A0A089G5R6_HUMAN Loading...

C-C chemokine receptor type 5

Receptor for a number of inflammatory CC-chemokines including CCL3/MIP-1-alpha, CCL4/MIP-1-beta and RANTES and subsequently transduces a signal by increasing the intracellular calcium ion level. May play a role in the control of granulocytic lineage proliferation or differentiation. Participates in T-lymphocyte migration to the infection site by acting as a chemotactic receptor.

AlphaFold DB , UniProt , Accession A0A089G5R6, Species HUMAN (Homo sapiens, Human), Gene CCR5, Length 352 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
1M39.9Very low38.7Very low218 Ų218151 Ų151100%1.07478%0.778SS**  084.70-94.2-171.5-176.700103.5Y3M1-Y3 PolarHBondContact O-N 3.44Å
2D33.5Very low38.8Very low153 Ų153150.3 Ų150.382%0.81878%0.775SS**  trans-100.2104.8-158.4-62.4-0.5000107.7Q4D2-Q4 PolarHBondContact O-N 3.25Å
3Y40.9Very low38.8Very low222 Ų222148.4 Ų148.487%0.87177%0.767SS**  trans-72.7104169-81-91.7000108.4M1M1-Y3 PolarHBondContact O-N 3.44Å
4Q35.3Very low38.8Very low180 Ų180152.6 Ų152.684%0.84177%0.77SS**  trans-93.799.5163.1-87173.3-41.800109.1D2D2-Q4 PolarHBondContact O-N 3.25Å
5V48.1Very low39.1Very low141 Ų141156.3 Ų156.386%0.85577%0.773SS**  trans-90.2101.9156.8178.10000106.1
6S36.9Very low39.6Very low106 Ų106154.3 Ų154.374%0.74177%0.772SS**  trans-130.597.3170.160.80000109.3
7S42.1Very low40Very low85 Ų85151.9 Ų151.959%0.59477%0.774SS**  trans-144.2132.2154.5-174.50000107.4I9S7-I9 PolarHBondContact OG-N 3.2Å
8P39.3Very low40.7Very low102 Ų102153.7 Ų153.766%0.66278%0.779SS**  -131.877.9120.836.3-24.2000109.3Y10P8-Y10 HydrophobicContact CB-CD2 4.5Å; P8-Y10 HydrophobicContact CB-CE2 4.21Å; P8-Y10 PolarHBondContact O-N 3.34Å
9I38Very low41.8Very low132 Ų132151.6 Ų151.668%0.67778%0.777SS**  trans-70.8108.5141.7-62.1176.6000103.8S7 D11S7-I9 PolarHBondContact OG-N 3.2Å; I9-D11 PolarHBondContact O-N 3.02Å
10Y36.8Very low43Very low205 Ų205146.3 Ų146.380%0.80475%0.753SS**  trans-65.385.7169.9-72.2-87.6000107.6P8 I12P8-Y10 HydrophobicContact CB-CD2 4.5Å; P8-Y10 HydrophobicContact CB-CE2 4.21Å; P8-Y10 PolarHBondContact O-N 3.34Å; Y10-I12 VanDerWaalsContact C-N 3.33Å; Y10-I12 PolarHBondContact O-N 3.45Å
11D34.8Very low44.1Very low117 Ų117146.4 Ų146.463%0.62675%0.75SS**  trans-64.2100.6162.5-83.8-26.5000106.7I9 N13I9-D11 PolarHBondContact O-N 3.02Å; D11-N13 PolarHBondContact O-N 3.14Å
12I40.4Very low45.4Very low143 Ų143140.1 Ų140.173%0.73372%0.717SS**  trans-69.179.1162.1-59.1175.4000105.8Y10 Y14Y10-I12 VanDerWaalsContact C-N 3.33Å; Y10-I12 PolarHBondContact O-N 3.45Å; I12-Y14 VanDerWaalsContact C-N 3.31Å; I12-Y14 HydrophobicContact CG2-CD2 3.85Å; I12-Y14 HydrophobicContact CG2-CE2 4.2Å; I12-Y14 PolarHBondContact O-N 3.35Å
13N38.7Very low47Very low125 Ų125137.1 Ų137.167%0.66870%0.7SS**  trans-71.986.3173-86.7-41.6000109.2D11 Y15D11-N13 PolarHBondContact O-N 3.14Å; N13-Y15 PolarHBondContact O-N 3.1Å
14Y38.1Very low48.3Very low208 Ų208132.1 Ų132.182%0.81669%0.688SS**  trans-79.799.8152.2-93.3-88.7000107.7I12 T16I12-Y14 VanDerWaalsContact C-N 3.31Å; I12-Y14 HydrophobicContact CG2-CD2 3.85Å; I12-Y14 HydrophobicContact CG2-CE2 4.2Å; I12-Y14 PolarHBondContact O-N 3.35Å; Y14-T16 PolarHBondContact O-N 3.28Å
15Y43.7Very low50.1Low208 Ų208124.8 Ų124.882%0.81666%0.656SS**  trans-54.5130162.3-108.2-103.8000108.5N13N13-Y15 PolarHBondContact O-N 3.1Å
16T46.7Very low51.3Low124 Ų124123.7 Ų123.776%0.76164%0.639SS**SBendtrans90112.6177.664.60000118Y14Y14-T16 PolarHBondContact O-N 3.28Å
17S47Very low53.4Low114 Ų114124.1 Ų124.180%0.79763%0.63SS**  trans75.385.1164-370000116.6
18E51.8Low55.2Low184 Ų184125.5 Ų125.586%0.8663%0.629SS**  trans-54.6130.3158.3-74.2-173.6168.700109.3C20E18-C20 PolarHBondContact O-N 3.22Å
19P61.6Low57.2Low114 Ų114121.4 Ų121.474%0.7460%0.604SS**  trans-60.3124.3175.421.8-29.7000109.5Q21P19-Q21 PolarHBondContact O-N 3.4Å
20C67.3Low59.5Low45 Ų45116.5 Ų116.530%0.30458%0.583SS.*  trans-52.4107.3-179-1740000110.1E18 K22 C269E18-C20 PolarHBondContact O-N 3.22Å; C20-K22 PolarHBondContact O-N 3.06Å; C20-C269 HydrophobicContact CB-CB 4.07Å; C20-C269 WeakPolarHBondContact CB-SG 3.42Å; C20-C269 WeakPolarHBondContact SG-CB 2.81Å; C20-C269 CovalentContact SG-SG 2.06Å; C20-C269 PolarHBondContact SG-SG 3.16Å
21Q65.6Low61.9Low149 Ų149116.9 Ų116.970%0.69658%0.583SS**  trans-76119.6-172.9-70.7-165.4-13.200111.8P19 I23P19-Q21 PolarHBondContact O-N 3.4Å; Q21-I23 HydrophobicContact CB-CD1 4.38Å; Q21-I23 HydrophobicContact CB-CG1 4.39Å
22K67.8Low64.5Low85 Ų85116.5 Ų116.537%0.3758%0.581SS.*  trans-104.829.7-175.9-55.2-178.9-169.91790114C20 N24 V25 K26 D276C20-K22 PolarHBondContact O-N 3.06Å; K22-N24 PolarHBondContact O-N 3.48Å; K22-V25 PolarHBondContact O-N 2.91Å; K22-K26 PolarHBondContact O-N 3.26Å; K22-D276 WeakPolarHBondContact CD-OD2 3.31Å; K22-D276 WeakPolarHBondContact CE-OD2 3.23Å; K22-D276 IonicContact NZ-OD1 2.78Å; K22-D276 PolarHBondContact NZ-OD1 3.49Å; K22-D276 IonicContact NZ-OD2 2.77Å; K22-D276 PolarHBondContact NZ-OD2 3.34Å
23I65.9Low66.8Low90 Ų90110.1 Ų110.146%0.46255%0.548SS..Hα-helixtrans-57.2-44.6-166.2-60.9170.6000112.8Q21 V25 Q27Q21-I23 HydrophobicContact CB-CD1 4.38Å; Q21-I23 HydrophobicContact CB-CG1 4.39Å; I23-V25 PolarHBondContact O-N 3.08Å; I23-Q27 PolarHBondContact O-N 3.2Å
24N69.2Low69.3Low118 Ų118105.3 Ų105.363%0.63152%0.523SS*.Hα-helixtrans-66.9-33.9-175.6-67.4-13000113.2K22 I28K22-N24 PolarHBondContact O-N 3.48Å; N24-I28 WeakPolarHBondContact O-CG1 3.43Å; N24-I28 PolarHBondContact O-N 2.94Å
25V72.3Confident72Confident26 Ų2699.1 Ų99.116%0.15851%0.509CS..Hα-helixtrans-71.9-43.8-177.3-176.70000110.7K22 I23 Q27 I28 A29 Q277K22-V25 PolarHBondContact O-N 2.91Å; I23-V25 PolarHBondContact O-N 3.08Å; V25-Q27 VanDerWaalsContact C-N 3.33Å; V25-Q27 PolarHBondContact O-N 3.35Å; V25-I28 PolarHBondContact O-N 3.27Å; V25-A29 WeakPolarHBondContact O-CB 3.45Å; V25-A29 PolarHBondContact O-N 3.4Å; V25-Q277 HydrophobicContact CB-CG 4.31Å; V25-Q277 HydrophobicContact CG1-CG 3.82Å; V25-Q277 HydrophobicContact CG2-CG 3.45Å; V25-Q277 VanDerWaalsContact CG2-CG 3.45Å
26K74.6Confident74.3Confident117 Ų11791.8 Ų91.851%0.50948%0.484SS..Hα-helixtrans-62.6-40.2-180-166.6178.3179.8-176.80111.7K22 A29 A30K22-K26 PolarHBondContact O-N 3.26Å; K26-A29 PolarHBondContact O-N 2.97Å; K26-A30 VanDerWaalsContact O-CB 3.3Å; K26-A30 WeakPolarHBondContact O-CB 3.49Å; K26-A30 PolarHBondContact O-N 2.64Å
27Q80Confident76.5Confident115 Ų11586.2 Ų86.254%0.53745%0.448SS..Hα-helixtrans-67.8-40.3179-70.8179.5-4.300113.1I23 V25 A30 R31I23-Q27 PolarHBondContact O-N 3.2Å; V25-Q27 VanDerWaalsContact C-N 3.33Å; V25-Q27 PolarHBondContact O-N 3.35Å; Q27-A30 PolarHBondContact O-N 3.14Å; Q27-R31 PolarHBondContact O-N 3.16Å
28I80.2Confident78.7Confident114 Ų11483.6 Ų83.659%0.58543%0.43SS*.Hα-helixtrans-66.6-45.9176.3-66.3168.4000110N24 V25 A30 R31 L32N24-I28 WeakPolarHBondContact O-CG1 3.43Å; N24-I28 PolarHBondContact O-N 2.94Å; V25-I28 PolarHBondContact O-N 3.27Å; I28-A30 VanDerWaalsContact C-N 3.33Å; I28-A30 PolarHBondContact O-N 3.16Å; I28-R31 PolarHBondContact O-N 3.03Å; I28-L32 PolarHBondContact O-N 3.41Å
29A81.9Confident80.7Confident16 Ų1679 Ų7913%0.13241%0.411CS..Hα-helixtrans-58-43.6176.400000111.9V25 K26 R31 L32 L33 Q280V25-A29 WeakPolarHBondContact O-CB 3.45Å; V25-A29 PolarHBondContact O-N 3.4Å; K26-A29 PolarHBondContact O-N 2.97Å; A29-R31 PolarHBondContact O-N 2.74Å; A29-L32 PolarHBondContact O-N 3.08Å; A29-L33 HydrophobicContact CB-CD1 3.77Å; A29-L33 HydrophobicContact CB-CG 4.25Å; A29-L33 VanDerWaalsContact O-CB 3.27Å; A29-L33 WeakPolarHBondContact O-CB 3.48Å; A29-L33 VanDerWaalsContact O-CG 3.25Å; A29-L33 WeakPolarHBondContact O-CG 3.39Å; A29-L33 PolarHBondContact O-N 2.9Å; A29-Q280 HydrophobicContact CB-CG 4.47Å
30A84.4Confident82.2Confident29 Ų2973.9 Ų73.924%0.2438%0.378CS..Hα-helixtrans-62.5-25.9178.800000114.1K26 Q27 I28 P34 A90K26-A30 VanDerWaalsContact O-CB 3.3Å; K26-A30 WeakPolarHBondContact O-CB 3.49Å; K26-A30 PolarHBondContact O-N 2.64Å; Q27-A30 PolarHBondContact O-N 3.14Å; I28-A30 VanDerWaalsContact C-N 3.33Å; I28-A30 PolarHBondContact O-N 3.16Å; A30-P34 VanDerWaalsContact O-CD 3.29Å; A30-P34 WeakPolarHBondContact O-CD 3.5Å; A30-P34 VanDerWaalsContact O-CG 3.28Å; A30-P34 WeakPolarHBondContact O-CG 3.41Å; A30-A90 VanDerWaalsContact CA-O 3.24Å; A30-A90 WeakPolarHBondContact CA-O 3.45Å; A30-A90 WeakPolarHBondContact CB-O 3.21Å
31R88.1Confident83.5Confident213 Ų21374.4 Ų74.480%0.80438%0.375SS*.Hα-helixtrans-88.6-35.8176.4-67.4-178.4-176.9-174.71.9112.9Q27 I28 A29 P35Q27-R31 PolarHBondContact O-N 3.16Å; I28-R31 PolarHBondContact O-N 3.03Å; A29-R31 PolarHBondContact O-N 2.74Å; R31-P35 WeakPolarHBondContact O-CD 3.35Å; R31-P35 WeakPolarHBondContact O-CG 3.37Å
32L88.5Confident84.9Confident110 Ų11072 Ų7258%0.57637%0.366SS*.Hα-helixtrans-90.9-40.3-172-172.568.8000113.5I28 A29 P35 L36I28-L32 PolarHBondContact O-N 3.41Å; A29-L32 PolarHBondContact O-N 3.08Å; L32-P35 WeakPolarHBondContact O-CD 3.29Å; L32-P35 WeakPolarHBondContact O-CG 2.91Å; L32-L36 WeakPolarHBondContact O-CB 3.33Å; L32-L36 PolarHBondContact O-N 3.33Å
33L89.4Confident86.1Confident8 Ų873.8 Ų73.84%0.04237%0.374CS..Hα-helixtrans-67.9-44.7-173.2-62.1177000113.4A29 L36 Y37 A90 Q280 T284A29-L33 HydrophobicContact CB-CD1 3.77Å; A29-L33 HydrophobicContact CB-CG 4.25Å; A29-L33 VanDerWaalsContact O-CB 3.27Å; A29-L33 WeakPolarHBondContact O-CB 3.48Å; A29-L33 VanDerWaalsContact O-CG 3.25Å; A29-L33 WeakPolarHBondContact O-CG 3.39Å; A29-L33 PolarHBondContact O-N 2.9Å; L33-L36 PolarHBondContact O-N 3.45Å; L33-Y37 HydrophobicContact CB-CD2 4.41Å; L33-Y37 HydrophobicContact CB-CE2 4.16Å; L33-Y37 HydrophobicContact CD2-CE1 4.2Å; L33-Y37 VanDerWaalsContact O-CB 3.29Å; L33-Y37 WeakPolarHBondContact O-CB 3.38Å; L33-Y37 PolarHBondContact O-N 3.04Å; L33-A90 HydrophobicContact CB-CB 3.96Å; L33-A90 HydrophobicContact CD1-CB 3.93Å; L33-Q280 HydrophobicContact CD1-CG 4.37Å; L33-Q280 VanDerWaalsContact CD1-NE2 3.26Å; L33-T284 HydrophobicContact CD2-CG2 3.72Å; L33-T284 WeakPolarHBondContact CD2-OG1 3.24Å
34P92.1Very high87.4Confident24 Ų2469.5 Ų69.516%0.15635%0.352CS..Hα-helixtrans-59-48.6-177.2-22.533000115A30 L36 S38 A87 A91A30-P34 VanDerWaalsContact O-CD 3.29Å; A30-P34 WeakPolarHBondContact O-CD 3.5Å; A30-P34 VanDerWaalsContact O-CG 3.28Å; A30-P34 WeakPolarHBondContact O-CG 3.41Å; P34-L36 VanDerWaalsContact C-N 3.35Å; P34-L36 PolarHBondContact O-N 3.11Å; P34-S38 WeakPolarHBondContact O-CB 3.47Å; P34-S38 PolarHBondContact O-N 3.22Å; P34-S38 PolarHBondContact O-OG 3Å; P34-A87 HydrophobicContact CB-CB 4.48Å; P34-A91 HydrophobicContact CB-CB 4.48Å; P34-A91 HydrophobicContact CG-CB 3.72Å
35P93.1Very high88.7Confident79 Ų7967.3 Ų67.351%0.51334%0.337SS..Hα-helixtrans-66.7-36.9177.325.2-32.8000112.1R31 L32 S38 L39R31-P35 WeakPolarHBondContact O-CD 3.35Å; R31-P35 WeakPolarHBondContact O-CG 3.37Å; L32-P35 WeakPolarHBondContact O-CD 3.29Å; L32-P35 WeakPolarHBondContact O-CG 2.91Å; P35-S38 PolarHBondContact O-N 2.66Å; P35-L39 PolarHBondContact O-N 3.25Å
36L92.3Very high89.7Confident54 Ų5470.4 Ų70.428%0.28336%0.355SS..Hα-helixtrans-65.3-47.5177.7-179.962.3000111.9L32 L33 P34 S38 L39 V40 T284L32-L36 WeakPolarHBondContact O-CB 3.33Å; L32-L36 PolarHBondContact O-N 3.33Å; L33-L36 PolarHBondContact O-N 3.45Å; P34-L36 VanDerWaalsContact C-N 3.35Å; P34-L36 PolarHBondContact O-N 3.11Å; L36-S38 VanDerWaalsContact C-N 3.3Å; L36-S38 PolarHBondContact O-N 3.49Å; L36-L39 WeakPolarHBondContact O-CB 3.41Å; L36-L39 PolarHBondContact O-N 3.42Å; L36-L39 VanDerWaalsContact O-N 3.16Å; L36-V40 WeakPolarHBondContact O-CG2 3.5Å; L36-V40 PolarHBondContact O-N 2.95Å; L36-T284 HydrophobicContact CD2-CG2 3.34Å
37Y92.6Very high90.6Very high6 Ų665.5 Ų65.52%0.02434%0.339CS..Hα-helixtrans-64.3-35.7176.9-75.1-1.9000112.1L33 L39 V40 F41 V83 W86 A87 T284 M287L33-Y37 HydrophobicContact CB-CD2 4.41Å; L33-Y37 HydrophobicContact CB-CE2 4.16Å; L33-Y37 HydrophobicContact CD2-CE1 4.2Å; L33-Y37 VanDerWaalsContact O-CB 3.29Å; L33-Y37 WeakPolarHBondContact O-CB 3.38Å; L33-Y37 PolarHBondContact O-N 3.04Å; Y37-L39 VanDerWaalsContact C-N 3.34Å; Y37-L39 PolarHBondContact O-N 2.93Å; Y37-V40 PolarHBondContact O-N 2.82Å; Y37-F41 WeakPolarHBondContact O-CB 3.41Å; Y37-F41 PolarHBondContact O-N 2.8Å; Y37-V83 HydrophobicContact CD2-CG1 4.49Å; Y37-V83 HydrophobicContact CG-CG1 4.01Å; Y37-V83 WeakPolarHBondContact O-CG1 3.38Å; Y37-W86 HydrophobicContact CD2-CB 4.33Å; Y37-W86 HydrophobicContact CE2-CB 4.15Å; Y37-A87 HydrophobicContact CD2-CB 4.06Å; Y37-A87 HydrophobicContact CG-CB 4.48Å; Y37-T284 HydrophobicContact CE1-CG2 4.03Å; Y37-T284 PolarHBondContact OH-OG1 3.32Å; Y37-M287 HydrophobicContact CD1-SD 4.38Å; Y37-M287 HydrophobicContact CE1-CB 4.32Å; Y37-M287 HydrophobicContact CE1-CG 4.48Å; Y37-M287 HydrophobicContact CE1-SD 3.57Å; Y37-M287 VanDerWaalsContact CE1-SD 3.57Å; Y37-M287 HydrophobicContact CE2-SD 3.93Å; Y37-M287 PolarHBondContact OH-SD 3.26Å
38S93.5Very high91.3Very high59 Ų5960 Ų6041%0.41331%0.313SS..Hα-helixtrans-61.7-42.8172.2-59.20000111.5P34 P35 L36 F41 I42P34-S38 WeakPolarHBondContact O-CB 3.47Å; P34-S38 PolarHBondContact O-N 3.22Å; P34-S38 PolarHBondContact O-OG 3Å; P35-S38 PolarHBondContact O-N 2.66Å; L36-S38 VanDerWaalsContact C-N 3.3Å; L36-S38 PolarHBondContact O-N 3.49Å; S38-F41 PolarHBondContact O-N 3.46Å; S38-I42 VanDerWaalsContact O-CG1 3.3Å; S38-I42 WeakPolarHBondContact O-CG1 3.34Å; S38-I42 PolarHBondContact O-N 3.21Å
39L93.6Very high92Very high89 Ų8957.8 Ų57.847%0.46630%0.301SS..Hα-helixtrans-64.5-45.1176.6-165.470.7000111.9P35 L36 Y37 F41 I42 F43P35-L39 PolarHBondContact O-N 3.25Å; L36-L39 WeakPolarHBondContact O-CB 3.41Å; L36-L39 PolarHBondContact O-N 3.42Å; L36-L39 VanDerWaalsContact O-N 3.16Å; Y37-L39 VanDerWaalsContact C-N 3.34Å; Y37-L39 PolarHBondContact O-N 2.93Å; L39-F41 VanDerWaalsContact C-N 3.31Å; L39-F41 PolarHBondContact O-N 3.07Å; L39-I42 PolarHBondContact O-N 3.27Å; L39-F43 HydrophobicContact CD1-CD2 3.91Å; L39-F43 HydrophobicContact CD1-CE2 3.32Å; L39-F43 HydrophobicContact CD1-CZ 4.13Å; L39-F43 HydrophobicContact CD2-CD2 4.49Å; L39-F43 HydrophobicContact CD2-CE2 4.09Å; L39-F43 HydrophobicContact CG-CD2 3.7Å; L39-F43 HydrophobicContact CG-CE2 3.51Å; L39-F43 WeakPolarHBondContact O-CD2 3.2Å; L39-F43 PolarHBondContact O-N 3.42Å
40V93.8Very high92.4Very high6 Ų658.8 Ų58.84%0.03630%0.304CS..Hα-helixtrans-59.5-44175.1171.50000110.6L36 Y37 G44 L80 T288L36-V40 WeakPolarHBondContact O-CG2 3.5Å; L36-V40 PolarHBondContact O-N 2.95Å; Y37-V40 PolarHBondContact O-N 2.82Å; V40-G44 WeakPolarHBondContact O-CA 3.38Å; V40-G44 PolarHBondContact O-N 3.23Å; V40-L80 HydrophobicContact CG1-CD2 4.21Å; V40-T288 HydrophobicContact CG2-CG2 3.65Å
41F94.9Very high92.7Very high56 Ų5657.5 Ų57.525%0.24629%0.293CS..Hα-helixtrans-60.4-50.4177.1178.6-103.2000111.6Y37 S38 L39 F45 L80 V83 P84Y37-F41 WeakPolarHBondContact O-CB 3.41Å; Y37-F41 PolarHBondContact O-N 2.8Å; S38-F41 PolarHBondContact O-N 3.46Å; L39-F41 VanDerWaalsContact C-N 3.31Å; L39-F41 PolarHBondContact O-N 3.07Å; F41-F45 HydrophobicContact CE2-CD2 4.32Å; F41-F45 HydrophobicContact CZ-CD2 4.31Å; F41-F45 WeakPolarHBondContact O-CB 3.39Å; F41-F45 PolarHBondContact O-N 3.43Å; F41-L80 HydrophobicContact CD2-CB 4.48Å; F41-L80 VanDerWaalsContact CD2-O 3.3Å; F41-L80 WeakPolarHBondContact CD2-O 3.42Å; F41-V83 HydrophobicContact CB-CG1 4.38Å; F41-P84 HydrophobicContact CD1-CG 4.37Å; F41-P84 HydrophobicContact CD2-CG 3.71Å; F41-P84 HydrophobicContact CE1-CG 4.49Å; F41-P84 HydrophobicContact CE2-CG 3.85Å; F41-P84 HydrophobicContact CG-CG 3.99Å; F41-P84 HydrophobicContact CZ-CG 4.25Å
42I94.6Very high93Very high97 Ų9748.5 Ų48.550%0.49726%0.26SS..Hα-helixtrans-60.8-54.8-178.3-68.1164.9000110.9S38 L39 V46S38-I42 VanDerWaalsContact O-CG1 3.3Å; S38-I42 WeakPolarHBondContact O-CG1 3.34Å; S38-I42 PolarHBondContact O-N 3.21Å; L39-I42 PolarHBondContact O-N 3.27Å; I42-V46 WeakPolarHBondContact O-CB 3.2Å; I42-V46 VanDerWaalsContact O-CG2 3.29Å; I42-V46 WeakPolarHBondContact O-CG2 3.4Å; I42-V46 PolarHBondContact O-N 3.24Å; I42-V46 VanDerWaalsContact O-N 3.1Å
43F93.2Very high93.1Very high123 Ų12346.8 Ų46.854%0.53925%0.252SS..Hα-helixtrans-68.4-40.7-177.7-71.4-54.8000112.4L39 G47 C291L39-F43 HydrophobicContact CD1-CD2 3.91Å; L39-F43 HydrophobicContact CD1-CE2 3.32Å; L39-F43 HydrophobicContact CD1-CZ 4.13Å; L39-F43 HydrophobicContact CD2-CD2 4.49Å; L39-F43 HydrophobicContact CD2-CE2 4.09Å; L39-F43 HydrophobicContact CG-CD2 3.7Å; L39-F43 HydrophobicContact CG-CE2 3.51Å; L39-F43 WeakPolarHBondContact O-CD2 3.2Å; L39-F43 PolarHBondContact O-N 3.42Å; F43-G47 WeakPolarHBondContact O-CA 3.35Å; F43-G47 PolarHBondContact O-N 3.24Å; F43-C291 HydrophobicContact CB-CB 4.34Å
44G94.4Very high92.9Very high0 Ų046.4 Ų46.40%025%0.25CC..Hα-helixtrans-64.3-45.7178.300000111.9V40 N48 L80V40-G44 WeakPolarHBondContact O-CA 3.38Å; V40-G44 PolarHBondContact O-N 3.23Å; G44-N48 VanDerWaalsContact O-CB 3.29Å; G44-N48 WeakPolarHBondContact O-CB 3.32Å; G44-N48 PolarHBondContact O-N 3.2Å; G44-N48 PolarHBondContact O-ND2 2.95Å; G44-L80 WeakPolarHBondContact O-CD1 3.49Å
45F95.4Very high92.8Very high72 Ų7245.4 Ų45.432%0.31624%0.243SC..Hα-helixtrans-66.1-51-178.9-172.8-92.3000111.1F41 G47 M49 L77F41-F45 HydrophobicContact CE2-CD2 4.32Å; F41-F45 HydrophobicContact CZ-CD2 4.31Å; F41-F45 WeakPolarHBondContact O-CB 3.39Å; F41-F45 PolarHBondContact O-N 3.43Å; F45-G47 PolarHBondContact O-N 3.23Å; F45-M49 HydrophobicContact CD1-CG 4.17Å; F45-M49 HydrophobicContact CD2-CE 4.38Å; F45-M49 HydrophobicContact CE1-CE 4.31Å; F45-M49 HydrophobicContact CE1-CG 3.94Å; F45-M49 HydrophobicContact CE2-CE 3.58Å; F45-M49 HydrophobicContact CE2-CG 4.48Å; F45-M49 HydrophobicContact CZ-CE 3.54Å; F45-M49 HydrophobicContact CZ-CG 4.11Å; F45-M49 VanDerWaalsContact O-CB 3.24Å; F45-M49 WeakPolarHBondContact O-CB 3.36Å; F45-M49 WeakPolarHBondContact O-CG 3.44Å; F45-M49 PolarHBondContact O-N 3.29Å; F45-L77 HydrophobicContact CD2-CD2 3.87Å; F45-L77 HydrophobicContact CE2-CD2 4.28Å
46V94.1Very high92.6Very high91 Ų9145.4 Ų45.455%0.55224%0.238SC*.Hα-helixtrans-61.8-45.2178.9174.90000110.9I42 L50I42-V46 WeakPolarHBondContact O-CB 3.2Å; I42-V46 VanDerWaalsContact O-CG2 3.29Å; I42-V46 WeakPolarHBondContact O-CG2 3.4Å; I42-V46 PolarHBondContact O-N 3.24Å; I42-V46 VanDerWaalsContact O-N 3.1Å; V46-L50 WeakPolarHBondContact O-CB 3.41Å; V46-L50 PolarHBondContact O-N 3.08Å
47G92.7Very high92.2Very high15 Ų1547 Ų4716%0.15525%0.247CC..Hα-helixtrans-62.4-51.7-179.700000112.7F43 F45 L50 V51 P294F43-G47 WeakPolarHBondContact O-CA 3.35Å; F43-G47 PolarHBondContact O-N 3.24Å; F45-G47 PolarHBondContact O-N 3.23Å; G47-L50 WeakPolarHBondContact O-CB 3.49Å; G47-L50 PolarHBondContact O-N 2.87Å; G47-V51 WeakPolarHBondContact O-CG2 3.41Å; G47-V51 PolarHBondContact O-N 2.9Å; G47-P294 VanDerWaalsContact C-CG 3.42Å
48N94.8Very high91.7Very high0 Ų048.6 Ų48.60%026%0.258CS..Hα-helixtrans-69-36.7-178.6-74-63.7000112.2G44 L50 V51 I52 A73 L77 C290G44-N48 VanDerWaalsContact O-CB 3.29Å; G44-N48 WeakPolarHBondContact O-CB 3.32Å; G44-N48 PolarHBondContact O-N 3.2Å; G44-N48 PolarHBondContact O-ND2 2.95Å; N48-L50 VanDerWaalsContact C-N 3.32Å; N48-L50 PolarHBondContact O-N 3.42Å; N48-V51 WeakPolarHBondContact O-CB 3.33Å; N48-V51 PolarHBondContact O-N 3.47Å; N48-I52 WeakPolarHBondContact O-CG1 3.45Å; N48-I52 PolarHBondContact O-N 2.96Å; N48-A73 HydrophobicContact CB-CB 4.49Å; N48-L77 HydrophobicContact CB-CD2 3.99Å; N48-L77 HydrophobicContact CB-CG 4.1Å; N48-C290 PolarHBondContact ND2-O 3.49Å
49M94.3Very high91Very high67 Ų6747.8 Ų47.833%0.3325%0.247SC..Hα-helixtrans-61.1-41.3171.9-75-62.6177.100112F45 V51 I52 L53 L77F45-M49 HydrophobicContact CD1-CG 4.17Å; F45-M49 HydrophobicContact CD2-CE 4.38Å; F45-M49 HydrophobicContact CE1-CE 4.31Å; F45-M49 HydrophobicContact CE1-CG 3.94Å; F45-M49 HydrophobicContact CE2-CE 3.58Å; F45-M49 HydrophobicContact CE2-CG 4.48Å; F45-M49 HydrophobicContact CZ-CE 3.54Å; F45-M49 HydrophobicContact CZ-CG 4.11Å; F45-M49 VanDerWaalsContact O-CB 3.24Å; F45-M49 WeakPolarHBondContact O-CB 3.36Å; F45-M49 WeakPolarHBondContact O-CG 3.44Å; F45-M49 PolarHBondContact O-N 3.29Å; M49-V51 VanDerWaalsContact C-N 3.35Å; M49-V51 PolarHBondContact O-N 3.24Å; M49-I52 PolarHBondContact O-N 3.38Å; M49-I52 HydrophobicContact SD-CD1 4.5Å; M49-L53 WeakPolarHBondContact O-CB 3.37Å; M49-L53 VanDerWaalsContact O-CG 3.3Å; M49-L53 WeakPolarHBondContact O-CG 3.34Å; M49-L53 PolarHBondContact O-N 2.91Å; M49-L77 HydrophobicContact CE-CD1 3.44Å; M49-L77 VanDerWaalsContact CE-CD1 3.44Å; M49-L77 HydrophobicContact CE-CD2 3.93Å; M49-L77 HydrophobicContact CE-CG 4.33Å; M49-L77 HydrophobicContact CG-CD2 4.37Å; M49-L77 HydrophobicContact SD-CD1 3.87Å
50L91.1Very high90.6Very high36 Ų3652.1 Ų52.119%0.18826%0.257CS..Hα-helixtrans-64.2-40.3176.5-173.959.7000112V46 G47 N48 L53 I54 L308 F311V46-L50 WeakPolarHBondContact O-CB 3.41Å; V46-L50 PolarHBondContact O-N 3.08Å; G47-L50 WeakPolarHBondContact O-CB 3.49Å; G47-L50 PolarHBondContact O-N 2.87Å; N48-L50 VanDerWaalsContact C-N 3.32Å; N48-L50 PolarHBondContact O-N 3.42Å; L50-L53 PolarHBondContact O-N 2.71Å; L50-I54 HydrophobicContact CD1-CD1 4.13Å; L50-I54 HydrophobicContact CD1-CG1 4.41Å; L50-I54 HydrophobicContact CG-CD1 3.93Å; L50-I54 WeakPolarHBondContact O-CB 3.21Å; L50-I54 VanDerWaalsContact O-CG1 3.3Å; L50-I54 WeakPolarHBondContact O-CG1 3.39Å; L50-I54 PolarHBondContact O-N 2.9Å; L50-L308 HydrophobicContact CD2-CD2 3.64Å; L50-L308 HydrophobicContact CD2-CG 4.49Å; L50-L308 HydrophobicContact CG-CD2 4.46Å; L50-F311 HydrophobicContact CD1-CD1 3.78Å; L50-F311 HydrophobicContact CD1-CE1 3.63Å; L50-F311 HydrophobicContact CD1-CZ 4.33Å
51V91.2Very high90.3Very high2 Ų253.8 Ų53.81%0.01227%0.266CS..Hα-helixtrans-57.8-49.9173.5172.20000110.6G47 N48 M49 L53 I54 L55 A73 P294 Y297 F304G47-V51 WeakPolarHBondContact O-CG2 3.41Å; G47-V51 PolarHBondContact O-N 2.9Å; N48-V51 WeakPolarHBondContact O-CB 3.33Å; N48-V51 PolarHBondContact O-N 3.47Å; M49-V51 VanDerWaalsContact C-N 3.35Å; M49-V51 PolarHBondContact O-N 3.24Å; V51-L53 PolarHBondContact O-N 2.6Å; V51-I54 PolarHBondContact O-N 2.77Å; V51-L55 HydrophobicContact CG1-CD1 3.75Å; V51-L55 HydrophobicContact CG1-CG 4.27Å; V51-L55 WeakPolarHBondContact O-CB 3.25Å; V51-L55 VanDerWaalsContact O-CG 3.26Å; V51-L55 WeakPolarHBondContact O-CG 3.42Å; V51-L55 PolarHBondContact O-N 2.7Å; V51-A73 HydrophobicContact CB-CB 4.47Å; V51-A73 HydrophobicContact CG1-CB 4.09Å; V51-P294 HydrophobicContact CG2-CB 4.02Å; V51-P294 HydrophobicContact CG2-CG 4.14Å; V51-Y297 HydrophobicContact CG1-CD2 4.29Å; V51-Y297 HydrophobicContact CG1-CE2 4.2Å; V51-Y297 HydrophobicContact CG2-CD2 3.77Å; V51-Y297 HydrophobicContact CG2-CE2 4.22Å; V51-F304 HydrophobicContact CB-CZ 4.41Å; V51-F304 HydrophobicContact CG2-CE2 4.12Å; V51-F304 HydrophobicContact CG2-CZ 3.67Å
52I93.4Very high89.8Confident24 Ų2458.6 Ų58.612%0.12329%0.287CS..Hα-helixtrans-57.8-48.8178.2-68.3171.3000110.8N48 M49 I54 L55 I56 L70 A73 I74 L77N48-I52 WeakPolarHBondContact O-CG1 3.45Å; N48-I52 PolarHBondContact O-N 2.96Å; M49-I52 PolarHBondContact O-N 3.38Å; M49-I52 HydrophobicContact SD-CD1 4.5Å; I52-I54 VanDerWaalsContact C-N 3.34Å; I52-I54 PolarHBondContact O-N 3.01Å; I52-L55 PolarHBondContact O-N 3.32Å; I52-I56 HydrophobicContact CG2-CD1 3.68Å; I52-I56 HydrophobicContact CG2-CG1 4.47Å; I52-I56 WeakPolarHBondContact O-CG1 3.38Å; I52-I56 PolarHBondContact O-N 3.11Å; I52-L70 HydrophobicContact CB-CD1 4.28Å; I52-L70 HydrophobicContact CG1-CD1 4.01Å; I52-L70 HydrophobicContact CG2-CD1 3.95Å; I52-A73 HydrophobicContact CD1-CB 4.21Å; I52-A73 HydrophobicContact CG1-CB 3.77Å; I52-I74 HydrophobicContact CD1-CG1 4.19Å; I52-L77 HydrophobicContact CD1-CD1 3.38Å; I52-L77 HydrophobicContact CD1-CG 4.46Å
53L90.1Very high89.4Confident75 Ų7555.9 Ų55.939%0.39328%0.276SS..Hα-helixtrans-60-42.2179.5-73171.1000112.3M49 L50 V51 N57 F311M49-L53 WeakPolarHBondContact O-CB 3.37Å; M49-L53 VanDerWaalsContact O-CG 3.3Å; M49-L53 WeakPolarHBondContact O-CG 3.34Å; M49-L53 PolarHBondContact O-N 2.91Å; L50-L53 PolarHBondContact O-N 2.71Å; V51-L53 PolarHBondContact O-N 2.6Å; L53-N57 WeakPolarHBondContact O-CB 3.3Å; L53-N57 PolarHBondContact O-N 3.34Å; L53-N57 PolarHBondContact O-ND2 3.31Å; L53-F311 HydrophobicContact CB-CE2 4.48Å; L53-F311 HydrophobicContact CD1-CZ 4.3Å
54I86.8Confident89.2Confident0 Ų050.7 Ų50.70%025%0.254CS..Hα-helixtrans-67.2-42.5177.7-72.1168.1000110.9L50 V51 I52 C58 K59 F304 Y307 L308L50-I54 HydrophobicContact CD1-CD1 4.13Å; L50-I54 HydrophobicContact CD1-CG1 4.41Å; L50-I54 HydrophobicContact CG-CD1 3.93Å; L50-I54 WeakPolarHBondContact O-CB 3.21Å; L50-I54 VanDerWaalsContact O-CG1 3.3Å; L50-I54 WeakPolarHBondContact O-CG1 3.39Å; L50-I54 PolarHBondContact O-N 2.9Å; V51-I54 PolarHBondContact O-N 2.77Å; I52-I54 VanDerWaalsContact C-N 3.34Å; I52-I54 PolarHBondContact O-N 3.01Å; I54-C58 HydrophobicContact CG2-CB 4.29Å; I54-C58 WeakPolarHBondContact O-CA 3.49Å; I54-C58 VanDerWaalsContact O-CB 3.25Å; I54-C58 WeakPolarHBondContact O-CB 3.48Å; I54-C58 PolarHBondContact O-N 3.06Å; I54-K59 PolarHBondContact O-N 3.17Å; I54-F304 HydrophobicContact CB-CE2 4.08Å; I54-F304 HydrophobicContact CD1-CE1 4.36Å; I54-F304 HydrophobicContact CD1-CE2 3.73Å; I54-F304 HydrophobicContact CD1-CZ 3.64Å; I54-F304 HydrophobicContact CG2-CD2 4.06Å; I54-F304 HydrophobicContact CG2-CE2 3.85Å; I54-Y307 HydrophobicContact CG2-CG 4.36Å; I54-L308 HydrophobicContact CD1-CB 4.44Å; I54-L308 HydrophobicContact CD1-CD2 4.41Å; I54-L308 HydrophobicContact CD1-CG 3.79Å
55L88.4Confident88.9Confident2 Ų251 Ų511%0.0126%0.256CS..Iπ-helixtrans-63.5-43.1-179.8-72.5174.6000111.9V51 I52 K59 R60 L61 D66 L69 L70V51-L55 HydrophobicContact CG1-CD1 3.75Å; V51-L55 HydrophobicContact CG1-CG 4.27Å; V51-L55 WeakPolarHBondContact O-CB 3.25Å; V51-L55 VanDerWaalsContact O-CG 3.26Å; V51-L55 WeakPolarHBondContact O-CG 3.42Å; V51-L55 PolarHBondContact O-N 2.7Å; I52-L55 PolarHBondContact O-N 3.32Å; L55-K59 HydrophobicContact CD2-CD 3.75Å; L55-K59 CarbonylContact O-C 3.35Å; L55-R60 PolarHBondContact O-N 3.39Å; L55-L61 HydrophobicContact CB-CD2 3.9Å; L55-L61 PolarHBondContact O-N 2.9Å; L55-D66 HydrophobicContact CD2-CB 4.23Å; L55-L69 HydrophobicContact CD1-CB 3.92Å; L55-L69 HydrophobicContact CD2-CB 4.48Å; L55-L70 HydrophobicContact CD1-CB 4.02Å
