A0A087XBA4_POEFO Loading...

Phospholipid phosphatase-related protein type 1

May play a role in neurite outgrowth and neurogenesis.

AlphaFold DB , UniProt , Accession A0A087XBA4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 324 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M37.4Very low46.5Very low253 Ų253147 Ų147100%1.24679%0.788SS**  0123.40-77.5172175.300107
2A38.7Very low47.8Very low92 Ų92143 Ų14376%0.7677%0.765SS**  cis-143.2133.911.100000108.8
3S41.3Very low49Very low119 Ų119136.3 Ų136.383%0.83273%0.728SS**  trans-70.8119163.4176.90000107.6
4H47.7Very low50.3Low158 Ų158132.1 Ų132.173%0.73171%0.712SS**  trans-147.2129.8170.4-121-86.3000110.4
5N45.4Very low51.5Low137 Ų137128.3 Ų128.373%0.73370%0.698SS**  trans105.944.6155.1-51.1-29.3000120.1
6T46.9Very low52.8Low131 Ų131127.9 Ų127.980%0.80469%0.688SS**SBendtrans-118.213.3158.345.90000114.4
7L47Very low54.2Low162 Ų162123.6 Ų123.685%0.84866%0.664SS**  trans-86-0.1177.3-91.4153.7000114.7S9L7-S9 PolarHBondContact O-N 3.45Å
8R46.6Very low55.7Low219 Ų219124.4 Ų124.483%0.82666%0.661SS**SBendtrans-81.8-9.3-168.2-156.6171-175.9174.31.8115.8I12R8-I12 HydrophobicContact CG-CD1 4.35Å; R8-I12 WeakPolarHBondContact O-CD1 3.5Å; R8-I12 WeakPolarHBondContact O-CG1 3.08Å
9S54.2Low57.2Low76 Ų76121.6 Ų121.653%0.53165%0.649SS.*SBendtrans-104.7-19.1-167-142.40000116.2L7L7-S9 PolarHBondContact O-N 3.45Å
10Y50.7Low58.5Low173 Ų173118.9 Ų118.968%0.67863%0.632SS**THydrogen-bonded Turntrans-77.1-30-171.4-75.9-84.6000114.4P14Y10-P14 WeakPolarHBondContact O-CD 3.34Å; Y10-P14 WeakPolarHBondContact O-CG 3.41Å
11S55.6Low59.9Low97 Ų97118.4 Ų118.468%0.67863%0.629SS**THydrogen-bonded Turntrans-90-17.4-179-162.60000114.2C15S11-C15 WeakPolarHBondContact O-CB 3.3Å; S11-C15 PolarHBondContact O-N 2.96Å
12I62.1Low62.4Low99 Ų99109.8 Ų109.851%0.50859%0.59SS.*Hα-helixtrans-79.8-38.3-173.5-60.2179.6000111.4R8 C15 F16R8-I12 HydrophobicContact CG-CD1 4.35Å; R8-I12 WeakPolarHBondContact O-CD1 3.5Å; R8-I12 WeakPolarHBondContact O-CG1 3.08Å; I12-C15 PolarHBondContact O-N 3.5Å; I12-F16 WeakPolarHBondContact O-CB 3.33Å; I12-F16 PolarHBondContact O-N 2.83Å
13I63.3Low64.9Low56 Ų56109.6 Ų109.629%0.28758%0.576SS.*Hα-helixtrans-67.6-46.9-178.1-62161.8000111.9C15 F16 I17I13-C15 VanDerWaalsContact C-N 3.29Å; I13-C15 PolarHBondContact O-N 3.49Å; I13-F16 PolarHBondContact O-N 3.01Å; I13-I17 HydrophobicContact CG2-CD1 4.05Å; I13-I17 WeakPolarHBondContact O-CG1 3.11Å; I13-I17 PolarHBondContact O-N 3.29Å; I13-I17 VanDerWaalsContact O-N 3.07Å
14P67.9Low67.3Low78 Ų78105.8 Ų105.851%0.50655%0.545SS..Hα-helixtrans-61.5-38174.3-2233.6000112.4Y10 F18Y10-P14 WeakPolarHBondContact O-CD 3.34Å; Y10-P14 WeakPolarHBondContact O-CG 3.41Å; P14-F18 VanDerWaalsContact O-CB 3.3Å; P14-F18 WeakPolarHBondContact O-CB 3.43Å; P14-F18 PolarHBondContact O-N 3.37Å
15C67.9Low69.4Low74 Ų74101.6 Ų101.650%0.553%0.534SS..Hα-helixtrans-65.2-43.4177.7-172.20000111.9S11 I12 I13 F18 V19S11-C15 WeakPolarHBondContact O-CB 3.3Å; S11-C15 PolarHBondContact O-N 2.96Å; I12-C15 PolarHBondContact O-N 3.5Å; I13-C15 VanDerWaalsContact C-N 3.29Å; I13-C15 PolarHBondContact O-N 3.49Å; C15-F18 PolarHBondContact O-N 3.19Å; C15-V19 WeakPolarHBondContact O-CG2 3.33Å; C15-V19 PolarHBondContact O-N 2.86Å
16F72.1Confident71.7Confident123 Ų12396.9 Ų96.954%0.53952%0.517SS..Hα-helixtrans-62.9-46.1176.5-176.7-99.8000112.1I12 I13 F18 V19 E20I12-F16 WeakPolarHBondContact O-CB 3.33Å; I12-F16 PolarHBondContact O-N 2.83Å; I13-F16 PolarHBondContact O-N 3.01Å; F16-F18 VanDerWaalsContact C-N 3.32Å; F16-F18 PolarHBondContact O-N 3.47Å; F16-V19 PolarHBondContact O-N 2.91Å; F16-E20 HydrophobicContact CD1-CG 4.33Å; F16-E20 HydrophobicContact CE1-CG 4.01Å; F16-E20 WeakPolarHBondContact CE1-OE1 3.25Å; F16-E20 WeakPolarHBondContact CE1-OE2 3.48Å; F16-E20 HydrophobicContact CZ-CG 4.16Å; F16-E20 WeakPolarHBondContact CZ-OE1 3.29Å; F16-E20 WeakPolarHBondContact O-CG 3.43Å; F16-E20 PolarHBondContact O-N 3.15Å
17I76.1Confident73.9Confident54 Ų5491.7 Ų91.728%0.27749%0.485SS..Hα-helixtrans-62.6-41.1176.2-66.9171.7000110.7I13 E20 L21 L116I13-I17 HydrophobicContact CG2-CD1 4.05Å; I13-I17 WeakPolarHBondContact O-CG1 3.11Å; I13-I17 PolarHBondContact O-N 3.29Å; I13-I17 VanDerWaalsContact O-N 3.07Å; I17-E20 PolarHBondContact O-N 3.48Å; I17-L21 HydrophobicContact CG2-CD1 3.96Å; I17-L21 HydrophobicContact CG2-CG 4.22Å; I17-L21 WeakPolarHBondContact O-CB 3.42Å; I17-L21 VanDerWaalsContact O-CG 3.25Å; I17-L21 WeakPolarHBondContact O-CG 2.78Å; I17-L21 PolarHBondContact O-N 3.31Å; I17-L116 HydrophobicContact CD1-CD1 4.24Å
18F81.4Confident76.1Confident139 Ų13986.8 Ų86.861%0.6146%0.462SS*.Hα-helixtrans-61.4-45.6177.2-177.4-98.1000111.8P14 C15 F16 E20 L21 V22P14-F18 VanDerWaalsContact O-CB 3.3Å; P14-F18 WeakPolarHBondContact O-CB 3.43Å; P14-F18 PolarHBondContact O-N 3.37Å; C15-F18 PolarHBondContact O-N 3.19Å; F16-F18 VanDerWaalsContact C-N 3.32Å; F16-F18 PolarHBondContact O-N 3.47Å; F18-E20 PolarHBondContact O-N 2.98Å; F18-L21 PolarHBondContact O-N 2.96Å; F18-V22 HydrophobicContact CD1-CG2 4.2Å; F18-V22 HydrophobicContact CE1-CG2 3.81Å; F18-V22 HydrophobicContact CE2-CG2 4.45Å; F18-V22 HydrophobicContact CZ-CG2 3.96Å; F18-V22 WeakPolarHBondContact O-CG2 3.44Å; F18-V22 PolarHBondContact O-N 3.07Å
