CD1 3.24Å; L390-W393 PolarHBondContact O-N 3.48Å; K391-W393 PolarHBondContact O-N 3.12Å; W393-A395 VanDerWaalsContact C-N 3.29Å; W393-A395 PolarHBondContact O-N 3.3Å
394K75.3Confident79.5Confident153 Ų15364.3 Ų64.367%0.66533%0.327SS*.  trans4853.4-174.9-61.1178.7-178.81750111.4N135 K391 I392N135-K394 PolarHBondContact ND2-O 3.21Å; K391-K394 PolarHBondContact O-N 3.07Å; I392-K394 VanDerWaalsContact C-N 3.26Å; I392-K394 PolarHBondContact O-N 2.95Å
395A73.8Confident78.7Confident48 Ų4866.4 Ų66.440%0.39734%0.337SS..PPolyproline II helixtrans-51.7148.6177.400000111W393 H397W393-A395 VanDerWaalsContact C-N 3.29Å; W393-A395 PolarHBondContact O-N 3.3Å; A395-H397 PolarHBondContact O-N 3.26Å
396P71Confident77.8Confident15 Ų1568.1 Ų68.110%0.09735%0.348CS..PPolyproline II helixtrans-57.6140.6177.223.8-30.9000109.9K133 V398 Y401K133-P396 VanDerWaalsContact O-CG 3.26Å; K133-P396 WeakPolarHBondContact O-CG 3.43Å; P396-V398 PolarHBondContact O-N 2.92Å; P396-Y401 HydrophobicContact CG-CD1 4.28Å; P396-Y401 HydrophobicContact CG-CE1 4.08Å; P396-Y401 WeakPolarHBondContact O-CE1 3.09Å
397H71.6Confident77.1Confident141 Ų14166.1 Ų66.165%0.65334%0.335SS*.PPolyproline II helixtrans-62.4140.6175.5-167.8-86.9000109A395 A399 K400A395-H397 PolarHBondContact O-N 3.26Å; H397-A399 PolarHBondContact ND1-N 3.18Å; H397-A399 PolarHBondContact O-N 3.14Å; H397-K400 PolarHBondContact O-N 3.49Å
398V69.8Low76.5Confident44 Ų4467.3 Ų67.327%0.26734%0.335SS..G310 helixtrans-57.8-29-171.6-171.40000113.4P188 P190 P396 K400 Y401P188-V398 HydrophobicContact CB-CG2 4.34Å; P190-V398 HydrophobicContact CB-CG1 3.72Å; P190-V398 HydrophobicContact CG-CG1 3.85Å; P396-V398 PolarHBondContact O-N 2.92Å; V398-K400 PolarHBondContact O-N 2.94Å; V398-Y401 HydrophobicContact CB-CE1 4.5Å; V398-Y401 HydrophobicContact CB-CE2 4.29Å; V398-Y401 HydrophobicContact CG1-CD2 3.89Å; V398-Y401 HydrophobicContact CG1-CE2 3.65Å; V398-Y401 HydrophobicContact CG1-CG 4.49Å; V398-Y401 HydrophobicContact CG2-CE1 4.49Å; V398-Y401 HydrophobicContact CG2-CE2 4.36Å; V398-Y401 PolarHBondContact O-N 3.38Å
399A63.8Low76Confident72 Ų7276.8 Ų76.860%0.59538%0.376SS*.G310 helixtrans-67.1-9.9174.300000115H397H397-A399 PolarHBondContact ND1-N 3.18Å; H397-A399 PolarHBondContact O-N 3.14Å
400K68.9Low75.3Confident65 Ų6576.6 Ų76.628%0.28337%0.372SS..G310 helixtrans-120.520.7180-59.4-165.9177.3-169.30112.6H397 V398 D403 V406H397-K400 PolarHBondContact O-N 3.49Å; V398-K400 PolarHBondContact O-N 2.94Å; K400-D403 PolarHBondContact O-N 3.15Å; K400-V406 HydrophobicContact CB-CG2 3.75Å; K400-V406 HydrophobicContact CD-CG2 3.77Å; K400-V406 HydrophobicContact CG-CG2 4.42Å