56I88.9Confident88.6Confident80 Ų8048.3 Ų48.341%0.4124%0.244SC..Iπ-helixtrans-75.3-53.4-180-64.1173.5000111I52 R60 L61 L70I52-I56 HydrophobicContact CG2-CD1 3.68Å; I52-I56 HydrophobicContact CG2-CG1 4.47Å; I52-I56 WeakPolarHBondContact O-CG1 3.38Å; I52-I56 PolarHBondContact O-N 3.11Å; I56-R60 WeakPolarHBondContact O-CA 3.43Å; I56-R60 PolarHBondContact O-N 3.15Å; I56-L61 HydrophobicContact CG1-CD1 4.35Å; I56-L70 HydrophobicContact CD1-CD1 4.4Å; I56-L70 HydrophobicContact CG1-CD1 4.39Å
57N84.4Confident88.6Confident88 Ų8844.7 Ų44.747%0.47122%0.222SC..Iπ-helixtrans-85.5-35.6-168.2-61.9-41.1000113.7L53L53-N57 WeakPolarHBondContact O-CB 3.3Å; L53-N57 PolarHBondContact O-N 3.34Å; L53-N57 PolarHBondContact O-ND2 3.31Å
58C81.8Confident88.7Confident39 Ų3944.1 Ų44.126%0.26422%0.215SC..Iπ-helixtrans-97.1-49.1-175.5-56.30000111.8I54 Y307I54-C58 HydrophobicContact CG2-CB 4.29Å; I54-C58 WeakPolarHBondContact O-CA 3.49Å; I54-C58 VanDerWaalsContact O-CB 3.25Å; I54-C58 WeakPolarHBondContact O-CB 3.48Å; I54-C58 PolarHBondContact O-N 3.06Å; C58-Y307 HydrophobicContact CB-CD1 3.68Å; C58-Y307 HydrophobicContact CB-CE1 4.27Å; C58-Y307 HydrophobicContact CB-CG 4.2Å
59K80.2Confident88.5Confident41 Ų4145.1 Ų45.118%0.17822%0.22CC..Iπ-helixtrans-86.5-22.4-177.8-77.3177.9139.8-154.70114I54 L55 L61 D66 Y307I54-K59 PolarHBondContact O-N 3.17Å; L55-K59 HydrophobicContact CD2-CD 3.75Å; L55-K59 CarbonylContact O-C 3.35Å; K59-L61 PolarHBondContact O-N 2.85Å; K59-D66 IonicContact NZ-OD1 3.93Å; K59-D66 PolarHBondContact NZ-OD1 3.3Å; K59-Y307 HydrophobicContact CD-CD2 4.29Å; K59-Y307 HydrophobicContact CD-CE2 4.12Å; K59-Y307 HydrophobicContact CG-CD2 3.97Å; K59-Y307 HydrophobicContact CG-CE2 3.61Å
60R85.3Confident88.6Confident180 Ų18043 Ų4368%0.67921%0.21SC*.THydrogen-bonded Turntrans54.631.9179.4-54-175.5-178-177.6-0.2113.8L55 I56 K62L55-R60 PolarHBondContact O-N 3.39Å; I56-R60 WeakPolarHBondContact O-CA 3.43Å; I56-R60 PolarHBondContact O-N 3.15Å; R60-K62 HydrophobicContact CB-CG 4.37Å; R60-K62 PolarHBondContact O-N 3Å
61L86Confident88.8Confident42 Ų4242.2 Ų42.222%0.2221%0.206CC..THydrogen-bonded Turntrans47.540.1172.2-55.8174.7000115L55 I56 K59 S63 D66 I67 L70L55-L61 HydrophobicContact CB-CD2 3.9Å; L55-L61 PolarHBondContact O-N 2.9Å; I56-L61 HydrophobicContact CG1-CD1 4.35Å; K59-L61 PolarHBondContact O-N 2.85Å; L61-S63 PolarHBondContact O-N 3.03Å; L61-D66 HydrophobicContact CD2-CB 4.24Å; L61-I67 HydrophobicContact CB-CD1 3.89Å; L61-I67 HydrophobicContact CD1-CD1 4.29Å; L61-I67 HydrophobicContact CG-CD1 4.46Å; L61-L70 HydrophobicContact CD1-CD2 3.79Å; L61-L70 HydrophobicContact CD2-CB 4.18Å; L61-L70 HydrophobicContact CD2-CD2 4.02Å
62K84.3Confident89Confident157 Ų15742.2 Ų42.268%0.68321%0.206SC*.  trans-76.3-6.7-172.1-65.9-175.4179.9-172.70114.6R60R60-K62 HydrophobicContact CB-CG 4.37Å; R60-K62 PolarHBondContact O-N 3Å
63S86.2Confident89.1Confident40 Ų4041.1 Ų41.128%0.2820%0.201SC..SBendtrans-133.1151.4-177.374.20000111.8L61 T65 D66 I67L61-S63 PolarHBondContact O-N 3.03Å; S63-T65 PolarHBondContact O-N 3.48Å; S63-D66 PolarHBondContact N-OD2 2.92Å; S63-D66 WeakPolarHBondContact O-CB 3.43Å; S63-D66 PolarHBondContact O-N 2.98Å; S63-D66 PolarHBondContact OG-N 3.3Å; S63-D66 PolarHBondContact OG-OD2 3.39Å; S63-I67 PolarHBondContact O-N 3Å
64M89.2Confident89.4Confident13 Ų1340 Ų406%0.06420%0.195CC..Hα-helixtrans-53.3-38.2174.3-176.3173.7176.800112.4D66 I67 Y68 R140 F144M64-D66 PolarHBondContact O-N 3.23Å; M64-I67 WeakPolarHBondContact O-CB 3.37Å; M64-I67 PolarHBondContact O-N 2.98Å; M64-Y68 HydrophobicContact CE-CE2 3.69Å; M64-Y68 VanDerWaalsContact CE-CZ 3.49Å; M64-Y68 WeakPolarHBondContact CE-OH 3.36Å; M64-Y68 HydrophobicContact CG-CD2 4.46Å; M64-Y68 HydrophobicContact CG-CE2 3.93Å; M64-Y68 PolarHBondContact O-N 3.31Å; M64-Y68 VanDerWaalsContact O-N 3.08Å; M64-R140 HydrophobicContact SD-CB 4.02Å; M64-R140 HydrophobicContact SD-CG 4.09Å; M64-F144 HydrophobicContact CE-CD1 3.55Å; M64-F144 HydrophobicContact CE-CE1 3.92Å; M64-F144 HydrophobicContact SD-CD1 4.26Å
65T88.6Confident89.9Confident7 Ų740 Ų404%0.04320%0.195CC..Hα-helixtrans-63-40.4174.6-40.80000112.5S63 I67 Y68 L69 L122 D125 R126 R140S63-T65 PolarHBondContact O-N 3.48Å; T65-I67 VanDerWaalsContact C-N 3.25Å; T65-I67 PolarHBondContact O-N 2.86Å; T65-Y68 PolarHBondContact O-N 3.36Å; T65-L69 HydrophobicContact CG2-CD1 4.23Å; T65-L69 HydrophobicContact CG2-CG 4.43Å; T65-L69 WeakPolarHBondContact O-CG 3.1Å; T65-L69 PolarHBondContact O-N 3.02Å; T65-L122 HydrophobicContact CG2-CD2 3.58Å; T65-D125 PolarHBondContact OG1-OD2 3.5Å; T65-R126 VanDerWaalsContact CB-NH2 3.3Å; T65-R126 PolarHBondContact OG1-NH2 3.23Å; T65-R140 PolarHBondContact OG1-NH2 2.89Å
66D89.6Confident90.2Very high15 Ų1540.3 Ų40.38%0.0820%0.197CC..Hα-helixtrans-65.6-32.8178.5-61.7-48.5000110.9L55 K59 L61 S63 M64 L70L55-D66 HydrophobicContact CD2-CB 4.23Å; K59-D66 IonicContact NZ-OD1 3.93Å; K59-D66 PolarHBondContact NZ-OD1 3.3Å; L61-D66 HydrophobicContact CD2-CB 4.24Å; S63-D66 PolarHBondContact N-OD2 2.92Å; S63-D66 WeakPolarHBondContact O-CB 3.43Å; S63-D66 PolarHBondContact O-N 2.98Å; S63-D66 PolarHBondContact OG-N 3.3Å; S63-D66 PolarHBondContact OG-OD2 3.39Å; M64-D66 PolarHBondContact O-N 3.23Å; D66-L70 WeakPolarHBondContact O-CB 3.37Å; D66-L70 PolarHBondContact O-N 3.23Å
67I93.8Very high90.6Very high15 Ų1537.3 Ų37.38%0.07718%0.181CC..Hα-helixtrans-64.2-46.4172-58.5-64.7000111L61 S63 M64 T65 L70 N71 V142L61-I67 HydrophobicContact CB-CD1 3.89Å; L61-I67 HydrophobicContact CD1-CD1 4.29Å; L61-I67 HydrophobicContact CG-CD1 4.46Å; S63-I67 PolarHBondContact O-N 3Å; M64-I67 WeakPolarHBondContact O-CB 3.37Å; M64-I67 PolarHBondContact O-N 2.98Å; T65-I67 VanDerWaalsContact C-N 3.25Å; T65-I67 PolarHBondContact O-N 2.86Å; I67-L70 WeakPolarHBondContact O-CB 3.33Å; I67-L70 PolarHBondContact O-N 3.45Å; I67-N71 PolarHBondContact O-N 2.78Å; I67-N71 PolarHBondContact O-ND2 3.37Å; I67-V142 HydrophobicContact CD1-CG1 4.16Å; I67-V142 HydrophobicContact CG1-CG1 4.19Å
68Y93.8Very high91.2Very high4 Ų436.2 Ų36.22%0.01617%0.172CC..Hα-helixtrans-67.1-38.3178.4-64.5-23.8000113.1M64 T65 L70 N71 L72 F118 L121 L122 D125 T148M64-Y68 HydrophobicContact CE-CE2 3.69Å; M64-Y68 VanDerWaalsContact CE-CZ 3.49Å; M64-Y68 WeakPolarHBondContact CE-OH 3.36Å; M64-Y68 HydrophobicContact CG-CD2 4.46Å; M64-Y68 HydrophobicContact CG-CE2 3.93Å; M64-Y68 PolarHBondContact O-N 3.31Å; M64-Y68 VanDerWaalsContact O-N 3.08Å; T65-Y68 PolarHBondContact O-N 3.36Å; Y68-L70 VanDerWaalsContact C-N 3.3Å; Y68-L70 PolarHBondContact O-N 3Å; Y68-N71 PolarHBondContact O-N 3.11Å; Y68-L72 WeakPolarHBondContact O-CB 3.25Å; Y68-L72 PolarHBondContact O-N 2.69Å; Y68-F118 HydrophobicContact CD1-CD1 4.13Å; Y68-F118 HydrophobicContact CD1-CE1 4.27Å; Y68-L121 HydrophobicContact CD1-CD1 4.42Å; Y68-L121 HydrophobicContact CD2-CB 4.02Å; Y68-L121 HydrophobicContact CE1-CB 4.43Å; Y68-L121 HydrophobicContact CE1-CD1 3.94Å; Y68-L121 HydrophobicContact CE2-CB 3.79Å; Y68-L121 HydrophobicContact CG-CB 4.41Å; Y68-L122 HydrophobicContact CD2-CD2 4.35Å; Y68-D125 HydrophobicContact CD2-CB 4.3Å; Y68-D125 HydrophobicContact CE2-CB 4.12Å; Y68-T148 WeakPolarHBondContact CE1-OG1 3.46Å; Y68-T148 WeakPolarHBondContact OH-CB 3.36Å; Y68-T148 PolarHBondContact OH-OG1 2.94Å
69L91.9Very high91.7Very high20 Ų2034.7 Ų34.711%0.10516%0.161CC..Hα-helixtrans-63.8-36.8173.3-70.7171.7000111.9L55 T65 A73 L122 Y297L55-L69 HydrophobicContact CD1-CB 3.92Å; L55-L69 HydrophobicContact CD2-CB 4.48Å; T65-L69 HydrophobicContact CG2-CD1 4.23Å; T65-L69 HydrophobicContact CG2-CG 4.43Å; T65-L69 WeakPolarHBondContact O-CG 3.1Å; T65-L69 PolarHBondContact O-N 3.02Å; L69-A73 PolarHBondContact O-N 3.48Å; L69-A73 VanDerWaalsContact O-N 3.08Å; L69-L122 HydrophobicContact CD2-CD1 3.88Å; L69-L122 HydrophobicContact CD2-CD2 4.2Å; L69-L122 HydrophobicContact CG-CD2 4.11Å; L69-Y297 HydrophobicContact CD2-CE1 3.96Å; L69-Y297 WeakPolarHBondContact CD2-OH 3.37Å
70L94.8Very high92.5Very high23 Ų2332.8 Ų32.812%0.1215%0.153CC..Hα-helixtrans-63.2-49.1174.9177.669.8000110.9I52 L55 I56 L61 D66 I67 Y68 L72 A73 I74I52-L70 HydrophobicContact CB-CD1 4.28Å; I52-L70 HydrophobicContact CG1-CD1 4.01Å; I52-L70 HydrophobicContact CG2-CD1 3.95Å; L55-L70 HydrophobicContact CD1-CB 4.02Å; I56-L70 HydrophobicContact CD1-CD1 4.4Å; I56-L70 HydrophobicContact CG1-CD1 4.39Å; L61-L70 HydrophobicContact CD1-CD2 3.79Å; L61-L70 HydrophobicContact CD2-CB 4.18Å; L61-L70 HydrophobicContact CD2-CD2 4.02Å; D66-L70 WeakPolarHBondContact O-CB 3.37Å; D66-L70 PolarHBondContact O-N 3.23Å; I67-L70 WeakPolarHBondContact O-CB 3.33Å; I67-L70 PolarHBondContact O-N 3.45Å; Y68-L70 VanDerWaalsContact C-N 3.3Å; Y68-L70 PolarHBondContact O-N 3Å; L70-L72 VanDerWaalsContact C-N 3.32Å; L70-L72 PolarHBondContact O-N 3.47Å; L70-A73 PolarHBondContact O-N 3.27Å; L70-I74 HydrophobicContact CD1-CD1 4.45Å; L70-I74 HydrophobicContact CG-CD1 4.07Å; L70-I74 WeakPolarHBondContact O-CG1 3.46Å; L70-I74 PolarHBondContact O-N 2.99Å
71N96.9Very high93Very high20 Ų2027.9 Ų27.911%0.10714%0.14CC..Hα-helixtrans-66.3-34.5180-75-81.3000112.5I67 Y68 I74 S75 F118 S149 W153I67-N71 PolarHBondContact O-N 2.78Å; I67-N71 PolarHBondContact O-ND2 3.37Å; Y68-N71 PolarHBondContact O-N 3.11Å; N71-I74 PolarHBondContact O-N 3.28Å; N71-S75 WeakPolarHBondContact O-CB 3.38Å; N71-S75 PolarHBondContact O-N 3.01Å; N71-F118 HydrophobicContact CB-CD1 3.8Å; N71-F118 HydrophobicContact CB-CD2 3.84Å; N71-F118 HydrophobicContact CB-CE1 3.44Å; N71-F118 VanDerWaalsContact CB-CE1 3.44Å; N71-F118 HydrophobicContact CB-CE2 3.5Å; N71-F118 HydrophobicContact CB-CG 4.01Å; N71-F118 HydrophobicContact CB-CZ 3.3Å; N71-S149 PolarHBondContact ND2-OG 3.34Å; N71-W153 PolarHBondContact OD1-NE1 3.5Å
72L94.4Very high93.4Very high1 Ų125.9 Ų25.91%0.00513%0.129CC..Hα-helixtrans-61.5-44.3172.2-178.258.9000111.5Y68 L70 I74 S75 D76 G115 F118 I119 L122 Y297Y68-L72 WeakPolarHBondContact O-CB 3.25Å; Y68-L72 PolarHBondContact O-N 2.69Å; L70-L72 VanDerWaalsContact C-N 3.32Å; L70-L72 PolarHBondContact O-N 3.47Å; L72-I74 VanDerWaalsContact C-N 3.35Å; L72-I74 PolarHBondContact O-N 2.9Å; L72-S75 WeakPolarHBondContact O-CB 3.26Å; L72-S75 PolarHBondContact O-N 3.27Å; L72-D76 PolarHBondContact O-N 3.47Å; L72-G115 WeakPolarHBondContact CD1-O 3.29Å; L72-F118 HydrophobicContact CB-CB 4.15Å; L72-F118 HydrophobicContact CD1-CB 4.35Å; L72-I119 HydrophobicContact CD1-CD1 4.43Å; L72-I119 HydrophobicContact CD1-CG1 4.05Å; L72-I119 HydrophobicContact CD2-CG1 4.06Å; L72-L122 HydrophobicContact CD2-CD1 3.93Å; L72-Y297 WeakPolarHBondContact CD2-OH 3.22Å
73A95.4Very high93.9Very high2 Ų218.5 Ų18.52%0.01710%0.097CC..Hα-helixtrans-64.7-37.3175.400000112.5N48 V51 I52 L69 L70 D76 L77N48-A73 HydrophobicContact CB-CB 4.49Å; V51-A73 HydrophobicContact CB-CB 4.47Å; V51-A73 HydrophobicContact CG1-CB 4.09Å; I52-A73 HydrophobicContact CD1-CB 4.21Å; I52-A73 HydrophobicContact CG1-CB 3.77Å; L69-A73 PolarHBondContact O-N 3.48Å; L69-A73 VanDerWaalsContact O-N 3.08Å; L70-A73 PolarHBondContact O-N 3.27Å; A73-D76 PolarHBondContact O-N 3.44Å; A73-L77 WeakPolarHBondContact O-CG 3.49Å; A73-L77 PolarHBondContact O-N 3.13Å
74I97.1Very high94.3Very high50 Ų5019.1 Ų19.126%0.25610%0.101SC..Hα-helixtrans-65.1-41.6174.2-67167.2000110.9I52 L70 N71 L72 L77 F78 W153I52-I74 HydrophobicContact CD1-CG1 4.19Å; L70-I74 HydrophobicContact CD1-CD1 4.45Å; L70-I74 HydrophobicContact CG-CD1 4.07Å; L70-I74 WeakPolarHBondContact O-CG1 3.46Å; L70-I74 PolarHBondContact O-N 2.99Å; N71-I74 PolarHBondContact O-N 3.28Å; L72-I74 VanDerWaalsContact C-N 3.35Å; L72-I74 PolarHBondContact O-N 2.9Å; I74-L77 WeakPolarHBondContact O-CB 3.37Å; I74-L77 PolarHBondContact O-N 2.9Å; I74-F78 HydrophobicContact CG2-CE1 4.38Å; I74-F78 HydrophobicContact CG2-CE2 4.34Å; I74-F78 HydrophobicContact CG2-CZ 4.17Å; I74-F78 PolarHBondContact O-N 3.22Å; I74-W153 HydrophobicContact CB-CZ2 4.29Å; I74-W153 HydrophobicContact CG2-CH2 4Å; I74-W153 HydrophobicContact CG2-CZ2 3.82Å
75S96.9Very high94.6Very high0 Ų021 Ų210%011%0.108CC..Hα-helixtrans-59-46.2174.6174.30000112N71 L72 L77 F78 F79 G111 S114 G115N71-S75 WeakPolarHBondContact O-CB 3.38Å; N71-S75 PolarHBondContact O-N 3.01Å; L72-S75 WeakPolarHBondContact O-CB 3.26Å; L72-S75 PolarHBondContact O-N 3.27Å; S75-L77 VanDerWaalsContact C-N 3.28Å; S75-L77 PolarHBondContact O-N 2.89Å; S75-F78 PolarHBondContact O-N 3.44Å; S75-F79 PolarHBondContact O-N 2.87Å; S75-F79 VanDerWaalsContact O-N 3.16Å; S75-G111 WeakPolarHBondContact O-CA 3.39Å; S75-G111 PolarHBondContact OG-O 2.95Å; S75-S114 WeakPolarHBondContact CB-OG 3.17Å; S75-S114 PolarHBondContact OG-OG 2.82Å; S75-G115 VanDerWaalsContact OG-CA 3.23Å; S75-G115 WeakPolarHBondContact OG-CA 3.46Å; S75-G115 PolarHBondContact OG-N 3.14Å
76D95.7Very high94.7Very high10 Ų1022.1 Ų22.15%0.05311%0.112CC..Hα-helixtrans-62.2-36.9175.4-72.4-32.3000111.3L72 A73 F79 L80 C290 N293L72-D76 PolarHBondContact O-N 3.47Å; A73-D76 PolarHBondContact O-N 3.44Å; D76-F79 WeakPolarHBondContact O-CB 3.39Å; D76-F79 PolarHBondContact O-N 2.86Å; D76-L80 WeakPolarHBondContact O-CB 3.43Å; D76-L80 WeakPolarHBondContact O-CD1 3.18Å; D76-L80 VanDerWaalsContact O-CG 3.22Å; D76-L80 WeakPolarHBondContact O-CG 3.39Å; D76-L80 PolarHBondContact O-N 3.4Å; D76-C290 HydrophobicContact CB-CB 4.39Å; D76-N293 PolarHBondContact OD2-ND2 2.89Å
77L96.4Very high94.8Very high16 Ų1621.8 Ų21.88%0.08411%0.111CC..Hα-helixtrans-65.4-42.9174.8-72.9176.9000113F45 N48 M49 I52 A73 I74 S75 F79 L80 L81F45-L77 HydrophobicContact CD2-CD2 3.87Å; F45-L77 HydrophobicContact CE2-CD2 4.28Å; N48-L77 HydrophobicContact CB-CD2 3.99Å; N48-L77 HydrophobicContact CB-CG 4.1Å; M49-L77 HydrophobicContact CE-CD1 3.44Å; M49-L77 VanDerWaalsContact CE-CD1 3.44Å; M49-L77 HydrophobicContact CE-CD2 3.93Å; M49-L77 HydrophobicContact CE-CG 4.33Å; M49-L77 HydrophobicContact CG-CD2 4.37Å; M49-L77 HydrophobicContact SD-CD1 3.87Å; I52-L77 HydrophobicContact CD1-CD1 3.38Å; I52-L77 HydrophobicContact CD1-CG 4.46Å; A73-L77 WeakPolarHBondContact O-CG 3.49Å; A73-L77 PolarHBondContact O-N 3.13Å; I74-L77 WeakPolarHBondContact O-CB 3.37Å; I74-L77 PolarHBondContact O-N 2.9Å; S75-L77 VanDerWaalsContact C-N 3.28Å; S75-L77 PolarHBondContact O-N 2.89Å; L77-F79 PolarHBondContact O-N 2.88Å; L77-L80 HydrophobicContact CD2-CD1 4.29Å; L77-L80 PolarHBondContact O-N 3.27Å; L77-L81 VanDerWaalsContact O-CG 3.26Å; L77-L81 WeakPolarHBondContact O-CG 3.3Å; L77-L81 PolarHBondContact O-N 3.42Å
78F96.1Very high94.8Very high66 Ų6624.6 Ų24.629%0.28912%0.124SC..Hα-helixtrans-58.1-40.6174.4-74.4-11.8000111.8I74 S75 L107 I110 W153I74-F78 HydrophobicContact CG2-CE1 4.38Å; I74-F78 HydrophobicContact CG2-CE2 4.34Å; I74-F78 HydrophobicContact CG2-CZ 4.17Å; I74-F78 PolarHBondContact O-N 3.22Å; S75-F78 PolarHBondContact O-N 3.44Å; F78-L107 HydrophobicContact CD1-CD2 4.47Å; F78-L107 HydrophobicContact CG-CD2 4.37Å; F78-I110 HydrophobicContact CD2-CG2 4.01Å; F78-I110 HydrophobicContact CE2-CG2 4.45Å; F78-W153 AromaticContact CD2-CH2 3.62Å; F78-W153 HydrophobicContact CD2-CH2 3.62Å; F78-W153 AromaticContact CD2-CZ3 3.61Å; F78-W153 HydrophobicContact CD2-CZ3 3.61Å; F78-W153 HydrophobicContact CE2-CE3 4.38Å; F78-W153 AromaticContact CE2-CH2 3.5Å; F78-W153 HydrophobicContact CE2-CH2 3.5Å; F78-W153 VanDerWaalsContact CE2-CH2 3.5Å; F78-W153 HydrophobicContact CE2-CZ2 4.45Å; F78-W153 AromaticContact CE2-CZ3 3.46Å; F78-W153 HydrophobicContact CE2-CZ3 3.46Å; F78-W153 VanDerWaalsContact CE2-CZ3 3.46Å
79F94.1Very high94.7Very high7 Ų727.4 Ų27.43%0.03114%0.135CC..Hα-helixtrans-63.4-50.6173.7-169.6-93.3000111.7S75 D76 L77 L81 T82 V83 Y108 F112 W248 M287 C290S75-F79 PolarHBondContact O-N 2.87Å; S75-F79 VanDerWaalsContact O-N 3.16Å; D76-F79 WeakPolarHBondContact O-CB 3.39Å; D76-F79 PolarHBondContact O-N 2.86Å; L77-F79 PolarHBondContact O-N 2.88Å; F79-L81 VanDerWaalsContact C-N 3.32Å; F79-L81 PolarHBondContact O-N 3.47Å; F79-T82 PolarHBondContact O-N 2.83Å; F79-T82 PolarHBondContact O-OG1 3.06Å; F79-V83 HydrophobicContact CD1-CG2 4.35Å; F79-V83 HydrophobicContact CE1-CG2 4.37Å; F79-Y108 AromaticContact CD2-CD2 3.92Å; F79-Y108 HydrophobicContact CD2-CD2 3.92Å; F79-Y108 HydrophobicContact CD2-CE2 4.16Å; F79-Y108 HydrophobicContact CD2-CG 4.49Å; F79-Y108 AromaticContact CE2-CD2 3.4Å; F79-Y108 HydrophobicContact CE2-CD2 3.4Å; F79-Y108 AromaticContact CE2-CE2 3.19Å; F79-Y108 HydrophobicContact CE2-CE2 3.19Å; F79-Y108 HydrophobicContact CE2-CG 4.21Å; F79-Y108 AromaticContact CE2-CZ 3.83Å; F79-Y108 HydrophobicContact CZ-CD2 4.02Å; F79-Y108 AromaticContact CZ-CE2 3.55Å; F79-Y108 HydrophobicContact CZ-CE2 3.55Å; F79-F112 HydrophobicContact CE2-CD2 4.19Å; F79-W248 HydrophobicContact CE2-CH2 4.46Å; F79-W248 HydrophobicContact CZ-CH2 4.2Å; F79-W248 HydrophobicContact CZ-CZ2 4.38Å; F79-M287 HydrophobicContact CE1-CB 4.16Å; F79-M287 HydrophobicContact CE1-CG 4.21Å; F79-M287 HydrophobicContact CZ-CB 4.32Å; F79-M287 HydrophobicContact CZ-CG 3.93Å; F79-C290 HydrophobicContact CD1-CB 3.99Å
80L95.8Very high94.5Very high0 Ų027.5 Ų27.50%014%0.138CC..Hα-helixtrans-59.8-36.7-178.9-78.1161.1000113.4V40 F41 G44 D76 L77 T82 V83 P84 C290V40-L80 HydrophobicContact CG1-CD2 4.21Å; F41-L80 HydrophobicContact CD2-CB 4.48Å; F41-L80 VanDerWaalsContact CD2-O 3.3Å; F41-L80 WeakPolarHBondContact CD2-O 3.42Å; G44-L80 WeakPolarHBondContact O-CD1 3.49Å; D76-L80 WeakPolarHBondContact O-CB 3.43Å; D76-L80 WeakPolarHBondContact O-CD1 3.18Å; D76-L80 VanDerWaalsContact O-CG 3.22Å; D76-L80 WeakPolarHBondContact O-CG 3.39Å; D76-L80 PolarHBondContact O-N 3.4Å; L77-L80 HydrophobicContact CD2-CD1 4.29Å; L77-L80 PolarHBondContact O-N 3.27Å; L80-T82 PolarHBondContact O-N 3.39Å; L80-T82 VanDerWaalsContact O-N 3.14Å; L80-V83 WeakPolarHBondContact O-CB 3.5Å; L80-V83 PolarHBondContact O-N 3.41Å; L80-V83 VanDerWaalsContact O-N 3.08Å; L80-P84 VanDerWaalsContact O-CD 3.3Å; L80-P84 WeakPolarHBondContact O-CD 3.45Å; L80-C290 WeakPolarHBondContact CD2-SG 3.4Å; L80-C290 HydrophobicContact CG-CB 4.31Å
81L96Very high94.1Very high78 Ų7829.1 Ų29.141%0.40816%0.155SC..Hα-helixtrans-60.2-23.8177.4-73.1171.9000112.8L77 F79 F85L77-L81 VanDerWaalsContact O-CG 3.26Å; L77-L81 WeakPolarHBondContact O-CG 3.3Å; L77-L81 PolarHBondContact O-N 3.42Å; F79-L81 VanDerWaalsContact C-N 3.32Å; F79-L81 PolarHBondContact O-N 3.47Å; L81-F85 WeakPolarHBondContact O-CD2 3.25Å; L81-F85 WeakPolarHBondContact O-CE2 3.29Å
82T95.3Very high93.7Very high0 Ų030.5 Ų30.50%017%0.169CC..Hα-helixtrans-85-24.1177.373.90000113.4F79 L80 F85 W86 L104 L107F79-T82 PolarHBondContact O-N 2.83Å; F79-T82 PolarHBondContact O-OG1 3.06Å; L80-T82 PolarHBondContact O-N 3.39Å; L80-T82 VanDerWaalsContact O-N 3.14Å; T82-F85 WeakPolarHBondContact O-CB 3.32Å; T82-F85 PolarHBondContact O-N 3.49Å; T82-W86 PolarHBondContact O-N 2.91Å; T82-W86 PolarHBondContact OG1-NE1 2.99Å; T82-W86 VanDerWaalsContact OG1-NE1 3.13Å; T82-L104 HydrophobicContact CG2-CB 4.44Å; T82-L104 HydrophobicContact CG2-CD2 4.02Å; T82-L104 WeakPolarHBondContact CG2-O 3.45Å; T82-L107 HydrophobicContact CG2-CB 3.6Å
83V94.1Very high93.5Very high1 Ų132.9 Ų32.91%0.00618%0.18CC..Hα-helixtrans-57.3-42.4-172.41750000113.8Y37 F41 F79 L80 F85 W86 A87Y37-V83 HydrophobicContact CD2-CG1 4.49Å; Y37-V83 HydrophobicContact CG-CG1 4.01Å; Y37-V83 WeakPolarHBondContact O-CG1 3.38Å; F41-V83 HydrophobicContact CB-CG1 4.38Å; F79-V83 HydrophobicContact CD1-CG2 4.35Å; F79-V83 HydrophobicContact CE1-CG2 4.37Å; L80-V83 WeakPolarHBondContact O-CB 3.5Å; L80-V83 PolarHBondContact O-N 3.41Å; L80-V83 VanDerWaalsContact O-N 3.08Å; V83-F85 VanDerWaalsContact C-N 3.26Å; V83-F85 PolarHBondContact O-N 3.33Å; V83-W86 PolarHBondContact O-N 2.91Å; V83-A87 WeakPolarHBondContact O-CB 3.28Å; V83-A87 PolarHBondContact O-N 3.36Å
84P94.4Very high93.4Very high54 Ų5433 Ų3335%0.35118%0.18SC..Hα-helixtrans-60.2-34.2176.9-25.735.5000113.7F41 L80 A87 H88F41-P84 HydrophobicContact CD1-CG 4.37Å; F41-P84 HydrophobicContact CD2-CG 3.71Å; F41-P84 HydrophobicContact CE1-CG 4.49Å; F41-P84 HydrophobicContact CE2-CG 3.85Å; F41-P84 HydrophobicContact CG-CG 3.99Å; F41-P84 HydrophobicContact CZ-CG 4.25Å; L80-P84 VanDerWaalsContact O-CD 3.3Å; L80-P84 WeakPolarHBondContact O-CD 3.45Å; P84-A87 WeakPolarHBondContact O-CB 3.46Å; P84-A87 PolarHBondContact O-N 3.07Å; P84-H88 PolarHBondContact O-N 3.05Å
85F94.6Very high93.2Very high51 Ų5134.7 Ų34.722%0.22419%0.19CC..Hα-helixtrans-72.4-39.9178.6-61.3-90.3000111.2L81 T82 V83 A87 H88 Y89 F96 M100 L104L81-F85 WeakPolarHBondContact O-CD2 3.25Å; L81-F85 WeakPolarHBondContact O-CE2 3.29Å; T82-F85 WeakPolarHBondContact O-CB 3.32Å; T82-F85 PolarHBondContact O-N 3.49Å; V83-F85 VanDerWaalsContact C-N 3.26Å; V83-F85 PolarHBondContact O-N 3.33Å; F85-A87 VanDerWaalsContact C-N 3.3Å; F85-A87 PolarHBondContact O-N 3.02Å; F85-H88 PolarHBondContact O-N 3.18Å; F85-Y89 WeakPolarHBondContact O-CB 3.18Å; F85-Y89 PolarHBondContact O-N 3.48Å; F85-F96 HydrophobicContact CB-CE2 4.31Å; F85-F96 AromaticContact CD1-CD1 3.97Å; F85-F96 HydrophobicContact CD1-CD1 3.97Å; F85-F96 AromaticContact CD1-CD2 3.96Å; F85-F96 HydrophobicContact CD1-CD2 3.96Å; F85-F96 AromaticContact CD1-CE1 3.76Å; F85-F96 HydrophobicContact CD1-CE1 3.76Å; F85-F96 AromaticContact CD1-CE2 3.76Å; F85-F96 HydrophobicContact CD1-CE2 3.76Å; F85-F96 HydrophobicContact CD1-CG 4.07Å; F85-F96 AromaticContact CD1-CZ 3.66Å; F85-F96 HydrophobicContact CD1-CZ 3.66Å; F85-F96 HydrophobicContact CE1-CD1 4.05Å; F85-F96 AromaticContact CE1-CE1 3.92Å; F85-F96 HydrophobicContact CE1-CE1 3.92Å; F85-F96 HydrophobicContact CE1-CZ 4.26Å; F85-M100 HydrophobicContact CD1-CE 4.4Å; F85-M100 HydrophobicContact CE1-CE 3.51Å; F85-M100 HydrophobicContact CE2-CE 4.42Å; F85-M100 HydrophobicContact CZ-CE 3.52Å; F85-L104 HydrophobicContact CB-CD1 3.56Å; F85-L104 HydrophobicContact CD1-CD1 3.59Å; F85-L104 HydrophobicContact CD2-CD1 3.8Å; F85-L104 HydrophobicContact CD2-CD2 3.7Å; F85-L104 HydrophobicContact CD2-CG 4.44Å; F85-L104 HydrophobicContact CE1-CD1 4.21Å; F85-L104 HydrophobicContact CE2-CD1 4.39Å; F85-L104 HydrophobicContact CE2-CD2 3.92Å; F85-L104 HydrophobicContact CG-CD1 3.36Å; F85-L104 HydrophobicContact CG-CD2 4.17Å; F85-L104 HydrophobicContact CG-CG 4.43Å
86W92.1Very high92.9Very high32 Ų3238.3 Ų38.312%0.12121%0.206CC..Hα-helixtrans-66-33.2172.9-58.6123.6000112.2Y37 T82 V83 Y89 A90 W94 Y108Y37-W86 HydrophobicContact CD2-CB 4.33Å; Y37-W86 HydrophobicContact CE2-CB 4.15Å; T82-W86 PolarHBondContact O-N 2.91Å; T82-W86 PolarHBondContact OG1-NE1 2.99Å; T82-W86 VanDerWaalsContact OG1-NE1 3.13Å; V83-W86 PolarHBondContact O-N 2.91Å; W86-Y89 HydrophobicContact CE3-CD1 4.07Å; W86-Y89 HydrophobicContact CZ3-CD1 4.34Å; W86-Y89 PolarHBondContact O-N 3.31Å; W86-A90 WeakPolarHBondContact O-CB 3.41Å; W86-A90 PolarHBondContact O-N 3.12Å; W86-W94 HydrophobicContact CE3-CZ3 4.2Å; W86-W94 HydrophobicContact CH2-CZ3 4.37Å; W86-W94 AromaticContact CZ3-CZ3 3.87Å; W86-W94 HydrophobicContact CZ3-CZ3 3.87Å; W86-Y108 AromaticContact NE1-CD2 3.95Å
87A91.9Very high92.8Very high7 Ų739.5 Ų39.56%0.05822%0.22CC..Hα-helixtrans-64-46.8173.500000111.7P34 Y37 V83 P84 F85 A90 A91P34-A87 HydrophobicContact CB-CB 4.48Å; Y37-A87 HydrophobicContact CD2-CB 4.06Å; Y37-A87 HydrophobicContact CG-CB 4.48Å; V83-A87 WeakPolarHBondContact O-CB 3.28Å; V83-A87 PolarHBondContact O-N 3.36Å; P84-A87 WeakPolarHBondContact O-CB 3.46Å; P84-A87 PolarHBondContact O-N 3.07Å; F85-A87 VanDerWaalsContact C-N 3.3Å; F85-A87 PolarHBondContact O-N 3.02Å; A87-A90 PolarHBondContact O-N 3.3Å; A87-A91 PolarHBondContact O-N 3.47Å; A87-A91 VanDerWaalsContact O-N 3.15Å
88H93.4Very high92.7Very high74 Ų7441.7 Ų41.734%0.34323%0.232SC..Hα-helixtrans-62.2-45.3173.9-17878000111.7P84 F85 A90 A91 A92 D95 F96P84-H88 PolarHBondContact O-N 3.05Å; F85-H88 PolarHBondContact O-N 3.18Å; H88-A90 VanDerWaalsContact C-N 3.3Å; H88-A90 PolarHBondContact O-N 2.88Å; H88-A91 PolarHBondContact O-N 2.9Å; H88-A91 VanDerWaalsContact O-N 3.1Å; H88-A92 PolarHBondContact O-N 2.93Å; H88-D95 IonicContact CD2-OD2 2.61Å; H88-D95 IonicContact CE1-OD2 2.85Å; H88-D95 IonicContact NE2-OD2 2.98Å; H88-D95 PolarHBondContact NE2-OD2 3.27Å; H88-F96 HydrophobicContact CB-CE2 4.32Å; H88-F96 HydrophobicContact CB-CZ 4.21Å; H88-F96 AromaticContact CD2-CE2 3.65Å; H88-F96 AromaticContact CD2-CZ 3.68Å
89Y91Very high92.5Very high64 Ų6444.1 Ų44.125%0.25125%0.253SS..Hα-helixtrans-59.1-40.5178.5178.2-121.5000112.5F85 W86 A92 W94F85-Y89 WeakPolarHBondContact O-CB 3.18Å; F85-Y89 PolarHBondContact O-N 3.48Å; W86-Y89 HydrophobicContact CE3-CD1 4.07Å; W86-Y89 HydrophobicContact CZ3-CD1 4.34Å; W86-Y89 PolarHBondContact O-N 3.31Å; Y89-A92 CarbonylContact O-C 3.59Å; Y89-W94 HydrophobicContact CD2-CB 3.88Å; Y89-W94 AromaticContact CD2-CE3 3.88Å; Y89-W94 HydrophobicContact CD2-CE3 3.88Å; Y89-W94 HydrophobicContact CE2-CB 3.93Å; Y89-W94 AromaticContact CG-CE3 4Å; Y89-W94 HydrophobicContact CG-CE3 4Å
90A87.6Confident92.5Very high22 Ų2246.5 Ų46.518%0.18227%0.265CS..Hα-helixtrans-66.7-36175.800000112.7A30 L33 W86 A87 H88A30-A90 VanDerWaalsContact CA-O 3.24Å; A30-A90 WeakPolarHBondContact CA-O 3.45Å; A30-A90 WeakPolarHBondContact CB-O 3.21Å; L33-A90 HydrophobicContact CB-CB 3.96Å; L33-A90 HydrophobicContact CD1-CB 3.93Å; W86-A90 WeakPolarHBondContact O-CB 3.41Å; W86-A90 PolarHBondContact O-N 3.12Å; A87-A90 PolarHBondContact O-N 3.3Å; H88-A90 VanDerWaalsContact C-N 3.3Å; H88-A90 PolarHBondContact O-N 2.88Å
91A87.8Confident92.5Very high56 Ų5646.5 Ų46.546%0.46327%0.265SS..Hα-helixtrans-74.7-35.6-179.800000113.1P34 A87 H88P34-A91 HydrophobicContact CB-CB 4.48Å; P34-A91 HydrophobicContact CG-CB 3.72Å; A87-A91 PolarHBondContact O-N 3.47Å; A87-A91 VanDerWaalsContact O-N 3.15Å; H88-A91 PolarHBondContact O-N 2.9Å; H88-A91 VanDerWaalsContact O-N 3.1Å