19V83.9Confident78.3Confident71 Ų7180.6 Ų80.643%0.4345%0.445SS..Hα-helixtrans-61.6-44.4175.8172.60000111.1C15 F16 L21 V22 I23C15-V19 WeakPolarHBondContact O-CG2 3.33Å; C15-V19 PolarHBondContact O-N 2.86Å; F16-V19 PolarHBondContact O-N 2.91Å; V19-L21 PolarHBondContact O-N 3.32Å; V19-V22 PolarHBondContact O-N 3.35Å; V19-I23 HydrophobicContact CG1-CD1 3.86Å; V19-I23 VanDerWaalsContact O-CG1 3.29Å; V19-I23 WeakPolarHBondContact O-CG1 3.42Å; V19-I23 PolarHBondContact O-N 3.42Å
20E84.4Confident80.1Confident66 Ų6680.9 Ų80.931%0.30844%0.44SS..Hα-helixtrans-60.8-42.6175.6-73.1-174.1148.200112F16 I17 F18 I23 M24F16-E20 HydrophobicContact CD1-CG 4.33Å; F16-E20 HydrophobicContact CE1-CG 4.01Å; F16-E20 WeakPolarHBondContact CE1-OE1 3.25Å; F16-E20 WeakPolarHBondContact CE1-OE2 3.48Å; F16-E20 HydrophobicContact CZ-CG 4.16Å; F16-E20 WeakPolarHBondContact CZ-OE1 3.29Å; F16-E20 WeakPolarHBondContact O-CG 3.43Å; F16-E20 PolarHBondContact O-N 3.15Å; I17-E20 PolarHBondContact O-N 3.48Å; F18-E20 PolarHBondContact O-N 2.98Å; E20-I23 PolarHBondContact O-N 3.4Å; E20-M24 WeakPolarHBondContact O-CB 3.46Å; E20-M24 VanDerWaalsContact O-CG 3.27Å; E20-M24 WeakPolarHBondContact O-CG 3.45Å; E20-M24 PolarHBondContact O-N 2.97Å
21L86.8Confident82.1Confident109 Ų10972.9 Ų72.957%0.57141%0.41SS*.Hα-helixtrans-64.4-40.6176.8-72.6175.5000112.1I17 F18 V19 M24 S25I17-L21 HydrophobicContact CG2-CD1 3.96Å; I17-L21 HydrophobicContact CG2-CG 4.22Å; I17-L21 WeakPolarHBondContact O-CB 3.42Å; I17-L21 VanDerWaalsContact O-CG 3.25Å; I17-L21 WeakPolarHBondContact O-CG 2.78Å; I17-L21 PolarHBondContact O-N 3.31Å; F18-L21 PolarHBondContact O-N 2.96Å; V19-L21 PolarHBondContact O-N 3.32Å; L21-M24 PolarHBondContact O-N 3.45Å; L21-S25 WeakPolarHBondContact O-CB 3.39Å; L21-S25 PolarHBondContact O-N 3.07Å; L21-S25 PolarHBondContact O-OG 3.05Å
22V91Very high83.7Confident72 Ų7274.6 Ų74.644%0.43640%0.402SS..Hα-helixtrans-62.9-47.3175.6170.90000110.3F18 V19 M24 S25 G26F18-V22 HydrophobicContact CD1-CG2 4.2Å; F18-V22 HydrophobicContact CE1-CG2 3.81Å; F18-V22 HydrophobicContact CE2-CG2 4.45Å; F18-V22 HydrophobicContact CZ-CG2 3.96Å; F18-V22 WeakPolarHBondContact O-CG2 3.44Å; F18-V22 PolarHBondContact O-N 3.07Å; V19-V22 PolarHBondContact O-N 3.35Å; V22-M24 VanDerWaalsContact C-N 3.34Å; V22-M24 PolarHBondContact O-N 2.92Å; V22-S25 WeakPolarHBondContact CA-OG 2.92Å; V22-S25 PolarHBondContact O-N 2.79Å; V22-S25 PolarHBondContact O-OG 2.96Å; V22-G26 PolarHBondContact O-N 3.37Å
23I91Very high85Confident89 Ų8975 Ų7546%0.45640%0.398SS..Hα-helixtrans-58.2-48.4176.4-67.5165.9000110.3V19 E20 S25 G26 T27 F132V19-I23 HydrophobicContact CG1-CD1 3.86Å; V19-I23 VanDerWaalsContact O-CG1 3.29Å; V19-I23 WeakPolarHBondContact O-CG1 3.42Å; V19-I23 PolarHBondContact O-N 3.42Å; E20-I23 PolarHBondContact O-N 3.4Å; I23-S25 PolarHBondContact O-N 2.98Å; I23-G26 PolarHBondContact O-N 3.3Å; I23-T27 PolarHBondContact O-N 3.47Å; I23-T27 PolarHBondContact O-OG1 3.14Å; I23-F132 HydrophobicContact CG2-CD2 4.3Å; I23-F132 HydrophobicContact CG2-CE2 3.92Å
24M91.6Very high86.1Confident38 Ų3873.4 Ų73.419%0.18739%0.39CS..Hα-helixtrans-59.7-47.4178.3-75.6-57.4-58.300112E20 L21 V22 G26 T27 V28 A131 F132 F135E20-M24 WeakPolarHBondContact O-CB 3.46Å; E20-M24 VanDerWaalsContact O-CG 3.27Å; E20-M24 WeakPolarHBondContact O-CG 3.45Å; E20-M24 PolarHBondContact O-N 2.97Å; L21-M24 PolarHBondContact O-N 3.45Å; V22-M24 VanDerWaalsContact C-N 3.34Å; V22-M24 PolarHBondContact O-N 2.92Å; M24-G26 VanDerWaalsContact C-N 3.31Å; M24-G26 PolarHBondContact O-N 2.92Å; M24-T27 WeakPolarHBondContact CA-OG1 3.05Å; M24-T27 PolarHBondContact O-N 3.29Å; M24-T27 PolarHBondContact O-OG1 3.5Å; M24-V28 VanDerWaalsContact O-CG2 3.31Å; M24-V28 WeakPolarHBondContact O-CG2 3.35Å; M24-V28 PolarHBondContact O-N 3.33Å; M24-A131 HydrophobicContact CE-CB 3.78Å; M24-F132 HydrophobicContact CE-CB 4.39Å; M24-F132 HydrophobicContact SD-CB 3.52Å; M24-F132 VanDerWaalsContact SD-CB 3.52Å; M24-F132 HydrophobicContact SD-CD2 3.96Å; M24-F132 HydrophobicContact SD-CG 4.23Å; M24-F135 HydrophobicContact CE-CD2 4.18Å
25S92Very high86.9Confident71 Ų7173.7 Ų73.750%0.49738%0.384SS..Hα-helixtrans-61-40.9178.171.40000112L21 V22 I23 V28 L29L21-S25 WeakPolarHBondContact O-CB 3.39Å; L21-S25 PolarHBondContact O-N 3.07Å; L21-S25 PolarHBondContact O-OG 3.05Å; V22-S25 WeakPolarHBondContact CA-OG 2.92Å; V22-S25 PolarHBondContact O-N 2.79Å; V22-S25 PolarHBondContact O-OG 2.96Å; I23-S25 PolarHBondContact O-N 2.98Å; S25-V28 PolarHBondContact O-N 3.18Å; S25-L29 VanDerWaalsContact O-CB 3.25Å; S25-L29 WeakPolarHBondContact O-CB 3.07Å; S25-L29 PolarHBondContact O-N 3.21Å
26G93.4Very high87.5Confident37 Ų3773.8 Ų73.838%0.38139%0.385SS..Hα-helixtrans-64.1-42.3175.400000112.3V22 I23 M24 L29 L30V22-G26 PolarHBondContact O-N 3.37Å; I23-G26 PolarHBondContact O-N 3.3Å; M24-G26 VanDerWaalsContact C-N 3.31Å; M24-G26 PolarHBondContact O-N 2.92Å; G26-L29 PolarHBondContact O-N 2.71Å; G26-L30 WeakPolarHBondContact O-CB 3.29Å; G26-L30 PolarHBondContact O-N 3.39Å