401Y75.5Confident73.8Confident20 Ų2078.3 Ų78.38%0.07839%0.387CS..THydrogen-bonded Turntrans-62.3143.4172.2-74.3-3.7000110.2G132 K133 P190 P396 V398 D403G132-Y401 CarbonylContact O-C 3.5Å; G132-Y401 VanDerWaalsContact O-CA 3.31Å; G132-Y401 WeakPolarHBondContact O-CA 3.43Å; K133-Y401 HydrophobicContact CB-CD1 4.45Å; K133-Y401 HydrophobicContact CB-CD2 4.22Å; K133-Y401 HydrophobicContact CB-CE1 4.2Å; K133-Y401 HydrophobicContact CB-CE2 3.97Å; K133-Y401 HydrophobicContact CB-CG 4.45Å; K133-Y401 HydrophobicContact CD-CD2 4.38Å; K133-Y401 HydrophobicContact CD-CE2 4.15Å; K133-Y401 HydrophobicContact CG-CD2 3.75Å; K133-Y401 HydrophobicContact CG-CE2 3.82Å; K133-Y401 HydrophobicContact CG-CG 4.2Å; P190-Y401 HydrophobicContact CG-CD2 4.27Å; P190-Y401 HydrophobicContact CG-CE2 4.45Å; P396-Y401 HydrophobicContact CG-CD1 4.28Å; P396-Y401 HydrophobicContact CG-CE1 4.08Å; P396-Y401 WeakPolarHBondContact O-CE1 3.09Å; V398-Y401 HydrophobicContact CB-CE1 4.5Å; V398-Y401 HydrophobicContact CB-CE2 4.29Å; V398-Y401 HydrophobicContact CG1-CD2 3.89Å; V398-Y401 HydrophobicContact CG1-CE2 3.65Å; V398-Y401 HydrophobicContact CG1-CG 4.49Å; V398-Y401 HydrophobicContact CG2-CE1 4.49Å; V398-Y401 HydrophobicContact CG2-CE2 4.36Å; V398-Y401 PolarHBondContact O-N 3.38Å; Y401-D403 VanDerWaalsContact C-N 3.27Å; Y401-D403 PolarHBondContact O-N 3.3Å
402F72.9Confident72.7Confident45 Ų4576.4 Ų76.420%0.19738%0.381CS..THydrogen-bonded Turntrans61.129.3-178.3-46.9-82000114.6F69 R71 H72 L131 G132 K133F69-F402 HydrophobicContact CD1-CD1 4.16Å; F69-F402 HydrophobicContact CD1-CG 4.37Å; F69-F402 AromaticContact CD2-CD1 3.64Å; F69-F402 HydrophobicContact CD2-CD1 3.64Å; F69-F402 HydrophobicContact CD2-CE1 4.05Å; F69-F402 HydrophobicContact CE1-CD1 4.16Å; F69-F402 HydrophobicContact CE1-CE1 4.27Å; F69-F402 AromaticContact CE2-CD1 3.64Å; F69-F402 HydrophobicContact CE2-CD1 3.64Å; F69-F402 AromaticContact CE2-CE1 3.54Å; F69-F402 HydrophobicContact CE2-CE1 3.54Å; F69-F402 HydrophobicContact CG-CB 4.42Å; F69-F402 AromaticContact CG-CD1 3.91Å; F69-F402 HydrophobicContact CG-CD1 3.91Å; F69-F402 HydrophobicContact CG-CG 4.38Å; F69-F402 AromaticContact CZ-CD1 3.91Å; F69-F402 HydrophobicContact CZ-CD1 3.91Å; F69-F402 AromaticContact CZ-CE1 3.67Å; F69-F402 HydrophobicContact CZ-CE1 3.67Å; F69-F402 HydrophobicContact CZ-CZ 4.24Å; R71-F402 CarbonylContact C-O 3.59Å; R71-F402 WeakPolarHBondContact CB-O 3.45Å; H72-F402 HydrophobicContact CB-CB 4.3Å; L131-F402 VanDerWaalsContact O-CE1 3.23Å; L131-F402 WeakPolarHBondContact O-CE1 3.2Å; G132-F402 PolarHBondContact O-N 3.04Å; K133-F402 HydrophobicContact CG-CZ 4.22Å
403D76.5Confident71.3Confident28 Ų2875.1 Ų75.115%0.1538%0.375CS..  trans-120.7109.4178.5-170.91.1000112.7R71 K400 Y401 Q405 V406R71-D403 CarbonylContact O-C 3.48Å; K400-D403 PolarHBondContact O-N 3.15Å; Y401-D403 VanDerWaalsContact C-N 3.27Å; Y401-D403 PolarHBondContact O-N 3.3Å; D403-Q405 PolarHBondContact O-N 3.23Å; D403-Q405 VanDerWaalsContact OD1-CB 3.3Å; D403-Q405 WeakPolarHBondContact OD1-CB 3.37Å; D403-Q405 WeakPolarHBondContact OD1-CG 3.42Å; D403-Q405 PolarHBondContact OD1-N 3Å; D403-V406 HydrophobicContact CB-CG2 4.49Å; D403-V406 WeakPolarHBondContact O-CB 3.32Å; D403-V406 WeakPolarHBondContact O-CG2 3.46Å; D403-V406 PolarHBondContact O-N 3.32Å