92A88.6Confident92.5Very high50 Ų5045.6 Ų45.641%0.41326%0.258SS..SBendtrans-133.9-107.2-171.800000111.5H88 Y89H88-A92 PolarHBondContact O-N 2.93Å; Y89-A92 CarbonylContact O-C 3.59Å
93Q88.4Confident92.5Very high51 Ų5150.2 Ų50.224%0.23828%0.283CS..  trans-148.5179.3-177.969.5-177.23.800110.2D95 H175Q93-D95 WeakPolarHBondContact CG-OD1 3.5Å; Q93-D95 PolarHBondContact NE2-OD1 3.36Å; Q93-D95 PolarHBondContact O-N 3.05Å; Q93-H175 HydrophobicContact CB-CB 4.34Å; Q93-H175 PolarHBondContact OE1-ND1 2.87Å; Q93-H175 VanDerWaalsContact OE1-ND1 3.16Å
94W93.3Very high92.6Very high3 Ų350.4 Ų50.41%0.01128%0.284CS..  trans-84.497.2178-169.7-94.7000112.4W86 Y89 F96 G97 M100 C101 L104 S169 Y176 C178W86-W94 HydrophobicContact CE3-CZ3 4.2Å; W86-W94 HydrophobicContact CH2-CZ3 4.37Å; W86-W94 AromaticContact CZ3-CZ3 3.87Å; W86-W94 HydrophobicContact CZ3-CZ3 3.87Å; Y89-W94 HydrophobicContact CD2-CB 3.88Å; Y89-W94 AromaticContact CD2-CE3 3.88Å; Y89-W94 HydrophobicContact CD2-CE3 3.88Å; Y89-W94 HydrophobicContact CE2-CB 3.93Å; Y89-W94 AromaticContact CG-CE3 4Å; Y89-W94 HydrophobicContact CG-CE3 4Å; W94-F96 HydrophobicContact CD2-CD2 4.21Å; W94-F96 HydrophobicContact CE3-CD2 4.24Å; W94-F96 HydrophobicContact CH2-CD2 4.14Å; W94-F96 HydrophobicContact CZ2-CB 3.92Å; W94-F96 HydrophobicContact CZ2-CD2 4.03Å; W94-F96 HydrophobicContact CZ2-CG 4.43Å; W94-F96 HydrophobicContact CZ3-CD2 4.22Å; W94-G97 PolarHBondContact NE1-O 3.5Å; W94-M100 HydrophobicContact CZ2-CB 4.45Å; W94-C101 HydrophobicContact CZ2-CB 3.66Å; W94-L104 HydrophobicContact CH2-CD1 3.6Å; W94-L104 HydrophobicContact CZ2-CD1 4.12Å; W94-S169 VanDerWaalsContact CD1-OG 3.22Å; W94-Y176 WeakPolarHBondContact CB-O 3.3Å; W94-Y176 PolarHBondContact N-O 3.18Å; W94-Y176 WeakPolarHBondContact O-CB 3.49Å; W94-C178 HydrophobicContact CB-CB 4.4Å; W94-C178 HydrophobicContact CD2-CB 3.49Å; W94-C178 VanDerWaalsContact CD2-CB 3.49Å; W94-C178 HydrophobicContact CE3-CB 3.66Å; W94-C178 HydrophobicContact CG-CB 3.8Å; W94-C178 HydrophobicContact CH2-CB 4.49Å; W94-C178 HydrophobicContact CZ2-CB 4.41Å; W94-C178 HydrophobicContact CZ3-CB 4.15Å
95D92.9Very high92.6Very high86 Ų8648.2 Ų48.246%0.4627%0.269SS..  trans-96-2.7-177.6-59.4-51.5000114.2H88 Q93H88-D95 IonicContact CD2-OD2 2.61Å; H88-D95 IonicContact CE1-OD2 2.85Å; H88-D95 IonicContact NE2-OD2 2.98Å; H88-D95 PolarHBondContact NE2-OD2 3.27Å; Q93-D95 WeakPolarHBondContact CG-OD1 3.5Å; Q93-D95 PolarHBondContact NE2-OD1 3.36Å; Q93-D95 PolarHBondContact O-N 3.05Å
96F92.5Very high92.7Very high76 Ų7646 Ų4633%0.33326%0.26SS..SBendtrans-91.70.3-170-50.9-75.6000114.7F85 H88 W94 M100F85-F96 HydrophobicContact CB-CE2 4.31Å; F85-F96 AromaticContact CD1-CD1 3.97Å; F85-F96 HydrophobicContact CD1-CD1 3.97Å; F85-F96 AromaticContact CD1-CD2 3.96Å; F85-F96 HydrophobicContact CD1-CD2 3.96Å; F85-F96 AromaticContact CD1-CE1 3.76Å; F85-F96 HydrophobicContact CD1-CE1 3.76Å; F85-F96 AromaticContact CD1-CE2 3.76Å; F85-F96 HydrophobicContact CD1-CE2 3.76Å; F85-F96 HydrophobicContact CD1-CG 4.07Å; F85-F96 AromaticContact CD1-CZ 3.66Å; F85-F96 HydrophobicContact CD1-CZ 3.66Å; F85-F96 HydrophobicContact CE1-CD1 4.05Å; F85-F96 AromaticContact CE1-CE1 3.92Å; F85-F96 HydrophobicContact CE1-CE1 3.92Å; F85-F96 HydrophobicContact CE1-CZ 4.26Å; H88-F96 HydrophobicContact CB-CE2 4.32Å; H88-F96 HydrophobicContact CB-CZ 4.21Å; H88-F96 AromaticContact CD2-CE2 3.65Å; H88-F96 AromaticContact CD2-CZ 3.68Å; W94-F96 HydrophobicContact CD2-CD2 4.21Å; W94-F96 HydrophobicContact CE3-CD2 4.24Å; W94-F96 HydrophobicContact CH2-CD2 4.14Å; W94-F96 HydrophobicContact CZ2-CB 3.92Å; W94-F96 HydrophobicContact CZ2-CD2 4.03Å; W94-F96 HydrophobicContact CZ2-CG 4.43Å; W94-F96 HydrophobicContact CZ3-CD2 4.22Å; F96-M100 HydrophobicContact CB-CB 3.7Å; F96-M100 HydrophobicContact CB-CG 3.76Å; F96-M100 HydrophobicContact CG-CG 4.48Å; F96-M100 WeakPolarHBondContact O-CB 3.47Å
97G92.8Very high92.9Very high35 Ų3546.5 Ų46.536%0.36127%0.265SS..Hα-helixtrans72.7177.2-179.700000114.7W94 C101W94-G97 PolarHBondContact NE1-O 3.5Å; G97-C101 PolarHBondContact O-N 3.39Å
98N93.3Very high93.1Very high62 Ų6246.8 Ų46.833%0.33227%0.265SS..Hα-helixtrans-69.2-41.2-171.7-175.573.3000113.7M100 C101 Q102 K168 S169N98-M100 VanDerWaalsContact C-N 3.32Å; N98-M100 PolarHBondContact O-N 3.05Å; N98-C101 WeakPolarHBondContact O-CB 3.26Å; N98-C101 PolarHBondContact O-N 3.33Å; N98-Q102 PolarHBondContact O-N 3.24Å; N98-K168 WeakPolarHBondContact OD1-CA 3.33Å; N98-S169 PolarHBondContact OD1-N 3.08Å
99T93.4Very high93.1Very high117 Ų11744.3 Ų44.372%0.71825%0.253SS*.Hα-helixtrans-60.6-43.2-178.7-49.20000111.6Q102 L103T99-Q102 PolarHBondContact O-N 3.36Å; T99-L103 WeakPolarHBondContact O-CB 3.26Å; T99-L103 PolarHBondContact O-N 3.48Å
100M94.5Very high93.4Very high58 Ų5842.5 Ų42.529%0.28625%0.247SC..Hα-helixtrans-70.2-34.9178.4-160.664153.600111.7F85 W94 F96 N98 L103 L104F85-M100 HydrophobicContact CD1-CE 4.4Å; F85-M100 HydrophobicContact CE1-CE 3.51Å; F85-M100 HydrophobicContact CE2-CE 4.42Å; F85-M100 HydrophobicContact CZ-CE 3.52Å; W94-M100 HydrophobicContact CZ2-CB 4.45Å; F96-M100 HydrophobicContact CB-CB 3.7Å; F96-M100 HydrophobicContact CB-CG 3.76Å; F96-M100 HydrophobicContact CG-CG 4.48Å; F96-M100 WeakPolarHBondContact O-CB 3.47Å; N98-M100 VanDerWaalsContact C-N 3.32Å; N98-M100 PolarHBondContact O-N 3.05Å; M100-L103 PolarHBondContact O-N 2.84Å; M100-L103 HydrophobicContact SD-CD2 4.13Å; M100-L104 HydrophobicContact CE-CD1 4.41Å; M100-L104 HydrophobicContact CG-CD1 3.64Å; M100-L104 HydrophobicContact CG-CG 4.08Å; M100-L104 VanDerWaalsContact O-CB 3.29Å; M100-L104 WeakPolarHBondContact O-CB 3.37Å; M100-L104 VanDerWaalsContact O-CG 3.24Å; M100-L104 WeakPolarHBondContact O-CG 3.46Å; M100-L104 PolarHBondContact O-N 2.85Å; M100-L104 HydrophobicContact SD-CD1 4.4Å; M100-L104 HydrophobicContact SD-CG 4.34Å
101C95.2Very high93.8Very high0 Ų041.6 Ų41.60%024%0.24CC..Hα-helixtrans-58.1-51.1174.4172.40000110.5W94 G97 N98 L103 L104 T105 T167 C178W94-C101 HydrophobicContact CZ2-CB 3.66Å; G97-C101 PolarHBondContact O-N 3.39Å; N98-C101 WeakPolarHBondContact O-CB 3.26Å; N98-C101 PolarHBondContact O-N 3.33Å; C101-L103 PolarHBondContact O-N 3.28Å; C101-L104 PolarHBondContact O-N 3.24Å; C101-T105 VanDerWaalsContact O-CB 3.27Å; C101-T105 WeakPolarHBondContact O-CB 3.35Å; C101-T105 PolarHBondContact O-N 3.24Å; C101-T105 PolarHBondContact O-OG1 2.92Å; C101-T167 VanDerWaalsContact SG-CG2 3.53Å; C101-C178 VanDerWaalsContact CA-SG 3.59Å; C101-C178 HydrophobicContact CB-CB 3.94Å; C101-C178 WeakPolarHBondContact CB-SG 3.44Å; C101-C178 WeakPolarHBondContact SG-CB 3.39Å; C101-C178 CovalentContact SG-SG 2.03Å; C101-C178 PolarHBondContact SG-SG 2.86Å
102Q94.8Very high94Very high58 Ų5839.3 Ų39.327%0.27122%0.22SC..Hα-helixtrans-63.2-42.6178.1-68.8-178.1-32.400113N98 T99 G106 I164 T167N98-Q102 PolarHBondContact O-N 3.24Å; T99-Q102 PolarHBondContact O-N 3.36Å; Q102-G106 PolarHBondContact O-N 3.32Å; Q102-I164 HydrophobicContact CB-CG2 4.27Å; Q102-T167 WeakPolarHBondContact CG-O 3.47Å; Q102-T167 PolarHBondContact NE2-O 3.43Å
103L95.7Very high94.3Very high98 Ų9836.9 Ų36.951%0.51320%0.2SC..Hα-helixtrans-63.6-49.1178.7179.664.2000111.9T99 M100 C101 G106 L107T99-L103 WeakPolarHBondContact O-CB 3.26Å; T99-L103 PolarHBondContact O-N 3.48Å; M100-L103 PolarHBondContact O-N 2.84Å; M100-L103 HydrophobicContact SD-CD2 4.13Å; C101-L103 PolarHBondContact O-N 3.28Å; L103-G106 WeakPolarHBondContact O-CA 3.47Å; L103-G106 PolarHBondContact O-N 2.9Å; L103-G106 VanDerWaalsContact O-N 3.16Å; L103-L107 HydrophobicContact CG-CD1 4.46Å; L103-L107 PolarHBondContact O-N 2.89Å
104L96.2Very high94.7Very high5 Ų534.5 Ų34.53%0.02619%0.189CC..Hα-helixtrans-68.7-38.4-178.4-68.8172.3000111.6T82 F85 W94 M100 C101 G106 L107 Y108T82-L104 HydrophobicContact CG2-CB 4.44Å; T82-L104 HydrophobicContact CG2-CD2 4.02Å; T82-L104 WeakPolarHBondContact CG2-O 3.45Å; F85-L104 HydrophobicContact CB-CD1 3.56Å; F85-L104 HydrophobicContact CD1-CD1 3.59Å; F85-L104 HydrophobicContact CD2-CD1 3.8Å; F85-L104 HydrophobicContact CD2-CD2 3.7Å; F85-L104 HydrophobicContact CD2-CG 4.44Å; F85-L104 HydrophobicContact CE1-CD1 4.21Å; F85-L104 HydrophobicContact CE2-CD1 4.39Å; F85-L104 HydrophobicContact CE2-CD2 3.92Å; F85-L104 HydrophobicContact CG-CD1 3.36Å; F85-L104 HydrophobicContact CG-CD2 4.17Å; F85-L104 HydrophobicContact CG-CG 4.43Å; W94-L104 HydrophobicContact CH2-CD1 3.6Å; W94-L104 HydrophobicContact CZ2-CD1 4.12Å; M100-L104 HydrophobicContact CE-CD1 4.41Å; M100-L104 HydrophobicContact CG-CD1 3.64Å; M100-L104 HydrophobicContact CG-CG 4.08Å; M100-L104 VanDerWaalsContact O-CB 3.29Å; M100-L104 WeakPolarHBondContact O-CB 3.37Å; M100-L104 VanDerWaalsContact O-CG 3.24Å; M100-L104 WeakPolarHBondContact O-CG 3.46Å; M100-L104 PolarHBondContact O-N 2.85Å; M100-L104 HydrophobicContact SD-CD1 4.4Å; M100-L104 HydrophobicContact SD-CG 4.34Å; C101-L104 PolarHBondContact O-N 3.24Å; L104-G106 VanDerWaalsContact C-N 3.27Å; L104-G106 PolarHBondContact O-N 3.48Å; L104-L107 PolarHBondContact O-N 3.47Å; L104-Y108 VanDerWaalsContact O-CB 3.28Å; L104-Y108 WeakPolarHBondContact O-CB 3.3Å; L104-Y108 PolarHBondContact O-N 2.81Å
105T95.1Very high94.8Very high8 Ų834.7 Ų34.75%0.04919%0.192CC..Hα-helixtrans-61.8-38.2170.4-63.20000111.5C101 Y108 F109 T167C101-T105 VanDerWaalsContact O-CB 3.27Å; C101-T105 WeakPolarHBondContact O-CB 3.35Å; C101-T105 PolarHBondContact O-N 3.24Å; C101-T105 PolarHBondContact O-OG1 2.92Å; T105-Y108 PolarHBondContact O-N 3.44Å; T105-F109 HydrophobicContact CG2-CD2 3.57Å; T105-F109 HydrophobicContact CG2-CE2 3.48Å; T105-F109 VanDerWaalsContact CG2-CE2 3.48Å; T105-F109 VanDerWaalsContact O-CD2 3.25Å; T105-F109 WeakPolarHBondContact O-CD2 2.96Å; T105-F109 PolarHBondContact O-N 3.12Å; T105-T167 HydrophobicContact CG2-CG2 4.07Å; T105-T167 WeakPolarHBondContact OG1-CG2 3.35Å
106G96.2Very high94.9Very high4 Ų430.6 Ų30.64%0.04117%0.17CC..Hα-helixtrans-62.1-51.8173.400000112.7Q102 L103 L104 Y108 F109 I110Q102-G106 PolarHBondContact O-N 3.32Å; L103-G106 WeakPolarHBondContact O-CA 3.47Å; L103-G106 PolarHBondContact O-N 2.9Å; L103-G106 VanDerWaalsContact O-N 3.16Å; L104-G106 VanDerWaalsContact C-N 3.27Å; L104-G106 PolarHBondContact O-N 3.48Å; G106-Y108 VanDerWaalsContact C-N 3.3Å; G106-Y108 PolarHBondContact O-N 2.93Å; G106-F109 PolarHBondContact O-N 3.48Å; G106-I110 VanDerWaalsContact O-CB 3.27Å; G106-I110 WeakPolarHBondContact O-CB 3.48Å; G106-I110 WeakPolarHBondContact O-CD1 3.16Å; G106-I110 WeakPolarHBondContact O-CG1 3.4Å; G106-I110 PolarHBondContact O-N 3.44Å
107L96.7Very high95.1Very high42 Ų4228 Ų2822%0.2216%0.159CC..Hα-helixtrans-59.9-40.4177.2-71.9174.8000112.3F78 T82 L103 L104 G111F78-L107 HydrophobicContact CD1-CD2 4.47Å; F78-L107 HydrophobicContact CG-CD2 4.37Å; T82-L107 HydrophobicContact CG2-CB 3.6Å; L103-L107 HydrophobicContact CG-CD1 4.46Å; L103-L107 PolarHBondContact O-N 2.89Å; L104-L107 PolarHBondContact O-N 3.47Å; L107-G111 PolarHBondContact O-N 3.23Å
108Y95.1Very high95.2Very high13 Ų1326.4 Ų26.45%0.05114%0.142CC..Hα-helixtrans-57.6-56.6174.6175.3-87.5000110.5F79 W86 L104 T105 G106 I110 G111 F112 E283 M287F79-Y108 AromaticContact CD2-CD2 3.92Å; F79-Y108 HydrophobicContact CD2-CD2 3.92Å; F79-Y108 HydrophobicContact CD2-CE2 4.16Å; F79-Y108 HydrophobicContact CD2-CG 4.49Å; F79-Y108 AromaticContact CE2-CD2 3.4Å; F79-Y108 HydrophobicContact CE2-CD2 3.4Å; F79-Y108 AromaticContact CE2-CE2 3.19Å; F79-Y108 HydrophobicContact CE2-CE2 3.19Å; F79-Y108 HydrophobicContact CE2-CG 4.21Å; F79-Y108 AromaticContact CE2-CZ 3.83Å; F79-Y108 HydrophobicContact CZ-CD2 4.02Å; F79-Y108 AromaticContact CZ-CE2 3.55Å; F79-Y108 HydrophobicContact CZ-CE2 3.55Å; W86-Y108 AromaticContact NE1-CD2 3.95Å; L104-Y108 VanDerWaalsContact O-CB 3.28Å; L104-Y108 WeakPolarHBondContact O-CB 3.3Å; L104-Y108 PolarHBondContact O-N 2.81Å; T105-Y108 PolarHBondContact O-N 3.44Å; G106-Y108 VanDerWaalsContact C-N 3.3Å; G106-Y108 PolarHBondContact O-N 2.93Å; Y108-I110 PolarHBondContact O-N 2.99Å; Y108-G111 PolarHBondContact O-N 3.28Å; Y108-F112 HydrophobicContact CE1-CD2 4.27Å; Y108-F112 HydrophobicContact CE1-CE2 4.35Å; Y108-F112 WeakPolarHBondContact O-CB 3.4Å; Y108-F112 PolarHBondContact O-N 3.37Å; Y108-E283 PolarHBondContact OH-OE1 3.5Å; Y108-M287 HydrophobicContact CE2-CE 4.03Å
109F94.9Very high95.2Very high23 Ų2323.6 Ų23.610%0.10113%0.127CC..Hα-helixtrans-67.6-36.1-178-78.6-59000113T105 G106 F112 F113 S160 I198T105-F109 HydrophobicContact CG2-CD2 3.57Å; T105-F109 HydrophobicContact CG2-CE2 3.48Å; T105-F109 VanDerWaalsContact CG2-CE2 3.48Å; T105-F109 VanDerWaalsContact O-CD2 3.25Å; T105-F109 WeakPolarHBondContact O-CD2 2.96Å; T105-F109 PolarHBondContact O-N 3.12Å; G106-F109 PolarHBondContact O-N 3.48Å; F109-F112 HydrophobicContact CD1-CD1 4.33Å; F109-F112 WeakPolarHBondContact O-CB 3.46Å; F109-F112 PolarHBondContact O-N 3.31Å; F109-F113 HydrophobicContact CB-CD2 4.25Å; F109-F113 HydrophobicContact CB-CE2 4.19Å; F109-F113 AromaticContact CD1-CE2 3.91Å; F109-F113 HydrophobicContact CD1-CE2 3.91Å; F109-F113 HydrophobicContact CG-CE2 4.38Å; F109-F113 WeakPolarHBondContact O-CD2 3.48Å; F109-F113 PolarHBondContact O-N 3.49Å; F109-S160 VanDerWaalsContact C-OG 3.22Å; F109-S160 WeakPolarHBondContact CB-OG 3.22Å; F109-S160 PolarHBondContact O-OG 3.04Å; F109-I198 HydrophobicContact CE1-CD1 4.41Å
110I96.8Very high95.2Very high25 Ų2518.7 Ų18.713%0.12810%0.096CC..Hα-helixtrans-62.6-51177.1-73.1166.8000109.7F78 G106 Y108 F112 S114 W153 V157 S160F78-I110 HydrophobicContact CD2-CG2 4.01Å; F78-I110 HydrophobicContact CE2-CG2 4.45Å; G106-I110 VanDerWaalsContact O-CB 3.27Å; G106-I110 WeakPolarHBondContact O-CB 3.48Å; G106-I110 WeakPolarHBondContact O-CD1 3.16Å; G106-I110 WeakPolarHBondContact O-CG1 3.4Å; G106-I110 PolarHBondContact O-N 3.44Å; Y108-I110 PolarHBondContact O-N 2.99Å; I110-F112 VanDerWaalsContact C-N 3.26Å; I110-F112 PolarHBondContact O-N 3.02Å; I110-S114 VanDerWaalsContact O-CB 3.25Å; I110-S114 WeakPolarHBondContact O-CB 3.27Å; I110-S114 PolarHBondContact O-N 3.25Å; I110-S114 PolarHBondContact O-OG 3.11Å; I110-W153 HydrophobicContact CG2-CE3 4.07Å; I110-W153 HydrophobicContact CG2-CZ3 3.61Å; I110-V157 HydrophobicContact CD1-CG2 4Å; I110-V157 HydrophobicContact CG1-CG2 4.21Å; I110-S160 PolarHBondContact N-OG 2.94Å
111G95.7Very high95.2Very high3 Ų317.4 Ų17.43%0.0319%0.09CC..Hα-helixtrans-63.2-33.7175.600000112.5S75 L107 Y108 G115S75-G111 WeakPolarHBondContact O-CA 3.39Å; S75-G111 PolarHBondContact OG-O 2.95Å; L107-G111 PolarHBondContact O-N 3.23Å; Y108-G111 PolarHBondContact O-N 3.28Å; G111-G115 PolarHBondContact O-N 3.45Å; G111-G115 VanDerWaalsContact O-N 3.1Å
112F92.1Very high95Very high8 Ų817.5 Ų17.54%0.0359%0.09CC..Hα-helixtrans-69.6-44.5179-175.1-102.4000113.8F79 Y108 F109 I110 I198 R202 W248 Y251F79-F112 HydrophobicContact CE2-CD2 4.19Å; Y108-F112 HydrophobicContact CE1-CD2 4.27Å; Y108-F112 HydrophobicContact CE1-CE2 4.35Å; Y108-F112 WeakPolarHBondContact O-CB 3.4Å; Y108-F112 PolarHBondContact O-N 3.37Å; F109-F112 HydrophobicContact CD1-CD1 4.33Å; F109-F112 WeakPolarHBondContact O-CB 3.46Å; F109-F112 PolarHBondContact O-N 3.31Å; I110-F112 VanDerWaalsContact C-N 3.26Å; I110-F112 PolarHBondContact O-N 3.02Å; F112-I198 HydrophobicContact CE1-CG2 4.3Å; F112-R202 VanDerWaalsContact CD1-CD 3.4Å; F112-R202 HydrophobicContact CE1-CG 4.41Å; F112-W248 AromaticContact CD2-CH2 3.65Å; F112-W248 HydrophobicContact CD2-CH2 3.65Å; F112-W248 HydrophobicContact CD2-CZ2 4.06Å; F112-W248 HydrophobicContact CD2-CZ3 4.09Å; F112-W248 HydrophobicContact CE2-CE3 4.02Å; F112-W248 AromaticContact CE2-CH2 3.34Å; F112-W248 HydrophobicContact CE2-CH2 3.34Å; F112-W248 HydrophobicContact CE2-CZ2 4.1Å; F112-W248 AromaticContact CE2-CZ3 3.31Å; F112-W248 HydrophobicContact CE2-CZ3 3.31Å; F112-W248 HydrophobicContact CZ-CZ3 4.2Å; F112-Y251 HydrophobicContact CZ-CE1 4.36Å
113F95.6Very high94.8Very high0 Ų014.8 Ų14.80%08%0.078CC..Hα-helixtrans-78.4-44.9177.9-73.3-60.7000112.4F109 G115 I116 F117 A156 A159 I198 L201 R202F109-F113 HydrophobicContact CB-CD2 4.25Å; F109-F113 HydrophobicContact CB-CE2 4.19Å; F109-F113 AromaticContact CD1-CE2 3.91Å; F109-F113 HydrophobicContact CD1-CE2 3.91Å; F109-F113 HydrophobicContact CG-CE2 4.38Å; F109-F113 WeakPolarHBondContact O-CD2 3.48Å; F109-F113 PolarHBondContact O-N 3.49Å; F113-G115 VanDerWaalsContact C-N 3.26Å; F113-G115 PolarHBondContact O-N 3.4Å; F113-I116 WeakPolarHBondContact O-CG2 3.32Å; F113-I116 PolarHBondContact O-N 3.37Å; F113-F117 HydrophobicContact CB-CD2 4.49Å; F113-F117 HydrophobicContact CB-CE2 4.04Å; F113-F117 HydrophobicContact CB-CZ 4.44Å; F113-F117 VanDerWaalsContact O-CD2 3.29Å; F113-F117 WeakPolarHBondContact O-CD2 3.42Å; F113-F117 VanDerWaalsContact O-CG 3.22Å; F113-F117 WeakPolarHBondContact O-CG 3.43Å; F113-F117 PolarHBondContact O-N 3.03Å; F113-F117 VanDerWaalsContact O-N 3.08Å; F113-A156 HydrophobicContact CB-CB 4.23Å; F113-A159 HydrophobicContact CD1-CB 4.41Å; F113-A159 HydrophobicContact CD2-CB 3.87Å; F113-A159 HydrophobicContact CE2-CB 4.17Å; F113-A159 HydrophobicContact CG-CB 4.03Å; F113-I198 HydrophobicContact CZ-CG1 4.18Å; F113-L201 HydrophobicContact CD1-CD1 4.26Å; F113-L201 HydrophobicContact CE1-CB 4.31Å; F113-L201 HydrophobicContact CE1-CD1 3.97Å; F113-R202 HydrophobicContact CD1-CG 4.39Å; F113-R202 HydrophobicContact CE1-CG 4.25Å
114S97.1Very high94.5Very high0 Ų013 Ų130%07%0.068CC..Hα-helixtrans-62.2-36.6178.958.90000111.5S75 I110 I116 F117 F118S75-S114 WeakPolarHBondContact CB-OG 3.17Å; S75-S114 PolarHBondContact OG-OG 2.82Å; I110-S114 VanDerWaalsContact O-CB 3.25Å; I110-S114 WeakPolarHBondContact O-CB 3.27Å; I110-S114 PolarHBondContact O-N 3.25Å; I110-S114 PolarHBondContact O-OG 3.11Å; S114-I116 PolarHBondContact O-N 3.47Å; S114-F117 PolarHBondContact O-N 3.28Å; S114-F118 WeakPolarHBondContact O-CD2 3Å; S114-F118 PolarHBondContact O-N 3.45Å
115G94.8Very high94.2Very high7 Ų712.9 Ų12.97%0.0727%0.068CC..Hα-helixtrans-56.5-51.4177.100000112.8L72 S75 G111 F113 F118 I119L72-G115 WeakPolarHBondContact CD1-O 3.29Å; S75-G115 VanDerWaalsContact OG-CA 3.23Å; S75-G115 WeakPolarHBondContact OG-CA 3.46Å; S75-G115 PolarHBondContact OG-N 3.14Å; G111-G115 PolarHBondContact O-N 3.45Å; G111-G115 VanDerWaalsContact O-N 3.1Å; F113-G115 VanDerWaalsContact C-N 3.26Å; F113-G115 PolarHBondContact O-N 3.4Å; G115-F118 PolarHBondContact O-N 2.95Å; G115-I119 WeakPolarHBondContact O-CG1 3.34Å; G115-I119 PolarHBondContact O-N 3.43Å; G115-I119 VanDerWaalsContact O-N 3.1Å
116I94.3Very high93.7Very high1 Ų115 Ų151%0.0058%0.075CC..Hα-helixtrans-68-36.8178-172.651.9000112.3F113 S114 F118 I119 I120 R202 P206 Y244F113-I116 WeakPolarHBondContact O-CG2 3.32Å; F113-I116 PolarHBondContact O-N 3.37Å; S114-I116 PolarHBondContact O-N 3.47Å; I116-F118 PolarHBondContact O-N 3.38Å; I116-I119 HydrophobicContact CD1-CB 4.33Å; I116-I119 HydrophobicContact CD1-CG2 4.43Å; I116-I119 PolarHBondContact O-N 3.16Å; I116-I120 HydrophobicContact CG1-CD1 4.24Å; I116-I120 WeakPolarHBondContact O-CG1 3.23Å; I116-I120 PolarHBondContact O-N 2.92Å; I116-R202 HydrophobicContact CG2-CG 4.19Å; I116-P206 HydrophobicContact CD1-CB 3.68Å; I116-P206 HydrophobicContact CD1-CG 3.92Å; I116-P206 HydrophobicContact CG1-CB 4.1Å; I116-P206 HydrophobicContact CG1-CG 3.98Å; I116-Y244 HydrophobicContact CB-CE2 4.22Å; I116-Y244 HydrophobicContact CD1-CD1 3.94Å; I116-Y244 HydrophobicContact CD1-CD2 4.22Å; I116-Y244 HydrophobicContact CD1-CE1 3.47Å; I116-Y244 VanDerWaalsContact CD1-CE1 3.47Å; I116-Y244 HydrophobicContact CD1-CE2 3.78Å; I116-Y244 HydrophobicContact CD1-CG 4.29Å; I116-Y244 HydrophobicContact CG1-CE1 4.24Å; I116-Y244 HydrophobicContact CG1-CE2 4.31Å
117F96.8Very high93.3Very high22 Ų2217.1 Ų17.110%0.0968%0.082CC..Hα-helixtrans-64.9-39.9177.8-64-24.6000112F113 S114 I120 L121 T152 V155 A156 L201 L205F113-F117 HydrophobicContact CB-CD2 4.49Å; F113-F117 HydrophobicContact CB-CE2 4.04Å; F113-F117 HydrophobicContact CB-CZ 4.44Å; F113-F117 VanDerWaalsContact O-CD2 3.29Å; F113-F117 WeakPolarHBondContact O-CD2 3.42Å; F113-F117 VanDerWaalsContact O-CG 3.22Å; F113-F117 WeakPolarHBondContact O-CG 3.43Å; F113-F117 PolarHBondContact O-N 3.03Å; F113-F117 VanDerWaalsContact O-N 3.08Å; S114-F117 PolarHBondContact O-N 3.28Å; F117-I120 HydrophobicContact CD1-CD1 4.38Å; F117-I120 WeakPolarHBondContact O-CB 3.36Å; F117-I120 PolarHBondContact O-N 3.44Å; F117-L121 WeakPolarHBondContact O-CG 3.16Å; F117-L121 PolarHBondContact O-N 2.88Å; F117-T152 HydrophobicContact CB-CG2 3.5Å; F117-T152 HydrophobicContact CD2-CG2 4.16Å; F117-T152 HydrophobicContact CG-CG2 4.32Å; F117-V155 HydrophobicContact CE2-CG1 3.84Å; F117-V155 HydrophobicContact CZ-CG1 4.34Å; F117-A156 HydrophobicContact CD2-CB 4.32Å; F117-A156 HydrophobicContact CE2-CB 4.42Å; F117-L201 HydrophobicContact CE1-CB 4.47Å; F117-L201 HydrophobicContact CE1-CD2 4.41Å; F117-L201 HydrophobicContact CZ-CD1 4.33Å; F117-L201 HydrophobicContact CZ-CD2 4.42Å; F117-L205 HydrophobicContact CE1-CD2 4.46Å
118F95.5Very high92.7Very high0 Ų017.5 Ų17.50%08%0.084CC..Hα-helixtrans-68.2-33.5174.2-75.5-62.4000112.6Y68 N71 L72 S114 G115 I116 L121 L122 T152 W153Y68-F118 HydrophobicContact CD1-CD1 4.13Å; Y68-F118 HydrophobicContact CD1-CE1 4.27Å; N71-F118 HydrophobicContact CB-CD1 3.8Å; N71-F118 HydrophobicContact CB-CD2 3.84Å; N71-F118 HydrophobicContact CB-CE1 3.44Å; N71-F118 VanDerWaalsContact CB-CE1 3.44Å; N71-F118 HydrophobicContact CB-CE2 3.5Å; N71-F118 HydrophobicContact CB-CG 4.01Å; N71-F118 HydrophobicContact CB-CZ 3.3Å; L72-F118 HydrophobicContact CB-CB 4.15Å; L72-F118 HydrophobicContact CD1-CB 4.35Å; S114-F118 WeakPolarHBondContact O-CD2 3Å; S114-F118 PolarHBondContact O-N 3.45Å; G115-F118 PolarHBondContact O-N 2.95Å; I116-F118 PolarHBondContact O-N 3.38Å; F118-L121 HydrophobicContact CD1-CD1 4.05Å; F118-L121 HydrophobicContact CE1-CD1 4.22Å; F118-L121 PolarHBondContact O-N 3.3Å; F118-L122 WeakPolarHBondContact O-CB 3.38Å; F118-L122 VanDerWaalsContact O-CG 3.26Å; F118-L122 WeakPolarHBondContact O-CG 3.34Å; F118-L122 PolarHBondContact O-N 3.43Å; F118-T152 HydrophobicContact CD2-CG2 4.41Å; F118-T152 HydrophobicContact CE1-CG2 4.14Å; F118-T152 HydrophobicContact CE2-CG2 3.99Å; F118-T152 HydrophobicContact CZ-CG2 3.82Å; F118-W153 HydrophobicContact CE2-CD2 4.49Å; F118-W153 AromaticContact CE2-CE2 3.93Å; F118-W153 HydrophobicContact CE2-CZ2 4.14Å; F118-W153 AromaticContact CE2-NE1 3.91Å; F118-W153 AromaticContact CZ-NE1 3.72Å
119I92.4Very high92.2Very high3 Ų317.9 Ų17.92%0.0159%0.09CC..Hα-helixtrans-64.2-41.2171.3-68.7170.2000111.2L72 G115 I116 L122 T123 I240 M241 Y244L72-I119 HydrophobicContact CD1-CD1 4.43Å; L72-I119 HydrophobicContact CD1-CG1 4.05Å; L72-I119 HydrophobicContact CD2-CG1 4.06Å; G115-I119 WeakPolarHBondContact O-CG1 3.34Å; G115-I119 PolarHBondContact O-N 3.43Å; G115-I119 VanDerWaalsContact O-N 3.1Å; I116-I119 HydrophobicContact CD1-CB 4.33Å; I116-I119 HydrophobicContact CD1-CG2 4.43Å; I116-I119 PolarHBondContact O-N 3.16Å; I119-L122 PolarHBondContact O-N 2.95Å; I119-T123 PolarHBondContact O-N 3.18Å; I119-T123 PolarHBondContact O-OG1 3.02Å; I119-I240 HydrophobicContact CD1-CG2 4.35Å; I119-I240 HydrophobicContact CG1-CG2 4.31Å; I119-M241 HydrophobicContact CG2-CE 3.43Å; I119-M241 VanDerWaalsContact CG2-CE 3.43Å; I119-M241 HydrophobicContact CG2-SD 3.83Å; I119-Y244 HydrophobicContact CD1-CD2 4.03Å; I119-Y244 HydrophobicContact CD1-CG 4.41Å
120I94.1Very high91.4Very high15 Ų1517.2 Ų17.28%0.0779%0.087CC..Hα-helixtrans-61.3-49173.9-73.2167.4000110.2I116 F117 L122 T123 I124 L205 P206 V209I116-I120 HydrophobicContact CG1-CD1 4.24Å; I116-I120 WeakPolarHBondContact O-CG1 3.23Å; I116-I120 PolarHBondContact O-N 2.92Å; F117-I120 HydrophobicContact CD1-CD1 4.38Å; F117-I120 WeakPolarHBondContact O-CB 3.36Å; F117-I120 PolarHBondContact O-N 3.44Å; I120-L122 VanDerWaalsContact C-N 3.33Å; I120-L122 PolarHBondContact O-N 3.26Å; I120-T123 WeakPolarHBondContact O-CA 3.14Å; I120-T123 WeakPolarHBondContact O-CB 3.27Å; I120-T123 PolarHBondContact O-N 3.46Å; I120-I124 HydrophobicContact CG2-CD1 3.78Å; I120-I124 HydrophobicContact CG2-CG1 4.47Å; I120-I124 WeakPolarHBondContact O-CG1 3.46Å; I120-I124 PolarHBondContact O-N 3.08Å; I120-L205 HydrophobicContact CD1-CD2 4.01Å; I120-L205 HydrophobicContact CD1-CG 4.06Å; I120-P206 HydrophobicContact CD1-CB 3.94Å; I120-P206 HydrophobicContact CG1-CB 3.91Å; I120-V209 HydrophobicContact CG2-CG1 4.23Å; I120-V209 HydrophobicContact CG2-CG2 4.1Å
121L94.4Very high90.7Very high31 Ų3117.8 Ų17.816%0.1629%0.092CC..Hα-helixtrans-61.6-38.9178.1-73.6178.7000112.5Y68 F117 F118 T123 I124 D125 T152Y68-L121 HydrophobicContact CD1-CD1 4.42Å; Y68-L121 HydrophobicContact CD2-CB 4.02Å; Y68-L121 HydrophobicContact CE1-CB 4.43Å; Y68-L121 HydrophobicContact CE1-CD1 3.94Å; Y68-L121 HydrophobicContact CE2-CB 3.79Å; Y68-L121 HydrophobicContact CG-CB 4.41Å; F117-L121 WeakPolarHBondContact O-CG 3.16Å; F117-L121 PolarHBondContact O-N 2.88Å; F118-L121 HydrophobicContact CD1-CD1 4.05Å; F118-L121 HydrophobicContact CE1-CD1 4.22Å; F118-L121 PolarHBondContact O-N 3.3Å; L121-T123 VanDerWaalsContact C-N 3.3Å; L121-T123 PolarHBondContact O-N 2.97Å; L121-I124 PolarHBondContact O-N 3.16Å; L121-D125 WeakPolarHBondContact O-CB 3.2Å; L121-D125 PolarHBondContact O-N 3.42Å; L121-T152 HydrophobicContact CD1-CG2 4.4Å; L121-T152 VanDerWaalsContact CD1-OG1 3.32Å; L121-T152 WeakPolarHBondContact CD1-OG1 3.15Å
122L90.5Very high90Very high1 Ų121.8 Ų21.81%0.00511%0.11CC..Hα-helixtrans-61.9-38.9172.6-77.9167.4000111.9T65 Y68 L69 L72 F118 I119 I120 R126T65-L122 HydrophobicContact CG2-CD2 3.58Å; Y68-L122 HydrophobicContact CD2-CD2 4.35Å; L69-L122 HydrophobicContact CD2-CD1 3.88Å; L69-L122 HydrophobicContact CD2-CD2 4.2Å; L69-L122 HydrophobicContact CG-CD2 4.11Å; L72-L122 HydrophobicContact CD2-CD1 3.93Å; F118-L122 WeakPolarHBondContact O-CB 3.38Å; F118-L122 VanDerWaalsContact O-CG 3.26Å; F118-L122 WeakPolarHBondContact O-CG 3.34Å; F118-L122 PolarHBondContact O-N 3.43Å; I119-L122 PolarHBondContact O-N 2.95Å; I120-L122 VanDerWaalsContact C-N 3.33Å; I120-L122 PolarHBondContact O-N 3.26Å; L122-R126 WeakPolarHBondContact O-CG 3.44Å; L122-R126 PolarHBondContact O-N 3.12Å