27T93.5Very high87.9Confident22 Ų2270 Ų7014%0.13537%0.372CS..Hα-helixtrans-65.9-41.1176.151.40000112.9I23 M24 L30 A31 F132I23-T27 PolarHBondContact O-N 3.47Å; I23-T27 PolarHBondContact O-OG1 3.14Å; M24-T27 WeakPolarHBondContact CA-OG1 3.05Å; M24-T27 PolarHBondContact O-N 3.29Å; M24-T27 PolarHBondContact O-OG1 3.5Å; T27-L30 PolarHBondContact O-N 2.87Å; T27-A31 WeakPolarHBondContact O-CB 3.49Å; T27-A31 PolarHBondContact O-N 2.86Å; T27-F132 HydrophobicContact CG2-CD2 4.03Å; T27-F132 HydrophobicContact CG2-CE2 3.67Å
28V93.6Very high87.7Confident60 Ų6073.6 Ų73.636%0.36439%0.392SS..Hα-helixtrans-65-44177.1171.90000110.4M24 S25 L30 A31 Y32 F135M24-V28 VanDerWaalsContact O-CG2 3.31Å; M24-V28 WeakPolarHBondContact O-CG2 3.35Å; M24-V28 PolarHBondContact O-N 3.33Å; S25-V28 PolarHBondContact O-N 3.18Å; V28-L30 VanDerWaalsContact C-N 3.34Å; V28-L30 PolarHBondContact O-N 2.94Å; V28-A31 PolarHBondContact O-N 3.41Å; V28-Y32 WeakPolarHBondContact O-CB 3.25Å; V28-Y32 PolarHBondContact O-N 3.33Å; V28-F135 HydrophobicContact CG2-CD1 4.3Å; V28-F135 HydrophobicContact CG2-CD2 3.77Å; V28-F135 HydrophobicContact CG2-CE1 4.07Å; V28-F135 HydrophobicContact CG2-CE2 3.53Å; V28-F135 HydrophobicContact CG2-CG 4.18Å; V28-F135 HydrophobicContact CG2-CZ 3.69Å
29L92.8Very high87.4Confident89 Ų8972.5 Ų72.547%0.46639%0.392SS..Hα-helixtrans-62.6-42.9178-175.762.9000111.2S25 G26 Y32 Y33S25-L29 VanDerWaalsContact O-CB 3.25Å; S25-L29 WeakPolarHBondContact O-CB 3.07Å; S25-L29 PolarHBondContact O-N 3.21Å; G26-L29 PolarHBondContact O-N 2.71Å; L29-Y32 PolarHBondContact O-N 3.37Å; L29-Y33 HydrophobicContact CD1-CD2 3.92Å; L29-Y33 HydrophobicContact CD1-CE2 3.4Å; L29-Y33 HydrophobicContact CD2-CE2 4.03Å; L29-Y33 HydrophobicContact CG-CD2 3.79Å; L29-Y33 HydrophobicContact CG-CE2 3.49Å; L29-Y33 VanDerWaalsContact CG-CE2 3.49Å; L29-Y33 WeakPolarHBondContact O-CD2 3.29Å; L29-Y33 PolarHBondContact O-N 3.15Å
30L91.9Very high87.1Confident82 Ų8274.1 Ų74.143%0.42939%0.393SS..Hα-helixtrans-64.1-44.5176.3-178.958.6000112G26 T27 V28 Y32 Y33 M34 I139G26-L30 WeakPolarHBondContact O-CB 3.29Å; G26-L30 PolarHBondContact O-N 3.39Å; T27-L30 PolarHBondContact O-N 2.87Å; V28-L30 VanDerWaalsContact C-N 3.34Å; V28-L30 PolarHBondContact O-N 2.94Å; L30-Y32 VanDerWaalsContact C-N 3.32Å; L30-Y32 PolarHBondContact O-N 2.77Å; L30-Y33 PolarHBondContact O-N 3.42Å; L30-M34 HydrophobicContact CD1-CG 4.35Å; L30-M34 VanDerWaalsContact O-CG 3.29Å; L30-M34 WeakPolarHBondContact O-CG 3.26Å; L30-M34 PolarHBondContact O-N 3.3Å; L30-I139 HydrophobicContact CB-CD1 4.27Å; L30-I139 HydrophobicContact CD2-CD1 4.06Å; L30-I139 HydrophobicContact CD2-CG2 4.27Å; L30-I139 HydrophobicContact CG-CD1 4.15Å; L30-I139 HydrophobicContact CG-CG1 4.4Å
31A91.2Very high87Confident4 Ų474 Ų743%0.03341%0.41CS..Hα-helixtrans-59.4-44.6174.700000111.3T27 V28 Y33 M34 E35 F135 I139T27-A31 WeakPolarHBondContact O-CB 3.49Å; T27-A31 PolarHBondContact O-N 2.86Å; V28-A31 PolarHBondContact O-N 3.41Å; A31-Y33 PolarHBondContact O-N 2.83Å; A31-M34 PolarHBondContact O-N 3.4Å; A31-E35 WeakPolarHBondContact O-CB 3.27Å; A31-E35 PolarHBondContact O-N 3.19Å; A31-F135 HydrophobicContact CB-CD1 3.93Å; A31-I139 HydrophobicContact CB-CD1 4.32Å; A31-I139 HydrophobicContact CB-CG1 3.97Å
32Y90.6Very high87Confident134 Ų13469.7 Ų69.753%0.52539%0.388SS..Hα-helixtrans-59.9-44.9175.6175.6-98.5000112.5V28 L29 L30 E35 C36V28-Y32 WeakPolarHBondContact O-CB 3.25Å; V28-Y32 PolarHBondContact O-N 3.33Å; L29-Y32 PolarHBondContact O-N 3.37Å; L30-Y32 VanDerWaalsContact C-N 3.32Å; L30-Y32 PolarHBondContact O-N 2.77Å; Y32-E35 PolarHBondContact O-N 3.29Å; Y32-C36 HydrophobicContact CD2-CB 4.12Å; Y32-C36 HydrophobicContact CE1-CB 4.45Å; Y32-C36 HydrophobicContact CE2-CB 3.77Å; Y32-C36 VanDerWaalsContact CE2-SG 3.53Å; Y32-C36 VanDerWaalsContact O-CB 3.3Å; Y32-C36 WeakPolarHBondContact O-CB 3.47Å; Y32-C36 PolarHBondContact O-N 2.92Å
33Y89.1Confident86.9Confident107 Ų10771.4 Ų71.442%0.4239%0.391SS..Hα-helixtrans-63.8-43.6176.2-81.1-64.9000111.8L29 L30 A31 E35 T37L29-Y33 HydrophobicContact CD1-CD2 3.92Å; L29-Y33 HydrophobicContact CD1-CE2 3.4Å; L29-Y33 HydrophobicContact CD2-CE2 4.03Å; L29-Y33 HydrophobicContact CG-CD2 3.79Å; L29-Y33 HydrophobicContact CG-CE2 3.49Å; L29-Y33 VanDerWaalsContact CG-CE2 3.49Å; L29-Y33 WeakPolarHBondContact O-CD2 3.29Å; L29-Y33 PolarHBondContact O-N 3.15Å; L30-Y33 PolarHBondContact O-N 3.42Å; A31-Y33 PolarHBondContact O-N 2.83Å; Y33-E35 VanDerWaalsContact C-N 3.29Å; Y33-E35 PolarHBondContact O-N 3.47Å; Y33-T37 HydrophobicContact CD1-CG2 3.75Å; Y33-T37 HydrophobicContact CE1-CG2 4.35Å; Y33-T37 WeakPolarHBondContact O-CB 3.4Å; Y33-T37 PolarHBondContact O-N 3.34Å; Y33-T37 VanDerWaalsContact O-N 3.07Å; Y33-T37 PolarHBondContact O-OG1 2.82Å
34M86.1Confident86.8Confident22 Ų2270.1 Ų70.111%0.10839%0.387CS..Hα-helixtrans-62.7-35.8177.9-69.4-71.3-67.700112.7L30 A31 F40 N142 A143L30-M34 HydrophobicContact CD1-CG 4.35Å; L30-M34 VanDerWaalsContact O-CG 3.29Å; L30-M34 WeakPolarHBondContact O-CG 3.26Å; L30-M34 PolarHBondContact O-N 3.3Å; A31-M34 PolarHBondContact O-N 3.4Å; M34-F40 HydrophobicContact CE-CD2 4.34Å; M34-F40 HydrophobicContact SD-CD2 3.39Å; M34-F40 WeakPolarHBondContact SD-CD2 3.31Å; M34-F40 HydrophobicContact SD-CE2 3.34Å; M34-F40 WeakPolarHBondContact SD-CE2 3.32Å; M34-F40 HydrophobicContact SD-CZ 4.48Å; M34-N142 HydrophobicContact CB-CB 4.2Å; M34-N142 HydrophobicContact CE-CB 3.96Å; M34-A143 HydrophobicContact CE-CB 4.04Å