404D79.7Confident69.7Low4 Ų475.5 Ų75.52%0.02139%0.392CS..G310 helixtrans-62.5-23.8177.9-80.3-28.3000111.8R71 H72 S73 W74 S75 V406 F407 W408 F410R71-D404 WeakPolarHBondContact O-CA 3.46Å; R71-D404 WeakPolarHBondContact O-CB 3.31Å; R71-D404 PolarHBondContact O-N 3.11Å; H72-D404 VanDerWaalsContact CA-CG 3.42Å; H72-D404 WeakPolarHBondContact CA-OD1 3.39Å; H72-D404 VanDerWaalsContact CA-OD2 3.24Å; H72-D404 WeakPolarHBondContact CA-OD2 3.38Å; H72-D404 IonicContact CD2-OD1 3.28Å; S73-D404 PolarHBondContact N-OD2 3.2Å; S73-D404 VanDerWaalsContact N-OD2 3.11Å; W74-D404 WeakPolarHBondContact CB-OD2 3.4Å; W74-D404 PolarHBondContact N-OD2 3.3Å; S75-D404 WeakPolarHBondContact CB-OD1 3.45Å; S75-D404 PolarHBondContact N-OD1 3.2Å; S75-D404 PolarHBondContact OG-OD1 2.96Å; D404-V406 PolarHBondContact O-N 2.97Å; D404-F407 PolarHBondContact O-N 3.37Å; D404-W408 HydrophobicContact CB-CG 4.48Å; D404-W408 WeakPolarHBondContact O-CB 3.35Å; D404-W408 PolarHBondContact O-N 2.93Å; D404-F410 HydrophobicContact CB-CE2 3.78Å; D404-F410 HydrophobicContact CB-CZ 3.63Å
405Q78.6Confident68Low44 Ų4474.5 Ų74.521%0.20640%0.398CS..G310 helixtrans-62.2-15.5178.9-64-173.8500113Y5 D403 F407 F410Y5-Q405 HydrophobicContact CE1-CB 4.21Å; Y5-Q405 PolarHBondContact OH-OE1 3.27Å; D403-Q405 PolarHBondContact O-N 3.23Å; D403-Q405 VanDerWaalsContact OD1-CB 3.3Å; D403-Q405 WeakPolarHBondContact OD1-CB 3.37Å; D403-Q405 WeakPolarHBondContact OD1-CG 3.42Å; D403-Q405 PolarHBondContact OD1-N 3Å; Q405-F407 VanDerWaalsContact C-N 3.31Å; Q405-F410 HydrophobicContact CB-CD2 4.45Å; Q405-F410 HydrophobicContact CG-CD2 3.81Å; Q405-F410 HydrophobicContact CG-CE2 4Å
406V73.9Confident66.5Low36 Ų3674.8 Ų74.822%0.21841%0.406CS..G310 helixtrans-68.2-33.1172.9-179.20000111.6K400 D403 D404K400-V406 HydrophobicContact CB-CG2 3.75Å; K400-V406 HydrophobicContact CD-CG2 3.77Å; K400-V406 HydrophobicContact CG-CG2 4.42Å; D403-V406 HydrophobicContact CB-CG2 4.49Å; D403-V406 WeakPolarHBondContact O-CB 3.32Å; D403-V406 WeakPolarHBondContact O-CG2 3.46Å; D403-V406 PolarHBondContact O-N 3.32Å; D404-V406 PolarHBondContact O-N 2.97Å
407F76.8Confident64.7Low59 Ų5984 Ų8426%0.25945%0.445SS..THydrogen-bonded Turntrans-116.5-28.7-170.7-54.8-66.5000113.7F79 N135 D404 Q405F79-F407 HydrophobicContact CE2-CD2 4.18Å; F79-F407 HydrophobicContact CE2-CE2 4.27Å; F79-F407 HydrophobicContact CZ-CB 4.25Å; F79-F407 HydrophobicContact CZ-CD1 4.41Å; F79-F407 AromaticContact CZ-CD2 3.96Å; F79-F407 HydrophobicContact CZ-CD2 3.96Å; F79-F407 HydrophobicContact CZ-CE2 4.43Å; F79-F407 AromaticContact CZ-CG 3.95Å; F79-F407 HydrophobicContact CZ-CG 3.95Å; N135-F407 HydrophobicContact CB-CE1 3.75Å; N135-F407 HydrophobicContact CB-CZ 3.8Å; D404-F407 PolarHBondContact O-N 3.37Å; Q405-F407 VanDerWaalsContact C-N 3.31Å