123T89.9Confident89.1Confident1 Ų123.8 Ų23.81%0.00613%0.128CC..Hα-helixtrans-67.2-45.2177.8-57.50000111.2I119 I120 L121 R126 Y127 V209 C213 Y214 M241I119-T123 PolarHBondContact O-N 3.18Å; I119-T123 PolarHBondContact O-OG1 3.02Å; I120-T123 WeakPolarHBondContact O-CA 3.14Å; I120-T123 WeakPolarHBondContact O-CB 3.27Å; I120-T123 PolarHBondContact O-N 3.46Å; L121-T123 VanDerWaalsContact C-N 3.3Å; L121-T123 PolarHBondContact O-N 2.97Å; T123-R126 PolarHBondContact O-N 2.96Å; T123-Y127 WeakPolarHBondContact O-CB 3.33Å; T123-Y127 PolarHBondContact O-N 3.39Å; T123-V209 HydrophobicContact CG2-CG1 4.15Å; T123-C213 HydrophobicContact CG2-CB 3.84Å; T123-Y214 HydrophobicContact CG2-CE2 3.89Å; T123-M241 HydrophobicContact CG2-CE 4.42Å; T123-M241 WeakPolarHBondContact OG1-CE 3.33Å
124I91.1Very high87.7Confident61 Ų6130 Ų3031%0.31317%0.165SC..Hα-helixtrans-64.9-44.2176.4-64.6168.6000110.8I120 L121 R126 Y127 L128 V209I120-I124 HydrophobicContact CG2-CD1 3.78Å; I120-I124 HydrophobicContact CG2-CG1 4.47Å; I120-I124 WeakPolarHBondContact O-CG1 3.46Å; I120-I124 PolarHBondContact O-N 3.08Å; L121-I124 PolarHBondContact O-N 3.16Å; I124-R126 VanDerWaalsContact C-N 3.28Å; I124-R126 PolarHBondContact O-N 3.37Å; I124-Y127 WeakPolarHBondContact O-CB 3.35Å; I124-Y127 PolarHBondContact O-N 2.92Å; I124-Y127 VanDerWaalsContact O-N 3.15Å; I124-L128 HydrophobicContact CG2-CD1 4.01Å; I124-L128 HydrophobicContact CG2-CG 4.29Å; I124-L128 WeakPolarHBondContact O-CG 3.32Å; I124-L128 PolarHBondContact O-N 3.37Å; I124-V209 HydrophobicContact CG1-CG1 4.04Å
125D88.4Confident86.1Confident3 Ų335.5 Ų35.52%0.01619%0.19CC..Hα-helixtrans-55.7-43.7176175.363.8000111.6T65 Y68 L121 A129 R140T65-D125 PolarHBondContact OG1-OD2 3.5Å; Y68-D125 HydrophobicContact CD2-CB 4.3Å; Y68-D125 HydrophobicContact CE2-CB 4.12Å; L121-D125 WeakPolarHBondContact O-CB 3.2Å; L121-D125 PolarHBondContact O-N 3.42Å; D125-A129 WeakPolarHBondContact O-CB 3.22Å; D125-A129 PolarHBondContact O-N 3.37Å; D125-A129 VanDerWaalsContact O-N 3.11Å; D125-R140 IonicContact OD1-CZ 3.94Å; D125-R140 IonicContact OD1-NE 2.71Å; D125-R140 PolarHBondContact OD1-NE 3.1Å; D125-R140 IonicContact OD1-NH2 3.42Å; D125-R140 PolarHBondContact OD1-NH2 3.13Å; D125-R140 IonicContact OD2-CZ 3.6Å; D125-R140 IonicContact OD2-NH2 2.65Å; D125-R140 PolarHBondContact OD2-NH2 3.49Å
126R85.6Confident84.6Confident53 Ų5335.7 Ų35.720%0.219%0.19CC..Hα-helixtrans-69-41.9175.3-72.6-60.7136-160.68.2113T65 L122 T123 I124 A129 V130 I237T65-R126 VanDerWaalsContact CB-NH2 3.3Å; T65-R126 PolarHBondContact OG1-NH2 3.23Å; L122-R126 WeakPolarHBondContact O-CG 3.44Å; L122-R126 PolarHBondContact O-N 3.12Å; T123-R126 PolarHBondContact O-N 2.96Å; I124-R126 VanDerWaalsContact C-N 3.28Å; I124-R126 PolarHBondContact O-N 3.37Å; R126-A129 PolarHBondContact O-N 3.08Å; R126-V130 WeakPolarHBondContact O-CG2 3.12Å; R126-V130 PolarHBondContact O-N 3.4Å; R126-I237 HydrophobicContact CG-CB 4.29Å; R126-I237 HydrophobicContact CG-CG1 3.56Å
127Y86.8Confident83.1Confident48 Ų4843 Ų4319%0.18823%0.228CC..Hα-helixtrans-56.2-52.1176.9173.5-100.1000111.2T123 I124 A129 V130 V131 H132 C213 I217T123-Y127 WeakPolarHBondContact O-CB 3.33Å; T123-Y127 PolarHBondContact O-N 3.39Å; I124-Y127 WeakPolarHBondContact O-CB 3.35Å; I124-Y127 PolarHBondContact O-N 2.92Å; I124-Y127 VanDerWaalsContact O-N 3.15Å; Y127-A129 VanDerWaalsContact C-N 3.32Å; Y127-A129 PolarHBondContact O-N 3.15Å; Y127-V130 PolarHBondContact O-N 2.99Å; Y127-V131 HydrophobicContact CD2-CB 4.37Å; Y127-V131 HydrophobicContact CD2-CG2 3.75Å; Y127-V131 HydrophobicContact CE2-CB 4.08Å; Y127-V131 HydrophobicContact CE2-CG1 4.29Å; Y127-V131 HydrophobicContact CE2-CG2 3.61Å; Y127-V131 WeakPolarHBondContact O-CB 3.37Å; Y127-V131 PolarHBondContact O-N 3.42Å; Y127-H132 AromaticContact CE1-CD2 3.78Å; Y127-H132 AromaticContact CE1-NE2 3.89Å; Y127-C213 VanDerWaalsContact CD2-CA 3.46Å; Y127-C213 HydrophobicContact CD2-CB 3.88Å; Y127-C213 VanDerWaalsContact CD2-O 3.25Å; Y127-C213 WeakPolarHBondContact CD2-O 3.29Å; Y127-C213 HydrophobicContact CG-CB 4.1Å; Y127-I217 HydrophobicContact CD2-CD1 4.49Å; Y127-I217 HydrophobicContact CD2-CG1 4.1Å
128L85.9Confident81.6Confident49 Ų4950 Ų5026%0.25726%0.259SS..Hα-helixtrans-60.8-42.5178.9-67.6175.2000111.5I124 V130 H132I124-L128 HydrophobicContact CG2-CD1 4.01Å; I124-L128 HydrophobicContact CG2-CG 4.29Å; I124-L128 WeakPolarHBondContact O-CG 3.32Å; I124-L128 PolarHBondContact O-N 3.37Å; L128-V130 VanDerWaalsContact C-N 3.27Å; L128-V130 PolarHBondContact O-N 3.22Å; L128-H132 HydrophobicContact CD2-CB 4.5Å; L128-H132 CarbonylContact O-C 3.55Å; L128-H132 WeakPolarHBondContact O-CA 3.18Å; L128-H132 PolarHBondContact O-N 3.29Å
129A83.1Confident80Confident21 Ų2153.1 Ų53.117%0.17428%0.276CS..Hα-helixtrans-63-30.6178.700000113.8D125 R126 Y127D125-A129 WeakPolarHBondContact O-CB 3.22Å; D125-A129 PolarHBondContact O-N 3.37Å; D125-A129 VanDerWaalsContact O-N 3.11Å; R126-A129 PolarHBondContact O-N 3.08Å; Y127-A129 VanDerWaalsContact C-N 3.32Å; Y127-A129 PolarHBondContact O-N 3.15Å
130V79.3Confident79.2Confident9 Ų956.3 Ų56.36%0.05529%0.288CS..Hα-helixtrans-94.4-46.3-175.7172.50000112.2R126 Y127 L128 I217 T220 R230 V234R126-V130 WeakPolarHBondContact O-CG2 3.12Å; R126-V130 PolarHBondContact O-N 3.4Å; Y127-V130 PolarHBondContact O-N 2.99Å; L128-V130 VanDerWaalsContact C-N 3.27Å; L128-V130 PolarHBondContact O-N 3.22Å; V130-I217 HydrophobicContact CB-CG1 4.36Å; V130-I217 HydrophobicContact CG1-CG1 4.34Å; V130-I217 HydrophobicContact CG1-CG2 4.24Å; V130-T220 HydrophobicContact CG1-CG2 4.49Å; V130-R230 HydrophobicContact CG2-CG 4.02Å; V130-V234 HydrophobicContact CG2-CG2 4.02Å
131V82.6Confident78.7Confident38 Ų3859 Ų5923%0.2330%0.304CS..Hα-helixtrans-89.1-34.8-172.8-177.70000111.5Y127 I217Y127-V131 HydrophobicContact CD2-CB 4.37Å; Y127-V131 HydrophobicContact CD2-CG2 3.75Å; Y127-V131 HydrophobicContact CE2-CB 4.08Å; Y127-V131 HydrophobicContact CE2-CG1 4.29Å; Y127-V131 HydrophobicContact CE2-CG2 3.61Å; Y127-V131 WeakPolarHBondContact O-CB 3.37Å; Y127-V131 PolarHBondContact O-N 3.42Å; V131-I217 HydrophobicContact CG2-CG1 4.21Å
132H80.8Confident78.3Confident86 Ų8660.1 Ų60.140%0.39831%0.313SS..  trans-12148.5-175.9-62-72.5000111.9Y127 L128 V134 F135 A136Y127-H132 AromaticContact CE1-CD2 3.78Å; Y127-H132 AromaticContact CE1-NE2 3.89Å; L128-H132 HydrophobicContact CD2-CB 4.5Å; L128-H132 CarbonylContact O-C 3.55Å; L128-H132 WeakPolarHBondContact O-CA 3.18Å; L128-H132 PolarHBondContact O-N 3.29Å; H132-V134 VanDerWaalsContact C-N 3.26Å; H132-V134 PolarHBondContact O-N 2.83Å; H132-V134 VanDerWaalsContact O-N 3.11Å; H132-F135 HydrophobicContact CB-CB 4.21Å; H132-F135 PolarHBondContact O-N 3.46Å; H132-A136 WeakPolarHBondContact O-CB 3.24Å; H132-A136 PolarHBondContact O-N 3.3Å
133A72.6Confident78.3Confident51 Ų5165 Ų6542%0.42134%0.343SS..Hα-helixtrans-53.7-35.2-171.900000114.8L137A133-L137 PolarHBondContact O-N 2.61Å
134V66.1Low78.2Confident129 Ų12969.9 Ų69.978%0.78236%0.364SS*.Hα-helixtrans-71.5-41.1178.8-179.20000111.9H132H132-V134 VanDerWaalsContact C-N 3.26Å; H132-V134 PolarHBondContact O-N 2.83Å; H132-V134 VanDerWaalsContact O-N 3.11Å
135F62.7Low78.3Confident117 Ų11767 Ų6751%0.51335%0.349SS..Hα-helixtrans-69.3-37.8175.2-177.1-100.2000111.3H132 L137 K138 D139H132-F135 HydrophobicContact CB-CB 4.21Å; H132-F135 PolarHBondContact O-N 3.46Å; F135-L137 PolarHBondContact O-N 2.85Å; F135-K138 PolarHBondContact O-N 3.27Å; F135-K138 VanDerWaalsContact O-N 3.1Å; F135-D139 HydrophobicContact CE1-CB 4.3Å; F135-D139 VanDerWaalsContact CE1-OD2 3.23Å; F135-D139 WeakPolarHBondContact CE1-OD2 3.43Å; F135-D139 VanDerWaalsContact CE2-OD2 3.31Å; F135-D139 WeakPolarHBondContact CE2-OD2 3.14Å; F135-D139 WeakPolarHBondContact CZ-OD2 3.23Å; F135-D139 PolarHBondContact O-N 2.86Å
136A63.8Low78.6Confident10 Ų1070.1 Ų70.18%0.08337%0.369CS..Hα-helixtrans-61.7-24.8178.500000114.3H132 K138 R140H132-A136 WeakPolarHBondContact O-CB 3.24Å; H132-A136 PolarHBondContact O-N 3.3Å; A136-K138 VanDerWaalsContact C-N 3.33Å; A136-R140 HydrophobicContact CB-CG 4.33Å; A136-R140 VanDerWaalsContact O-CB 3.29Å; A136-R140 WeakPolarHBondContact O-CB 3.25Å; A136-R140 WeakPolarHBondContact O-CG 3.13Å; A136-R140 PolarHBondContact O-N 2.88Å
137L63.8Low79Confident154 Ų15471.1 Ų71.181%0.80638%0.38SS*.Hα-helixtrans-71-27.2175.8-76.8164.3000112.9A133 F135A133-L137 PolarHBondContact O-N 2.61Å; F135-L137 PolarHBondContact O-N 2.85Å
138K63.9Low79.5Confident169 Ų16969.9 Ų69.974%0.73538%0.378SS*.Hα-helixtrans-90.9-38-178.1-167.2177.7176.6-175.20112.5F135 A136F135-K138 PolarHBondContact O-N 3.27Å; F135-K138 VanDerWaalsContact O-N 3.1Å; A136-K138 VanDerWaalsContact C-N 3.33Å
139D63Low80Confident66 Ų6667.7 Ų67.735%0.35337%0.367SS..Hα-helixtrans-103.3-11.7-167-72.92000115.2F135 T141F135-D139 HydrophobicContact CE1-CB 4.3Å; F135-D139 VanDerWaalsContact CE1-OD2 3.23Å; F135-D139 WeakPolarHBondContact CE1-OD2 3.43Å; F135-D139 VanDerWaalsContact CE2-OD2 3.31Å; F135-D139 WeakPolarHBondContact CE2-OD2 3.14Å; F135-D139 WeakPolarHBondContact CZ-OD2 3.23Å; F135-D139 PolarHBondContact O-N 2.86Å; D139-T141 VanDerWaalsContact C-N 3.27Å; D139-T141 PolarHBondContact O-N 3.39Å; D139-T141 VanDerWaalsContact O-N 3.14Å
140R75.2Confident80.7Confident71 Ų7170.9 Ų70.927%0.26838%0.383SS..  trans-90.446.3-178.8-63.1176.270.7-135.1-0.3113.5M64 T65 D125 A136M64-R140 HydrophobicContact SD-CB 4.02Å; M64-R140 HydrophobicContact SD-CG 4.09Å; T65-R140 PolarHBondContact OG1-NH2 2.89Å; D125-R140 IonicContact OD1-CZ 3.94Å; D125-R140 IonicContact OD1-NE 2.71Å; D125-R140 PolarHBondContact OD1-NE 3.1Å; D125-R140 IonicContact OD1-NH2 3.42Å; D125-R140 PolarHBondContact OD1-NH2 3.13Å; D125-R140 IonicContact OD2-CZ 3.6Å; D125-R140 IonicContact OD2-NH2 2.65Å; D125-R140 PolarHBondContact OD2-NH2 3.49Å; A136-R140 HydrophobicContact CB-CG 4.33Å; A136-R140 VanDerWaalsContact O-CB 3.29Å; A136-R140 WeakPolarHBondContact O-CB 3.25Å; A136-R140 WeakPolarHBondContact O-CG 3.13Å; A136-R140 PolarHBondContact O-N 2.88Å
141T82.7Confident81.6Confident70 Ų7075 Ų7543%0.42941%0.405SS..  trans-77154.4175.264.90000111.1D139 T143 F144 G145D139-T141 VanDerWaalsContact C-N 3.27Å; D139-T141 PolarHBondContact O-N 3.39Å; D139-T141 VanDerWaalsContact O-N 3.14Å; T141-T143 PolarHBondContact O-N 2.71Å; T141-F144 PolarHBondContact O-N 3.35Å; T141-F144 PolarHBondContact OG1-N 3.14Å; T141-G145 PolarHBondContact O-N 3.08Å; T141-G145 VanDerWaalsContact O-N 3.16Å
142V86.9Confident82.3Confident56 Ų5674 Ų7434%0.33940%0.399SS..Hα-helixtrans-59.4-37.9175.2174.30000110.7I67 F144 G145 V146I67-V142 HydrophobicContact CD1-CG1 4.16Å; I67-V142 HydrophobicContact CG1-CG1 4.19Å; V142-F144 PolarHBondContact O-N 2.65Å; V142-G145 PolarHBondContact O-N 3.38Å; V142-G145 VanDerWaalsContact O-N 3.16Å; V142-V146 HydrophobicContact CG1-CG2 4.43Å; V142-V146 WeakPolarHBondContact O-CG2 3.41Å; V142-V146 PolarHBondContact O-N 3.34Å
143T89.3Confident83.2Confident103 Ų10372.2 Ų72.263%0.63239%0.388SS*.Hα-helixtrans-57.2-47.8176.7-48.40000111.8T141 G145 V146 V147T141-T143 PolarHBondContact O-N 2.71Å; T143-G145 VanDerWaalsContact C-N 3.33Å; T143-G145 PolarHBondContact O-N 3.43Å; T143-V146 PolarHBondContact O-N 2.9Å; T143-V147 WeakPolarHBondContact O-CG2 3.22Å; T143-V147 PolarHBondContact O-N 2.89Å
144F89.3Confident84.4Confident103 Ų10373.1 Ų73.145%0.45239%0.389SS..Hα-helixtrans-62.7-42177.3-170.6-103.1000111.4M64 T141 V142 V146 V147 T148M64-F144 HydrophobicContact CE-CD1 3.55Å; M64-F144 HydrophobicContact CE-CE1 3.92Å; M64-F144 HydrophobicContact SD-CD1 4.26Å; T141-F144 PolarHBondContact O-N 3.35Å; T141-F144 PolarHBondContact OG1-N 3.14Å; V142-F144 PolarHBondContact O-N 2.65Å; F144-V146 VanDerWaalsContact C-N 3.3Å; F144-V146 PolarHBondContact O-N 3.38Å; F144-V147 PolarHBondContact O-N 3.43Å; F144-T148 HydrophobicContact CD1-CG2 3.9Å; F144-T148 HydrophobicContact CE1-CG2 3.48Å; F144-T148 VanDerWaalsContact CE1-CG2 3.48Å; F144-T148 HydrophobicContact CE2-CG2 4.21Å; F144-T148 HydrophobicContact CG-CG2 4.42Å; F144-T148 HydrophobicContact CZ-CG2 3.66Å; F144-T148 WeakPolarHBondContact O-CG2 3.25Å; F144-T148 PolarHBondContact O-N 3.03Å; F144-T148 PolarHBondContact O-OG1 2.87Å
145G91.7Very high85.9Confident0 Ų070.3 Ų70.30%037%0.371CS..Hα-helixtrans-59-36174.200000114.4T141 V142 T143 T148 S149T141-G145 PolarHBondContact O-N 3.08Å; T141-G145 VanDerWaalsContact O-N 3.16Å; V142-G145 PolarHBondContact O-N 3.38Å; V142-G145 VanDerWaalsContact O-N 3.16Å; T143-G145 VanDerWaalsContact C-N 3.33Å; T143-G145 PolarHBondContact O-N 3.43Å; G145-T148 WeakPolarHBondContact CA-OG1 3.46Å; G145-T148 PolarHBondContact O-OG1 2.9Å; G145-T148 VanDerWaalsContact O-OG1 3.08Å; G145-S149 WeakPolarHBondContact O-CB 3.27Å; G145-S149 PolarHBondContact O-N 3.22Å; G145-S149 VanDerWaalsContact O-N 3.14Å; G145-S149 PolarHBondContact O-OG 3.1Å
146V94.7Very high87.5Confident70 Ų7064.8 Ų64.842%0.42435%0.347SS..Hα-helixtrans-70.2-47.9175.2172.50000110.6V142 T143 F144 T148 S149 V150V142-V146 HydrophobicContact CG1-CG2 4.43Å; V142-V146 WeakPolarHBondContact O-CG2 3.41Å; V142-V146 PolarHBondContact O-N 3.34Å; T143-V146 PolarHBondContact O-N 2.9Å; F144-V146 VanDerWaalsContact C-N 3.3Å; F144-V146 PolarHBondContact O-N 3.38Å; V146-T148 PolarHBondContact O-N 3.47Å; V146-S149 WeakPolarHBondContact O-CB 3.37Å; V146-S149 PolarHBondContact O-N 3.39Å; V146-V150 WeakPolarHBondContact O-CG2 3.44Å; V146-V150 PolarHBondContact O-N 3.07Å
147V95.6Very high89.1Confident74 Ų7467.2 Ų67.245%0.44836%0.361SS..Hα-helixtrans-60-48179.9172.80000111.1T143 F144 S149 V150 I151T143-V147 WeakPolarHBondContact O-CG2 3.22Å; T143-V147 PolarHBondContact O-N 2.89Å; F144-V147 PolarHBondContact O-N 3.43Å; V147-S149 VanDerWaalsContact C-N 3.3Å; V147-S149 PolarHBondContact O-N 3.41Å; V147-V150 PolarHBondContact O-N 2.9Å; V147-I151 HydrophobicContact CG1-CD1 4.02Å; V147-I151 WeakPolarHBondContact O-CG1 3.37Å; V147-I151 PolarHBondContact O-N 3.36Å; V147-I151 VanDerWaalsContact O-N 3.08Å
148T95.8Very high90.7Very high21 Ų2166.3 Ų66.313%0.12935%0.351CS..Hα-helixtrans-62-38.9177.253.90000111.7Y68 F144 G145 V146 I151 T152Y68-T148 WeakPolarHBondContact CE1-OG1 3.46Å; Y68-T148 WeakPolarHBondContact OH-CB 3.36Å; Y68-T148 PolarHBondContact OH-OG1 2.94Å; F144-T148 HydrophobicContact CD1-CG2 3.9Å; F144-T148 HydrophobicContact CE1-CG2 3.48Å; F144-T148 VanDerWaalsContact CE1-CG2 3.48Å; F144-T148 HydrophobicContact CE2-CG2 4.21Å; F144-T148 HydrophobicContact CG-CG2 4.42Å; F144-T148 HydrophobicContact CZ-CG2 3.66Å; F144-T148 WeakPolarHBondContact O-CG2 3.25Å; F144-T148 PolarHBondContact O-N 3.03Å; F144-T148 PolarHBondContact O-OG1 2.87Å; G145-T148 WeakPolarHBondContact CA-OG1 3.46Å; G145-T148 PolarHBondContact O-OG1 2.9Å; G145-T148 VanDerWaalsContact O-OG1 3.08Å; V146-T148 PolarHBondContact O-N 3.47Å; T148-I151 PolarHBondContact O-N 2.95Å; T148-T152 WeakPolarHBondContact O-CB 3.3Å; T148-T152 PolarHBondContact O-N 3.04Å; T148-T152 PolarHBondContact O-OG1 3.29Å
149S97.1Very high92.2Very high4 Ų459 Ų593%0.02832%0.321CS..Hα-helixtrans-62.9-43.3176.6-59.40000112.2N71 G145 V146 V147 I151 T152 W153N71-S149 PolarHBondContact ND2-OG 3.34Å; G145-S149 WeakPolarHBondContact O-CB 3.27Å; G145-S149 PolarHBondContact O-N 3.22Å; G145-S149 VanDerWaalsContact O-N 3.14Å; G145-S149 PolarHBondContact O-OG 3.1Å; V146-S149 WeakPolarHBondContact O-CB 3.37Å; V146-S149 PolarHBondContact O-N 3.39Å; V147-S149 VanDerWaalsContact C-N 3.3Å; V147-S149 PolarHBondContact O-N 3.41Å; S149-I151 VanDerWaalsContact C-N 3.35Å; S149-I151 PolarHBondContact O-N 3.32Å; S149-T152 WeakPolarHBondContact O-CB 3.42Å; S149-T152 PolarHBondContact O-N 2.87Å; S149-W153 PolarHBondContact O-N 3.4Å
150V98Very high93.7Very high87 Ų8755.8 Ų55.853%0.52730%0.304SS..Hα-helixtrans-60.3-45.8176.3171.80000110.7V146 V147 T152 W153 V154V146-V150 WeakPolarHBondContact O-CG2 3.44Å; V146-V150 PolarHBondContact O-N 3.07Å; V147-V150 PolarHBondContact O-N 2.9Å; V150-T152 VanDerWaalsContact C-N 3.32Å; V150-T152 PolarHBondContact O-N 2.99Å; V150-W153 PolarHBondContact O-N 2.8Å; V150-V154 WeakPolarHBondContact O-CG2 3.34Å; V150-V154 PolarHBondContact O-N 2.78Å; V150-V154 VanDerWaalsContact O-N 3.07Å
151I97.9Very high94.6Very high97 Ų9755.5 Ų55.550%0.49731%0.308SS..Hα-helixtrans-59.9-44.7176.2-65.3166.7000110.4V147 T148 S149 W153 V154 V155V147-I151 HydrophobicContact CG1-CD1 4.02Å; V147-I151 WeakPolarHBondContact O-CG1 3.37Å; V147-I151 PolarHBondContact O-N 3.36Å; V147-I151 VanDerWaalsContact O-N 3.08Å; T148-I151 PolarHBondContact O-N 2.95Å; S149-I151 VanDerWaalsContact C-N 3.35Å; S149-I151 PolarHBondContact O-N 3.32Å; I151-W153 VanDerWaalsContact C-N 3.34Å; I151-W153 PolarHBondContact O-N 2.83Å; I151-V154 PolarHBondContact O-N 3.17Å; I151-V155 HydrophobicContact CG2-CG2 4.33Å; I151-V155 WeakPolarHBondContact O-CG2 3.26Å; I151-V155 PolarHBondContact O-N 2.93Å
152T98Very high95Very high17 Ų1753.3 Ų53.310%0.10430%0.295CS..Hα-helixtrans-60.9-40.6178.2-640000112.7F117 F118 L121 T148 S149 V150 V155 A156F117-T152 HydrophobicContact CB-CG2 3.5Å; F117-T152 HydrophobicContact CD2-CG2 4.16Å; F117-T152 HydrophobicContact CG-CG2 4.32Å; F118-T152 HydrophobicContact CD2-CG2 4.41Å; F118-T152 HydrophobicContact CE1-CG2 4.14Å; F118-T152 HydrophobicContact CE2-CG2 3.99Å; F118-T152 HydrophobicContact CZ-CG2 3.82Å; L121-T152 HydrophobicContact CD1-CG2 4.4Å; L121-T152 VanDerWaalsContact CD1-OG1 3.32Å; L121-T152 WeakPolarHBondContact CD1-OG1 3.15Å; T148-T152 WeakPolarHBondContact O-CB 3.3Å; T148-T152 PolarHBondContact O-N 3.04Å; T148-T152 PolarHBondContact O-OG1 3.29Å; S149-T152 WeakPolarHBondContact O-CB 3.42Å; S149-T152 PolarHBondContact O-N 2.87Å; V150-T152 VanDerWaalsContact C-N 3.32Å; V150-T152 PolarHBondContact O-N 2.99Å; T152-V155 PolarHBondContact O-N 3.42Å; T152-A156 WeakPolarHBondContact O-CB 3.46Å; T152-A156 PolarHBondContact O-N 2.95Å
153W98.2Very high95.1Very high47 Ų4750.7 Ų50.718%0.17828%0.279CS..Hα-helixtrans-61.7-45.7174.2-81112.6000112N71 I74 F78 I110 F118 S149 V150 I151 V155 A156 V157N71-W153 PolarHBondContact OD1-NE1 3.5Å; I74-W153 HydrophobicContact CB-CZ2 4.29Å; I74-W153 HydrophobicContact CG2-CH2 4Å; I74-W153 HydrophobicContact CG2-CZ2 3.82Å; F78-W153 AromaticContact CD2-CH2 3.62Å; F78-W153 HydrophobicContact CD2-CH2 3.62Å; F78-W153 AromaticContact CD2-CZ3 3.61Å; F78-W153 HydrophobicContact CD2-CZ3 3.61Å; F78-W153 HydrophobicContact CE2-CE3 4.38Å; F78-W153 AromaticContact CE2-CH2 3.5Å; F78-W153 HydrophobicContact CE2-CH2 3.5Å; F78-W153 VanDerWaalsContact CE2-CH2 3.5Å; F78-W153 HydrophobicContact CE2-CZ2 4.45Å; F78-W153 AromaticContact CE2-CZ3 3.46Å; F78-W153 HydrophobicContact CE2-CZ3 3.46Å; F78-W153 VanDerWaalsContact CE2-CZ3 3.46Å; I110-W153 HydrophobicContact CG2-CE3 4.07Å; I110-W153 HydrophobicContact CG2-CZ3 3.61Å; F118-W153 HydrophobicContact CE2-CD2 4.49Å; F118-W153 AromaticContact CE2-CE2 3.93Å; F118-W153 HydrophobicContact CE2-CZ2 4.14Å; F118-W153 AromaticContact CE2-NE1 3.91Å; F118-W153 AromaticContact CZ-NE1 3.72Å; S149-W153 PolarHBondContact O-N 3.4Å; V150-W153 PolarHBondContact O-N 2.8Å; I151-W153 VanDerWaalsContact C-N 3.34Å; I151-W153 PolarHBondContact O-N 2.83Å; W153-V155 VanDerWaalsContact C-N 3.35Å; W153-V155 PolarHBondContact O-N 3.42Å; W153-A156 PolarHBondContact O-N 3.3Å; W153-V157 WeakPolarHBondContact O-CG2 3.35Å; W153-V157 PolarHBondContact O-N 3.25Å
154V98.2Very high95.2Very high71 Ų7147.7 Ų47.743%0.4326%0.259SS..Hα-helixtrans-58.8-47.9176.6172.50000110.5V150 I151 A156 V157 F158V150-V154 WeakPolarHBondContact O-CG2 3.34Å; V150-V154 PolarHBondContact O-N 2.78Å; V150-V154 VanDerWaalsContact O-N 3.07Å; I151-V154 PolarHBondContact O-N 3.17Å; V154-A156 VanDerWaalsContact C-N 3.34Å; V154-A156 PolarHBondContact O-N 3.19Å; V154-V157 PolarHBondContact O-N 2.88Å; V154-F158 HydrophobicContact CG1-CD2 3.65Å; V154-F158 HydrophobicContact CG1-CE2 3.49Å; V154-F158 VanDerWaalsContact CG1-CE2 3.49Å; V154-F158 WeakPolarHBondContact O-CD2 3.36Å; V154-F158 PolarHBondContact O-N 3.35Å
155V97.8Very high95.4Very high70 Ų7047.8 Ų47.842%0.42426%0.263SS..Hα-helixtrans-61.3-41.2177.3174.50000111.8F117 I151 T152 W153 V157 F158 A159F117-V155 HydrophobicContact CE2-CG1 3.84Å; F117-V155 HydrophobicContact CZ-CG1 4.34Å; I151-V155 HydrophobicContact CG2-CG2 4.33Å; I151-V155 WeakPolarHBondContact O-CG2 3.26Å; I151-V155 PolarHBondContact O-N 2.93Å; T152-V155 PolarHBondContact O-N 3.42Å; W153-V155 VanDerWaalsContact C-N 3.35Å; W153-V155 PolarHBondContact O-N 3.42Å; V155-V157 PolarHBondContact O-N 2.89Å; V155-F158 PolarHBondContact O-N 3.26Å; V155-A159 WeakPolarHBondContact O-CB 3.24Å; V155-A159 PolarHBondContact O-N 3.45Å
156A97.6Very high95.4Very high0 Ų049 Ų490%027%0.268CS..Hα-helixtrans-64-39.6177.400000112.2F113 F117 T152 W153 V154 A159 S160F113-A156 HydrophobicContact CB-CB 4.23Å; F117-A156 HydrophobicContact CD2-CB 4.32Å; F117-A156 HydrophobicContact CE2-CB 4.42Å; T152-A156 WeakPolarHBondContact O-CB 3.46Å; T152-A156 PolarHBondContact O-N 2.95Å; W153-A156 PolarHBondContact O-N 3.3Å; V154-A156 VanDerWaalsContact C-N 3.34Å; V154-A156 PolarHBondContact O-N 3.19Å; A156-A159 PolarHBondContact O-N 3.4Å; A156-S160 WeakPolarHBondContact O-CB 3.26Å; A156-S160 PolarHBondContact O-N 3.22Å; A156-S160 VanDerWaalsContact O-N 3.13Å; A156-S160 PolarHBondContact O-OG 3.4Å
157V97.2Very high95.3Very high61 Ų6145.8 Ų45.837%0.3725%0.249SC..Hα-helixtrans-62.3-50.4173.7171.90000110.2I110 W153 V154 V155 A159 S160 L161I110-V157 HydrophobicContact CD1-CG2 4Å; I110-V157 HydrophobicContact CG1-CG2 4.21Å; W153-V157 WeakPolarHBondContact O-CG2 3.35Å; W153-V157 PolarHBondContact O-N 3.25Å; V154-V157 PolarHBondContact O-N 2.88Å; V155-V157 PolarHBondContact O-N 2.89Å; V157-A159 VanDerWaalsContact C-N 3.34Å; V157-A159 PolarHBondContact O-N 2.64Å; V157-S160 WeakPolarHBondContact O-CA 3.41Å; V157-S160 WeakPolarHBondContact O-CB 3.35Å; V157-S160 PolarHBondContact O-N 3.13Å; V157-L161 WeakPolarHBondContact O-CG 3.48Å; V157-L161 PolarHBondContact O-N 3.34Å; V157-L161 VanDerWaalsContact O-N 3.11Å
158F96.6Very high95.1Very high136 Ų13647.4 Ų47.460%0.59625%0.25SC*.Hα-helixtrans-59-42177.8-82.4-69.4000112.9V154 V155 S160 L161V154-F158 HydrophobicContact CG1-CD2 3.65Å; V154-F158 HydrophobicContact CG1-CE2 3.49Å; V154-F158 VanDerWaalsContact CG1-CE2 3.49Å; V154-F158 WeakPolarHBondContact O-CD2 3.36Å; V154-F158 PolarHBondContact O-N 3.35Å; V155-F158 PolarHBondContact O-N 3.26Å; F158-S160 PolarHBondContact O-N 3.35Å; F158-L161 HydrophobicContact CD1-CD1 3.64Å; F158-L161 HydrophobicContact CE1-CD1 4.11Å; F158-L161 HydrophobicContact CG-CD1 4.47Å; F158-L161 PolarHBondContact O-N 3.24Å
159A95.1Very high94.9Very high14 Ų1447.5 Ų47.512%0.11625%0.251CS..Hα-helixtrans-62.9-27.7176.300000112.9F113 V155 A156 V157 K197 L201F113-A159 HydrophobicContact CD1-CB 4.41Å; F113-A159 HydrophobicContact CD2-CB 3.87Å; F113-A159 HydrophobicContact CE2-CB 4.17Å; F113-A159 HydrophobicContact CG-CB 4.03Å; V155-A159 WeakPolarHBondContact O-CB 3.24Å; V155-A159 PolarHBondContact O-N 3.45Å; A156-A159 PolarHBondContact O-N 3.4Å; V157-A159 VanDerWaalsContact C-N 3.34Å; V157-A159 PolarHBondContact O-N 2.64Å; A159-K197 PolarHBondContact O-NZ 3.19Å; A159-L201 HydrophobicContact CB-CD1 4.38Å
160S95.4Very high94.5Very high0 Ų051 Ų510%027%0.267CS..Hα-helixtrans-82.8-26.5-179.9-55.80000113.1F109 I110 A156 V157 F158 G163 I164F109-S160 VanDerWaalsContact C-OG 3.22Å; F109-S160 WeakPolarHBondContact CB-OG 3.22Å; F109-S160 PolarHBondContact O-OG 3.04Å; I110-S160 PolarHBondContact N-OG 2.94Å; A156-S160 WeakPolarHBondContact O-CB 3.26Å; A156-S160 PolarHBondContact O-N 3.22Å; A156-S160 VanDerWaalsContact O-N 3.13Å; A156-S160 PolarHBondContact O-OG 3.4Å; V157-S160 WeakPolarHBondContact O-CA 3.41Å; V157-S160 WeakPolarHBondContact O-CB 3.35Å; V157-S160 PolarHBondContact O-N 3.13Å; F158-S160 PolarHBondContact O-N 3.35Å; S160-G163 WeakPolarHBondContact O-CA 3.29Å; S160-G163 PolarHBondContact O-N 3.38Å; S160-I164 PolarHBondContact O-N 3.37Å; S160-I164 VanDerWaalsContact O-N 3.15Å
161L93.9Very high94Very high65 Ų6553 Ų5334%0.3427%0.269SS..Hα-helixtrans-51.6-47.5-173.7-71.8176.6000114.7V157 F158 G163 I164 I165V157-L161 WeakPolarHBondContact O-CG 3.48Å; V157-L161 PolarHBondContact O-N 3.34Å; V157-L161 VanDerWaalsContact O-N 3.11Å; F158-L161 HydrophobicContact CD1-CD1 3.64Å; F158-L161 HydrophobicContact CE1-CD1 4.11Å; F158-L161 HydrophobicContact CG-CD1 4.47Å; F158-L161 PolarHBondContact O-N 3.24Å; L161-G163 VanDerWaalsContact C-N 3.26Å; L161-G163 PolarHBondContact O-N 2.77Å; L161-I164 PolarHBondContact O-N 2.86Å; L161-I164 VanDerWaalsContact O-N 3.08Å; L161-I165 VanDerWaalsContact O-CG1 3.3Å; L161-I165 WeakPolarHBondContact O-CG1 3.49Å; L161-I165 PolarHBondContact O-N 3.21Å
162P90.9Very high93.2Very high24 Ų2452.4 Ų52.416%0.15626%0.264CS..Hα-helixtrans-59.2-40178.6-23.534.3000112I164 I165 F166 F193P162-I164 VanDerWaalsContact C-N 3.3Å; P162-I164 PolarHBondContact O-N 2.85Å; P162-I165 PolarHBondContact O-N 3.39Å; P162-F166 HydrophobicContact CB-CD2 4.44Å; P162-F166 HydrophobicContact CB-CE2 4.31Å; P162-F166 WeakPolarHBondContact O-CD2 3.19Å; P162-F166 PolarHBondContact O-N 3.47Å; P162-F166 VanDerWaalsContact O-N 3.12Å; P162-F193 HydrophobicContact CG-CE1 4.36Å
163G88.8Confident92.4Very high1 Ų154.8 Ų54.81%0.0129%0.292CS..Hα-helixtrans-62.1-38176.900000112.5S160 L161 T167S160-G163 WeakPolarHBondContact O-CA 3.29Å; S160-G163 PolarHBondContact O-N 3.38Å; L161-G163 VanDerWaalsContact C-N 3.26Å; L161-G163 PolarHBondContact O-N 2.77Å; G163-T167 VanDerWaalsContact O-CB 3.23Å; G163-T167 WeakPolarHBondContact O-CB 3.47Å; G163-T167 PolarHBondContact O-N 2.88Å; G163-T167 PolarHBondContact O-OG1 3.39Å