35E84.3Confident86.6Confident84 Ų8472.4 Ų72.439%0.39340%0.397SS..Hα-helixtrans-84.5-45.7-176.7-166.573.6176.700112.9A31 Y32 Y33 N142 K198A31-E35 WeakPolarHBondContact O-CB 3.27Å; A31-E35 PolarHBondContact O-N 3.19Å; Y32-E35 PolarHBondContact O-N 3.29Å; Y33-E35 VanDerWaalsContact C-N 3.29Å; Y33-E35 PolarHBondContact O-N 3.47Å; E35-N142 PolarHBondContact OE2-ND2 2.9Å; E35-N142 PolarHBondContact OE2-OD1 3.44Å; E35-K198 IonicContact OE1-NZ 3.31Å; E35-K198 PolarHBondContact OE1-NZ 2.9Å; E35-K198 IonicContact OE2-NZ 3.75Å; E35-K198 PolarHBondContact OE2-NZ 3.33Å
36C81.8Confident86.4Confident77 Ų7769.7 Ų69.752%0.5238%0.38SS..Hα-helixtrans-101.6-4.7-167.9-62.20000113.7Y32Y32-C36 HydrophobicContact CD2-CB 4.12Å; Y32-C36 HydrophobicContact CE1-CB 4.45Å; Y32-C36 HydrophobicContact CE2-CB 3.77Å; Y32-C36 VanDerWaalsContact CE2-SG 3.53Å; Y32-C36 VanDerWaalsContact O-CB 3.3Å; Y32-C36 WeakPolarHBondContact O-CB 3.47Å; Y32-C36 PolarHBondContact O-N 2.92Å
37T80.4Confident86.3Confident44 Ų4468.1 Ų68.127%0.2736%0.363SS..  trans-126.1140.3177.572.80000111.3Y33 L39Y33-T37 HydrophobicContact CD1-CG2 3.75Å; Y33-T37 HydrophobicContact CE1-CG2 4.35Å; Y33-T37 WeakPolarHBondContact O-CB 3.4Å; Y33-T37 PolarHBondContact O-N 3.34Å; Y33-T37 VanDerWaalsContact O-N 3.07Å; Y33-T37 PolarHBondContact O-OG1 2.82Å; T37-L39 PolarHBondContact O-N 3.43Å; T37-L39 WeakPolarHBondContact OG1-CB 3.38Å
38D71.4Confident86.1Confident129 Ų12971.3 Ų71.369%0.6938%0.375SS*.THydrogen-bonded Turntrans-77.933.4174.8-55.3-42.6000111.7F40D38-F40 PolarHBondContact O-N 2.81Å
39L74.5Confident85.7Confident115 Ų11568.5 Ų68.560%0.60236%0.358SS*.THydrogen-bonded Turntrans-60.3-29.8-175.4-169.370.3000111.4T37T37-L39 PolarHBondContact O-N 3.43Å; T37-L39 WeakPolarHBondContact OG1-CB 3.38Å
40F78.1Confident85.3Confident105 Ų10567 Ų6746%0.46135%0.35SS..SBendtrans-121.8112175.7-53.8-78.2000109.8M34 D38 V146M34-F40 HydrophobicContact CE-CD2 4.34Å; M34-F40 HydrophobicContact SD-CD2 3.39Å; M34-F40 WeakPolarHBondContact SD-CD2 3.31Å; M34-F40 HydrophobicContact SD-CE2 3.34Å; M34-F40 WeakPolarHBondContact SD-CE2 3.32Å; M34-F40 HydrophobicContact SD-CZ 4.48Å; D38-F40 PolarHBondContact O-N 2.81Å; F40-V146 HydrophobicContact CB-CG1 3.67Å
41G81.2Confident85.2Confident64 Ų6465.2 Ų65.266%0.6634%0.341SS*.PPolyproline II helixtrans-66.2136.9174.600000111.3H43 V146G41-H43 PolarHBondContact O-N 3.47Å; G41-V146 WeakPolarHBondContact O-CG1 3.46Å
42V87.3Confident85.2Confident19 Ų1968.3 Ų68.312%0.11537%0.367CS..PPolyproline II helixtrans-63.1131.7177.6-175.50000110.1V44 E189 R192 R193V42-V44 PolarHBondContact O-N 3.48Å; V42-E189 HydrophobicContact CG2-CG 3.96Å; V42-R192 HydrophobicContact CG1-CB 3.85Å; V42-R193 HydrophobicContact CG1-CG 4.48Å; V42-R193 HydrophobicContact CG2-CG 3.98Å; V42-R193 VanDerWaalsContact CG2-NE 3.3Å
43H89.4Confident85.3Confident108 Ų10868 Ų6850%0.537%0.37SS..PPolyproline II helixtrans-57.9133.1174.1-176.670.3000110.8G41 Q45 V146 V147 G149G41-H43 PolarHBondContact O-N 3.47Å; H43-Q45 PolarHBondContact O-N 3.38Å; H43-V146 WeakPolarHBondContact CB-O 3.27Å; H43-V146 PolarHBondContact N-O 3.19Å; H43-V147 WeakPolarHBondContact CB-O 3.46Å; H43-G149 VanDerWaalsContact O-CA 3.27Å; H43-G149 WeakPolarHBondContact O-CA 3.47Å
44V88.8Confident85.5Confident61 Ų6163.5 Ų63.537%0.3735%0.353SS..  trans-89.595.7179.7179.90000108.8V42V42-V44 PolarHBondContact O-N 3.48Å
45Q87Confident85.9Confident87 Ų8767 Ų6741%0.40737%0.37SS..  trans-72.7141.6170-165.4178.89.100110.5H43 R192H43-Q45 PolarHBondContact O-N 3.38Å; Q45-R192 PolarHBondContact O-NH1 2.7Å
46G88.6Confident86.4Confident13 Ų1366.5 Ų66.513%0.13437%0.367CS..  trans-77.5157173.800000113.3F174 I175G46-F174 VanDerWaalsContact C-CE2 3.5Å; G46-I175 CarbonylContact C-O 3.29Å; G46-I175 WeakPolarHBondContact CA-O 3.35Å
47F90.5Very high87.1Confident5 Ų566.8 Ų66.82%0.02237%0.368CS..EExtended strand (participates in β ladder)trans-148.1164.5-176.858.8-88.7000112.8L54 L151 F155 L156 I175 I180F47-L54 HydrophobicContact CB-CD1 4.12Å; F47-L151 HydrophobicContact CB-CD1 3.59Å; F47-L151 HydrophobicContact CD1-CD1 4.17Å; F47-L151 HydrophobicContact CG-CD1 4.21Å; F47-F155 AromaticContact CD1-CE1 3.67Å; F47-F155 HydrophobicContact CD1-CE1 3.67Å; F47-F155 HydrophobicContact CD1-CZ 4.14Å; F47-F155 HydrophobicContact CD2-CE1 4.15Å; F47-F155 AromaticContact CE1-CE1 3.52Å; F47-F155 HydrophobicContact CE1-CE1 3.52Å; F47-F155 AromaticContact CE1-CZ 3.72Å; F47-F155 HydrophobicContact CE1-CZ 3.72Å; F47-F155 HydrophobicContact CE2-CE1 4.01Å; F47-F155 AromaticContact CG-CE1 3.96Å; F47-F155 HydrophobicContact CG-CE1 3.96Å; F47-F155 AromaticContact CZ-CE1 3.66Å; F47-F155 HydrophobicContact CZ-CE1 3.66Å; F47-F155 HydrophobicContact CZ-CZ 4.05Å; F47-L156 HydrophobicContact CD2-CD2 3.69Å; F47-L156 HydrophobicContact CE2-CD2 3.56Å; F47-L156 HydrophobicContact CZ-CD2 4.5Å; F47-I175 HydrophobicContact CE2-CD1 4.3Å; F47-I175 PolarHBondContact N-O 2.9Å; F47-I175 PolarHBondContact O-N 2.74Å; F47-I180 HydrophobicContact CE1-CD1 4.21Å; F47-I180 HydrophobicContact CE2-CD1 3.59Å; F47-I180 HydrophobicContact CZ-CD1 3.23Å; F47-I180 HydrophobicContact CZ-CG1 3.8Å