408W80.1Confident64.3Low87 Ų8781.2 Ų81.233%0.3344%0.435SS..SBendtrans-110.7146.2-170.8-60.990.7000112.3W74 S75 A78 F79 D404 F410W74-W408 HydrophobicContact CB-CD2 4.07Å; W74-W408 HydrophobicContact CB-CG 4.21Å; W74-W408 HydrophobicContact CB-CZ2 4.42Å; W74-W408 HydrophobicContact CE3-CD2 4.5Å; W74-W408 HydrophobicContact CE3-CE3 4.07Å; W74-W408 HydrophobicContact CE3-CZ3 4.24Å; S75-W408 PolarHBondContact OG-NE1 3.45Å; A78-W408 HydrophobicContact CB-CH2 3.6Å; A78-W408 HydrophobicContact CB-CZ2 3.47Å; A78-W408 VanDerWaalsContact CB-CZ2 3.47Å; F79-W408 HydrophobicContact CE1-CZ2 4.46Å; D404-W408 HydrophobicContact CB-CG 4.48Å; D404-W408 WeakPolarHBondContact O-CB 3.35Å; D404-W408 PolarHBondContact O-N 2.93Å; W408-F410 HydrophobicContact CB-CD2 4.34Å; W408-F410 HydrophobicContact CB-CE2 3.67Å; W408-F410 HydrophobicContact CB-CZ 4.03Å
409K77.9Confident64Low201 Ų20183.2 Ų83.287%0.87444%0.443SS*.  trans-85.5116.1172.9-174.3-175.5178.9-171.30108.9
410F72.9Confident64Low74 Ų7483.8 Ų83.833%0.32544%0.435SS..  trans-98.8133.7172.4-68.8-84.8000110.6D404 Q405 W408 H412D404-F410 HydrophobicContact CB-CE2 3.78Å; D404-F410 HydrophobicContact CB-CZ 3.63Å; Q405-F410 HydrophobicContact CB-CD2 4.45Å; Q405-F410 HydrophobicContact CG-CD2 3.81Å; Q405-F410 HydrophobicContact CG-CE2 4Å; W408-F410 HydrophobicContact CB-CD2 4.34Å; W408-F410 HydrophobicContact CB-CE2 3.67Å; W408-F410 HydrophobicContact CB-CZ 4.03Å; F410-H412 VanDerWaalsContact C-N 3.26Å; F410-H412 PolarHBondContact O-N 3.1Å
411P55.7Low63.8Low113 Ų11384.9 Ų84.973%0.73444%0.444SS*.SBendtrans-67.2-24.1-176.620.7-28000113.5
412H55.2Low63Low160 Ų16088.9 Ų88.974%0.74147%0.467SS*.SBendtrans-136127.7171.5-56.4-65.5000109F410 A414F410-H412 VanDerWaalsContact C-N 3.26Å; F410-H412 PolarHBondContact O-N 3.1Å; H412-A414 PolarHBondContact O-N 3.34Å; H412-A414 VanDerWaalsContact O-N 3.07Å
413L50.4Low62.4Low105 Ų10591.9 Ų91.955%0.5549%0.485SS..  trans-60.5113.4163.5-75.4160.6000105.6Y5 V415Y5-L413 WeakPolarHBondContact OH-CD2 3.1Å; L413-V415 HydrophobicContact CB-CG2 4.06Å; L413-V415 PolarHBondContact O-N 3.15Å
414A44.1Very low61.4Low71 Ų7196.4 Ų96.459%0.58751%0.509SS*.  trans-65.383.4164.600000107.1H412 G416H412-A414 PolarHBondContact O-N 3.34Å; H412-A414 VanDerWaalsContact O-N 3.07Å; A414-G416 PolarHBondContact O-N 2.92Å
415V39.6Very low59.9Low132 Ų132103.5 Ų103.580%0.855%0.546SS*.  trans-74.497164.1-179.10000104.8L413L413-V415 HydrophobicContact CB-CG2 4.06Å; L413-V415 PolarHBondContact O-N 3.15Å
416G42.4Very low58.4Low54 Ų54108.5 Ų108.556%0.55757%0.574SS**  trans79.5106.4173.500000114.6A414A414-G416 PolarHBondContact O-N 2.92Å
417F31.7Very low57Low210 Ų210115.1 Ų115.192%0.92161%0.607SS**  trans-164.40140.6-85.9-63.7000109.6

Retrieved 417 of 417 residues in 122.8 ms (Link to these results)

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