164I92.3Very high91.6Very high39 Ų3959.9 Ų59.920%0.232%0.322CS..Hα-helixtrans-70.3-45.1178.9-60167.1000110.8Q102 S160 L161 P162 F166 T167Q102-I164 HydrophobicContact CB-CG2 4.27Å; S160-I164 PolarHBondContact O-N 3.37Å; S160-I164 VanDerWaalsContact O-N 3.15Å; L161-I164 PolarHBondContact O-N 2.86Å; L161-I164 VanDerWaalsContact O-N 3.08Å; P162-I164 VanDerWaalsContact C-N 3.3Å; P162-I164 PolarHBondContact O-N 2.85Å; I164-F166 PolarHBondContact O-N 3.05Å; I164-T167 PolarHBondContact O-N 3.18Å
165I92.6Very high91Very high105 Ų10560.4 Ų60.454%0.53832%0.319SS..Hα-helixtrans-64.9-42.3-175.9-67.1163.9000111.3L161 P162L161-I165 VanDerWaalsContact O-CG1 3.3Å; L161-I165 WeakPolarHBondContact O-CG1 3.49Å; L161-I165 PolarHBondContact O-N 3.21Å; P162-I165 PolarHBondContact O-N 3.39Å
166F92Very high90.6Very high26 Ų2662.4 Ų62.411%0.11432%0.32CS..Hα-helixtrans-82.6-14.9-178.6-63.9-59.4000113.5P162 I164 S180 H181 F182 P183 W190P162-F166 HydrophobicContact CB-CD2 4.44Å; P162-F166 HydrophobicContact CB-CE2 4.31Å; P162-F166 WeakPolarHBondContact O-CD2 3.19Å; P162-F166 PolarHBondContact O-N 3.47Å; P162-F166 VanDerWaalsContact O-N 3.12Å; I164-F166 PolarHBondContact O-N 3.05Å; F166-S180 WeakPolarHBondContact O-CA 3.26Å; F166-H181 PolarHBondContact O-N 3.04Å; F166-F182 HydrophobicContact CB-CD1 3.89Å; F166-F182 HydrophobicContact CB-CE1 3.83Å; F166-F182 AromaticContact CD1-CD1 3.98Å; F166-F182 HydrophobicContact CD1-CD1 3.98Å; F166-F182 AromaticContact CD2-CD1 3.84Å; F166-F182 HydrophobicContact CD2-CD1 3.84Å; F166-F182 AromaticContact CD2-CE1 3.77Å; F166-F182 HydrophobicContact CD2-CE1 3.77Å; F166-F182 HydrophobicContact CE2-CD1 4.44Å; F166-F182 AromaticContact CG-CD1 3.62Å; F166-F182 HydrophobicContact CG-CD1 3.62Å; F166-F182 AromaticContact CG-CE1 3.82Å; F166-F182 HydrophobicContact CG-CE1 3.82Å; F166-P183 HydrophobicContact CE1-CG 4.44Å; F166-W190 HydrophobicContact CD2-CE3 4.35Å; F166-W190 HydrophobicContact CE1-CD2 4.35Å; F166-W190 AromaticContact CE2-CD2 3.69Å; F166-W190 HydrophobicContact CE2-CD2 3.69Å; F166-W190 AromaticContact CE2-CE3 3.27Å; F166-W190 HydrophobicContact CE2-CE3 3.27Å; F166-W190 HydrophobicContact CE2-CG 4.38Å; F166-W190 HydrophobicContact CE2-CH2 4.08Å; F166-W190 HydrophobicContact CE2-CZ2 4.45Å; F166-W190 AromaticContact CE2-CZ3 3.49Å; F166-W190 HydrophobicContact CE2-CZ3 3.49Å; F166-W190 VanDerWaalsContact CE2-CZ3 3.49Å; F166-W190 AromaticContact CZ-CD2 3.43Å; F166-W190 HydrophobicContact CZ-CD2 3.43Å; F166-W190 VanDerWaalsContact CZ-CD2 3.43Å; F166-W190 AromaticContact CZ-CE2 3.6Å; F166-W190 AromaticContact CZ-CE3 3.49Å; F166-W190 HydrophobicContact CZ-CE3 3.49Å; F166-W190 VanDerWaalsContact CZ-CE3 3.49Å; F166-W190 HydrophobicContact CZ-CG 4.04Å; F166-W190 AromaticContact CZ-CH2 3.85Å; F166-W190 HydrophobicContact CZ-CH2 3.85Å; F166-W190 AromaticContact CZ-CZ2 3.81Å; F166-W190 HydrophobicContact CZ-CZ2 3.81Å; F166-W190 AromaticContact CZ-CZ3 3.71Å; F166-W190 HydrophobicContact CZ-CZ3 3.71Å
167T92.2Very high90.2Very high3 Ų363 Ų632%0.01832%0.324CS..EExtended strand (participates in β ladder)trans-85.2126.8179.1-600000111C101 Q102 T105 G163 I164 S179 S180C101-T167 VanDerWaalsContact SG-CG2 3.53Å; Q102-T167 WeakPolarHBondContact CG-O 3.47Å; Q102-T167 PolarHBondContact NE2-O 3.43Å; T105-T167 HydrophobicContact CG2-CG2 4.07Å; T105-T167 WeakPolarHBondContact OG1-CG2 3.35Å; G163-T167 VanDerWaalsContact O-CB 3.23Å; G163-T167 WeakPolarHBondContact O-CB 3.47Å; G163-T167 PolarHBondContact O-N 2.88Å; G163-T167 PolarHBondContact O-OG1 3.39Å; I164-T167 PolarHBondContact O-N 3.18Å; T167-S179 WeakPolarHBondContact CA-O 3.24Å; T167-S180 PolarHBondContact OG1-OG 3.14Å
168K92Very high90Very high108 Ų10860.7 Ų60.747%0.4731%0.311SS..EExtended strand (participates in β ladder)trans-138.8155.4179.3-64.1-175.4-179.7178.70110N98 S179N98-K168 WeakPolarHBondContact OD1-CA 3.33Å; K168-S179 PolarHBondContact N-O 3.06Å; K168-S179 PolarHBondContact O-N 2.89Å; K168-S179 VanDerWaalsContact O-N 3.14Å
169S92.1Very high89.6Confident23 Ų2355.8 Ų55.816%0.16129%0.293CS..EExtended strand (participates in β ladder)trans-93.3125.5166.4-175.10000110W94 N98 T177W94-S169 VanDerWaalsContact CD1-OG 3.22Å; N98-S169 PolarHBondContact OD1-N 3.08Å; S169-T177 WeakPolarHBondContact CA-O 3.29Å; S169-T177 PolarHBondContact OG-O 3.33Å; S169-T177 VanDerWaalsContact OG-O 3.05Å
170Q88.8Confident89.3Confident78 Ų7857.8 Ų57.836%0.36431%0.306SS..EExtended strand (participates in β ladder)trans-140.6160.6176.561.5170.53100111.2E172 T177 H181Q170-E172 HydrophobicContact CG-CG 4.14Å; Q170-E172 PolarHBondContact NE2-OE1 2.96Å; Q170-T177 PolarHBondContact N-O 3.2Å; Q170-T177 PolarHBondContact O-N 3.26Å; Q170-T177 PolarHBondContact O-OG1 3.36Å; Q170-H181 WeakPolarHBondContact CG-NE2 3.23Å; Q170-H181 PolarHBondContact NE2-CE1 2.92Å; Q170-H181 PolarHBondContact NE2-NE2 3.39Å
171K87.1Confident88.9Confident128 Ų12860.2 Ų60.256%0.55732%0.317SS*.EExtended strand (participates in β ladder)trans-86.3112.2175.8-170.7178.7179.2-1770109.1G173 Y176K171-G173 WeakPolarHBondContact CE-O 3.47Å; K171-Y176 HydrophobicContact CB-CD1 4.12Å; K171-Y176 HydrophobicContact CB-CE1 3.91Å; K171-Y176 HydrophobicContact CG-CE1 4.47Å
172E81.4Confident88.7Confident84 Ų8458.6 Ų58.639%0.39331%0.308SS..EExtended strand (participates in β ladder)trans-107.8102.6175.9-74.2175.3170.900108.9Q170 L174 H175 T177 H181Q170-E172 HydrophobicContact CG-CG 4.14Å; Q170-E172 PolarHBondContact NE2-OE1 2.96Å; E172-L174 PolarHBondContact O-N 2.92Å; E172-H175 PolarHBondContact N-O 3.46Å; E172-H175 PolarHBondContact O-N 3Å; E172-T177 HydrophobicContact CB-CG2 4.25Å; E172-T177 WeakPolarHBondContact OE2-CG2 3.37Å; E172-T177 PolarHBondContact OE2-OG1 2.93Å; E172-H181 IonicContact OE1-CE1 3.16Å; E172-H181 PolarHBondContact OE1-CE1 3.48Å; E172-H181 VanDerWaalsContact OE1-CE1 3.32Å; E172-H181 IonicContact OE1-NE2 2.9Å
173G80.7Confident88.6Confident68 Ų6859.8 Ų59.870%0.70132%0.315SS*.THydrogen-bonded Turntrans66.3-117.9-172.500000111.9K171K171-G173 WeakPolarHBondContact CE-O 3.47Å
174L81.8Confident88.5Confident153 Ų15370.3 Ų70.380%0.80136%0.356SS*.THydrogen-bonded Turntrans-90.9-10.3-178.8-70.5168.1000113.9E172E172-L174 PolarHBondContact O-N 2.92Å
175H84.5Confident88.4Confident82 Ų8273.8 Ų73.838%0.3838%0.384SS..EExtended strand (participates in β ladder)trans-121.3150.5-170.9-64.4-66.6000112.5Q93 E172Q93-H175 HydrophobicContact CB-CB 4.34Å; Q93-H175 PolarHBondContact OE1-ND1 2.87Å; Q93-H175 VanDerWaalsContact OE1-ND1 3.16Å; E172-H175 PolarHBondContact N-O 3.46Å; E172-H175 PolarHBondContact O-N 3Å
176Y89.2Confident88.3Confident112 Ų11273.5 Ų73.544%0.43938%0.38SS..EExtended strand (participates in β ladder)trans-83.4131.1167.3-72.7-85.5000110.1W94 K171W94-Y176 WeakPolarHBondContact CB-O 3.3Å; W94-Y176 PolarHBondContact N-O 3.18Å; W94-Y176 WeakPolarHBondContact O-CB 3.49Å; K171-Y176 HydrophobicContact CB-CD1 4.12Å; K171-Y176 HydrophobicContact CB-CE1 3.91Å; K171-Y176 HydrophobicContact CG-CE1 4.47Å
177T89.9Confident88.1Confident14 Ų1477.6 Ų77.69%0.08640%0.396CS..EExtended strand (participates in β ladder)trans-117.7159.6176.458.50000110.3S169 Q170 E172S169-T177 WeakPolarHBondContact CA-O 3.29Å; S169-T177 PolarHBondContact OG-O 3.33Å; S169-T177 VanDerWaalsContact OG-O 3.05Å; Q170-T177 PolarHBondContact N-O 3.2Å; Q170-T177 PolarHBondContact O-N 3.26Å; Q170-T177 PolarHBondContact O-OG1 3.36Å; E172-T177 HydrophobicContact CB-CG2 4.25Å; E172-T177 WeakPolarHBondContact OE2-CG2 3.37Å; E172-T177 PolarHBondContact OE2-OG1 2.93Å
178C92.3Very high87.9Confident12 Ų1281.5 Ų81.58%0.08141%0.414CS..EExtended strand (participates in β ladder)trans-122.9100170.1173.40000106.6W94 C101W94-C178 HydrophobicContact CB-CB 4.4Å; W94-C178 HydrophobicContact CD2-CB 3.49Å; W94-C178 VanDerWaalsContact CD2-CB 3.49Å; W94-C178 HydrophobicContact CE3-CB 3.66Å; W94-C178 HydrophobicContact CG-CB 3.8Å; W94-C178 HydrophobicContact CH2-CB 4.49Å; W94-C178 HydrophobicContact CZ2-CB 4.41Å; W94-C178 HydrophobicContact CZ3-CB 4.15Å; C101-C178 VanDerWaalsContact CA-SG 3.59Å; C101-C178 HydrophobicContact CB-CB 3.94Å; C101-C178 WeakPolarHBondContact CB-SG 3.44Å; C101-C178 WeakPolarHBondContact SG-CB 3.39Å; C101-C178 CovalentContact SG-SG 2.03Å; C101-C178 PolarHBondContact SG-SG 2.86Å
179S88.6Confident87.9Confident32 Ų3282.4 Ų82.422%0.22442%0.418CS..EExtended strand (participates in β ladder)trans-142.6162.1-169.849.60000111.5T167 K168 H181T167-S179 WeakPolarHBondContact CA-O 3.24Å; K168-S179 PolarHBondContact N-O 3.06Å; K168-S179 PolarHBondContact O-N 2.89Å; K168-S179 VanDerWaalsContact O-N 3.14Å; S179-H181 PolarHBondContact O-CD2 2.95Å; S179-H181 VanDerWaalsContact O-CD2 3.3Å; S179-H181 PolarHBondContact OG-CE1 2.87Å; S179-H181 PolarHBondContact OG-NE2 3.5Å
180S88.3Confident87.9Confident56 Ų5684.2 Ų84.239%0.39242%0.421SS..EExtended strand (participates in β ladder)trans-83123.9179.4-63.30000111F166 T167F166-S180 WeakPolarHBondContact O-CA 3.26Å; T167-S180 PolarHBondContact OG1-OG 3.14Å
181H88.3Confident87.9Confident52 Ų5282.5 Ų82.524%0.24141%0.413CS..  trans-115.7107.3177.4-64.2-68.8000110.5F166 Q170 E172 S179F166-H181 PolarHBondContact O-N 3.04Å; Q170-H181 WeakPolarHBondContact CG-NE2 3.23Å; Q170-H181 PolarHBondContact NE2-CE1 2.92Å; Q170-H181 PolarHBondContact NE2-NE2 3.39Å; E172-H181 IonicContact OE1-CE1 3.16Å; E172-H181 PolarHBondContact OE1-CE1 3.48Å; E172-H181 VanDerWaalsContact OE1-CE1 3.32Å; E172-H181 IonicContact OE1-NE2 2.9Å; S179-H181 PolarHBondContact O-CD2 2.95Å; S179-H181 VanDerWaalsContact O-CD2 3.3Å; S179-H181 PolarHBondContact OG-CE1 2.87Å; S179-H181 PolarHBondContact OG-NE2 3.5Å
182F88.9Confident88.1Confident31 Ų3178.2 Ų78.214%0.13640%0.396CS..  trans-87.5148.5174.7-55.1-58.9000111F166 Y184 Y187 W190 K191 Q194F166-F182 HydrophobicContact CB-CD1 3.89Å; F166-F182 HydrophobicContact CB-CE1 3.83Å; F166-F182 AromaticContact CD1-CD1 3.98Å; F166-F182 HydrophobicContact CD1-CD1 3.98Å; F166-F182 AromaticContact CD2-CD1 3.84Å; F166-F182 HydrophobicContact CD2-CD1 3.84Å; F166-F182 AromaticContact CD2-CE1 3.77Å; F166-F182 HydrophobicContact CD2-CE1 3.77Å; F166-F182 HydrophobicContact CE2-CD1 4.44Å; F166-F182 AromaticContact CG-CD1 3.62Å; F166-F182 HydrophobicContact CG-CD1 3.62Å; F166-F182 AromaticContact CG-CE1 3.82Å; F166-F182 HydrophobicContact CG-CE1 3.82Å; F182-Y184 PolarHBondContact O-N 3.13Å; F182-Y187 HydrophobicContact CB-CD2 3.88Å; F182-Y187 HydrophobicContact CB-CE2 4.39Å; F182-Y187 HydrophobicContact CD2-CD2 4.34Å; F182-Y187 HydrophobicContact CD2-CE2 4.09Å; F182-W190 HydrophobicContact CB-CB 4.01Å; F182-W190 HydrophobicContact CD1-CB 3.57Å; F182-W190 HydrophobicContact CD1-CG 4.44Å; F182-W190 HydrophobicContact CE1-CB 4.22Å; F182-W190 HydrophobicContact CG-CB 3.83Å; F182-K191 HydrophobicContact CD2-CB 4.29Å; F182-K191 HydrophobicContact CE2-CB 4.25Å; F182-Q194 HydrophobicContact CZ-CB 4.31Å
183P88.6Confident88.6Confident49 Ų4978.6 Ų78.632%0.31840%0.396SS..  trans-63130.8177.325.2-33.4000111F166 S185 Q186 Y187F166-P183 HydrophobicContact CE1-CG 4.44Å; P183-S185 VanDerWaalsContact C-N 3.27Å; P183-S185 PolarHBondContact O-N 3.35Å; P183-Q186 HydrophobicContact CG-CB 4.44Å; P183-Q186 CarbonylContact O-C 3.47Å; P183-Q186 PolarHBondContact O-N 2.97Å; P183-Y187 WeakPolarHBondContact O-CA 3.4Å; P183-Y187 PolarHBondContact O-N 2.71Å
184Y87.1Confident89.1Confident222 Ų22276 Ų7687%0.87137%0.366SS*.G310 helixtrans-54.5-38.9-175.4-68.2-75.8000113.7F182 Q186 Y187F182-Y184 PolarHBondContact O-N 3.13Å; Y184-Q186 PolarHBondContact O-N 3.29Å; Y184-Y187 PolarHBondContact O-N 2.86Å
185S90.2Very high89.5Confident111 Ų11168.8 Ų68.878%0.77633%0.329SS*.G310 helixtrans-63.5-23.4179.8560000114P183P183-S185 VanDerWaalsContact C-N 3.27Å; P183-S185 PolarHBondContact O-N 3.35Å
186Q90.9Very high89.9Confident100 Ų10068.5 Ų68.547%0.46733%0.329SS..G310 helixtrans-133.126.6-176.6-65.4-178.5-18.800111.5P183 Y184 Q188 F189 W190P183-Q186 HydrophobicContact CG-CB 4.44Å; P183-Q186 CarbonylContact O-C 3.47Å; P183-Q186 PolarHBondContact O-N 2.97Å; Y184-Q186 PolarHBondContact O-N 3.29Å; Q186-Q188 PolarHBondContact O-N 2.97Å; Q186-F189 HydrophobicContact CB-CB 4.44Å; Q186-F189 PolarHBondContact O-N 2.93Å; Q186-F189 VanDerWaalsContact O-N 3.16Å; Q186-W190 PolarHBondContact O-N 3.16Å; Q186-W190 VanDerWaalsContact OE1-NE1 3.12Å
187Y88.1Confident90.2Very high111 Ų11164.3 Ų64.344%0.43531%0.313SS..Hα-helixtrans-55.7-51.4-171.1177.6-96.3000112.1F182 P183 Y184 F189 W190 K191F182-Y187 HydrophobicContact CB-CD2 3.88Å; F182-Y187 HydrophobicContact CB-CE2 4.39Å; F182-Y187 HydrophobicContact CD2-CD2 4.34Å; F182-Y187 HydrophobicContact CD2-CE2 4.09Å; P183-Y187 WeakPolarHBondContact O-CA 3.4Å; P183-Y187 PolarHBondContact O-N 2.71Å; Y184-Y187 PolarHBondContact O-N 2.86Å; Y187-F189 VanDerWaalsContact C-N 3.32Å; Y187-F189 PolarHBondContact O-N 2.77Å; Y187-W190 PolarHBondContact O-N 3.22Å; Y187-K191 HydrophobicContact CE1-CD 4.16Å; Y187-K191 WeakPolarHBondContact O-CB 3.34Å; Y187-K191 PolarHBondContact O-N 3.02Å
188Q88.1Confident90.3Very high86 Ų8663.9 Ų63.940%0.40231%0.31SS..Hα-helixtrans-64.3-37.4-179.1-167.363.341.100112.3Q186 N192Q186-Q188 PolarHBondContact O-N 2.97Å; Q188-N192 PolarHBondContact NE2-OD1 3.42Å; Q188-N192 VanDerWaalsContact O-CB 3.24Å; Q188-N192 WeakPolarHBondContact O-CB 3.08Å; Q188-N192 PolarHBondContact O-N 3.45Å; Q188-N192 PolarHBondContact O-ND2 2.66Å; Q188-N192 PolarHBondContact O-OD1 3.47Å
189F91.3Very high90.2Very high127 Ų12763.9 Ų63.956%0.55731%0.31SS*.Hα-helixtrans-62.6-51.1178.6175.2-93.9000111Q186 Y187 N192 F193Q186-F189 HydrophobicContact CB-CB 4.44Å; Q186-F189 PolarHBondContact O-N 2.93Å; Q186-F189 VanDerWaalsContact O-N 3.16Å; Y187-F189 VanDerWaalsContact C-N 3.32Å; Y187-F189 PolarHBondContact O-N 2.77Å; F189-N192 PolarHBondContact O-N 3.1Å; F189-F193 VanDerWaalsContact O-CB 3.24Å; F189-F193 WeakPolarHBondContact O-CB 3.27Å; F189-F193 PolarHBondContact O-N 2.98Å
190W91.4Very high90.5Very high60 Ų6066.6 Ų66.623%0.22732%0.321CS..Hα-helixtrans-69.3-38.2-179-74.9106.7000112.7F166 F182 Q186 Y187 F193 Q194F166-W190 HydrophobicContact CD2-CE3 4.35Å; F166-W190 HydrophobicContact CE1-CD2 4.35Å; F166-W190 AromaticContact CE2-CD2 3.69Å; F166-W190 HydrophobicContact CE2-CD2 3.69Å; F166-W190 AromaticContact CE2-CE3 3.27Å; F166-W190 HydrophobicContact CE2-CE3 3.27Å; F166-W190 HydrophobicContact CE2-CG 4.38Å; F166-W190 HydrophobicContact CE2-CH2 4.08Å; F166-W190 HydrophobicContact CE2-CZ2 4.45Å; F166-W190 AromaticContact CE2-CZ3 3.49Å; F166-W190 HydrophobicContact CE2-CZ3 3.49Å; F166-W190 VanDerWaalsContact CE2-CZ3 3.49Å; F166-W190 AromaticContact CZ-CD2 3.43Å; F166-W190 HydrophobicContact CZ-CD2 3.43Å; F166-W190 VanDerWaalsContact CZ-CD2 3.43Å; F166-W190 AromaticContact CZ-CE2 3.6Å; F166-W190 AromaticContact CZ-CE3 3.49Å; F166-W190 HydrophobicContact CZ-CE3 3.49Å; F166-W190 VanDerWaalsContact CZ-CE3 3.49Å; F166-W190 HydrophobicContact CZ-CG 4.04Å; F166-W190 AromaticContact CZ-CH2 3.85Å; F166-W190 HydrophobicContact CZ-CH2 3.85Å; F166-W190 AromaticContact CZ-CZ2 3.81Å; F166-W190 HydrophobicContact CZ-CZ2 3.81Å; F166-W190 AromaticContact CZ-CZ3 3.71Å; F166-W190 HydrophobicContact CZ-CZ3 3.71Å; F182-W190 HydrophobicContact CB-CB 4.01Å; F182-W190 HydrophobicContact CD1-CB 3.57Å; F182-W190 HydrophobicContact CD1-CG 4.44Å; F182-W190 HydrophobicContact CE1-CB 4.22Å; F182-W190 HydrophobicContact CG-CB 3.83Å; Q186-W190 PolarHBondContact O-N 3.16Å; Q186-W190 VanDerWaalsContact OE1-NE1 3.12Å; Y187-W190 PolarHBondContact O-N 3.22Å; W190-F193 HydrophobicContact CE3-CD1 4.07Å; W190-F193 HydrophobicContact CZ3-CD1 4.06Å; W190-F193 HydrophobicContact CZ3-CE1 4.29Å; W190-F193 PolarHBondContact O-N 2.99Å; W190-Q194 WeakPolarHBondContact O-CB 3.39Å; W190-Q194 PolarHBondContact O-N 2.76Å
191K89Confident90.8Very high42 Ų4265.8 Ų65.818%0.18331%0.312CS..Hα-helixtrans-57.7-53172.4-169.8-175.2178.6-170.50110.3F182 Y187 F193 Q194 T195 D258 T259F182-K191 HydrophobicContact CD2-CB 4.29Å; F182-K191 HydrophobicContact CE2-CB 4.25Å; Y187-K191 HydrophobicContact CE1-CD 4.16Å; Y187-K191 WeakPolarHBondContact O-CB 3.34Å; Y187-K191 PolarHBondContact O-N 3.02Å; K191-F193 PolarHBondContact O-N 3.09Å; K191-Q194 PolarHBondContact O-N 3.3Å; K191-T195 PolarHBondContact O-N 3.26Å; K191-T195 VanDerWaalsContact O-N 3.09Å; K191-T195 PolarHBondContact O-OG1 3.06Å; K191-T195 VanDerWaalsContact O-OG1 3.08Å; K191-D258 PolarHBondContact NZ-O 2.83Å; K191-T259 HydrophobicContact CD-CG2 4.47Å; K191-T259 HydrophobicContact CG-CG2 4.21Å
192N91Very high90.9Very high39 Ų3963.4 Ų63.421%0.20930%0.301CS..Hα-helixtrans-61.6-45.2178.7-71.3-5.6000112.3Q188 F189 Q194 T195 L196 T259Q188-N192 PolarHBondContact NE2-OD1 3.42Å; Q188-N192 VanDerWaalsContact O-CB 3.24Å; Q188-N192 WeakPolarHBondContact O-CB 3.08Å; Q188-N192 PolarHBondContact O-N 3.45Å; Q188-N192 PolarHBondContact O-ND2 2.66Å; Q188-N192 PolarHBondContact O-OD1 3.47Å; F189-N192 PolarHBondContact O-N 3.1Å; N192-Q194 PolarHBondContact O-N 3.46Å; N192-T195 PolarHBondContact O-N 3.06Å; N192-L196 VanDerWaalsContact O-CB 3.29Å; N192-L196 WeakPolarHBondContact O-CB 3.45Å; N192-L196 VanDerWaalsContact O-CG 3.25Å; N192-L196 WeakPolarHBondContact O-CG 3.37Å; N192-L196 PolarHBondContact O-N 3.38Å; N192-T259 WeakPolarHBondContact OD1-CG2 3.41Å
193F93Very high90.9Very high91 Ų9163.7 Ų63.740%0.39930%0.304SS..Hα-helixtrans-59.1-46.7179.4176-98.9000111.3P162 F189 W190 K191 K197P162-F193 HydrophobicContact CG-CE1 4.36Å; F189-F193 VanDerWaalsContact O-CB 3.24Å; F189-F193 WeakPolarHBondContact O-CB 3.27Å; F189-F193 PolarHBondContact O-N 2.98Å; W190-F193 HydrophobicContact CE3-CD1 4.07Å; W190-F193 HydrophobicContact CZ3-CD1 4.06Å; W190-F193 HydrophobicContact CZ3-CE1 4.29Å; W190-F193 PolarHBondContact O-N 2.99Å; K191-F193 PolarHBondContact O-N 3.09Å; F193-K197 WeakPolarHBondContact O-CB 3.22Å; F193-K197 PolarHBondContact O-N 3.4Å
194Q90.8Very high91.2Very high13 Ų1365 Ų656%0.06131%0.311CS..Hα-helixtrans-64-45.8-179.7-173.271.3-7.700111.5F182 W190 K191 N192 I198F182-Q194 HydrophobicContact CZ-CB 4.31Å; W190-Q194 WeakPolarHBondContact O-CB 3.39Å; W190-Q194 PolarHBondContact O-N 2.76Å; K191-Q194 PolarHBondContact O-N 3.3Å; N192-Q194 PolarHBondContact O-N 3.46Å; Q194-I198 HydrophobicContact CG-CD1 4.25Å; Q194-I198 WeakPolarHBondContact O-CG1 3.39Å; Q194-I198 PolarHBondContact O-N 2.96Å; Q194-I198 VanDerWaalsContact O-N 3.08Å
195T90.8Very high91.5Very high3 Ų357.4 Ų57.42%0.01829%0.285CS..Hα-helixtrans-63-51.2177.9-57.80000111.5K191 N192 K197 I198 V199 L256 T259K191-T195 PolarHBondContact O-N 3.26Å; K191-T195 VanDerWaalsContact O-N 3.09Å; K191-T195 PolarHBondContact O-OG1 3.06Å; K191-T195 VanDerWaalsContact O-OG1 3.08Å; N192-T195 PolarHBondContact O-N 3.06Å; T195-K197 VanDerWaalsContact C-N 3.32Å; T195-K197 PolarHBondContact O-N 3.21Å; T195-I198 PolarHBondContact O-N 3.47Å; T195-V199 HydrophobicContact CG2-CG2 4.38Å; T195-V199 WeakPolarHBondContact O-CG2 3.23Å; T195-V199 PolarHBondContact O-N 3.39Å; T195-L256 HydrophobicContact CG2-CD1 4.28Å; T195-T259 WeakPolarHBondContact CB-OG1 3.28Å; T195-T259 HydrophobicContact CG2-CG2 4.07Å; T195-T259 WeakPolarHBondContact CG2-OG1 3.03Å; T195-T259 PolarHBondContact OG1-OG1 3.38Å
196L92.9Very high91.5Very high75 Ų7552.1 Ų52.139%0.39325%0.248SC..Hα-helixtrans-61.5-41.8-179.7-71.3175.2000111.2N192 I198 V199 I200 F260N192-L196 VanDerWaalsContact O-CB 3.29Å; N192-L196 WeakPolarHBondContact O-CB 3.45Å; N192-L196 VanDerWaalsContact O-CG 3.25Å; N192-L196 WeakPolarHBondContact O-CG 3.37Å; N192-L196 PolarHBondContact O-N 3.38Å; L196-I198 PolarHBondContact O-N 2.93Å; L196-V199 PolarHBondContact O-N 2.94Å; L196-I200 HydrophobicContact CB-CD1 4.32Å; L196-I200 VanDerWaalsContact O-CB 3.23Å; L196-I200 WeakPolarHBondContact O-CB 3.44Å; L196-I200 WeakPolarHBondContact O-CD1 3.08Å; L196-I200 WeakPolarHBondContact O-CG1 3.25Å; L196-I200 PolarHBondContact O-N 3.16Å; L196-F260 HydrophobicContact CD2-CE2 4.37Å; L196-F260 HydrophobicContact CD2-CZ 4.41Å
197K94.2Very high91.5Very high24 Ų2451.2 Ų51.210%0.10425%0.246CC..Hα-helixtrans-56-49.4174.2-179.7-158.773.5178.40111.3A159 F193 T195 L201A159-K197 PolarHBondContact O-NZ 3.19Å; F193-K197 WeakPolarHBondContact O-CB 3.22Å; F193-K197 PolarHBondContact O-N 3.4Å; T195-K197 VanDerWaalsContact C-N 3.32Å; T195-K197 PolarHBondContact O-N 3.21Å; K197-L201 HydrophobicContact CG-CD1 3.85Å; K197-L201 WeakPolarHBondContact O-CB 3.36Å; K197-L201 VanDerWaalsContact O-CG 3.27Å; K197-L201 WeakPolarHBondContact O-CG 3.24Å; K197-L201 PolarHBondContact O-N 3.01Å
198I91.8Very high91.8Very high5 Ų550.7 Ų50.73%0.02625%0.25CS..Hα-helixtrans-61.2-51.4179.3-70.5168.5000110.2F109 F112 F113 Q194 T195 L196 I200 L201 R202F109-I198 HydrophobicContact CE1-CD1 4.41Å; F112-I198 HydrophobicContact CE1-CG2 4.3Å; F113-I198 HydrophobicContact CZ-CG1 4.18Å; Q194-I198 HydrophobicContact CG-CD1 4.25Å; Q194-I198 WeakPolarHBondContact O-CG1 3.39Å; Q194-I198 PolarHBondContact O-N 2.96Å; Q194-I198 VanDerWaalsContact O-N 3.08Å; T195-I198 PolarHBondContact O-N 3.47Å; L196-I198 PolarHBondContact O-N 2.93Å; I198-I200 PolarHBondContact O-N 3.4Å; I198-L201 PolarHBondContact O-N 3.06Å; I198-R202 WeakPolarHBondContact O-CB 3.49Å; I198-R202 WeakPolarHBondContact O-CG 3.5Å; I198-R202 PolarHBondContact O-N 3.47Å
199V91.8Very high92Very high13 Ų1347.6 Ų47.68%0.07924%0.237CC..Hα-helixtrans-62.9-45-177.8172.70000111.6T195 L196 L203 V204 L256T195-V199 HydrophobicContact CG2-CG2 4.38Å; T195-V199 WeakPolarHBondContact O-CG2 3.23Å; T195-V199 PolarHBondContact O-N 3.39Å; L196-V199 PolarHBondContact O-N 2.94Å; V199-L203 HydrophobicContact CG1-CB 4.45Å; V199-L203 HydrophobicContact CG1-CD2 4.34Å; V199-L203 WeakPolarHBondContact O-CA 3.48Å; V199-L203 VanDerWaalsContact O-CB 3.24Å; V199-L203 WeakPolarHBondContact O-CB 3.49Å; V199-L203 PolarHBondContact O-N 3.45Å; V199-V204 HydrophobicContact CG1-CG2 4.38Å; V199-V204 PolarHBondContact O-N 2.94Å; V199-V204 VanDerWaalsContact O-N 3.09Å; V199-L256 HydrophobicContact CG2-CB 4.33Å; V199-L256 HydrophobicContact CG2-CD1 4.27Å
200I94Very high91.8Very high88 Ų8842.9 Ų42.945%0.45122%0.217SC..Iπ-helixtrans-62.7-50.7179.6-69.7166.2000110.2L196 I198 R202 V204 L205L196-I200 HydrophobicContact CB-CD1 4.32Å; L196-I200 VanDerWaalsContact O-CB 3.23Å; L196-I200 WeakPolarHBondContact O-CB 3.44Å; L196-I200 WeakPolarHBondContact O-CD1 3.08Å; L196-I200 WeakPolarHBondContact O-CG1 3.25Å; L196-I200 PolarHBondContact O-N 3.16Å; I198-I200 PolarHBondContact O-N 3.4Å; I200-R202 PolarHBondContact O-N 3.08Å; I200-V204 PolarHBondContact O-N 3.35Å; I200-L205 VanDerWaalsContact O-CB 3.25Å; I200-L205 WeakPolarHBondContact O-CB 3.43Å; I200-L205 PolarHBondContact O-N 3.08Å
201L94.3Very high91.7Very high40 Ų4044.1 Ų44.121%0.20923%0.231CC..Iπ-helixtrans-73-28.4-174.6-65.9177.5000113.4F113 F117 A159 K197 I198 L205 P206F113-L201 HydrophobicContact CD1-CD1 4.26Å; F113-L201 HydrophobicContact CE1-CB 4.31Å; F113-L201 HydrophobicContact CE1-CD1 3.97Å; F117-L201 HydrophobicContact CE1-CB 4.47Å; F117-L201 HydrophobicContact CE1-CD2 4.41Å; F117-L201 HydrophobicContact CZ-CD1 4.33Å; F117-L201 HydrophobicContact CZ-CD2 4.42Å; A159-L201 HydrophobicContact CB-CD1 4.38Å; K197-L201 HydrophobicContact CG-CD1 3.85Å; K197-L201 WeakPolarHBondContact O-CB 3.36Å; K197-L201 VanDerWaalsContact O-CG 3.27Å; K197-L201 WeakPolarHBondContact O-CG 3.24Å; K197-L201 PolarHBondContact O-N 3.01Å; I198-L201 PolarHBondContact O-N 3.06Å; L201-L205 HydrophobicContact CD2-CD2 4.25Å; L201-P206 WeakPolarHBondContact O-CD 3.24Å
202R90Very high91.8Very high2 Ų246.6 Ų46.61%0.00825%0.245CC..Iπ-helixtrans-109.6-18.5-170.6-62.4-167.969.7-129.114.5115.5F112 F113 I116 I198 I200 P206 Y244 W248F112-R202 VanDerWaalsContact CD1-CD 3.4Å; F112-R202 HydrophobicContact CE1-CG 4.41Å; F113-R202 HydrophobicContact CD1-CG 4.39Å; F113-R202 HydrophobicContact CE1-CG 4.25Å; I116-R202 HydrophobicContact CG2-CG 4.19Å; I198-R202 WeakPolarHBondContact O-CB 3.49Å; I198-R202 WeakPolarHBondContact O-CG 3.5Å; I198-R202 PolarHBondContact O-N 3.47Å; I200-R202 PolarHBondContact O-N 3.08Å; R202-P206 VanDerWaalsContact C-CG 3.46Å; R202-P206 WeakPolarHBondContact O-CG 3.34Å; R202-Y244 WeakPolarHBondContact CB-OH 3.24Å; R202-Y244 PolarHBondContact NE-OH 3.38Å; R202-Y244 WeakPolarHBondContact O-CE1 3.48Å; R202-Y244 PolarHBondContact O-OH 3.09Å; R202-W248 VanDerWaalsContact NH1-CE3 3.35Å; R202-W248 VanDerWaalsContact NH2-CE3 3.26Å
203L90.6Very high91.7Very high36 Ų3645 Ų4519%0.18824%0.238CC..Iπ-helixtrans-116.2-59.5177.6-173.366.1000110.1V199 L207 Y245 A249 N252V199-L203 HydrophobicContact CG1-CB 4.45Å; V199-L203 HydrophobicContact CG1-CD2 4.34Å; V199-L203 WeakPolarHBondContact O-CA 3.48Å; V199-L203 VanDerWaalsContact O-CB 3.24Å; V199-L203 WeakPolarHBondContact O-CB 3.49Å; V199-L203 PolarHBondContact O-N 3.45Å; L203-L207 WeakPolarHBondContact O-CB 3.18Å; L203-L207 PolarHBondContact O-N 3.48Å; L203-Y245 HydrophobicContact CD1-CD1 4.06Å; L203-Y245 HydrophobicContact CD1-CE1 4.01Å; L203-A249 HydrophobicContact CD1-CB 4Å; L203-N252 HydrophobicContact CB-CB 4.46Å; L203-N252 HydrophobicContact CD2-CB 4.35Å
204V93.4Very high91.3Very high77 Ų7742 Ų4247%0.46722%0.224SC..Iπ-helixtrans-69.7-51.1-171-177.20000112.2V199 I200 L207 L208V199-V204 HydrophobicContact CG1-CG2 4.38Å; V199-V204 PolarHBondContact O-N 2.94Å; V199-V204 VanDerWaalsContact O-N 3.09Å; I200-V204 PolarHBondContact O-N 3.35Å; V204-L207 PolarHBondContact O-N 3.45Å; V204-L208 WeakPolarHBondContact O-CB 3.3Å; V204-L208 PolarHBondContact O-N 3.4Å
205L93.6Very high91.1Very high62 Ų6244.8 Ų44.833%0.32525%0.245SC..Hα-helixtrans-59.1-54.3-179.1178.167.2000112.8F117 I120 I200 L201 L207 L208 V209F117-L205 HydrophobicContact CE1-CD2 4.46Å; I120-L205 HydrophobicContact CD1-CD2 4.01Å; I120-L205 HydrophobicContact CD1-CG 4.06Å; I200-L205 VanDerWaalsContact O-CB 3.25Å; I200-L205 WeakPolarHBondContact O-CB 3.43Å; I200-L205 PolarHBondContact O-N 3.08Å; L201-L205 HydrophobicContact CD2-CD2 4.25Å; L205-L207 PolarHBondContact O-N 3.17Å; L205-L208 PolarHBondContact O-N 3.46Å; L205-V209 WeakPolarHBondContact O-CG2 3.44Å; L205-V209 PolarHBondContact O-N 3.36Å