48F90.3Very high87.7Confident89 Ų8969.2 Ų69.239%0.3937%0.373SS..EExtended strand (participates in β ladder)trans-93.2139.4172.2-62.5-82000110.8N50 D51 F174F48-N50 VanDerWaalsContact C-N 3.29Å; F48-N50 PolarHBondContact O-N 2.9Å; F48-D51 HydrophobicContact CB-CB 4.35Å; F48-F174 HydrophobicContact CD1-CB 4.07Å; F48-F174 HydrophobicContact CD1-CD2 4.07Å; F48-F174 HydrophobicContact CD2-CD2 4.09Å; F48-F174 HydrophobicContact CE1-CB 3.71Å; F48-F174 AromaticContact CE1-CD2 3.77Å; F48-F174 HydrophobicContact CE1-CD2 3.77Å; F48-F174 HydrophobicContact CE1-CG 4.18Å; F48-F174 AromaticContact CE2-CD2 3.77Å; F48-F174 HydrophobicContact CE2-CD2 3.77Å; F48-F174 HydrophobicContact CE2-CE2 4.2Å; F48-F174 HydrophobicContact CG-CD2 4.23Å; F48-F174 HydrophobicContact CZ-CB 4.29Å; F48-F174 AromaticContact CZ-CD2 3.61Å; F48-F174 HydrophobicContact CZ-CD2 3.61Å; F48-F174 HydrophobicContact CZ-CE2 4.36Å; F48-F174 HydrophobicContact CZ-CG 4.31Å
49C84.7Confident88.7Confident0 Ų064.9 Ų64.90%035%0.352CS..THydrogen-bonded Turntrans-53.9-38.5-177.9-86.30000115.8Y163 C168 Q173 I175C49-Y163 HydrophobicContact CB-CE1 4.49Å; C49-Y163 WeakPolarHBondContact O-CE1 3.5Å; C49-Y163 PolarHBondContact O-OH 3.49Å; C49-C168 HydrophobicContact CB-CB 4.3Å; C49-C168 WeakPolarHBondContact CB-SG 3.31Å; C49-C168 WeakPolarHBondContact SG-CA 3.27Å; C49-C168 WeakPolarHBondContact SG-CB 3.45Å; C49-C168 CovalentContact SG-SG 2.01Å; C49-C168 PolarHBondContact SG-SG 2.85Å; C49-Q173 PolarHBondContact N-O 2.86Å; C49-I175 WeakPolarHBondContact SG-CD1 3.27Å
50N84.9Confident89.5Confident57 Ų5760.2 Ų60.231%0.30533%0.332SS..THydrogen-bonded Turntrans-121.241.1-172-71.7-34.8000111.6F48 A52 Y163 N171F48-N50 VanDerWaalsContact C-N 3.29Å; F48-N50 PolarHBondContact O-N 2.9Å; N50-A52 PolarHBondContact O-N 3.22Å; N50-Y163 WeakPolarHBondContact OD1-CE1 3.49Å; N50-N171 HydrophobicContact CB-CB 4.48Å; N50-N171 PolarHBondContact ND2-OD1 3.26Å
51D89.9Confident90.1Very high46 Ų4659.2 Ų59.225%0.24633%0.334CS..  trans-75.4111.5176.8-164-29.3000111.4F48 E53 L54 M55 L156F48-D51 HydrophobicContact CB-CB 4.35Å; D51-E53 PolarHBondContact O-N 2.91Å; D51-E53 WeakPolarHBondContact OD1-CB 3.49Å; D51-E53 PolarHBondContact OD1-N 3.25Å; D51-L54 HydrophobicContact CB-CB 4.26Å; D51-L54 HydrophobicContact CB-CD1 4.16Å; D51-L54 HydrophobicContact CB-CG 4.21Å; D51-L54 PolarHBondContact O-N 3.44Å; D51-L54 VanDerWaalsContact O-N 3.07Å; D51-M55 VanDerWaalsContact O-CG 3.24Å; D51-M55 WeakPolarHBondContact O-CG 3.27Å; D51-M55 PolarHBondContact O-N 2.88Å; D51-L156 HydrophobicContact CB-CD1 4.19Å
52A90.5Very high90.2Very high69 Ų6959.7 Ų59.757%0.5732%0.319SS*.THydrogen-bonded Turntrans-64.7-18.5-179.600000113.8N50 K56N50-A52 PolarHBondContact O-N 3.22Å; A52-K56 PolarHBondContact O-NZ 3.41Å; A52-K56 VanDerWaalsContact O-NZ 3.15Å
53E93Very high90.1Very high126 Ų12665.2 Ų65.259%0.58934%0.344SS*.THydrogen-bonded Turntrans-77.5-28.3174.9-61.2-166.7171.700112.1D51 P153D51-E53 PolarHBondContact O-N 2.91Å; D51-E53 WeakPolarHBondContact OD1-CB 3.49Å; D51-E53 PolarHBondContact OD1-N 3.25Å; E53-P153 VanDerWaalsContact O-CA 3.3Å; E53-P153 WeakPolarHBondContact O-CA 3.33Å; E53-P153 VanDerWaalsContact O-O 3.12Å
54L93.9Very high90Very high13 Ų1363.5 Ų63.57%0.06834%0.344CS..THydrogen-bonded Turntrans-99.9-3.2-178.4-58178.3000113.9F47 D51 L151 S152 P153 Y154 F155 L156F47-L54 HydrophobicContact CB-CD1 4.12Å; D51-L54 HydrophobicContact CB-CB 4.26Å; D51-L54 HydrophobicContact CB-CD1 4.16Å; D51-L54 HydrophobicContact CB-CG 4.21Å; D51-L54 PolarHBondContact O-N 3.44Å; D51-L54 VanDerWaalsContact O-N 3.07Å; L54-L151 HydrophobicContact CD1-CB 4.4Å; L54-L151 HydrophobicContact CD1-CD1 3.83Å; L54-L151 HydrophobicContact CD2-CB 3.87Å; L54-S152 WeakPolarHBondContact CD2-O 3.29Å; L54-P153 CarbonylContact C-O 3.04Å; L54-P153 WeakPolarHBondContact CA-O 3.33Å; L54-Y154 CarbonylContact O-C 2.89Å; L54-F155 PolarHBondContact O-N 3Å; L54-L156 HydrophobicContact CB-CB 4.49Å; L54-L156 HydrophobicContact CB-CD1 3.8Å; L54-L156 HydrophobicContact CB-CG 3.83Å; L54-L156 WeakPolarHBondContact O-CB 3.21Å; L54-L156 PolarHBondContact O-N 3.38Å
55M93.5Very high89.9Confident95 Ų9561 Ų6147%0.46833%0.329SS..  trans-94.418.7179-71.4176.376.600113.7D51 P153 L156D51-M55 VanDerWaalsContact O-CG 3.24Å; D51-M55 WeakPolarHBondContact O-CG 3.27Å; D51-M55 PolarHBondContact O-N 2.88Å; M55-P153 PolarHBondContact N-O 3.32Å; M55-L156 HydrophobicContact CG-CB 3.98Å; M55-L156 HydrophobicContact CG-CD1 3.64Å; M55-L156 HydrophobicContact CG-CG 4.46Å