206P90.7Very high90.8Very high0 Ų045.4 Ų45.40%025%0.252CS..Hα-helixtrans-65.1-27.7178.625.9-34.4000111.9I116 I120 L201 R202 M210 Y245I116-P206 HydrophobicContact CD1-CB 3.68Å; I116-P206 HydrophobicContact CD1-CG 3.92Å; I116-P206 HydrophobicContact CG1-CB 4.1Å; I116-P206 HydrophobicContact CG1-CG 3.98Å; I120-P206 HydrophobicContact CD1-CB 3.94Å; I120-P206 HydrophobicContact CG1-CB 3.91Å; L201-P206 WeakPolarHBondContact O-CD 3.24Å; R202-P206 VanDerWaalsContact C-CG 3.46Å; R202-P206 WeakPolarHBondContact O-CG 3.34Å; P206-M210 VanDerWaalsContact O-CB 3.25Å; P206-M210 WeakPolarHBondContact O-CB 3.33Å; P206-M210 PolarHBondContact O-N 2.92Å; P206-Y245 WeakPolarHBondContact CB-OH 3.39Å; P206-Y245 HydrophobicContact CG-CE1 4.46Å; P206-Y245 WeakPolarHBondContact CG-OH 3.33Å; P206-Y245 PolarHBondContact O-OH 3.37Å
207L91.1Very high90.3Very high82 Ų8242 Ų4243%0.42923%0.234SC..Hα-helixtrans-72-43.1179.9-173.979.7000109.8L203 V204 L205 M210 V211 Y245L203-L207 WeakPolarHBondContact O-CB 3.18Å; L203-L207 PolarHBondContact O-N 3.48Å; V204-L207 PolarHBondContact O-N 3.45Å; L205-L207 PolarHBondContact O-N 3.17Å; L207-M210 WeakPolarHBondContact O-CB 3.43Å; L207-M210 PolarHBondContact O-N 3.14Å; L207-V211 WeakPolarHBondContact O-CG2 3.24Å; L207-V211 PolarHBondContact O-N 2.96Å; L207-Y245 WeakPolarHBondContact CA-OH 3.38Å; L207-Y245 HydrophobicContact CD1-CE2 4.49Å; L207-Y245 PolarHBondContact N-OH 3.44Å
208L93.9Very high89.7Confident100 Ų10045.9 Ų45.952%0.52426%0.255SS..Hα-helixtrans-58.8-48.4173.7-178.764.1000111.1V204 L205 M210 V211 I212V204-L208 WeakPolarHBondContact O-CB 3.3Å; V204-L208 PolarHBondContact O-N 3.4Å; L205-L208 PolarHBondContact O-N 3.46Å; L208-M210 VanDerWaalsContact C-N 3.29Å; L208-M210 PolarHBondContact O-N 3.31Å; L208-V211 PolarHBondContact O-N 2.9Å; L208-I212 HydrophobicContact CD1-CD1 3.84Å; L208-I212 HydrophobicContact CD1-CG1 4.39Å; L208-I212 HydrophobicContact CG-CD1 3.89Å; L208-I212 VanDerWaalsContact O-CG1 3.32Å; L208-I212 WeakPolarHBondContact O-CG1 3.25Å; L208-I212 PolarHBondContact O-N 2.88Å
209V92.1Very high89.3Confident21 Ų2153.5 Ų53.513%0.12729%0.288CS..Hα-helixtrans-59.3-43.3176.4172.80000110.6I120 T123 I124 L205 C213I120-V209 HydrophobicContact CG2-CG1 4.23Å; I120-V209 HydrophobicContact CG2-CG2 4.1Å; T123-V209 HydrophobicContact CG2-CG1 4.15Å; I124-V209 HydrophobicContact CG1-CG1 4.04Å; L205-V209 WeakPolarHBondContact O-CG2 3.44Å; L205-V209 PolarHBondContact O-N 3.36Å; V209-C213 WeakPolarHBondContact O-CB 3.38Å; V209-C213 PolarHBondContact O-N 2.95Å; V209-C213 PolarHBondContact O-SG 2.8Å
210M87.2Confident88.7Confident28 Ų2854.4 Ų54.414%0.13829%0.294CS..Hα-helixtrans-59.8-52.9178.5-174.4-175.1-169.400111P206 L207 L208 I212 C213 Y214 F238 M241 I242 Y245P206-M210 VanDerWaalsContact O-CB 3.25Å; P206-M210 WeakPolarHBondContact O-CB 3.33Å; P206-M210 PolarHBondContact O-N 2.92Å; L207-M210 WeakPolarHBondContact O-CB 3.43Å; L207-M210 PolarHBondContact O-N 3.14Å; L208-M210 VanDerWaalsContact C-N 3.29Å; L208-M210 PolarHBondContact O-N 3.31Å; M210-I212 VanDerWaalsContact C-N 3.35Å; M210-I212 PolarHBondContact O-N 3.35Å; M210-C213 PolarHBondContact O-N 3.29Å; M210-Y214 HydrophobicContact CB-CD2 4.29Å; M210-Y214 HydrophobicContact CG-CD2 3.49Å; M210-Y214 VanDerWaalsContact CG-CD2 3.49Å; M210-Y214 HydrophobicContact CG-CE2 3.82Å; M210-Y214 WeakPolarHBondContact O-CB 3.17Å; M210-Y214 VanDerWaalsContact O-CD2 3.27Å; M210-Y214 WeakPolarHBondContact O-CD2 3.4Å; M210-Y214 PolarHBondContact O-N 3.41Å; M210-F238 HydrophobicContact CE-CD2 3.98Å; M210-F238 HydrophobicContact CE-CE2 3.63Å; M210-M241 HydrophobicContact CE-CB 4.48Å; M210-M241 HydrophobicContact CE-CG 4.02Å; M210-M241 HydrophobicContact CG-CG 4.13Å; M210-M241 HydrophobicContact SD-CG 3.73Å; M210-I242 HydrophobicContact CE-CG1 4.13Å; M210-Y245 HydrophobicContact SD-CD2 4.19Å; M210-Y245 HydrophobicContact SD-CE2 3.63Å
211V89.8Confident87.8Confident85 Ų8551.1 Ų51.152%0.51528%0.277SS..Hα-helixtrans-58-48.5-178.8171.40000110.7L207 L208 S215L207-V211 WeakPolarHBondContact O-CG2 3.24Å; L207-V211 PolarHBondContact O-N 2.96Å; L208-V211 PolarHBondContact O-N 2.9Å; V211-S215 WeakPolarHBondContact O-CB 3.41Å; V211-S215 PolarHBondContact O-N 2.93Å; V211-S215 VanDerWaalsContact O-N 3.13Å; V211-S215 PolarHBondContact O-OG 3.44Å
212I91.1Very high86.9Confident94 Ų9455.9 Ų55.948%0.48230%0.302SS..Hα-helixtrans-64.1-51.8-179.2-64.8168.5000111L208 M210 G216L208-I212 HydrophobicContact CD1-CD1 3.84Å; L208-I212 HydrophobicContact CD1-CG1 4.39Å; L208-I212 HydrophobicContact CG-CD1 3.89Å; L208-I212 VanDerWaalsContact O-CG1 3.32Å; L208-I212 WeakPolarHBondContact O-CG1 3.25Å; L208-I212 PolarHBondContact O-N 2.88Å; M210-I212 VanDerWaalsContact C-N 3.35Å; M210-I212 PolarHBondContact O-N 3.35Å; I212-G216 PolarHBondContact O-N 2.86Å
213C88.8Confident86.2Confident7 Ų766.4 Ų66.45%0.04734%0.341CS..Hα-helixtrans-66.9-48.3-173.6-68.80000111.7T123 Y127 V209 M210 S215 G216 I217T123-C213 HydrophobicContact CG2-CB 3.84Å; Y127-C213 VanDerWaalsContact CD2-CA 3.46Å; Y127-C213 HydrophobicContact CD2-CB 3.88Å; Y127-C213 VanDerWaalsContact CD2-O 3.25Å; Y127-C213 WeakPolarHBondContact CD2-O 3.29Å; Y127-C213 HydrophobicContact CG-CB 4.1Å; V209-C213 WeakPolarHBondContact O-CB 3.38Å; V209-C213 PolarHBondContact O-N 2.95Å; V209-C213 PolarHBondContact O-SG 2.8Å; M210-C213 PolarHBondContact O-N 3.29Å; C213-S215 PolarHBondContact O-N 3.02Å; C213-G216 PolarHBondContact O-N 2.82Å; C213-I217 VanDerWaalsContact O-CG1 3.29Å; C213-I217 WeakPolarHBondContact O-CG1 3.39Å; C213-I217 PolarHBondContact O-N 3.44Å
214Y84.3Confident85Confident28 Ų2867.5 Ų67.511%0.1135%0.351CS..Hα-helixtrans-71.9-30.4-176.9-74.7-75.4000112.8T123 M210 G216 I217 L218 V234 I237 F238T123-Y214 HydrophobicContact CG2-CE2 3.89Å; M210-Y214 HydrophobicContact CB-CD2 4.29Å; M210-Y214 HydrophobicContact CG-CD2 3.49Å; M210-Y214 VanDerWaalsContact CG-CD2 3.49Å; M210-Y214 HydrophobicContact CG-CE2 3.82Å; M210-Y214 WeakPolarHBondContact O-CB 3.17Å; M210-Y214 VanDerWaalsContact O-CD2 3.27Å; M210-Y214 WeakPolarHBondContact O-CD2 3.4Å; M210-Y214 PolarHBondContact O-N 3.41Å; Y214-G216 PolarHBondContact O-N 3.09Å; Y214-I217 HydrophobicContact CD1-CD1 4.21Å; Y214-I217 HydrophobicContact CE1-CD1 4.35Å; Y214-I217 PolarHBondContact O-N 2.9Å; Y214-L218 VanDerWaalsContact O-CB 3.22Å; Y214-L218 WeakPolarHBondContact O-CB 3.39Å; Y214-L218 PolarHBondContact O-N 2.97Å; Y214-V234 HydrophobicContact CE1-CG1 4.22Å; Y214-I237 WeakPolarHBondContact OH-CG2 3.34Å; Y214-I237 PolarHBondContact OH-O 3.3Å; Y214-F238 AromaticContact CD1-CD2 3.82Å; Y214-F238 HydrophobicContact CD1-CD2 3.82Å; Y214-F238 HydrophobicContact CD2-CD2 4.3Å; Y214-F238 HydrophobicContact CE1-CB 3.71Å; Y214-F238 AromaticContact CE1-CD2 3.65Å; Y214-F238 HydrophobicContact CE1-CD2 3.65Å; Y214-F238 HydrophobicContact CE1-CG 4.13Å; Y214-F238 HydrophobicContact CE2-CD2 4.15Å; Y214-F238 HydrophobicContact CG-CD2 4.15Å; Y214-F238 AromaticContact CZ-CD2 3.83Å; Y214-F238 WeakPolarHBondContact OH-CA 3.24Å; Y214-F238 PolarHBondContact OH-N 3.48Å
215S86.2Confident83.3Confident71 Ų7174.8 Ų74.850%0.49737%0.371SS..Hα-helixtrans-60.4-45.7171.7-62.30000111.4V211 C213 K219V211-S215 WeakPolarHBondContact O-CB 3.41Å; V211-S215 PolarHBondContact O-N 2.93Å; V211-S215 VanDerWaalsContact O-N 3.13Å; V211-S215 PolarHBondContact O-OG 3.44Å; C213-S215 PolarHBondContact O-N 3.02Å; S215-K219 WeakPolarHBondContact O-CB 3.09Å; S215-K219 PolarHBondContact O-N 3.46Å
216G85.2Confident81.5Confident16 Ų1679.1 Ų79.117%0.16539%0.394CS..Hα-helixtrans-69.7-38.2177.200000113.4I212 C213 Y214 T220I212-G216 PolarHBondContact O-N 2.86Å; C213-G216 PolarHBondContact O-N 2.82Å; Y214-G216 PolarHBondContact O-N 3.09Å; G216-T220 PolarHBondContact O-N 2.73Å; G216-T220 VanDerWaalsContact O-N 3.08Å; G216-T220 PolarHBondContact O-OG1 2.86Å
217I83.1Confident80.3Confident4 Ų484.7 Ų84.72%0.02142%0.42CS..Hα-helixtrans-61.9-48.3174.5-71.3164000110.4Y127 V130 V131 C213 Y214 K219 T220 L221 V234Y127-I217 HydrophobicContact CD2-CD1 4.49Å; Y127-I217 HydrophobicContact CD2-CG1 4.1Å; V130-I217 HydrophobicContact CB-CG1 4.36Å; V130-I217 HydrophobicContact CG1-CG1 4.34Å; V130-I217 HydrophobicContact CG1-CG2 4.24Å; V131-I217 HydrophobicContact CG2-CG1 4.21Å; C213-I217 VanDerWaalsContact O-CG1 3.29Å; C213-I217 WeakPolarHBondContact O-CG1 3.39Å; C213-I217 PolarHBondContact O-N 3.44Å; Y214-I217 HydrophobicContact CD1-CD1 4.21Å; Y214-I217 HydrophobicContact CE1-CD1 4.35Å; Y214-I217 PolarHBondContact O-N 2.9Å; I217-K219 PolarHBondContact O-N 2.88Å; I217-T220 PolarHBondContact O-N 3.42Å; I217-L221 HydrophobicContact CG2-CD1 3.58Å; I217-L221 HydrophobicContact CG2-CG 4.14Å; I217-L221 WeakPolarHBondContact O-CB 3.5Å; I217-L221 VanDerWaalsContact O-CG 3.3Å; I217-L221 WeakPolarHBondContact O-CG 3.29Å; I217-L221 PolarHBondContact O-N 3.02Å; I217-V234 HydrophobicContact CG2-CB 4.4Å; I217-V234 HydrophobicContact CG2-CG1 3.64Å; I217-V234 HydrophobicContact CG2-CG2 3.83Å
218L81.5Confident78.8Confident104 Ų10486.7 Ų86.755%0.54543%0.431SS..Hα-helixtrans-61.7-45.6-179.2-175.362.7000110.9Y214 T220 L221 L222Y214-L218 VanDerWaalsContact O-CB 3.22Å; Y214-L218 WeakPolarHBondContact O-CB 3.39Å; Y214-L218 PolarHBondContact O-N 2.97Å; L218-T220 VanDerWaalsContact C-N 3.31Å; L218-T220 PolarHBondContact O-N 2.81Å; L218-L221 PolarHBondContact O-N 3.29Å; L218-L222 HydrophobicContact CD1-CD1 4.38Å; L218-L222 HydrophobicContact CD1-CG 4.32Å; L218-L222 HydrophobicContact CG-CD1 4.06Å; L218-L222 HydrophobicContact CG-CG 4.43Å; L218-L222 WeakPolarHBondContact O-CB 3.47Å; L218-L222 VanDerWaalsContact O-CG 3.28Å; L218-L222 WeakPolarHBondContact O-CG 3.43Å; L218-L222 PolarHBondContact O-N 3.08Å
219K83.3Confident77.2Confident165 Ų16590.8 Ų90.872%0.71745%0.445SS*.Hα-helixtrans-56.6-44.2175.7-173176.8-178.41770112.1S215 I217 R223S215-K219 WeakPolarHBondContact O-CB 3.09Å; S215-K219 PolarHBondContact O-N 3.46Å; I217-K219 PolarHBondContact O-N 2.88Å; K219-R223 PolarHBondContact O-N 2.82Å
220T78.1Confident75.8Confident33 Ų3392.4 Ų92.420%0.20245%0.449CS..Hα-helixtrans-73.2-34.4179.9-570000112.4V130 G216 I217 L218 R223 C224V130-T220 HydrophobicContact CG1-CG2 4.49Å; G216-T220 PolarHBondContact O-N 2.73Å; G216-T220 VanDerWaalsContact O-N 3.08Å; G216-T220 PolarHBondContact O-OG1 2.86Å; I217-T220 PolarHBondContact O-N 3.42Å; L218-T220 VanDerWaalsContact C-N 3.31Å; L218-T220 PolarHBondContact O-N 2.81Å; T220-R223 PolarHBondContact O-N 2.89Å; T220-C224 WeakPolarHBondContact O-CB 3.44Å; T220-C224 PolarHBondContact O-N 3.39Å; T220-C224 VanDerWaalsContact O-N 3.12Å
221L75.2Confident74.9Confident19 Ų1994.1 Ų94.110%0.09946%0.456CS..Hα-helixtrans-69.9-40.2175.5-72.1173.2000112.2I217 L218 R223 C224 V234I217-L221 HydrophobicContact CG2-CD1 3.58Å; I217-L221 HydrophobicContact CG2-CG 4.14Å; I217-L221 WeakPolarHBondContact O-CB 3.5Å; I217-L221 VanDerWaalsContact O-CG 3.3Å; I217-L221 WeakPolarHBondContact O-CG 3.29Å; I217-L221 PolarHBondContact O-N 3.02Å; L218-L221 PolarHBondContact O-N 3.29Å; L221-R223 PolarHBondContact O-N 3.1Å; L221-C224 CarbonylContact O-C 3.09Å; L221-C224 PolarHBondContact O-N 3.06Å; L221-V234 HydrophobicContact CD1-CG1 4.3Å; L221-V234 HydrophobicContact CD1-CG2 4.45Å
222L75.3Confident73.8Confident139 Ų13997 Ų9773%0.72846%0.458SS*.Hα-helixtrans-62.2-31.7174.5-70.6171.6000112.1L218L218-L222 HydrophobicContact CD1-CD1 4.38Å; L218-L222 HydrophobicContact CD1-CG 4.32Å; L218-L222 HydrophobicContact CG-CD1 4.06Å; L218-L222 HydrophobicContact CG-CG 4.43Å; L218-L222 WeakPolarHBondContact O-CB 3.47Å; L218-L222 VanDerWaalsContact O-CG 3.28Å; L218-L222 WeakPolarHBondContact O-CG 3.43Å; L218-L222 PolarHBondContact O-N 3.08Å
223R75.1Confident72.6Confident223 Ų22394 Ų9484%0.84245%0.448SS*.Hα-helixtrans-78.9-27.7177.4-166.1173.8-178.7-178.30.7113.5K219 T220 L221K219-R223 PolarHBondContact O-N 2.82Å; T220-R223 PolarHBondContact O-N 2.89Å; L221-R223 PolarHBondContact O-N 3.1Å
224C65.9Low71.7Confident59 Ų5994.3 Ų94.340%0.39945%0.449SS..  trans-116.787.4-175.4-62.60000111T220 L221 N226T220-C224 WeakPolarHBondContact O-CB 3.44Å; T220-C224 PolarHBondContact O-N 3.39Å; T220-C224 VanDerWaalsContact O-N 3.12Å; L221-C224 CarbonylContact O-C 3.09Å; L221-C224 PolarHBondContact O-N 3.06Å; C224-N226 VanDerWaalsContact C-N 3.3Å; C224-N226 PolarHBondContact O-N 3.03Å
225R58.4Low71.1Confident231 Ų23198.5 Ų98.587%0.87247%0.471SS*.THydrogen-bonded Turntrans-71.3-3.9-169.4-173163.1132.8167-4.9116.6
226N55.5Low70.4Confident153 Ų15396.8 Ų96.882%0.81846%0.456SS*.THydrogen-bonded Turntrans-120.915.6-161.4-100.55.5000118.5C224C224-N226 VanDerWaalsContact C-N 3.3Å; C224-N226 PolarHBondContact O-N 3.03Å
227E65.1Low69.7Low116 Ų11696.3 Ų96.354%0.54245%0.45SS..  trans-120.880.2-179.2-69.6-143.5176.300115.8K229 R230 H231E227-K229 PolarHBondContact O-N 2.03Å; E227-K229 VanDerWaalsContact O-N 3.12Å; E227-R230 HydrophobicContact CB-CB 4.11Å; E227-R230 WeakPolarHBondContact O-CB 3.3Å; E227-R230 PolarHBondContact O-N 3.14Å; E227-H231 PolarHBondContact O-CD2 3.05Å; E227-H231 VanDerWaalsContact O-CD2 3.3Å; E227-H231 PolarHBondContact O-N 3.18Å
228N60.3Low69.4Low125 Ų12599.6 Ų99.667%0.66846%0.464SS*.Hα-helixtrans-53.4-32.7179.4-69.9-12.6000114.9
229K58.8Low69.3Low186 Ų18696.6 Ų96.681%0.80945%0.451SS*.Hα-helixtrans-70.5-31.5178.6-76.1-179.4-179.6170.60112.8E227E227-K229 PolarHBondContact O-N 2.03Å; E227-K229 VanDerWaalsContact O-N 3.12Å
230R64Low69.1Low54 Ų5488.8 Ų88.820%0.20442%0.418CS..Hα-helixtrans-73.4-36.3-179.2-149.9174.176.8173.33.7111.1V130 E227 R232 V234V130-R230 HydrophobicContact CG2-CG 4.02Å; E227-R230 HydrophobicContact CB-CB 4.11Å; E227-R230 WeakPolarHBondContact O-CB 3.3Å; E227-R230 PolarHBondContact O-N 3.14Å; R230-R232 PolarHBondContact O-N 3.23Å; R230-V234 WeakPolarHBondContact O-CG2 3.05Å; R230-V234 PolarHBondContact O-N 3.08Å
231H67.4Low69.2Low65 Ų6587.2 Ų87.230%0.30141%0.408SS..Hα-helixtrans-59.3-43.8173.4-75.6-83000113E227 A233 V234 M235E227-H231 PolarHBondContact O-CD2 3.05Å; E227-H231 VanDerWaalsContact O-CD2 3.3Å; E227-H231 PolarHBondContact O-N 3.18Å; H231-A233 PolarHBondContact O-N 3.06Å; H231-V234 PolarHBondContact O-N 3.04Å; H231-M235 WeakPolarHBondContact O-CG 3.3Å; H231-M235 PolarHBondContact O-N 3.34Å
232R67.6Low69.8Low144 Ų14489.4 Ų89.454%0.54342%0.419SS..Hα-helixtrans-63.1-41.1-177.8-68.6-178.2-176.2175.4-0.7113.2R230 M235 L236 E302R230-R232 PolarHBondContact O-N 3.23Å; R232-M235 PolarHBondContact O-N 2.81Å; R232-L236 PolarHBondContact O-N 3.3Å; R232-E302 IonicContact CZ-OE1 3.32Å; R232-E302 IonicContact CZ-OE2 2.98Å; R232-E302 IonicContact NE-OE1 3.86Å; R232-E302 IonicContact NH1-OE1 3.78Å; R232-E302 PolarHBondContact NH1-OE1 2.78Å; R232-E302 IonicContact NH1-OE2 3.98Å; R232-E302 PolarHBondContact NH1-OE2 3.25Å; R232-E302 IonicContact NH2-OE1 3.87Å
233A64.8Low70.5Confident33 Ų3384.1 Ų84.127%0.27339%0.393SS..Hα-helixtrans-69-34.8178.700000112.6H231 I237H231-A233 PolarHBondContact O-N 3.06Å; A233-I237 PolarHBondContact O-N 3.32Å
234V69.8Low71.1Confident13 Ų1373.7 Ų73.78%0.07935%0.353CS..Hα-helixtrans-66.6-45.1173.5170.90000110.6V130 Y214 I217 L221 R230 H231 L236 I237 F238V130-V234 HydrophobicContact CG2-CG2 4.02Å; Y214-V234 HydrophobicContact CE1-CG1 4.22Å; I217-V234 HydrophobicContact CG2-CB 4.4Å; I217-V234 HydrophobicContact CG2-CG1 3.64Å; I217-V234 HydrophobicContact CG2-CG2 3.83Å; L221-V234 HydrophobicContact CD1-CG1 4.3Å; L221-V234 HydrophobicContact CD1-CG2 4.45Å; R230-V234 WeakPolarHBondContact O-CG2 3.05Å; R230-V234 PolarHBondContact O-N 3.08Å; H231-V234 PolarHBondContact O-N 3.04Å; V234-L236 VanDerWaalsContact C-N 3.32Å; V234-L236 PolarHBondContact O-N 3Å; V234-I237 PolarHBondContact O-N 3.46Å; V234-F238 VanDerWaalsContact O-CB 3.32Å; V234-F238 WeakPolarHBondContact O-CB 3.39Å; V234-F238 PolarHBondContact O-N 3.28Å
235M72.4Confident72.2Confident115 Ų11572.2 Ų72.257%0.56734%0.34SS*.Hα-helixtrans-60.2-40.1177.2-71.3-59-154.900112.2H231 R232 F238 S239H231-M235 WeakPolarHBondContact O-CG 3.3Å; H231-M235 PolarHBondContact O-N 3.34Å; R232-M235 PolarHBondContact O-N 2.81Å; M235-F238 PolarHBondContact O-N 2.8Å; M235-S239 WeakPolarHBondContact O-CB 3.44Å; M235-S239 PolarHBondContact O-N 3.32Å; M235-S239 PolarHBondContact O-OG 3.22Å
236L71.2Confident73.9Confident35 Ų3566.4 Ų66.418%0.18333%0.325CS..Hα-helixtrans-58.7-51.1176.8178.266.8000112.3R232 V234 F238 S239 I240 I296 Y297 V300R232-L236 PolarHBondContact O-N 3.3Å; V234-L236 VanDerWaalsContact C-N 3.32Å; V234-L236 PolarHBondContact O-N 3Å; L236-F238 VanDerWaalsContact C-N 3.32Å; L236-S239 PolarHBondContact O-N 2.86Å; L236-I240 HydrophobicContact CD1-CD1 4.45Å; L236-I240 HydrophobicContact CG-CD1 4.22Å; L236-I240 VanDerWaalsContact O-CG1 3.3Å; L236-I240 WeakPolarHBondContact O-CG1 3.07Å; L236-I240 PolarHBondContact O-N 3.03Å; L236-I296 HydrophobicContact CD1-CG2 3.9Å; L236-Y297 HydrophobicContact CD1-CD1 4.49Å; L236-V300 HydrophobicContact CB-CG1 4.14Å; L236-V300 HydrophobicContact CD1-CB 3.64Å; L236-V300 HydrophobicContact CD1-CG1 3.61Å
237I71.3Confident75.6Confident7 Ų761 Ų614%0.03629%0.294CS..Hα-helixtrans-70.6-32.7-178.6-56.9-48000111.2R126 Y214 A233 V234 I240 M241R126-I237 HydrophobicContact CG-CB 4.29Å; R126-I237 HydrophobicContact CG-CG1 3.56Å; Y214-I237 WeakPolarHBondContact OH-CG2 3.34Å; Y214-I237 PolarHBondContact OH-O 3.3Å; A233-I237 PolarHBondContact O-N 3.32Å; V234-I237 PolarHBondContact O-N 3.46Å; I237-I240 HydrophobicContact CD1-CD1 3.78Å; I237-I240 PolarHBondContact O-N 3.21Å; I237-M241 PolarHBondContact O-N 2.82Å
238F77.5Confident76.9Confident73 Ų7356 Ų5632%0.3227%0.27SS..Hα-helixtrans-63.7-44.1174.4-175.3-110.5000111.5M210 Y214 V234 M235 L236 M241 I242M210-F238 HydrophobicContact CE-CD2 3.98Å; M210-F238 HydrophobicContact CE-CE2 3.63Å; Y214-F238 AromaticContact CD1-CD2 3.82Å; Y214-F238 HydrophobicContact CD1-CD2 3.82Å; Y214-F238 HydrophobicContact CD2-CD2 4.3Å; Y214-F238 HydrophobicContact CE1-CB 3.71Å; Y214-F238 AromaticContact CE1-CD2 3.65Å; Y214-F238 HydrophobicContact CE1-CD2 3.65Å; Y214-F238 HydrophobicContact CE1-CG 4.13Å; Y214-F238 HydrophobicContact CE2-CD2 4.15Å; Y214-F238 HydrophobicContact CG-CD2 4.15Å; Y214-F238 AromaticContact CZ-CD2 3.83Å; Y214-F238 WeakPolarHBondContact OH-CA 3.24Å; Y214-F238 PolarHBondContact OH-N 3.48Å; V234-F238 VanDerWaalsContact O-CB 3.32Å; V234-F238 WeakPolarHBondContact O-CB 3.39Å; V234-F238 PolarHBondContact O-N 3.28Å; M235-F238 PolarHBondContact O-N 2.8Å; L236-F238 VanDerWaalsContact C-N 3.32Å; F238-M241 PolarHBondContact O-N 2.94Å; F238-I242 HydrophobicContact CD1-CD1 3.71Å; F238-I242 HydrophobicContact CE1-CD1 3.18Å; F238-I242 HydrophobicContact CE1-CG1 4.28Å; F238-I242 HydrophobicContact CE2-CD1 4.08Å; F238-I242 HydrophobicContact CE2-CG1 4.47Å; F238-I242 HydrophobicContact CG-CD1 4.37Å; F238-I242 HydrophobicContact CZ-CD1 3.41Å; F238-I242 VanDerWaalsContact CZ-CD1 3.41Å; F238-I242 HydrophobicContact CZ-CG1 4.25Å; F238-I242 PolarHBondContact O-N 3.28Å
239S79.4Confident78.3Confident40 Ų4050.9 Ų50.928%0.2825%0.246SC..Hα-helixtrans-60.6-45.8174.1-63.70000112.2M235 L236 M241 I242 V243M235-S239 WeakPolarHBondContact O-CB 3.44Å; M235-S239 PolarHBondContact O-N 3.32Å; M235-S239 PolarHBondContact O-OG 3.22Å; L236-S239 PolarHBondContact O-N 2.86Å; S239-M241 VanDerWaalsContact C-N 3.28Å; S239-M241 PolarHBondContact O-N 3.11Å; S239-I242 PolarHBondContact O-N 3.39Å; S239-V243 WeakPolarHBondContact O-CB 3.36Å; S239-V243 VanDerWaalsContact O-CG2 3.25Å; S239-V243 WeakPolarHBondContact O-CG2 3.07Å; S239-V243 PolarHBondContact O-N 3.14Å
240I79Confident80Confident2 Ų244.1 Ų44.11%0.0122%0.221CC..Hα-helixtrans-57.1-44.1176.8-65.2163.7000110.7I119 L236 I237 Y244 I296 Y297I119-I240 HydrophobicContact CD1-CG2 4.35Å; I119-I240 HydrophobicContact CG1-CG2 4.31Å; L236-I240 HydrophobicContact CD1-CD1 4.45Å; L236-I240 HydrophobicContact CG-CD1 4.22Å; L236-I240 VanDerWaalsContact O-CG1 3.3Å; L236-I240 WeakPolarHBondContact O-CG1 3.07Å; L236-I240 PolarHBondContact O-N 3.03Å; I237-I240 HydrophobicContact CD1-CD1 3.78Å; I237-I240 PolarHBondContact O-N 3.21Å; I240-Y244 WeakPolarHBondContact O-CB 3.17Å; I240-Y244 PolarHBondContact O-N 3.29Å; I240-I296 HydrophobicContact CG1-CD1 4.26Å; I240-I296 HydrophobicContact CG1-CG2 3.77Å; I240-Y297 HydrophobicContact CD1-CD1 4.48Å; I240-Y297 HydrophobicContact CD1-CE1 3.67Å; I240-Y297 HydrophobicContact CG1-CE1 4.41Å
241M80.2Confident81.3Confident0 Ų042.5 Ų42.50%022%0.215CC..Hα-helixtrans-68.5-43.5-179-171.366.975.100112.8I119 T123 M210 I237 F238 S239 V243 Y244 Y245I119-M241 HydrophobicContact CG2-CE 3.43Å; I119-M241 VanDerWaalsContact CG2-CE 3.43Å; I119-M241 HydrophobicContact CG2-SD 3.83Å; T123-M241 HydrophobicContact CG2-CE 4.42Å; T123-M241 WeakPolarHBondContact OG1-CE 3.33Å; M210-M241 HydrophobicContact CE-CB 4.48Å; M210-M241 HydrophobicContact CE-CG 4.02Å; M210-M241 HydrophobicContact CG-CG 4.13Å; M210-M241 HydrophobicContact SD-CG 3.73Å; I237-M241 PolarHBondContact O-N 2.82Å; F238-M241 PolarHBondContact O-N 2.94Å; S239-M241 VanDerWaalsContact C-N 3.28Å; S239-M241 PolarHBondContact O-N 3.11Å; M241-V243 VanDerWaalsContact C-N 3.34Å; M241-Y244 WeakPolarHBondContact O-CB 3.07Å; M241-Y244 PolarHBondContact O-N 2.89Å; M241-Y245 HydrophobicContact CG-CD2 4.14Å; M241-Y245 HydrophobicContact CG-CE2 3.65Å; M241-Y245 WeakPolarHBondContact O-CD2 3.45Å; M241-Y245 PolarHBondContact O-N 3.01Å; M241-Y245 VanDerWaalsContact O-N 3.14Å; M241-Y245 HydrophobicContact SD-CE2 3.73Å
242I86.9Confident82.4Confident64 Ų6439.4 Ų39.433%0.32820%0.201SC..Hα-helixtrans-61.5-46.7176.2-73.6177.9000110.3M210 F238 S239 Y244 Y245 L246M210-I242 HydrophobicContact CE-CG1 4.13Å; F238-I242 HydrophobicContact CD1-CD1 3.71Å; F238-I242 HydrophobicContact CE1-CD1 3.18Å; F238-I242 HydrophobicContact CE1-CG1 4.28Å; F238-I242 HydrophobicContact CE2-CD1 4.08Å; F238-I242 HydrophobicContact CE2-CG1 4.47Å; F238-I242 HydrophobicContact CG-CD1 4.37Å; F238-I242 HydrophobicContact CZ-CD1 3.41Å; F238-I242 VanDerWaalsContact CZ-CD1 3.41Å; F238-I242 HydrophobicContact CZ-CG1 4.25Å; F238-I242 PolarHBondContact O-N 3.28Å; S239-I242 PolarHBondContact O-N 3.39Å; I242-Y244 VanDerWaalsContact C-N 3.27Å; I242-Y244 PolarHBondContact O-N 3.28Å; I242-Y245 PolarHBondContact O-N 3.34Å; I242-Y245 VanDerWaalsContact O-N 3.11Å; I242-L246 HydrophobicContact CG2-CD1 3.84Å; I242-L246 HydrophobicContact CG2-CG 4.14Å; I242-L246 WeakPolarHBondContact O-CG 3.4Å; I242-L246 PolarHBondContact O-N 2.75Å
243V89.2Confident83.5Confident28 Ų2836.8 Ų36.817%0.1720%0.197CC..Hα-helixtrans-61-40.2179.2172.80000110.6S239 M241 Y245 L246 F247 I292 I296S239-V243 WeakPolarHBondContact O-CB 3.36Å; S239-V243 VanDerWaalsContact O-CG2 3.25Å; S239-V243 WeakPolarHBondContact O-CG2 3.07Å; S239-V243 PolarHBondContact O-N 3.14Å; M241-V243 VanDerWaalsContact C-N 3.34Å; V243-Y245 VanDerWaalsContact C-N 3.35Å; V243-Y245 PolarHBondContact O-N 3.13Å; V243-L246 PolarHBondContact O-N 2.68Å; V243-F247 HydrophobicContact CG1-CD2 3.85Å; V243-F247 HydrophobicContact CG1-CE2 3.82Å; V243-F247 WeakPolarHBondContact O-CD2 3.47Å; V243-F247 PolarHBondContact O-N 2.83Å; V243-F247 VanDerWaalsContact O-N 3.13Å; V243-I292 HydrophobicContact CG1-CG2 3.73Å; V243-I296 HydrophobicContact CB-CD1 3.97Å; V243-I296 HydrophobicContact CG1-CD1 3.99Å; V243-I296 HydrophobicContact CG2-CD1 4.03Å
244Y87.9Confident84.7Confident4 Ų436 Ų362%0.01619%0.189CC..Hα-helixtrans-54.8-48.7172.6172.4-92.3000112.1I116 I119 R202 I240 M241 I242 F247 W248 H289I116-Y244 HydrophobicContact CB-CE2 4.22Å; I116-Y244 HydrophobicContact CD1-CD1 3.94Å; I116-Y244 HydrophobicContact CD1-CD2 4.22Å; I116-Y244 HydrophobicContact CD1-CE1 3.47Å; I116-Y244 VanDerWaalsContact CD1-CE1 3.47Å; I116-Y244 HydrophobicContact CD1-CE2 3.78Å; I116-Y244 HydrophobicContact CD1-CG 4.29Å; I116-Y244 HydrophobicContact CG1-CE1 4.24Å; I116-Y244 HydrophobicContact CG1-CE2 4.31Å; I119-Y244 HydrophobicContact CD1-CD2 4.03Å; I119-Y244 HydrophobicContact CD1-CG 4.41Å; R202-Y244 WeakPolarHBondContact CB-OH 3.24Å; R202-Y244 PolarHBondContact NE-OH 3.38Å; R202-Y244 WeakPolarHBondContact O-CE1 3.48Å; R202-Y244 PolarHBondContact O-OH 3.09Å; I240-Y244 WeakPolarHBondContact O-CB 3.17Å; I240-Y244 PolarHBondContact O-N 3.29Å; M241-Y244 WeakPolarHBondContact O-CB 3.07Å; M241-Y244 PolarHBondContact O-N 2.89Å; I242-Y244 VanDerWaalsContact C-N 3.27Å; I242-Y244 PolarHBondContact O-N 3.28Å; Y244-F247 PolarHBondContact O-N 3.1Å; Y244-W248 AromaticContact CD2-CD1 3.45Å; Y244-W248 VanDerWaalsContact CD2-CD1 3.45Å; Y244-W248 HydrophobicContact CD2-CG 4.28Å; Y244-W248 HydrophobicContact CE1-CB 4.43Å; Y244-W248 HydrophobicContact CE2-CB 4.18Å; Y244-W248 AromaticContact CE2-CD1 3.39Å; Y244-W248 AromaticContact CE2-CG 3.89Å; Y244-W248 HydrophobicContact CE2-CG 3.89Å; Y244-W248 WeakPolarHBondContact O-CB 3.42Å; Y244-W248 PolarHBondContact O-N 3.29Å; Y244-H289 WeakPolarHBondContact CA-NE2 3.37Å; Y244-H289 AromaticContact CD2-CE1 4Å
245Y90.4Very high85.6Confident29 Ų2936.8 Ų36.811%0.11419%0.191CC..Hα-helixtrans-66.9-39.2178.6-72.7-62.2000113.5L203 P206 L207 M210 M241 I242 V243 F247 A249 P250L203-Y245 HydrophobicContact CD1-CD1 4.06Å; L203-Y245 HydrophobicContact CD1-CE1 4.01Å; P206-Y245 WeakPolarHBondContact CB-OH 3.39Å; P206-Y245 HydrophobicContact CG-CE1 4.46Å; P206-Y245 WeakPolarHBondContact CG-OH 3.33Å; P206-Y245 PolarHBondContact O-OH 3.37Å; L207-Y245 WeakPolarHBondContact CA-OH 3.38Å; L207-Y245 HydrophobicContact CD1-CE2 4.49Å; L207-Y245 PolarHBondContact N-OH 3.44Å; M210-Y245 HydrophobicContact SD-CD2 4.19Å; M210-Y245 HydrophobicContact SD-CE2 3.63Å; M241-Y245 HydrophobicContact CG-CD2 4.14Å; M241-Y245 HydrophobicContact CG-CE2 3.65Å; M241-Y245 WeakPolarHBondContact O-CD2 3.45Å; M241-Y245 PolarHBondContact O-N 3.01Å; M241-Y245 VanDerWaalsContact O-N 3.14Å; M241-Y245 HydrophobicContact SD-CE2 3.73Å; I242-Y245 PolarHBondContact O-N 3.34Å; I242-Y245 VanDerWaalsContact O-N 3.11Å; V243-Y245 VanDerWaalsContact C-N 3.35Å; V243-Y245 PolarHBondContact O-N 3.13Å; Y245-F247 PolarHBondContact O-N 3.2Å; Y245-A249 HydrophobicContact CD1-CB 4.38Å; Y245-A249 WeakPolarHBondContact O-CA 3.23Å; Y245-A249 WeakPolarHBondContact O-CB 3.44Å; Y245-A249 PolarHBondContact O-N 2.88Å; Y245-P250 WeakPolarHBondContact O-CD 3.32Å