56K95.6Very high90Very high74 Ų7464.6 Ų64.632%0.32234%0.344SS..PPolyproline II helixtrans-64.7151.5176.4-57-52.8-179.7-153.70110.8A52 P153 Y154 S157 Y249A52-K56 PolarHBondContact O-NZ 3.41Å; A52-K56 VanDerWaalsContact O-NZ 3.15Å; K56-P153 HydrophobicContact CB-CB 4.17Å; K56-P153 WeakPolarHBondContact CB-O 3.27Å; K56-P153 HydrophobicContact CG-CB 3.72Å; K56-P153 WeakPolarHBondContact CG-O 3.44Å; K56-P153 PolarHBondContact N-O 3.33Å; K56-Y154 WeakPolarHBondContact O-CA 3.24Å; K56-S157 WeakPolarHBondContact O-CB 3.17Å; K56-S157 PolarHBondContact O-OG 2.94Å; K56-Y249 HydrophobicContact CB-CD1 4.17Å; K56-Y249 HydrophobicContact CB-CD2 4.09Å; K56-Y249 HydrophobicContact CB-CG 3.76Å; K56-Y249 HydrophobicContact CD-CD1 4.32Å; K56-Y249 HydrophobicContact CD-CE1 4.39Å; K56-Y249 HydrophobicContact CG-CD1 3.94Å; K56-Y249 HydrophobicContact CG-CE1 4.49Å; K56-Y249 HydrophobicContact CG-CG 4.06Å
57P94.8Very high90.1Very high83 Ų8365.6 Ų65.654%0.53935%0.347SS..PPolyproline II helixtrans-62142.7179.626-34.8000110.8P59 Y249P57-P59 WeakPolarHBondContact O-CD 3.25Å; P57-Y249 HydrophobicContact CG-CD2 4.01Å; P57-Y249 HydrophobicContact CG-CE2 3.93Å
58Y94.4Very high90.2Very high95 Ų9566.4 Ų66.437%0.37335%0.353SS..PPolyproline II helixtrans-64120.3175.6178-126.8000110.4G60 Y154 V158 V187Y58-G60 VanDerWaalsContact CE1-CA 3.45Å; Y58-G60 WeakPolarHBondContact CE2-O 3.49Å; Y58-G60 VanDerWaalsContact CZ-C 3.44Å; Y58-G60 VanDerWaalsContact CZ-O 3.26Å; Y58-G60 PolarHBondContact O-N 3.38Å; Y58-G60 VanDerWaalsContact OH-C 3.31Å; Y58-G60 PolarHBondContact OH-O 3.09Å; Y58-G60 VanDerWaalsContact OH-O 3.13Å; Y58-Y154 AromaticContact CD2-CD2 3.58Å; Y58-Y154 HydrophobicContact CD2-CD2 3.58Å; Y58-Y154 AromaticContact CD2-CE2 3.75Å; Y58-Y154 HydrophobicContact CD2-CE2 3.75Å; Y58-Y154 HydrophobicContact CD2-CG 4.29Å; Y58-Y154 HydrophobicContact CE2-CD2 4.19Å; Y58-Y154 AromaticContact CE2-CE2 3.86Å; Y58-Y154 HydrophobicContact CE2-CE2 3.86Å; Y58-V158 HydrophobicContact CD1-CG1 4.4Å; Y58-V158 HydrophobicContact CD2-CG1 3.37Å; Y58-V158 HydrophobicContact CE2-CG1 3.88Å; Y58-V158 HydrophobicContact CG-CG1 3.68Å; Y58-V187 HydrophobicContact CE2-CG1 3.8Å
59P91.9Very high90.2Very high39 Ų3963 Ų6325%0.25334%0.339SS..  trans-74.6-3.5-177.229.2-35.6000114.2P57 Y154 E248 R250P57-P59 WeakPolarHBondContact O-CD 3.25Å; P59-Y154 HydrophobicContact CG-CD1 4.11Å; P59-Y154 HydrophobicContact CG-CE1 4.33Å; P59-E248 HydrophobicContact CB-CB 4.48Å; P59-E248 VanDerWaalsContact CB-O 3.3Å; P59-E248 WeakPolarHBondContact CB-O 3.44Å; P59-E248 WeakPolarHBondContact CG-O 3.28Å; P59-R250 HydrophobicContact CG-CG 3.87Å
60G91.9Very high90.5Very high17 Ų1768.5 Ų68.518%0.17537%0.369CS..  trans93.1-167.4-175.200000113Y58Y58-G60 VanDerWaalsContact CE1-CA 3.45Å; Y58-G60 WeakPolarHBondContact CE2-O 3.49Å; Y58-G60 VanDerWaalsContact CZ-C 3.44Å; Y58-G60 VanDerWaalsContact CZ-O 3.26Å; Y58-G60 PolarHBondContact O-N 3.38Å; Y58-G60 VanDerWaalsContact OH-C 3.31Å; Y58-G60 PolarHBondContact OH-O 3.09Å; Y58-G60 VanDerWaalsContact OH-O 3.13Å
61T89.6Confident91Very high83 Ų8370.5 Ų70.551%0.50938%0.378SS..  trans-66.2157.6178.650.40000111.6E63 S64 R250T61-E63 PolarHBondContact O-N 2.8Å; T61-S64 PolarHBondContact N-OG 2.77Å; T61-S64 PolarHBondContact O-N 3.16Å; T61-S64 VanDerWaalsContact O-N 3.08Å; T61-S64 PolarHBondContact O-OG 2.94Å; T61-S64 PolarHBondContact OG1-OG 3.15Å; T61-R250 PolarHBondContact O-NH2 3.05Å
62E84.6Confident91.3Very high74 Ų7469 Ų6935%0.34637%0.37SS..G310 helixtrans-56.5-30.2173.9-72-67.9149.100113.1S64 S65 P69 R245 R250E62-S64 VanDerWaalsContact C-N 3.27Å; E62-S64 PolarHBondContact O-N 3.27Å; E62-S65 WeakPolarHBondContact O-CB 3.33Å; E62-S65 PolarHBondContact O-N 3.41Å; E62-P69 HydrophobicContact CB-CG 3.95Å; E62-P69 HydrophobicContact CG-CG 4.33Å; E62-P69 WeakPolarHBondContact O-CD 3.31Å; E62-P69 VanDerWaalsContact OE2-CG 3.24Å; E62-P69 WeakPolarHBondContact OE2-CG 3.38Å; E62-R245 IonicContact OE1-NH1 3.52Å; E62-R245 IonicContact OE2-CZ 3.21Å; E62-R245 IonicContact OE2-NH1 3.34Å; E62-R245 PolarHBondContact OE2-NH1 3.02Å; E62-R245 IonicContact OE2-NH2 3.56Å; E62-R250 IonicContact OE1-CZ 3.95Å; E62-R250 IonicContact OE1-NH1 3.87Å; E62-R250 PolarHBondContact OE1-NH1 3.2Å; E62-R250 IonicContact OE2-CZ 2.71Å; E62-R250 IonicContact OE2-NH1 2.92Å; E62-R250 PolarHBondContact OE2-NH1 2.79Å
63E85.1Confident91.5Very high135 Ų13569.2 Ų69.263%0.63136%0.357SS*.G310 helixtrans-68.8-22.3177.4-58.6-58.7157.500113.9T61 S65T61-E63 PolarHBondContact O-N 2.8Å; E63-S65 VanDerWaalsContact C-N 3.33Å
64S86Confident91.6Very high72 Ų7266.8 Ų66.850%0.50335%0.353SS..G310 helixtrans-91.13.8177.360.60000113T61 E62T61-S64 PolarHBondContact N-OG 2.77Å; T61-S64 PolarHBondContact O-N 3.16Å; T61-S64 VanDerWaalsContact O-N 3.08Å; T61-S64 PolarHBondContact O-OG 2.94Å; T61-S64 PolarHBondContact OG1-OG 3.15Å; E62-S64 VanDerWaalsContact C-N 3.27Å; E62-S64 PolarHBondContact O-N 3.27Å
65S88.1Confident91.7Very high9 Ų970.2 Ų70.26%0.06337%0.374CS..SBendtrans-62.1149.5170.7-85.70000111.9E62 E63 V67 P68 E248 R250E62-S65 WeakPolarHBondContact O-CB 3.33Å; E62-S65 PolarHBondContact O-N 3.41Å; E63-S65 VanDerWaalsContact C-N 3.33Å; S65-V67 WeakPolarHBondContact CB-O 3.39Å; S65-V67 PolarHBondContact O-N 2.94Å; S65-P68 WeakPolarHBondContact O-CD 3.41Å; S65-E248 WeakPolarHBondContact CA-OE1 3.26Å; S65-E248 WeakPolarHBondContact CB-OE2 3.44Å; S65-E248 PolarHBondContact OG-OE2 3.2Å; S65-R250 PolarHBondContact OG-NE 3.31Å; S65-R250 PolarHBondContact OG-NH2 2.84Å
66F88.3Confident91.8Very high163 Ų16366.2 Ų66.272%0.71536%0.355SS*.SBendtrans-55.4-37.8169-175.5-102.8000111.6E248F66-E248 WeakPolarHBondContact CB-OE1 3.36Å; F66-E248 PolarHBondContact N-OE1 3.39Å
67V90.8Very high91.8Very high33 Ų3364.6 Ų64.620%0.236%0.355CS..SBendtrans-119.897.9168.5-174.20000109.1S65 L72 N244 R245S65-V67 WeakPolarHBondContact CB-O 3.39Å; S65-V67 PolarHBondContact O-N 2.94Å; V67-L72 HydrophobicContact CG1-CB 4Å; V67-L72 HydrophobicContact CG1-CD1 4.4Å; V67-N244 WeakPolarHBondContact CG2-ND2 3.11Å; V67-R245 PolarHBondContact O-NH2 3.3Å
68P92.6Very high91.9Very high23 Ų2363 Ų6315%0.14935%0.349CS..  trans-58.7138175-25.534.7000111.4S65 L70 I71 L72S65-P68 WeakPolarHBondContact O-CD 3.41Å; P68-L70 PolarHBondContact O-N 3.46Å; P68-I71 HydrophobicContact CB-CD1 4.41Å; P68-I71 HydrophobicContact CB-CG1 4.36Å; P68-I71 HydrophobicContact CG-CD1 4.07Å; P68-I71 PolarHBondContact O-N 3.18Å; P68-I71 VanDerWaalsContact O-N 3.09Å; P68-L72 PolarHBondContact O-N 2.99Å; P68-L72 VanDerWaalsContact O-N 3.11Å
69P90.4Very high91.9Very high16 Ų1660.2 Ų60.210%0.10435%0.346CS..Hα-helixtrans-55.9-36.5-179.1-28.436.1000113.4E62 I71 L72 Y73E62-P69 HydrophobicContact CB-CG 3.95Å; E62-P69 HydrophobicContact CG-CG 4.33Å; E62-P69 WeakPolarHBondContact O-CD 3.31Å; E62-P69 VanDerWaalsContact OE2-CG 3.24Å; E62-P69 WeakPolarHBondContact OE2-CG 3.38Å; P69-I71 PolarHBondContact O-N 2.85Å; P69-L72 PolarHBondContact O-N 3.08Å; P69-Y73 HydrophobicContact CB-CD2 4.37Å; P69-Y73 HydrophobicContact CB-CE2 3.8Å; P69-Y73 WeakPolarHBondContact O-CB 3.44Å; P69-Y73 WeakPolarHBondContact O-CD1 3.13Å; P69-Y73 WeakPolarHBondContact O-CD2 3.47Å; P69-Y73 PolarHBondContact O-N 3.42Å
70L91.7Very high92Very high117 Ų11758.4 Ų58.461%0.61333%0.334SS*.Hα-helixtrans-56.9-48.6177.1-176.867.4000111.7P68 Y73 C74P68-L70 PolarHBondContact O-N 3.46Å; L70-Y73 PolarHBondContact O-N 2.94Å; L70-C74 WeakPolarHBondContact O-CB 3.34Å; L70-C74 PolarHBondContact O-N 3.37Å; L70-C74 PolarHBondContact O-SG 3.49Å
71I94.3Very high92.2Very high99 Ų9959.4 Ų59.451%0.50834%0.337SS..Hα-helixtrans-65.5-44.2179.7-60.6-179.7000109.7P68 P69 Y73 C74 V75P68-I71 HydrophobicContact CB-CD1 4.41Å; P68-I71 HydrophobicContact CB-CG1 4.36Å; P68-I71 HydrophobicContact CG-CD1 4.07Å; P68-I71 PolarHBondContact O-N 3.18Å; P68-I71 VanDerWaalsContact O-N 3.09Å; P69-I71 PolarHBondContact O-N 2.85Å; I71-Y73 PolarHBondContact O-N 3.28Å; I71-C74 PolarHBondContact O-N 3.36Å; I71-V75 HydrophobicContact CG2-CG2 4.32Å; I71-V75 WeakPolarHBondContact O-CB 3.26Å; I71-V75 VanDerWaalsContact O-CG2 3.27Å; I71-V75 WeakPolarHBondContact O-CG2 3.34Å; I71-V75 PolarHBondContact O-N 2.95Å
72L95.4Very high92.4Very high14 Ų1459.3 Ų59.37%0.07334%0.336CS..Hα-helixtrans-59-50.6178.5-176.365.7000111.3V67 P68 P69 C74 V75 V76 D199 A241V67-L72 HydrophobicContact CG1-CB 4Å; V67-L72 HydrophobicContact CG1-CD1 4.4Å; P68-L72 PolarHBondContact O-N 2.99Å; P68-L72 VanDerWaalsContact O-N 3.11Å; P69-L72 PolarHBondContact O-N 3.08Å; L72-C74 PolarHBondContact O-N 3.45Å; L72-V75 PolarHBondContact O-N 3.49Å; L72-V76 HydrophobicContact CD1-CG2 3.97Å; L72-V76 HydrophobicContact CG-CG2 4.14Å; L72-V76 VanDerWaalsContact O-CB 3.27Å; L72-V76 WeakPolarHBondContact O-CB 3.4Å; L72-V76 WeakPolarHBondContact O-CG2 3.48Å; L72-V76 PolarHBondContact O-N 2.85Å; L72-D199 HydrophobicContact CD2-CB 3.49Å; L72-D199 VanDerWaalsContact CD2-CB 3.49Å; L72-D199 WeakPolarHBondContact CD2-OD2 3.4Å; L72-A241 HydrophobicContact CD1-CB 4.08Å
73Y95Very high92.8Very high74 Ų7458.3 Ų58.329%0.2933%0.332SS..Hα-helixtrans-66.1-39.4-177-59.3-16.9000111.7P69 L70 I71 A77 D199 L202P69-Y73 HydrophobicContact CB-CD2 4.37Å; P69-Y73 HydrophobicContact CB-CE2 3.8Å; P69-Y73 WeakPolarHBondContact O-CB 3.44Å; P69-Y73 WeakPolarHBondContact O-CD1 3.13Å; P69-Y73 WeakPolarHBondContact O-CD2 3.47Å; P69-Y73 PolarHBondContact O-N 3.42Å; L70-Y73 PolarHBondContact O-N 2.94Å; I71-Y73 PolarHBondContact O-N 3.28Å; Y73-A77 WeakPolarHBondContact O-CB 3.36Å; Y73-A77 PolarHBondContact O-N 3.3Å; Y73-D199 VanDerWaalsContact CE1-OD1 3.31Å; Y73-D199 WeakPolarHBondContact CE1-OD1 3.21Å; Y73-D199 PolarHBondContact OH-OD1 2.92Å; Y73-L202 HydrophobicContact CD1-CD1 4.02Å; Y73-L202 HydrophobicContact CE1-CD1 3.8Å
74C95.7Very high93.2Very high75 Ų7551.9 Ų51.951%0.50730%0.302SS..Hα-helixtrans-59.8-47.5171.8-72.20000111.8L70 I71 L72 A77 A78L70-C74 WeakPolarHBondContact O-CB 3.34Å; L70-C74 PolarHBondContact O-N 3.37Å; L70-C74 PolarHBondContact O-SG 3.49Å; I71-C74 PolarHBondContact O-N 3.36Å; L72-C74 PolarHBondContact O-N 3.45Å; C74-A77 PolarHBondContact O-N 3.36Å; C74-A78 WeakPolarHBondContact O-CB 3.35Å; C74-A78 PolarHBondContact O-N 2.87Å
75V95.9Very high93.5Very high84 Ų8453.8 Ų53.851%0.50930%0.302SS..Hα-helixtrans-66.7-45.3-179.6170.80000111.4I71 L72 A77 A78 A79I71-V75 HydrophobicContact CG2-CG2 4.32Å; I71-V75 WeakPolarHBondContact O-CB 3.26Å; I71-V75 VanDerWaalsContact O-CG2 3.27Å; I71-V75 WeakPolarHBondContact O-CG2 3.34Å; I71-V75 PolarHBondContact O-N 2.95Å; L72-V75 PolarHBondContact O-N 3.49Å; V75-A77 VanDerWaalsContact C-N 3.27Å; V75-A77 PolarHBondContact O-N 3.45Å; V75-A78 PolarHBondContact O-N 2.88Å; V75-A79 WeakPolarHBondContact O-CB 3.39Å; V75-A79 PolarHBondContact O-N 3.23Å