246L92.4Very high86.4Confident109 Ų10934.3 Ų34.357%0.57118%0.18SC*.Hα-helixtrans-58.6-35.7177.5-71.2174.5000111.8I242 V243I242-L246 HydrophobicContact CG2-CD1 3.84Å; I242-L246 HydrophobicContact CG2-CG 4.14Å; I242-L246 WeakPolarHBondContact O-CG 3.4Å; I242-L246 PolarHBondContact O-N 2.75Å; V243-L246 PolarHBondContact O-N 2.68Å
247F91.9Very high87.2Confident39 Ų3935.7 Ų35.717%0.17119%0.187CC..Hα-helixtrans-89.2-38.2-177.5-77.2-114.6000112.6V243 Y244 Y245 L285 T288 H289 I292V243-F247 HydrophobicContact CG1-CD2 3.85Å; V243-F247 HydrophobicContact CG1-CE2 3.82Å; V243-F247 WeakPolarHBondContact O-CD2 3.47Å; V243-F247 PolarHBondContact O-N 2.83Å; V243-F247 VanDerWaalsContact O-N 3.13Å; Y244-F247 PolarHBondContact O-N 3.1Å; Y245-F247 PolarHBondContact O-N 3.2Å; F247-L285 HydrophobicContact CD1-CD1 3.94Å; F247-L285 HydrophobicContact CD1-CG 4.25Å; F247-L285 VanDerWaalsContact CD1-O 3.32Å; F247-L285 WeakPolarHBondContact CD1-O 3.16Å; F247-L285 HydrophobicContact CE1-CD1 4.03Å; F247-L285 HydrophobicContact CG-CD1 4.47Å; F247-T288 WeakPolarHBondContact CD1-OG1 3.31Å; F247-T288 VanDerWaalsContact CE1-OG1 3.24Å; F247-T288 WeakPolarHBondContact CE1-OG1 3.4Å; F247-H289 HydrophobicContact CB-CB 3.97Å; F247-H289 HydrophobicContact CD1-CB 4.02Å; F247-H289 HydrophobicContact CG-CB 4.21Å; F247-I292 HydrophobicContact CE1-CD1 4.31Å; F247-I292 HydrophobicContact CE1-CG1 3.87Å; F247-I292 HydrophobicContact CZ-CD1 4.21Å; F247-I292 HydrophobicContact CZ-CG1 3.93Å
248W91.4Very high87.8Confident10 Ų1036.5 Ų36.54%0.03819%0.191CC..Hα-helixtrans-103.2-28.2-171.7-74.1109.1000115.3F79 F112 R202 Y244 P250 Y251 N252 G286 H289F79-W248 HydrophobicContact CE2-CH2 4.46Å; F79-W248 HydrophobicContact CZ-CH2 4.2Å; F79-W248 HydrophobicContact CZ-CZ2 4.38Å; F112-W248 AromaticContact CD2-CH2 3.65Å; F112-W248 HydrophobicContact CD2-CH2 3.65Å; F112-W248 HydrophobicContact CD2-CZ2 4.06Å; F112-W248 HydrophobicContact CD2-CZ3 4.09Å; F112-W248 HydrophobicContact CE2-CE3 4.02Å; F112-W248 AromaticContact CE2-CH2 3.34Å; F112-W248 HydrophobicContact CE2-CH2 3.34Å; F112-W248 HydrophobicContact CE2-CZ2 4.1Å; F112-W248 AromaticContact CE2-CZ3 3.31Å; F112-W248 HydrophobicContact CE2-CZ3 3.31Å; F112-W248 HydrophobicContact CZ-CZ3 4.2Å; R202-W248 VanDerWaalsContact NH1-CE3 3.35Å; R202-W248 VanDerWaalsContact NH2-CE3 3.26Å; Y244-W248 AromaticContact CD2-CD1 3.45Å; Y244-W248 VanDerWaalsContact CD2-CD1 3.45Å; Y244-W248 HydrophobicContact CD2-CG 4.28Å; Y244-W248 HydrophobicContact CE1-CB 4.43Å; Y244-W248 HydrophobicContact CE2-CB 4.18Å; Y244-W248 AromaticContact CE2-CD1 3.39Å; Y244-W248 AromaticContact CE2-CG 3.89Å; Y244-W248 HydrophobicContact CE2-CG 3.89Å; Y244-W248 WeakPolarHBondContact O-CB 3.42Å; Y244-W248 PolarHBondContact O-N 3.29Å; W248-P250 VanDerWaalsContact C-CD 3.47Å; W248-Y251 HydrophobicContact CE3-CD1 4.23Å; W248-Y251 HydrophobicContact CZ3-CD1 4.27Å; W248-Y251 PolarHBondContact O-N 2.88Å; W248-N252 PolarHBondContact O-N 3.41Å; W248-N252 VanDerWaalsContact O-N 3.1Å; W248-N252 PolarHBondContact O-ND2 3.23Å; W248-G286 VanDerWaalsContact CE2-O 3.29Å; W248-G286 VanDerWaalsContact CZ2-C 3.4Å; W248-G286 WeakPolarHBondContact CZ2-O 3.37Å; W248-H289 AromaticContact CD1-CG 3.86Å; W248-H289 AromaticContact NE1-CG 3.45Å; W248-H289 AromaticContact NE1-ND1 3.55Å
249A90.8Very high88.2Confident18 Ų1833.4 Ų33.415%0.14918%0.178CC..Hα-helixtrans-59.7-41.117900000112.8L203 Y245 Y251 N252 I253L203-A249 HydrophobicContact CD1-CB 4Å; Y245-A249 HydrophobicContact CD1-CB 4.38Å; Y245-A249 WeakPolarHBondContact O-CA 3.23Å; Y245-A249 WeakPolarHBondContact O-CB 3.44Å; Y245-A249 PolarHBondContact O-N 2.88Å; A249-Y251 VanDerWaalsContact C-N 3.31Å; A249-Y251 PolarHBondContact O-N 2.91Å; A249-N252 PolarHBondContact O-N 2.98Å; A249-I253 VanDerWaalsContact O-CG1 3.29Å; A249-I253 WeakPolarHBondContact O-CG1 3.42Å; A249-I253 PolarHBondContact O-N 3.4Å
250P93.7Very high88.4Confident44 Ų4434.4 Ų34.429%0.28618%0.178SC..Hα-helixtrans-54.9-46.2176.6-26.936000112.5Y245 W248 I253 V254 T282 L285Y245-P250 WeakPolarHBondContact O-CD 3.32Å; W248-P250 VanDerWaalsContact C-CD 3.47Å; P250-I253 PolarHBondContact O-N 3.26Å; P250-V254 WeakPolarHBondContact O-CG2 3.17Å; P250-V254 PolarHBondContact O-N 3.34Å; P250-T282 HydrophobicContact CB-CG2 3.6Å; P250-L285 HydrophobicContact CG-CD2 4.39Å
251Y91.6Very high88.3Confident20 Ų2036 Ų368%0.07819%0.186CC..Hα-helixtrans-63-47.3177.8173-99.4000112.1F112 W248 A249 I253 V254 H255 M279 E283F112-Y251 HydrophobicContact CZ-CE1 4.36Å; W248-Y251 HydrophobicContact CE3-CD1 4.23Å; W248-Y251 HydrophobicContact CZ3-CD1 4.27Å; W248-Y251 PolarHBondContact O-N 2.88Å; A249-Y251 VanDerWaalsContact C-N 3.31Å; A249-Y251 PolarHBondContact O-N 2.91Å; Y251-I253 VanDerWaalsContact C-N 3.28Å; Y251-I253 PolarHBondContact O-N 3.11Å; Y251-V254 PolarHBondContact O-N 3.38Å; Y251-H255 VanDerWaalsContact O-CB 3.25Å; Y251-H255 WeakPolarHBondContact O-CB 3.43Å; Y251-H255 PolarHBondContact O-N 3.09Å; Y251-M279 HydrophobicContact CE2-CG 4.25Å; Y251-E283 HydrophobicContact CD2-CB 3.64Å; Y251-E283 HydrophobicContact CD2-CG 4.29Å; Y251-E283 HydrophobicContact CE2-CB 3.69Å; Y251-E283 HydrophobicContact CE2-CG 4Å
252N90.8Very high87.7Confident1 Ų144 Ų441%0.00522%0.222CC..Hα-helixtrans-62.8-36-179.1-69.4-73000112L203 W248 A249 L256L203-N252 HydrophobicContact CB-CB 4.46Å; L203-N252 HydrophobicContact CD2-CB 4.35Å; W248-N252 PolarHBondContact O-N 3.41Å; W248-N252 VanDerWaalsContact O-N 3.1Å; W248-N252 PolarHBondContact O-ND2 3.23Å; A249-N252 PolarHBondContact O-N 2.98Å; N252-L256 WeakPolarHBondContact O-CB 3.25Å; N252-L256 PolarHBondContact O-N 3.43Å; N252-L256 VanDerWaalsContact O-N 3.09Å
253I90.9Very high87Confident89 Ų8950.1 Ų50.146%0.45625%0.247SC..Hα-helixtrans-67.8-48.3176-66.6164.8000110.4A249 P250 Y251 H255 L256 L257A249-I253 VanDerWaalsContact O-CG1 3.29Å; A249-I253 WeakPolarHBondContact O-CG1 3.42Å; A249-I253 PolarHBondContact O-N 3.4Å; P250-I253 PolarHBondContact O-N 3.26Å; Y251-I253 VanDerWaalsContact C-N 3.28Å; Y251-I253 PolarHBondContact O-N 3.11Å; I253-H255 VanDerWaalsContact C-N 3.34Å; I253-H255 PolarHBondContact O-N 3.14Å; I253-L256 WeakPolarHBondContact O-CB 3.25Å; I253-L256 PolarHBondContact O-N 3.26Å; I253-L257 HydrophobicContact CG2-CD1 4.24Å; I253-L257 WeakPolarHBondContact O-CG 3.5Å; I253-L257 PolarHBondContact O-N 3.3Å
254V90.7Very high85.8Confident17 Ų1751.3 Ų51.310%0.10326%0.257CS..Hα-helixtrans-63.5-40.6179174.60000111.4P250 Y251 L256 L257 D258 L275 A278 M279 T282P250-V254 WeakPolarHBondContact O-CG2 3.17Å; P250-V254 PolarHBondContact O-N 3.34Å; Y251-V254 PolarHBondContact O-N 3.38Å; V254-L256 VanDerWaalsContact C-N 3.32Å; V254-L256 PolarHBondContact O-N 2.96Å; V254-L257 WeakPolarHBondContact O-CB 3.37Å; V254-L257 PolarHBondContact O-N 2.93Å; V254-D258 PolarHBondContact O-N 2.88Å; V254-L275 HydrophobicContact CG1-CD1 3.98Å; V254-L275 HydrophobicContact CG1-CG 4.24Å; V254-A278 HydrophobicContact CG1-CB 4.06Å; V254-A278 HydrophobicContact CG2-CB 4.18Å; V254-M279 HydrophobicContact CG1-CB 3.88Å; V254-T282 HydrophobicContact CG2-CG2 4.16Å
255H88.5Confident84.7Confident28 Ų2853.5 Ų53.513%0.1328%0.281CS..Hα-helixtrans-63.9-36.2176.9-169.861.8000112.6Y251 I253 D258 T259Y251-H255 VanDerWaalsContact O-CB 3.25Å; Y251-H255 WeakPolarHBondContact O-CB 3.43Å; Y251-H255 PolarHBondContact O-N 3.09Å; I253-H255 VanDerWaalsContact C-N 3.34Å; I253-H255 PolarHBondContact O-N 3.14Å; H255-D258 PolarHBondContact O-N 3.48Å; H255-T259 PolarHBondContact O-N 3.09Å; H255-T259 VanDerWaalsContact O-N 3.14Å; H255-T259 PolarHBondContact O-OG1 3.48Å
256L89.1Confident83.6Confident63 Ų6354.6 Ų54.633%0.3329%0.288SS..Hα-helixtrans-64.8-47172.2-173.571.5000111T195 V199 N252 I253 V254 D258 T259 F260T195-L256 HydrophobicContact CG2-CD1 4.28Å; V199-L256 HydrophobicContact CG2-CB 4.33Å; V199-L256 HydrophobicContact CG2-CD1 4.27Å; N252-L256 WeakPolarHBondContact O-CB 3.25Å; N252-L256 PolarHBondContact O-N 3.43Å; N252-L256 VanDerWaalsContact O-N 3.09Å; I253-L256 WeakPolarHBondContact O-CB 3.25Å; I253-L256 PolarHBondContact O-N 3.26Å; V254-L256 VanDerWaalsContact C-N 3.32Å; V254-L256 PolarHBondContact O-N 2.96Å; L256-D258 VanDerWaalsContact C-N 3.29Å; L256-D258 PolarHBondContact O-N 2.85Å; L256-T259 PolarHBondContact O-N 2.88Å; L256-F260 HydrophobicContact CD1-CD2 3.68Å; L256-F260 HydrophobicContact CD1-CE2 3.55Å; L256-F260 HydrophobicContact CG-CD2 4.14Å; L256-F260 HydrophobicContact CG-CE2 4.49Å; L256-F260 WeakPolarHBondContact O-CD2 3.49Å; L256-F260 PolarHBondContact O-N 3.4Å; L256-F260 VanDerWaalsContact O-N 3.09Å
257L87.7Confident82.5Confident64 Ų6454.8 Ų54.834%0.33529%0.29SS..Hα-helixtrans-60.7-38176.7-69.4172.2000112.1I253 V254 T259 F260 Q261 L275I253-L257 HydrophobicContact CG2-CD1 4.24Å; I253-L257 WeakPolarHBondContact O-CG 3.5Å; I253-L257 PolarHBondContact O-N 3.3Å; V254-L257 WeakPolarHBondContact O-CB 3.37Å; V254-L257 PolarHBondContact O-N 2.93Å; L257-T259 VanDerWaalsContact C-N 3.33Å; L257-T259 PolarHBondContact O-N 3.05Å; L257-F260 CarbonylContact O-C 3.5Å; L257-F260 PolarHBondContact O-N 2.9Å; L257-Q261 WeakPolarHBondContact O-CG 3.37Å; L257-Q261 PolarHBondContact O-N 3.45Å; L257-Q261 VanDerWaalsContact O-N 3.1Å; L257-L275 HydrophobicContact CB-CD1 4.09Å; L257-L275 HydrophobicContact CB-CD2 4.48Å
258D84.3Confident81.8Confident24 Ų2457.4 Ų57.413%0.12831%0.306CS..Hα-helixtrans-66.5-35.3177.6-176.973.4000112.9K191 V254 H255 L256 Q261 L275K191-D258 PolarHBondContact NZ-O 2.83Å; V254-D258 PolarHBondContact O-N 2.88Å; H255-D258 PolarHBondContact O-N 3.48Å; L256-D258 VanDerWaalsContact C-N 3.29Å; L256-D258 PolarHBondContact O-N 2.85Å; D258-Q261 WeakPolarHBondContact O-CG 3.2Å; D258-Q261 PolarHBondContact OD1-NE2 3.36Å; D258-L275 HydrophobicContact CB-CD2 3.68Å; D258-L275 HydrophobicContact CB-CG 4.43Å
259T84.3Confident81.1Confident8 Ų860.4 Ų60.45%0.04933%0.327CS..Hα-helixtrans-73.7-36.4178.1-580000111.9K191 N192 T195 H255 L256 L257K191-T259 HydrophobicContact CD-CG2 4.47Å; K191-T259 HydrophobicContact CG-CG2 4.21Å; N192-T259 WeakPolarHBondContact OD1-CG2 3.41Å; T195-T259 WeakPolarHBondContact CB-OG1 3.28Å; T195-T259 HydrophobicContact CG2-CG2 4.07Å; T195-T259 WeakPolarHBondContact CG2-OG1 3.03Å; T195-T259 PolarHBondContact OG1-OG1 3.38Å; H255-T259 PolarHBondContact O-N 3.09Å; H255-T259 VanDerWaalsContact O-N 3.14Å; H255-T259 PolarHBondContact O-OG1 3.48Å; L256-T259 PolarHBondContact O-N 2.88Å; L257-T259 VanDerWaalsContact C-N 3.33Å; L257-T259 PolarHBondContact O-N 3.05Å
260F83.8Confident80.5Confident62 Ų6263.2 Ų63.227%0.27235%0.346SS..THydrogen-bonded Turntrans-109.538.6-176.6-61.4-72.2000112.8L196 L256 L257 E262 F263 S264L196-F260 HydrophobicContact CD2-CE2 4.37Å; L196-F260 HydrophobicContact CD2-CZ 4.41Å; L256-F260 HydrophobicContact CD1-CD2 3.68Å; L256-F260 HydrophobicContact CD1-CE2 3.55Å; L256-F260 HydrophobicContact CG-CD2 4.14Å; L256-F260 HydrophobicContact CG-CE2 4.49Å; L256-F260 WeakPolarHBondContact O-CD2 3.49Å; L256-F260 PolarHBondContact O-N 3.4Å; L256-F260 VanDerWaalsContact O-N 3.09Å; L257-F260 CarbonylContact O-C 3.5Å; L257-F260 PolarHBondContact O-N 2.9Å; F260-E262 VanDerWaalsContact C-N 3.3Å; F260-E262 PolarHBondContact O-N 3.44Å; F260-F263 HydrophobicContact CB-CB 4.44Å; F260-F263 PolarHBondContact O-N 3.38Å; F260-S264 WeakPolarHBondContact O-CB 3.34Å; F260-S264 PolarHBondContact O-N 3.49Å; F260-S264 PolarHBondContact O-OG 3.36Å
261Q77.3Confident79.8Confident36 Ų3662.5 Ų62.517%0.16834%0.342CS..THydrogen-bonded Turntrans-57.9-40178.9-77174.8-3.500112.9L257 D258 F263 S264 G265 L266 L275L257-Q261 WeakPolarHBondContact O-CG 3.37Å; L257-Q261 PolarHBondContact O-N 3.45Å; L257-Q261 VanDerWaalsContact O-N 3.1Å; D258-Q261 WeakPolarHBondContact O-CG 3.2Å; D258-Q261 PolarHBondContact OD1-NE2 3.36Å; Q261-F263 VanDerWaalsContact C-N 3.35Å; Q261-F263 PolarHBondContact O-N 2.83Å; Q261-S264 PolarHBondContact O-N 3.23Å; Q261-G265 PolarHBondContact O-N 2.97Å; Q261-L266 PolarHBondContact O-N 3.42Å; Q261-L275 HydrophobicContact CG-CD2 3.91Å; Q261-L275 VanDerWaalsContact NE2-CD2 3.27Å
262E69Low79.1Confident166 Ų16662.6 Ų62.678%0.77635%0.346SS*.THydrogen-bonded Turntrans-62.5-41.7179.2-67.2-17717500111.7F260F260-E262 VanDerWaalsContact C-N 3.3Å; F260-E262 PolarHBondContact O-N 3.44Å
263F71.6Confident78.6Confident194 Ų19464.6 Ų64.685%0.85136%0.356SS*.THydrogen-bonded Turntrans-74.2-28.8177.9-166.8-96.3000112.5F260 Q261 G265F260-F263 HydrophobicContact CB-CB 4.44Å; F260-F263 PolarHBondContact O-N 3.38Å; Q261-F263 VanDerWaalsContact C-N 3.35Å; Q261-F263 PolarHBondContact O-N 2.83Å; F263-G265 VanDerWaalsContact C-N 3.33Å
264S63.9Low78.2Confident52 Ų5269.4 Ų69.436%0.36437%0.369SS..THydrogen-bonded Turntrans-86.5-1-178.3-51.50000113.6F260 Q261 L266F260-S264 WeakPolarHBondContact O-CB 3.34Å; F260-S264 PolarHBondContact O-N 3.49Å; F260-S264 PolarHBondContact O-OG 3.36Å; Q261-S264 PolarHBondContact O-N 3.23Å; S264-L266 VanDerWaalsContact C-N 3.28Å; S264-L266 PolarHBondContact O-N 2.99Å
265G63.7Low77.9Confident51 Ų5169.4 Ų69.453%0.52637%0.368SS..THydrogen-bonded Turntrans68.922.5-177.400000114.2Q261 F263Q261-G265 PolarHBondContact O-N 2.97Å; F263-G265 VanDerWaalsContact C-N 3.33Å
266L69.1Low77.5Confident51 Ų5169.3 Ų69.327%0.26737%0.369SS..  trans-102.822-175.2-70.8168.1000113.3Q261 S264 N268 S271Q261-L266 PolarHBondContact O-N 3.42Å; S264-L266 VanDerWaalsContact C-N 3.28Å; S264-L266 PolarHBondContact O-N 2.99Å; L266-N268 PolarHBondContact O-N 3.47Å; L266-N268 VanDerWaalsContact O-N 3.14Å; L266-S271 WeakPolarHBondContact O-CB 3.43Å
267N67.9Low77.2Confident113 Ų11370.5 Ų70.560%0.60437%0.372SS*.  trans-73.72.1-173.363.8-14.5000115.5
268N77.6Confident77.1Confident95 Ų9569.1 Ų69.151%0.50837%0.371SS..SBendtrans-82.2143.4177.1-65-36000111.5L266 S270 S271 S272L266-N268 PolarHBondContact O-N 3.47Å; L266-N268 VanDerWaalsContact O-N 3.14Å; N268-S270 PolarHBondContact O-N 2.92Å; N268-S271 WeakPolarHBondContact O-CB 3.45Å; N268-S271 PolarHBondContact O-N 3.36Å; N268-S272 PolarHBondContact O-N 3.02Å
269C76.6Confident77.3Confident72 Ų7270 Ų7049%0.48637%0.374SS..Hα-helixtrans-57.6-33.2-179.7166.10000113.1C20 N273C20-C269 HydrophobicContact CB-CB 4.07Å; C20-C269 WeakPolarHBondContact CB-SG 3.42Å; C20-C269 WeakPolarHBondContact SG-CB 2.81Å; C20-C269 CovalentContact SG-SG 2.06Å; C20-C269 PolarHBondContact SG-SG 3.16Å; C269-N273 WeakPolarHBondContact O-CB 3.3Å; C269-N273 PolarHBondContact O-N 3.45Å
270S77.9Confident77.3Confident77 Ų7772.8 Ų72.854%0.53839%0.387SS..Hα-helixtrans-66.6-40.4174.463.50000112.8N268 R274N268-S270 PolarHBondContact O-N 2.92Å; S270-R274 WeakPolarHBondContact O-CG 3.29Å; S270-R274 PolarHBondContact O-N 2.91Å
271S78.9Confident77.5Confident29 Ų2974.7 Ų74.720%0.20340%0.403CS..Hα-helixtrans-69.2-43.8176.5-64.40000111.5L266 N268 N273 R274 L275L266-S271 WeakPolarHBondContact O-CB 3.43Å; N268-S271 WeakPolarHBondContact O-CB 3.45Å; N268-S271 PolarHBondContact O-N 3.36Å; S271-N273 PolarHBondContact O-N 2.92Å; S271-R274 PolarHBondContact O-N 2.82Å; S271-L275 WeakPolarHBondContact O-CB 3.35Å; S271-L275 PolarHBondContact O-N 3.45Å
272S78.3Confident78.2Confident23 Ų2373.8 Ų73.816%0.16140%0.4CS..Hα-helixtrans-58.2-47.5174.4177.20000111.4N268 R274 L275 D276N268-S272 PolarHBondContact O-N 3.02Å; S272-R274 PolarHBondContact O-N 2.87Å; S272-L275 WeakPolarHBondContact O-CA 3.19Å; S272-L275 WeakPolarHBondContact O-CB 3.2Å; S272-L275 PolarHBondContact O-N 3.31Å; S272-D276 PolarHBondContact O-N 2.62Å
273N79.5Confident79.2Confident43 Ų4367.9 Ų67.923%0.2337%0.372CS..Hα-helixtrans-62.4-39.1178.6-169.324.8000112.8C269 S271 L275 D276 Q277C269-N273 WeakPolarHBondContact O-CB 3.3Å; C269-N273 PolarHBondContact O-N 3.45Å; S271-N273 PolarHBondContact O-N 2.92Å; N273-L275 VanDerWaalsContact C-N 3.3Å; N273-L275 PolarHBondContact O-N 3.18Å; N273-D276 PolarHBondContact O-N 3.09Å; N273-Q277 WeakPolarHBondContact O-CG 3.49Å; N273-Q277 PolarHBondContact O-N 3.45Å; N273-Q277 VanDerWaalsContact O-N 3.14Å
274R82.6Confident80Confident190 Ų19059.2 Ų59.272%0.71734%0.336SS*.Hα-helixtrans-64.8-36.3173.1-72.6179.7-173.5-154.22.5111.8S270 S271 S272 Q277 A278S270-R274 WeakPolarHBondContact O-CG 3.29Å; S270-R274 PolarHBondContact O-N 2.91Å; S271-R274 PolarHBondContact O-N 2.82Å; S272-R274 PolarHBondContact O-N 2.87Å; R274-Q277 PolarHBondContact O-N 3.22Å; R274-A278 WeakPolarHBondContact O-CB 3.34Å; R274-A278 PolarHBondContact O-N 2.92Å
275L83.6Confident81.3Confident17 Ų1760 Ų609%0.08934%0.335CS..Hα-helixtrans-71-38.5179.2-16171.8000111.8V254 L257 D258 Q261 S271 S272 N273 Q277 A278 M279V254-L275 HydrophobicContact CG1-CD1 3.98Å; V254-L275 HydrophobicContact CG1-CG 4.24Å; L257-L275 HydrophobicContact CB-CD1 4.09Å; L257-L275 HydrophobicContact CB-CD2 4.48Å; D258-L275 HydrophobicContact CB-CD2 3.68Å; D258-L275 HydrophobicContact CB-CG 4.43Å; Q261-L275 HydrophobicContact CG-CD2 3.91Å; Q261-L275 VanDerWaalsContact NE2-CD2 3.27Å; S271-L275 WeakPolarHBondContact O-CB 3.35Å; S271-L275 PolarHBondContact O-N 3.45Å; S272-L275 WeakPolarHBondContact O-CA 3.19Å; S272-L275 WeakPolarHBondContact O-CB 3.2Å; S272-L275 PolarHBondContact O-N 3.31Å; N273-L275 VanDerWaalsContact C-N 3.3Å; N273-L275 PolarHBondContact O-N 3.18Å; L275-Q277 VanDerWaalsContact C-N 3.33Å; L275-Q277 PolarHBondContact O-N 2.83Å; L275-A278 CarbonylContact O-C 3.6Å; L275-A278 PolarHBondContact O-N 3.41Å; L275-M279 WeakPolarHBondContact O-CB 3.34Å; L275-M279 PolarHBondContact O-N 3.44Å
276D80.4Confident82.6Confident26 Ų2657.5 Ų57.514%0.13931%0.31CS..Hα-helixtrans-61.8-42.1172.4-63.1-65.7000111.8K22 S272 N273 M279 Q280K22-D276 WeakPolarHBondContact CD-OD2 3.31Å; K22-D276 WeakPolarHBondContact CE-OD2 3.23Å; K22-D276 IonicContact NZ-OD1 2.78Å; K22-D276 PolarHBondContact NZ-OD1 3.49Å; K22-D276 IonicContact NZ-OD2 2.77Å; K22-D276 PolarHBondContact NZ-OD2 3.34Å; S272-D276 PolarHBondContact O-N 2.62Å; N273-D276 PolarHBondContact O-N 3.09Å; D276-M279 PolarHBondContact O-N 3.45Å; D276-Q280 WeakPolarHBondContact O-CB 3.33Å; D276-Q280 PolarHBondContact O-N 3.46Å
277Q82.4Confident83.5Confident87 Ų8755.4 Ų55.441%0.40730%0.299SS..Hα-helixtrans-60.3-47.1174.2-71.5174.15.900111V25 N273 R274 L275 M279 Q280 V281V25-Q277 HydrophobicContact CB-CG 4.31Å; V25-Q277 HydrophobicContact CG1-CG 3.82Å; V25-Q277 HydrophobicContact CG2-CG 3.45Å; V25-Q277 VanDerWaalsContact CG2-CG 3.45Å; N273-Q277 WeakPolarHBondContact O-CG 3.49Å; N273-Q277 PolarHBondContact O-N 3.45Å; N273-Q277 VanDerWaalsContact O-N 3.14Å; R274-Q277 PolarHBondContact O-N 3.22Å; L275-Q277 VanDerWaalsContact C-N 3.33Å; L275-Q277 PolarHBondContact O-N 2.83Å; Q277-M279 VanDerWaalsContact C-N 3.29Å; Q277-M279 PolarHBondContact O-N 3.08Å; Q277-Q280 PolarHBondContact O-N 2.69Å; Q277-V281 VanDerWaalsContact O-CG2 3.32Å; Q277-V281 WeakPolarHBondContact O-CG2 3.45Å; Q277-V281 PolarHBondContact O-N 3.32Å
278A87.4Confident84.5Confident36 Ų3651 Ų5130%0.29828%0.276SS..Hα-helixtrans-60.6-40.317600000111.3V254 R274 L275 V281 T282V254-A278 HydrophobicContact CG1-CB 4.06Å; V254-A278 HydrophobicContact CG2-CB 4.18Å; R274-A278 WeakPolarHBondContact O-CB 3.34Å; R274-A278 PolarHBondContact O-N 2.92Å; L275-A278 CarbonylContact O-C 3.6Å; L275-A278 PolarHBondContact O-N 3.41Å; A278-V281 PolarHBondContact O-N 3.4Å; A278-T282 VanDerWaalsContact O-CB 3.31Å; A278-T282 WeakPolarHBondContact O-CB 3.45Å; A278-T282 VanDerWaalsContact O-CG2 3.24Å; A278-T282 WeakPolarHBondContact O-CG2 3.38Å; A278-T282 PolarHBondContact O-N 3.01Å; A278-T282 PolarHBondContact O-OG1 3.41Å
279M86.8Confident85.1Confident42 Ų4247 Ų4721%0.20725%0.254CS..Hα-helixtrans-64.2-47178.7-171.6162.763.200110.6Y251 V254 L275 D276 Q277 V281 T282 E283Y251-M279 HydrophobicContact CE2-CG 4.25Å; V254-M279 HydrophobicContact CG1-CB 3.88Å; L275-M279 WeakPolarHBondContact O-CB 3.34Å; L275-M279 PolarHBondContact O-N 3.44Å; D276-M279 PolarHBondContact O-N 3.45Å; Q277-M279 VanDerWaalsContact C-N 3.29Å; Q277-M279 PolarHBondContact O-N 3.08Å; M279-V281 PolarHBondContact O-N 2.92Å; M279-T282 PolarHBondContact O-N 3.35Å; M279-T282 PolarHBondContact O-OG1 3.03Å; M279-E283 WeakPolarHBondContact O-CB 3.29Å; M279-E283 PolarHBondContact O-N 2.86Å
280Q85.4Confident85.7Confident66 Ų6643.7 Ų43.731%0.30823%0.232SC..Hα-helixtrans-60.5-45.7177.5-168.769.45700112.1A29 L33 D276 Q277 T284A29-Q280 HydrophobicContact CB-CG 4.47Å; L33-Q280 HydrophobicContact CD1-CG 4.37Å; L33-Q280 VanDerWaalsContact CD1-NE2 3.26Å; D276-Q280 WeakPolarHBondContact O-CB 3.33Å; D276-Q280 PolarHBondContact O-N 3.46Å; Q277-Q280 PolarHBondContact O-N 2.69Å; Q280-T284 VanDerWaalsContact O-CB 3.28Å; Q280-T284 WeakPolarHBondContact O-CB 3.35Å; Q280-T284 PolarHBondContact O-N 2.86Å; Q280-T284 PolarHBondContact O-OG1 3Å
281V88.3Confident86.2Confident102 Ų10240.8 Ų40.862%0.61821%0.212SC*.Hα-helixtrans-67-46.6-179.5171.30000111Q277 A278 M279 T284 L285Q277-V281 VanDerWaalsContact O-CG2 3.32Å; Q277-V281 WeakPolarHBondContact O-CG2 3.45Å; Q277-V281 PolarHBondContact O-N 3.32Å; A278-V281 PolarHBondContact O-N 3.4Å; M279-V281 PolarHBondContact O-N 2.92Å; V281-T284 WeakPolarHBondContact O-CB 3.41Å; V281-T284 PolarHBondContact O-N 3.1Å; V281-L285 PolarHBondContact O-N 3.49Å
282T91.9Very high86.6Confident17 Ų1741.1 Ų41.110%0.10421%0.211CC..Hα-helixtrans-71.3-34-178.555.60000112.6P250 V254 A278 M279 L285 G286P250-T282 HydrophobicContact CB-CG2 3.6Å; V254-T282 HydrophobicContact CG2-CG2 4.16Å; A278-T282 VanDerWaalsContact O-CB 3.31Å; A278-T282 WeakPolarHBondContact O-CB 3.45Å; A278-T282 VanDerWaalsContact O-CG2 3.24Å; A278-T282 WeakPolarHBondContact O-CG2 3.38Å; A278-T282 PolarHBondContact O-N 3.01Å; A278-T282 PolarHBondContact O-OG1 3.41Å; M279-T282 PolarHBondContact O-N 3.35Å; M279-T282 PolarHBondContact O-OG1 3.03Å; T282-L285 PolarHBondContact O-N 3.25Å; T282-G286 PolarHBondContact O-N 3.01Å
283E89.4Confident86.9Confident42 Ų4240 Ų4020%0.19620%0.203CC..Hα-helixtrans-63-46.8171.1-177.1173.1-158.700110.6Y108 Y251 M279 L285 G286 M287Y108-E283 PolarHBondContact OH-OE1 3.5Å; Y251-E283 HydrophobicContact CD2-CB 3.64Å; Y251-E283 HydrophobicContact CD2-CG 4.29Å; Y251-E283 HydrophobicContact CE2-CB 3.69Å; Y251-E283 HydrophobicContact CE2-CG 4Å; M279-E283 WeakPolarHBondContact O-CB 3.29Å; M279-E283 PolarHBondContact O-N 2.86Å; E283-L285 VanDerWaalsContact C-N 3.32Å; E283-L285 PolarHBondContact O-N 3.36Å; E283-G286 CarbonylContact O-C 3.4Å; E283-G286 WeakPolarHBondContact O-CA 3.32Å; E283-G286 PolarHBondContact O-N 3.17Å; E283-G286 VanDerWaalsContact O-N 3.08Å; E283-M287 HydrophobicContact CG-CE 4.03Å; E283-M287 HydrophobicContact CG-CG 4.47Å; E283-M287 WeakPolarHBondContact O-CG 3.24Å; E283-M287 PolarHBondContact O-N 2.84Å
284T88.4Confident87.1Confident13 Ų1338.5 Ų38.58%0.0820%0.196CC..Hα-helixtrans-59.4-43.3177.2-61.10000111.5L33 L36 Y37 Q280 V281 M287 T288L33-T284 HydrophobicContact CD2-CG2 3.72Å; L33-T284 WeakPolarHBondContact CD2-OG1 3.24Å; L36-T284 HydrophobicContact CD2-CG2 3.34Å; Y37-T284 HydrophobicContact CE1-CG2 4.03Å; Y37-T284 PolarHBondContact OH-OG1 3.32Å; Q280-T284 VanDerWaalsContact O-CB 3.28Å; Q280-T284 WeakPolarHBondContact O-CB 3.35Å; Q280-T284 PolarHBondContact O-N 2.86Å; Q280-T284 PolarHBondContact O-OG1 3Å; V281-T284 WeakPolarHBondContact O-CB 3.41Å; V281-T284 PolarHBondContact O-N 3.1Å; T284-M287 PolarHBondContact O-N 3.01Å; T284-T288 WeakPolarHBondContact O-CG2 3.43Å; T284-T288 PolarHBondContact O-N 3.2Å
285L91.9Very high87.2Confident67 Ų6733.2 Ų33.235%0.35118%0.181SC..Hα-helixtrans-57.4-51171.7179.665.2000110.4F247 P250 V281 T282 E283 M287 T288F247-L285 HydrophobicContact CD1-CD1 3.94Å; F247-L285 HydrophobicContact CD1-CG 4.25Å; F247-L285 VanDerWaalsContact CD1-O 3.32Å; F247-L285 WeakPolarHBondContact CD1-O 3.16Å; F247-L285 HydrophobicContact CE1-CD1 4.03Å; F247-L285 HydrophobicContact CG-CD1 4.47Å; P250-L285 HydrophobicContact CG-CD2 4.39Å; V281-L285 PolarHBondContact O-N 3.49Å; T282-L285 PolarHBondContact O-N 3.25Å; E283-L285 VanDerWaalsContact C-N 3.32Å; E283-L285 PolarHBondContact O-N 3.36Å; L285-M287 VanDerWaalsContact C-N 3.31Å; L285-M287 PolarHBondContact O-N 3.16Å; L285-T288 PolarHBondContact O-N 2.94Å; L285-T288 VanDerWaalsContact O-N 3.09Å; L285-T288 PolarHBondContact O-OG1 3.35Å
286G90.8Very high87Confident0 Ų033 Ų330%018%0.18CC..Hα-helixtrans-54.2-44.5175.300000113.1W248 T282 E283 T288 H289W248-G286 VanDerWaalsContact CE2-O 3.29Å; W248-G286 VanDerWaalsContact CZ2-C 3.4Å; W248-G286 WeakPolarHBondContact CZ2-O 3.37Å; T282-G286 PolarHBondContact O-N 3.01Å; E283-G286 CarbonylContact O-C 3.4Å; E283-G286 WeakPolarHBondContact O-CA 3.32Å; E283-G286 PolarHBondContact O-N 3.17Å; E283-G286 VanDerWaalsContact O-N 3.08Å; G286-T288 VanDerWaalsContact C-N 3.27Å; G286-T288 PolarHBondContact O-N 3.26Å; G286-H289 WeakPolarHBondContact O-CB 3.32Å; G286-H289 PolarHBondContact O-N 3.15Å
287M86.8Confident86.9Confident6 Ų632.3 Ų32.33%0.0318%0.175CC..Hα-helixtrans-59.5-36.4178-67.8-159.9-179.800112.5Y37 F79 Y108 E283 T284 L285 H289 C290Y37-M287 HydrophobicContact CD1-SD 4.38Å; Y37-M287 HydrophobicContact CE1-CB 4.32Å; Y37-M287 HydrophobicContact CE1-CG 4.48Å; Y37-M287 HydrophobicContact CE1-SD 3.57Å; Y37-M287 VanDerWaalsContact CE1-SD 3.57Å; Y37-M287 HydrophobicContact CE2-SD 3.93Å; Y37-M287 PolarHBondContact OH-SD 3.26Å; F79-M287 HydrophobicContact CE1-CB 4.16Å; F79-M287 HydrophobicContact CE1-CG 4.21Å; F79-M287 HydrophobicContact CZ-CB 4.32Å; F79-M287 HydrophobicContact CZ-CG 3.93Å; Y108-M287 HydrophobicContact CE2-CE 4.03Å; E283-M287 HydrophobicContact CG-CE 4.03Å; E283-M287 HydrophobicContact CG-CG 4.47Å; E283-M287 WeakPolarHBondContact O-CG 3.24Å; E283-M287 PolarHBondContact O-N 2.84Å; T284-M287 PolarHBondContact O-N 3.01Å; L285-M287 VanDerWaalsContact C-N 3.31Å; L285-M287 PolarHBondContact O-N 3.16Å; M287-H289 PolarHBondContact O-N 3.42Å; M287-C290 PolarHBondContact O-SG 3.36Å
288T89.9Confident86.5Confident22 Ų2229.6 Ų29.614%0.13517%0.168CC..Hα-helixtrans-65.7-19.917865.60000113.1V40 F247 T284 L285 G286 C290 C291V40-T288 HydrophobicContact CG2-CG2 3.65Å; F247-T288 WeakPolarHBondContact CD1-OG1 3.31Å; F247-T288 VanDerWaalsContact CE1-OG1 3.24Å; F247-T288 WeakPolarHBondContact CE1-OG1 3.4Å; T284-T288 WeakPolarHBondContact O-CG2 3.43Å; T284-T288 PolarHBondContact O-N 3.2Å; L285-T288 PolarHBondContact O-N 2.94Å; L285-T288 VanDerWaalsContact O-N 3.09Å; L285-T288 PolarHBondContact O-OG1 3.35Å; G286-T288 VanDerWaalsContact C-N 3.27Å; G286-T288 PolarHBondContact O-N 3.26Å; T288-C290 PolarHBondContact O-N 2.75Å; T288-C290 VanDerWaalsContact O-N 3.14Å; T288-C291 PolarHBondContact O-N 3.1Å; T288-C291 PolarHBondContact O-SG 2.81Å
289H91Very high85.7Confident9 Ų935.9 Ų35.94%0.04219%0.188CC..G310 helixtrans-55.1-35.1179.8177.7-93.8000113.4Y244 F247 W248 G286 M287 C291 I292Y244-H289 WeakPolarHBondContact CA-NE2 3.37Å; Y244-H289 AromaticContact CD2-CE1 4Å; F247-H289 HydrophobicContact CB-CB 3.97Å; F247-H289 HydrophobicContact CD1-CB 4.02Å; F247-H289 HydrophobicContact CG-CB 4.21Å; W248-H289 AromaticContact CD1-CG 3.86Å; W248-H289 AromaticContact NE1-CG 3.45Å; W248-H289 AromaticContact NE1-ND1 3.55Å; G286-H289 WeakPolarHBondContact O-CB 3.32Å; G286-H289 PolarHBondContact O-N 3.15Å; M287-H289 PolarHBondContact O-N 3.42Å; H289-C291 PolarHBondContact O-N 3.29Å; H289-C291 VanDerWaalsContact O-N 3.11Å; H289-I292 WeakPolarHBondContact O-CB 3.5Å; H289-I292 PolarHBondContact O-N 3.26Å
290C87.8Confident84.7Confident4 Ų436.9 Ų36.93%0.02720%0.197CC..G310 helixtrans-62.2-20.4-176.265.60000114N48 D76 F79 L80 M287 T288N48-C290 PolarHBondContact ND2-O 3.49Å; D76-C290 HydrophobicContact CB-CB 4.39Å; F79-C290 HydrophobicContact CD1-CB 3.99Å; L80-C290 WeakPolarHBondContact CD2-SG 3.4Å; L80-C290 HydrophobicContact CG-CB 4.31Å; M287-C290 PolarHBondContact O-SG 3.36Å; T288-C290 PolarHBondContact O-N 2.75Å; T288-C290 VanDerWaalsContact O-N 3.14Å
291C88.3Confident83.8Confident16 Ų1634.2 Ų34.211%0.10819%0.187CC..G310 helixtrans-94.6-8174.3730000113.8F43 T288 H289F43-C291 HydrophobicContact CB-CB 4.34Å; T288-C291 PolarHBondContact O-N 3.1Å; T288-C291 PolarHBondContact O-SG 2.81Å; H289-C291 PolarHBondContact O-N 3.29Å; H289-C291 VanDerWaalsContact O-N 3.11Å
292I87.7Confident82.9Confident35 Ų3533.6 Ų33.618%0.17918%0.177CC..Hα-helixtrans-82.2-29.9-177-53.6-59.6000111.9V243 F247 H289 I295 I296V243-I292 HydrophobicContact CG1-CG2 3.73Å; F247-I292 HydrophobicContact CE1-CD1 4.31Å; F247-I292 HydrophobicContact CE1-CG1 3.87Å; F247-I292 HydrophobicContact CZ-CD1 4.21Å; F247-I292 HydrophobicContact CZ-CG1 3.93Å; H289-I292 WeakPolarHBondContact O-CB 3.5Å; H289-I292 PolarHBondContact O-N 3.26Å; I292-I295 HydrophobicContact CD1-CD1 4.22Å; I292-I295 WeakPolarHBondContact O-CA 3.36Å; I292-I295 WeakPolarHBondContact O-CB 3.28Å; I292-I295 PolarHBondContact O-N 3.46Å; I292-I296 HydrophobicContact CG2-CD1 3.93Å; I292-I296 HydrophobicContact CG2-CG1 3.95Å; I292-I296 WeakPolarHBondContact O-CG1 3.44Å; I292-I296 PolarHBondContact O-N 2.88Å
293N84.7Confident81.7Confident0 Ų040.3 Ų40.30%021%0.205CC..Hα-helixtrans-54.7-50.8-179.6-74.3-28.6000113.1D76 I295 I296 Y297D76-N293 PolarHBondContact OD2-ND2 2.89Å; N293-I295 VanDerWaalsContact C-N 3.3Å; N293-I295 PolarHBondContact O-N 3.36Å; N293-I296 PolarHBondContact O-N 3.42Å; N293-Y297 HydrophobicContact CB-CE2 4.28Å; N293-Y297 VanDerWaalsContact O-CD2 3.24Å; N293-Y297 WeakPolarHBondContact O-CD2 3.37Å; N293-Y297 VanDerWaalsContact O-CG 3.26Å; N293-Y297 PolarHBondContact O-N 3.24Å; N293-Y297 VanDerWaalsContact O-N 3.09Å
294P84.8Confident80.7Confident12 Ų1239.3 Ų39.38%0.07820%0.2CC..Hα-helixtrans-59-36.8173.7-25.334.5000114.1G47 V51 Y297 A298G47-P294 VanDerWaalsContact C-CG 3.42Å; V51-P294 HydrophobicContact CG2-CB 4.02Å; V51-P294 HydrophobicContact CG2-CG 4.14Å; P294-Y297 PolarHBondContact O-N 2.69Å; P294-A298 PolarHBondContact O-N 3Å
295I83.3Confident80.1Confident78 Ų7844.7 Ų44.740%0.422%0.219SC..Hα-helixtrans-63.3-48.5177.7-63.5175.8000109.3I292 N293 Y297 A298 F299I292-I295 HydrophobicContact CD1-CD1 4.22Å; I292-I295 WeakPolarHBondContact O-CA 3.36Å; I292-I295 WeakPolarHBondContact O-CB 3.28Å; I292-I295 PolarHBondContact O-N 3.46Å; N293-I295 VanDerWaalsContact C-N 3.3Å; N293-I295 PolarHBondContact O-N 3.36Å; I295-Y297 VanDerWaalsContact C-N 3.26Å; I295-Y297 PolarHBondContact O-N 2.89Å; I295-A298 PolarHBondContact O-N 2.61Å; I295-A298 VanDerWaalsContact O-N 3.1Å; I295-F299 HydrophobicContact CG2-CD2 3.59Å; I295-F299 HydrophobicContact CG2-CE2 3.76Å; I295-F299 VanDerWaalsContact O-CD2 3.23Å; I295-F299 WeakPolarHBondContact O-CD2 3.18Å; I295-F299 PolarHBondContact O-N 2.9Å
296I80.9Confident79.4Confident13 Ų1345.9 Ų45.97%0.06723%0.226CC..Hα-helixtrans-56.7-43.6176.2-64169.6000110.4L236 I240 V243 I292 N293 A298 F299 V300L236-I296 HydrophobicContact CD1-CG2 3.9Å; I240-I296 HydrophobicContact CG1-CD1 4.26Å; I240-I296 HydrophobicContact CG1-CG2 3.77Å; V243-I296 HydrophobicContact CB-CD1 3.97Å; V243-I296 HydrophobicContact CG1-CD1 3.99Å; V243-I296 HydrophobicContact CG2-CD1 4.03Å; I292-I296 HydrophobicContact CG2-CD1 3.93Å; I292-I296 HydrophobicContact CG2-CG1 3.95Å; I292-I296 WeakPolarHBondContact O-CG1 3.44Å; I292-I296 PolarHBondContact O-N 2.88Å; N293-I296 PolarHBondContact O-N 3.42Å; I296-A298 PolarHBondContact O-N 2.98Å; I296-F299 PolarHBondContact O-N 3.42Å; I296-V300 HydrophobicContact CG2-CB 4.26Å; I296-V300 HydrophobicContact CG2-CG2 4.04Å; I296-V300 WeakPolarHBondContact O-CA 3.37Å; I296-V300 VanDerWaalsContact O-CB 3.24Å; I296-V300 WeakPolarHBondContact O-CB 3.39Å; I296-V300 PolarHBondContact O-N 3.49Å
297Y78.4Confident78.6Confident11 Ų1149.8 Ų49.84%0.04324%0.241CC..Hα-helixtrans-64.4-39178.4-55-31.5000112.9V51 L69 L72 L236 I240 N293 P294 I295 G301 F304V51-Y297 HydrophobicContact CG1-CD2 4.29Å; V51-Y297 HydrophobicContact CG1-CE2 4.2Å; V51-Y297 HydrophobicContact CG2-CD2 3.77Å; V51-Y297 HydrophobicContact CG2-CE2 4.22Å; L69-Y297 HydrophobicContact CD2-CE1 3.96Å; L69-Y297 WeakPolarHBondContact CD2-OH 3.37Å; L72-Y297 WeakPolarHBondContact CD2-OH 3.22Å; L236-Y297 HydrophobicContact CD1-CD1 4.49Å; I240-Y297 HydrophobicContact CD1-CD1 4.48Å; I240-Y297 HydrophobicContact CD1-CE1 3.67Å; I240-Y297 HydrophobicContact CG1-CE1 4.41Å; N293-Y297 HydrophobicContact CB-CE2 4.28Å; N293-Y297 VanDerWaalsContact O-CD2 3.24Å; N293-Y297 WeakPolarHBondContact O-CD2 3.37Å; N293-Y297 VanDerWaalsContact O-CG 3.26Å; N293-Y297 PolarHBondContact O-N 3.24Å; N293-Y297 VanDerWaalsContact O-N 3.09Å; P294-Y297 PolarHBondContact O-N 2.69Å; I295-Y297 VanDerWaalsContact C-N 3.26Å; I295-Y297 PolarHBondContact O-N 2.89Å; Y297-G301 VanDerWaalsContact O-CA 3.24Å; Y297-G301 WeakPolarHBondContact O-CA 3.24Å; Y297-G301 PolarHBondContact O-N 3.02Å; Y297-F304 WeakPolarHBondContact O-CD1 3.39Å
298A73.6Confident78.1Confident30 Ų3050.7 Ų50.725%0.24825%0.246CC..Hα-helixtrans-67.5-39.7179.200000112.9P294 I295 I296 L308P294-A298 PolarHBondContact O-N 3Å; I295-A298 PolarHBondContact O-N 2.61Å; I295-A298 VanDerWaalsContact O-N 3.1Å; I296-A298 PolarHBondContact O-N 2.98Å; A298-L308 HydrophobicContact CB-CD1 4.13Å
299F70Confident77.5Confident168 Ų16854 Ų5474%0.73726%0.263SS*.Hα-helixtrans-91-39.3-175.6-72.7-74.9000113.7I295 I296I295-F299 HydrophobicContact CG2-CD2 3.59Å; I295-F299 HydrophobicContact CG2-CE2 3.76Å; I295-F299 VanDerWaalsContact O-CD2 3.23Å; I295-F299 WeakPolarHBondContact O-CD2 3.18Å; I295-F299 PolarHBondContact O-N 2.9Å; I296-F299 PolarHBondContact O-N 3.42Å
300V66.3Low76.9Confident64 Ų6457.3 Ų57.339%0.38828%0.283SS..Hα-helixtrans-95.5-26.2-175.2-172.10000111.6L236 I296 E302L236-V300 HydrophobicContact CB-CG1 4.14Å; L236-V300 HydrophobicContact CD1-CB 3.64Å; L236-V300 HydrophobicContact CD1-CG1 3.61Å; I296-V300 HydrophobicContact CG2-CB 4.26Å; I296-V300 HydrophobicContact CG2-CG2 4.04Å; I296-V300 WeakPolarHBondContact O-CA 3.37Å; I296-V300 VanDerWaalsContact O-CB 3.24Å; I296-V300 WeakPolarHBondContact O-CB 3.39Å; I296-V300 PolarHBondContact O-N 3.49Å; V300-E302 PolarHBondContact O-N 3.49Å
301G66.8Low76.4Confident10 Ų1058.2 Ų58.210%0.10329%0.286CS..  trans-92.789-177.600000114.1Y297 K303 F304 R305Y297-G301 VanDerWaalsContact O-CA 3.24Å; Y297-G301 WeakPolarHBondContact O-CA 3.24Å; Y297-G301 PolarHBondContact O-N 3.02Å; G301-K303 PolarHBondContact O-N 2.97Å; G301-K303 VanDerWaalsContact O-N 3.14Å; G301-F304 WeakPolarHBondContact O-CA 3.29Å; G301-F304 WeakPolarHBondContact O-CB 3.27Å; G301-F304 PolarHBondContact O-N 3.45Å; G301-R305 PolarHBondContact O-N 3.14Å
302E67.8Low75.9Confident88 Ų8861.7 Ų61.741%0.41130%0.3SS..Hα-helixtrans-51.4-41.1176.4-73179.4163.400113.6R232 V300 R305 N306R232-E302 IonicContact CZ-OE1 3.32Å; R232-E302 IonicContact CZ-OE2 2.98Å; R232-E302 IonicContact NE-OE1 3.86Å; R232-E302 IonicContact NH1-OE1 3.78Å; R232-E302 PolarHBondContact NH1-OE1 2.78Å; R232-E302 IonicContact NH1-OE2 3.98Å; R232-E302 PolarHBondContact NH1-OE2 3.25Å; R232-E302 IonicContact NH2-OE1 3.87Å; V300-E302 PolarHBondContact O-N 3.49Å; E302-R305 PolarHBondContact O-N 2.97Å; E302-N306 PolarHBondContact O-N 3.37Å; E302-N306 VanDerWaalsContact O-N 3.13Å
303K68.3Low75.4Confident159 Ų15966.1 Ų66.169%0.69132%0.32SS*.Hα-helixtrans-64.4-42.6176.6-69.7-175.5179.4-179.40111.6G301 N306 Y307G301-K303 PolarHBondContact O-N 2.97Å; G301-K303 VanDerWaalsContact O-N 3.14Å; K303-N306 PolarHBondContact O-N 3.48Å; K303-Y307 HydrophobicContact CB-CE2 4.43Å; K303-Y307 WeakPolarHBondContact O-CD2 3.49Å; K303-Y307 PolarHBondContact O-N 3.23Å; K303-Y307 VanDerWaalsContact O-N 3.11Å
304F67.8Low74.8Confident20 Ų2072.7 Ų72.79%0.08835%0.349CS..Hα-helixtrans-66-43.2-179.8-174-99.8000110.5V51 I54 Y297 G301 N306 Y307 L308V51-F304 HydrophobicContact CB-CZ 4.41Å; V51-F304 HydrophobicContact CG2-CE2 4.12Å; V51-F304 HydrophobicContact CG2-CZ 3.67Å; I54-F304 HydrophobicContact CB-CE2 4.08Å; I54-F304 HydrophobicContact CD1-CE1 4.36Å; I54-F304 HydrophobicContact CD1-CE2 3.73Å; I54-F304 HydrophobicContact CD1-CZ 3.64Å; I54-F304 HydrophobicContact CG2-CD2 4.06Å; I54-F304 HydrophobicContact CG2-CE2 3.85Å; Y297-F304 WeakPolarHBondContact O-CD1 3.39Å; G301-F304 WeakPolarHBondContact O-CA 3.29Å; G301-F304 WeakPolarHBondContact O-CB 3.27Å; G301-F304 PolarHBondContact O-N 3.45Å; F304-N306 VanDerWaalsContact C-N 3.33Å; F304-N306 PolarHBondContact O-N 3.14Å; F304-Y307 PolarHBondContact O-N 3.38Å; F304-Y307 VanDerWaalsContact O-N 3.14Å; F304-L308 HydrophobicContact CD1-CD1 3.63Å; F304-L308 HydrophobicContact CD1-CG 4.39Å; F304-L308 HydrophobicContact CE1-CD1 3.35Å; F304-L308 HydrophobicContact CE1-CG 4.03Å; F304-L308 HydrophobicContact CZ-CD1 4.29Å; F304-L308 WeakPolarHBondContact O-CB 3.28Å; F304-L308 PolarHBondContact O-N 3.18Å
305R75.4Confident74Confident127 Ų12776.3 Ų76.348%0.47936%0.364SS..Hα-helixtrans-55.7-44.3173.5-170.3176.669.2-169.21.4112.7G301 E302 L308 L309G301-R305 PolarHBondContact O-N 3.14Å; E302-R305 PolarHBondContact O-N 2.97Å; R305-L308 VanDerWaalsContact O-CB 3.23Å; R305-L308 WeakPolarHBondContact O-CB 2.92Å; R305-L308 PolarHBondContact O-N 3.5Å; R305-L309 WeakPolarHBondContact O-CG 3.48Å; R305-L309 PolarHBondContact O-N 3.41Å
306N76.6Confident73.3Confident92 Ų9275.5 Ų75.549%0.49236%0.36SS..Hα-helixtrans-64.6-40.5177.2-71.8-6.1000112.1E302 K303 F304 L309 V310E302-N306 PolarHBondContact O-N 3.37Å; E302-N306 VanDerWaalsContact O-N 3.13Å; K303-N306 PolarHBondContact O-N 3.48Å; F304-N306 VanDerWaalsContact C-N 3.33Å; F304-N306 PolarHBondContact O-N 3.14Å; N306-L309 PolarHBondContact O-N 3.41Å; N306-V310 WeakPolarHBondContact O-CG2 3.16Å; N306-V310 PolarHBondContact O-N 2.92Å
307Y75.6Confident72.4Confident82 Ų8276.9 Ų76.932%0.32237%0.374SS..Hα-helixtrans-66.5-38.2174.1-70.7-60.7000112.6I54 C58 K59 K303 F304 V310 F311I54-Y307 HydrophobicContact CG2-CG 4.36Å; C58-Y307 HydrophobicContact CB-CD1 3.68Å; C58-Y307 HydrophobicContact CB-CE1 4.27Å; C58-Y307 HydrophobicContact CB-CG 4.2Å; K59-Y307 HydrophobicContact CD-CD2 4.29Å; K59-Y307 HydrophobicContact CD-CE2 4.12Å; K59-Y307 HydrophobicContact CG-CD2 3.97Å; K59-Y307 HydrophobicContact CG-CE2 3.61Å; K303-Y307 HydrophobicContact CB-CE2 4.43Å; K303-Y307 WeakPolarHBondContact O-CD2 3.49Å; K303-Y307 PolarHBondContact O-N 3.23Å; K303-Y307 VanDerWaalsContact O-N 3.11Å; F304-Y307 PolarHBondContact O-N 3.38Å; F304-Y307 VanDerWaalsContact O-N 3.14Å; Y307-V310 PolarHBondContact O-N 3.29Å; Y307-F311 VanDerWaalsContact O-CB 3.26Å; Y307-F311 WeakPolarHBondContact O-CB 3.39Å; Y307-F311 PolarHBondContact O-N 3.36Å
308L76.1Confident71.3Confident24 Ų2483.7 Ų83.713%0.12640%0.403CS..Hα-helixtrans-55.1-51.9172.2-114.7164.9000110.5L50 I54 A298 F304 R305 V310 F311 F312L50-L308 HydrophobicContact CD2-CD2 3.64Å; L50-L308 HydrophobicContact CD2-CG 4.49Å; L50-L308 HydrophobicContact CG-CD2 4.46Å; I54-L308 HydrophobicContact CD1-CB 4.44Å; I54-L308 HydrophobicContact CD1-CD2 4.41Å; I54-L308 HydrophobicContact CD1-CG 3.79Å; A298-L308 HydrophobicContact CB-CD1 4.13Å; F304-L308 HydrophobicContact CD1-CD1 3.63Å; F304-L308 HydrophobicContact CD1-CG 4.39Å; F304-L308 HydrophobicContact CE1-CD1 3.35Å; F304-L308 HydrophobicContact CE1-CG 4.03Å; F304-L308 HydrophobicContact CZ-CD1 4.29Å; F304-L308 WeakPolarHBondContact O-CB 3.28Å; F304-L308 PolarHBondContact O-N 3.18Å; R305-L308 VanDerWaalsContact O-CB 3.23Å; R305-L308 WeakPolarHBondContact O-CB 2.92Å; R305-L308 PolarHBondContact O-N 3.5Å; L308-V310 PolarHBondContact O-N 3.06Å; L308-F311 PolarHBondContact O-N 3.5Å; L308-F312 HydrophobicContact CD2-CD2 3.62Å; L308-F312 HydrophobicContact CD2-CE2 3.28Å; L308-F312 HydrophobicContact CD2-CZ 4.49Å; L308-F312 WeakPolarHBondContact O-CB 3.48Å; L308-F312 VanDerWaalsContact O-CD2 3.26Å; L308-F312 WeakPolarHBondContact O-CD2 3.44Å; L308-F312 PolarHBondContact O-N 3.37Å
309L76.6Confident70.4Confident93 Ų9391.7 Ų91.749%0.48743%0.427SS..Hα-helixtrans-60-45.9178.1-71.4170.7000112.1R305 N306 F311 F312 Q313R305-L309 WeakPolarHBondContact O-CG 3.48Å; R305-L309 PolarHBondContact O-N 3.41Å; N306-L309 PolarHBondContact O-N 3.41Å; L309-F311 VanDerWaalsContact C-N 3.34Å; L309-F311 PolarHBondContact O-N 3.45Å; L309-F312 PolarHBondContact O-N 3.32Å; L309-Q313 WeakPolarHBondContact O-CB 3.49Å; L309-Q313 VanDerWaalsContact O-CG 3.26Å; L309-Q313 WeakPolarHBondContact O-CG 3.32Å; L309-Q313 PolarHBondContact O-N 2.95Å
310V78.2Confident69.6Low77 Ų7790.6 Ų90.647%0.46742%0.422SS..Hα-helixtrans-63.8-39.91771720000111.5N306 Y307 L308 Q313 K314N306-V310 WeakPolarHBondContact O-CG2 3.16Å; N306-V310 PolarHBondContact O-N 2.92Å; Y307-V310 PolarHBondContact O-N 3.29Å; L308-V310 PolarHBondContact O-N 3.06Å; V310-Q313 PolarHBondContact O-N 3.43Å; V310-K314 WeakPolarHBondContact O-CB 3.47Å; V310-K314 PolarHBondContact O-N 3.43Å
311F76.5Confident68.7Low23 Ų2391.1 Ų91.110%0.10143%0.428CS..Hα-helixtrans-64-47.7176.5-178.6-92.8000111.1L50 L53 Y307 L308 L309 Q313 K314 H315 I316L50-F311 HydrophobicContact CD1-CD1 3.78Å; L50-F311 HydrophobicContact CD1-CE1 3.63Å; L50-F311 HydrophobicContact CD1-CZ 4.33Å; L53-F311 HydrophobicContact CB-CE2 4.48Å; L53-F311 HydrophobicContact CD1-CZ 4.3Å; Y307-F311 VanDerWaalsContact O-CB 3.26Å; Y307-F311 WeakPolarHBondContact O-CB 3.39Å; Y307-F311 PolarHBondContact O-N 3.36Å; L308-F311 PolarHBondContact O-N 3.5Å; L309-F311 VanDerWaalsContact C-N 3.34Å; L309-F311 PolarHBondContact O-N 3.45Å; F311-Q313 PolarHBondContact O-N 2.98Å; F311-K314 PolarHBondContact O-N 3.26Å; F311-H315 AromaticContact CD2-CD2 3.65Å; F311-H315 AromaticContact CE2-CD2 3.67Å; F311-H315 HydrophobicContact CZ-CB 4.41Å; F311-H315 WeakPolarHBondContact O-CB 3.48Å; F311-H315 PolarHBondContact O-N 3.35Å; F311-I316 HydrophobicContact CE1-CD1 4.49Å
312F79.5Confident67.6Low90 Ų9099.7 Ų99.740%0.39546%0.463SS..Iπ-helixtrans-57.9-47.2174.4-90.5-75.1000111.2L308 L309 K314 I316 A317L308-F312 HydrophobicContact CD2-CD2 3.62Å; L308-F312 HydrophobicContact CD2-CE2 3.28Å; L308-F312 HydrophobicContact CD2-CZ 4.49Å; L308-F312 WeakPolarHBondContact O-CB 3.48Å; L308-F312 VanDerWaalsContact O-CD2 3.26Å; L308-F312 WeakPolarHBondContact O-CD2 3.44Å; L308-F312 PolarHBondContact O-N 3.37Å; L309-F312 PolarHBondContact O-N 3.32Å; F312-K314 PolarHBondContact O-N 3.41Å; F312-I316 HydrophobicContact CD1-CB 3.93Å; F312-I316 HydrophobicContact CD1-CD1 3.27Å; F312-I316 HydrophobicContact CD1-CG1 4.14Å; F312-I316 HydrophobicContact CD1-CG2 4.03Å; F312-I316 HydrophobicContact CE1-CD1 3.26Å; F312-I316 HydrophobicContact CE1-CG1 4.47Å; F312-I316 HydrophobicContact CE1-CG2 4.45Å; F312-I316 HydrophobicContact CG-CD1 4.17Å; F312-I316 HydrophobicContact CZ-CD1 4.15Å; F312-I316 CarbonylContact O-C 3.51Å; F312-I316 WeakPolarHBondContact O-CA 3.41Å; F312-I316 WeakPolarHBondContact O-CB 3.3Å; F312-I316 PolarHBondContact O-N 3.2Å; F312-A317 PolarHBondContact O-N 2.06Å
313Q75.9Confident66.6Low127 Ų127100.9 Ų100.959%0.59348%0.479SS*.Iπ-helixtrans-61.7-45177.7-74171.2-7.600112.4L309 V310 F311 K318L309-Q313 WeakPolarHBondContact O-CB 3.49Å; L309-Q313 VanDerWaalsContact O-CG 3.26Å; L309-Q313 WeakPolarHBondContact O-CG 3.32Å; L309-Q313 PolarHBondContact O-N 2.95Å; V310-Q313 PolarHBondContact O-N 3.43Å; F311-Q313 PolarHBondContact O-N 2.98Å; Q313-K318 PolarHBondContact O-N 3.31Å
314K71.6Confident65.3Low139 Ų13997.1 Ų97.160%0.60447%0.472SS*.Iπ-helixtrans-75.6-37.4-173.8-170.4177.9179.9-175.50113.6V310 F311 F312 K318V310-K314 WeakPolarHBondContact O-CB 3.47Å; V310-K314 PolarHBondContact O-N 3.43Å; F311-K314 PolarHBondContact O-N 3.26Å; F312-K314 PolarHBondContact O-N 3.41Å; K314-K318 VanDerWaalsContact O-CB 3.3Å; K314-K318 WeakPolarHBondContact O-CB 3.32Å
315H69.7Low63.6Low88 Ų88101.8 Ų101.841%0.40751%0.507SS..Iπ-helixtrans-110.5-31.1-170.7-70-79.5000114.2F311 R319F311-H315 AromaticContact CD2-CD2 3.65Å; F311-H315 AromaticContact CE2-CD2 3.67Å; F311-H315 HydrophobicContact CZ-CB 4.41Å; F311-H315 WeakPolarHBondContact O-CB 3.48Å; F311-H315 PolarHBondContact O-N 3.35Å; H315-R319 WeakPolarHBondContact O-CB 3.35Å; H315-R319 WeakPolarHBondContact O-CD 3.14Å; H315-R319 WeakPolarHBondContact O-CG 3.34Å
316I67.6Low62.1Low60 Ų60102.8 Ų102.831%0.30852%0.521SS..Iπ-helixtrans-101.4-56.5-175.2-66.2170.6000109.3F311 F312 K318 R319 F320F311-I316 HydrophobicContact CE1-CD1 4.49Å; F312-I316 HydrophobicContact CD1-CB 3.93Å; F312-I316 HydrophobicContact CD1-CD1 3.27Å; F312-I316 HydrophobicContact CD1-CG1 4.14Å; F312-I316 HydrophobicContact CD1-CG2 4.03Å; F312-I316 HydrophobicContact CE1-CD1 3.26Å; F312-I316 HydrophobicContact CE1-CG1 4.47Å; F312-I316 HydrophobicContact CE1-CG2 4.45Å; F312-I316 HydrophobicContact CG-CD1 4.17Å; F312-I316 HydrophobicContact CZ-CD1 4.15Å; F312-I316 CarbonylContact O-C 3.51Å; F312-I316 WeakPolarHBondContact O-CA 3.41Å; F312-I316 WeakPolarHBondContact O-CB 3.3Å; F312-I316 PolarHBondContact O-N 3.2Å; I316-K318 VanDerWaalsContact C-N 3.32Å; I316-K318 PolarHBondContact O-N 3.17Å; I316-R319 PolarHBondContact O-N 3.49Å; I316-F320 HydrophobicContact CG2-CD2 3.63Å; I316-F320 HydrophobicContact CG2-CE2 3.82Å; I316-F320 WeakPolarHBondContact O-CD2 3.25Å; I316-F320 PolarHBondContact O-N 3.18Å
317A61.3Low60.2Low43 Ų43107.4 Ų107.436%0.35554%0.536SS..Iπ-helixtrans-61.6-38.317700000112F312 R319 F320 C321F312-A317 PolarHBondContact O-N 2.06Å; A317-R319 VanDerWaalsContact C-N 3.3Å; A317-R319 PolarHBondContact O-N 2.98Å; A317-F320 PolarHBondContact O-N 2.9Å; A317-C321 WeakPolarHBondContact O-CA 3.23Å; A317-C321 WeakPolarHBondContact O-CB 3.34Å; A317-C321 PolarHBondContact O-N 3Å; A317-C321 PolarHBondContact O-SG 2.78Å; A317-C321 VanDerWaalsContact O-SG 3.39Å
318K55.6Low58.5Low154 Ų154112.6 Ų112.667%0.6756%0.564SS**Hα-helixtrans-68.3-25.3174.9-153.1175.6-174.6178.20114Q313 K314 I316 K322Q313-K318 PolarHBondContact O-N 3.31Å; K314-K318 VanDerWaalsContact O-CB 3.3Å; K314-K318 WeakPolarHBondContact O-CB 3.32Å; I316-K318 VanDerWaalsContact C-N 3.32Å; I316-K318 PolarHBondContact O-N 3.17Å; K318-K322 PolarHBondContact O-N 3Å
319R54.9Low56.6Low198 Ų198120.1 Ų120.175%0.74760%0.598SS**Hα-helixtrans-82.1-40.7172.9-89-177.2170.3179.1-3.6111.7H315 I316 A317 K322 C323H315-R319 WeakPolarHBondContact O-CB 3.35Å; H315-R319 WeakPolarHBondContact O-CD 3.14Å; H315-R319 WeakPolarHBondContact O-CG 3.34Å; I316-R319 PolarHBondContact O-N 3.49Å; A317-R319 VanDerWaalsContact C-N 3.3Å; A317-R319 PolarHBondContact O-N 2.98Å; R319-K322 WeakPolarHBondContact O-CB 3.45Å; R319-K322 PolarHBondContact O-N 3.29Å; R319-C323 PolarHBondContact O-N 2.81Å
320F52.6Low54.7Low144 Ų144124.2 Ų124.263%0.63262%0.615SS**Hα-helixtrans-72.5-36.9176.1-83.7-81.6000112.6I316 A317 K322 C323 C324I316-F320 HydrophobicContact CG2-CD2 3.63Å; I316-F320 HydrophobicContact CG2-CE2 3.82Å; I316-F320 WeakPolarHBondContact O-CD2 3.25Å; I316-F320 PolarHBondContact O-N 3.18Å; A317-F320 PolarHBondContact O-N 2.9Å; F320-K322 PolarHBondContact O-N 3.4Å; F320-C323 CarbonylContact O-C 3.58Å; F320-C323 WeakPolarHBondContact O-CA 3.4Å; F320-C323 WeakPolarHBondContact O-CB 3.36Å; F320-C323 PolarHBondContact O-N 2.98Å; F320-C324 PolarHBondContact O-N 3.35Å
321C47.4Very low52.7Low76 Ų76124.9 Ų124.951%0.51463%0.628SS.*Hα-helixtrans-69.1-16.8169.1-73.50000113.2A317 C323 C324A317-C321 WeakPolarHBondContact O-CA 3.23Å; A317-C321 WeakPolarHBondContact O-CB 3.34Å; A317-C321 PolarHBondContact O-N 3Å; A317-C321 PolarHBondContact O-SG 2.78Å; A317-C321 VanDerWaalsContact O-SG 3.39Å; C321-C323 VanDerWaalsContact C-N 3.31Å; C321-C324 CarbonylContact O-C 3.53Å
322K45.3Very low50.7Low190 Ų190129.9 Ų129.983%0.82666%0.663SS**Hα-helixtrans-74.4-22.7166.3-108.7-174.4175.4-169.20112.5K318 R319 F320K318-K322 PolarHBondContact O-N 3Å; R319-K322 WeakPolarHBondContact O-CB 3.45Å; R319-K322 PolarHBondContact O-N 3.29Å; F320-K322 PolarHBondContact O-N 3.4Å
323C45.8Very low48.6Very low112 Ų112134.6 Ų134.676%0.75769%0.687SS**Hα-helixtrans-91.5-13.3170.9-76.80000113.6R319 F320 C321R319-C323 PolarHBondContact O-N 2.81Å; F320-C323 CarbonylContact O-C 3.58Å; F320-C323 WeakPolarHBondContact O-CA 3.4Å; F320-C323 WeakPolarHBondContact O-CB 3.36Å; F320-C323 PolarHBondContact O-N 2.98Å; C321-C323 VanDerWaalsContact C-N 3.31Å
324C40.3Very low46.8Very low81 Ų81140.5 Ų140.555%0.54770%0.703SS.*  trans-112.895.8174.4-76.40000110.5F320 C321 I326F320-C324 PolarHBondContact O-N 3.35Å; C321-C324 CarbonylContact O-C 3.53Å; C324-I326 PolarHBondContact O-N 2.95Å
325S33.4Very low45Very low118 Ų118139 Ų13983%0.82572%0.717SS**THydrogen-bonded Turntrans-7132.1176.262.50000114.5
326I43.6Very low43.5Very low148 Ų148140.1 Ų140.176%0.75974%0.735SS**THydrogen-bonded Turntrans-116.6-11.4-173.5-65-178.3000113C324C324-I326 PolarHBondContact O-N 2.95Å
327F36.6Very low42.1Very low188 Ų188142.4 Ų142.483%0.82576%0.756SS**  trans-119.143.2179.9-111-84.1000113.7
328Q40.1Very low41.1Very low191 Ų191146.8 Ų146.889%0.89378%0.778SS**  trans-104.175.3165.8-155.8169.1-1700107.7
329Q36.3Very low40.1Very low182 Ų182149.3 Ų149.385%0.8579%0.785SS**  trans-111.1131.7162.8-155.1162.77.900108.4
330E36.3Very low39.3Very low180 Ų180146 Ų14684%0.84179%0.786SS**PPolyproline II helixtrans-61.9147.8-155.2-67.5157.8145.800114.5
331A35.3Very low38.3Very low90 Ų90149.7 Ų149.774%0.74480%0.796SS**PPolyproline II helixtrans-70.4134163.900000109.4E333A331-E333 PolarHBondContact O-N 3.26Å
332P36Very low37.7Very low129 Ų129150.9 Ų150.984%0.83881%0.805SS**PPolyproline II helixtrans-75.7126.5164.9510.4000109
333E35.4Very low37.3Very low189 Ų189147.1 Ų147.188%0.88380%0.799SS**PPolyproline II helixtrans-58.9145.3179.7-66.9178.8143.700112.8A331 A335A331-E333 PolarHBondContact O-N 3.26Å; E333-A335 PolarHBondContact O-N 3.48Å
334R37.3Very low36.8Very low250 Ų250145.5 Ų145.594%0.94380%0.801SS**PPolyproline II helixtrans-67.2116168.4-80.4175172.5166.6-3.4109.5
335A33.8Very low36.6Very low107 Ų107150.6 Ų150.688%0.88482%0.816SS**PPolyproline II helixtrans-88.5119.215500000109.4E333E333-A335 PolarHBondContact O-N 3.48Å
336S38.8Very low36.7Very low113 Ų113154 Ų15479%0.7982%0.819SS**PPolyproline II helixtrans-93.5127.8173.451.50000111.3
337S37.5Very low36.4Very low107 Ų107156.1 Ų156.175%0.74883%0.826SS**  trans-171.7102.914855.50000107.4
338V40.9Very low36.4Very low135 Ų135154.5 Ų154.582%0.81882%0.824SS**  48.894.987.1-172.30000112.6
339Y34.6Very low36.1Very low208 Ų208150.5 Ų150.582%0.81682%0.817SS**  -172.5131.3115.6-137.6-96.6000111
340T37.7Very low36.1Very low127 Ų127148.6 Ų148.678%0.77982%0.818SS**  trans-96.8135.5170.3-43.30000108.1
341R31.3Very low36.1Very low223 Ų223143.2 Ų143.284%0.84281%0.811SS**  trans-154.4113.4143.1-156.4167-178.4163.8-0.3111.8
342S34.6Very low35.9Very low100 Ų100151.1 Ų151.170%0.69984%0.839SS**  trans-72.6137.6157.9166.30000109.2
343T37.6Very low35.9Very low112 Ų112152.2 Ų152.269%0.68784%0.839SS**  trans-170116.8133.624.90000108.2
344G35.6Very low35.9Very low78 Ų78150.3 Ų150.380%0.80484%0.837SS**  trans-78.3138.8156.600000108.8
345E35.3Very low35.8Very low187 Ų187144.7 Ų144.787%0.87483%0.831SS**  trans-134.3109.3161.2-90.917417000107.2
346Q36.9Very low35.9Very low189 Ų189146.9 Ų146.988%0.88383%0.828SS**  trans-107.3111.7159.8-114.9178.6-2300104.4
347E36.6Very low35.8Very low194 Ų194149.1 Ų149.191%0.90783%0.83SS**  trans-132.7119.5158.8-85.9-166.8160.900109.6
348I35.9Very low35.7Very low153 Ų153151.9 Ų151.979%0.78584%0.836SS**  trans-97.7126.7163.9-67.6169.1000104.9
349S33.6Very low35.3Very low107 Ų107153.1 Ų153.175%0.74884%0.837SS**  trans161126.3131.2-78.90000115.9
350V36.2Very low35.3Very low143 Ų143148.8 Ų148.887%0.86784%0.838SS**  trans86.7110.6138-176.50000120.4
351G36.3Very low35.1Very low67 Ų67150.7 Ų150.769%0.69184%0.843SS**  82.1102.6119.700000119.2
352L31.7Very low35.5Very low255 Ų255144.1 Ų144.1100%1.33584%0.844SS**  -166.8092.3-136.8108.4000109.9

Retrieved 352 of 352 residues in 620.9 ms (Link to these results)