76V96.5Very high93.6Very high12 Ų1257.9 Ų57.97%0.07332%0.322CS..Hα-helixtrans-59.7-37.9179.8164.30000111.4L72 P80 F130 L134 L202 S206L72-V76 HydrophobicContact CD1-CG2 3.97Å; L72-V76 HydrophobicContact CG-CG2 4.14Å; L72-V76 VanDerWaalsContact O-CB 3.27Å; L72-V76 WeakPolarHBondContact O-CB 3.4Å; L72-V76 WeakPolarHBondContact O-CG2 3.48Å; L72-V76 PolarHBondContact O-N 2.85Å; V76-P80 WeakPolarHBondContact O-CD 3.39Å; V76-P80 WeakPolarHBondContact O-CG 3.35Å; V76-F130 WeakPolarHBondContact O-CZ 2.91Å; V76-L134 HydrophobicContact CG1-CD2 3.75Å; V76-L202 HydrophobicContact CG1-CB 4.22Å; V76-L202 WeakPolarHBondContact CG1-O 3.45Å; V76-S206 PolarHBondContact O-OG 3.24Å
77A95.5Very high93.6Very high40 Ų4051 Ų5133%0.33130%0.297SS..Hα-helixtrans-81.9-45.1177.100000113.2Y73 C74 V75 T81 L134Y73-A77 WeakPolarHBondContact O-CB 3.36Å; Y73-A77 PolarHBondContact O-N 3.3Å; C74-A77 PolarHBondContact O-N 3.36Å; V75-A77 VanDerWaalsContact C-N 3.27Å; V75-A77 PolarHBondContact O-N 3.45Å; A77-T81 PolarHBondContact O-OG1 3.39Å; A77-L134 HydrophobicContact CB-CD1 4.14Å
78A95.9Very high93.5Very high48 Ų4849.7 Ų49.740%0.39729%0.288SS..Hα-helixtrans-76.3-40.4-172.700000113.1C74 V75 T81 V82C74-A78 WeakPolarHBondContact O-CB 3.35Å; C74-A78 PolarHBondContact O-N 2.87Å; V75-A78 PolarHBondContact O-N 2.88Å; A78-T81 VanDerWaalsContact CA-OG1 3.27Å; A78-T81 WeakPolarHBondContact CA-OG1 3.27Å; A78-T81 PolarHBondContact O-N 3.33Å; A78-T81 PolarHBondContact O-OG1 2.91Å; A78-V82 WeakPolarHBondContact O-CB 3.11Å; A78-V82 VanDerWaalsContact O-CG2 3.26Å; A78-V82 WeakPolarHBondContact O-CG2 3.44Å; A78-V82 PolarHBondContact O-N 2.92Å
79A94.5Very high93.3Very high38 Ų3850.8 Ų50.831%0.31430%0.295SS..Hα-helixtrans-62.4-47.8-174.200000112.3V75 I83V75-A79 WeakPolarHBondContact O-CB 3.39Å; V75-A79 PolarHBondContact O-N 3.23Å; A79-I83 WeakPolarHBondContact O-CB 3.41Å; A79-I83 WeakPolarHBondContact O-CD1 3.25Å; A79-I83 VanDerWaalsContact O-CG1 3.24Å; A79-I83 WeakPolarHBondContact O-CG1 3.3Å; A79-I83 PolarHBondContact O-N 3.47Å
80P94.8Very high93Very high0 Ų052.7 Ų52.70%031%0.308CS..Hα-helixtrans-67.5-38.6176.4-21.435.2000113V76 I83 I84 F130 S206 L210V76-P80 WeakPolarHBondContact O-CD 3.39Å; V76-P80 WeakPolarHBondContact O-CG 3.35Å; P80-I83 PolarHBondContact O-N 2.96Å; P80-I84 HydrophobicContact CB-CD1 4.47Å; P80-I84 VanDerWaalsContact O-CB 3.28Å; P80-I84 WeakPolarHBondContact O-CB 3.27Å; P80-I84 WeakPolarHBondContact O-CD1 3.37Å; P80-I84 WeakPolarHBondContact O-CG1 3.48Å; P80-I84 PolarHBondContact O-N 3.36Å; P80-F130 HydrophobicContact CB-CD1 4.45Å; P80-F130 HydrophobicContact CB-CD2 4.33Å; P80-F130 HydrophobicContact CB-CE1 3.95Å; P80-F130 HydrophobicContact CB-CE2 3.81Å; P80-F130 HydrophobicContact CB-CZ 3.61Å; P80-F130 HydrophobicContact CG-CE1 4.19Å; P80-F130 HydrophobicContact CG-CE2 3.82Å; P80-F130 HydrophobicContact CG-CZ 3.48Å; P80-F130 VanDerWaalsContact CG-CZ 3.48Å; P80-S206 WeakPolarHBondContact CG-OG 3.38Å; P80-L210 HydrophobicContact CB-CB 4.37Å; P80-L210 HydrophobicContact CB-CD1 4.39Å; P80-L210 HydrophobicContact CG-CB 4.41Å; P80-L210 HydrophobicContact CG-CD2 4.28Å
81T94.8Very high92.6Very high39 Ų3950.8 Ų50.824%0.23930%0.297CS..Hα-helixtrans-62.9-44.8178.634.40000111.8A77 A78 F85 I127 F130A77-T81 PolarHBondContact O-OG1 3.39Å; A78-T81 VanDerWaalsContact CA-OG1 3.27Å; A78-T81 WeakPolarHBondContact CA-OG1 3.27Å; A78-T81 PolarHBondContact O-N 3.33Å; A78-T81 PolarHBondContact O-OG1 2.91Å; T81-F85 VanDerWaalsContact O-CB 3.29Å; T81-F85 WeakPolarHBondContact O-CB 3.41Å; T81-F85 PolarHBondContact O-N 3.38Å; T81-I127 HydrophobicContact CG2-CD1 4.24Å; T81-I127 HydrophobicContact CG2-CG1 4.2Å; T81-I127 HydrophobicContact CG2-CG2 3.79Å; T81-F130 HydrophobicContact CG2-CD1 4.18Å; T81-F130 HydrophobicContact CG2-CE1 4.33Å
82V95Very high92Very high80 Ų8050.7 Ų50.749%0.48529%0.291SS..Hα-helixtrans-63.5-46.1176172.10000111.1A78 I84 F85 I86A78-V82 WeakPolarHBondContact O-CB 3.11Å; A78-V82 VanDerWaalsContact O-CG2 3.26Å; A78-V82 WeakPolarHBondContact O-CG2 3.44Å; A78-V82 PolarHBondContact O-N 2.92Å; V82-I84 PolarHBondContact O-N 2.91Å; V82-F85 PolarHBondContact O-N 2.74Å; V82-I86 HydrophobicContact CG1-CD1 3.63Å; V82-I86 HydrophobicContact CG1-CG1 4.36Å; V82-I86 WeakPolarHBondContact O-CB 3.26Å; V82-I86 VanDerWaalsContact O-CG1 3.29Å; V82-I86 WeakPolarHBondContact O-CG1 3.42Å; V82-I86 PolarHBondContact O-N 2.89Å
83I93.4Very high91.4Very high53 Ų5353.7 Ų53.727%0.27231%0.31SS..Hα-helixtrans-66.2-40.4-179.5-67.1164.4000111.6A79 P80 G87 L210 I214A79-I83 WeakPolarHBondContact O-CB 3.41Å; A79-I83 WeakPolarHBondContact O-CD1 3.25Å; A79-I83 VanDerWaalsContact O-CG1 3.24Å; A79-I83 WeakPolarHBondContact O-CG1 3.3Å; A79-I83 PolarHBondContact O-N 3.47Å; P80-I83 PolarHBondContact O-N 2.96Å; I83-G87 PolarHBondContact O-N 3.33Å; I83-L210 HydrophobicContact CB-CD1 3.84Å; I83-L210 HydrophobicContact CD1-CD1 3.96Å; I83-L210 HydrophobicContact CD1-CD2 3.59Å; I83-L210 HydrophobicContact CD1-CG 4.34Å; I83-L210 HydrophobicContact CG2-CD1 3.65Å; I83-I214 HydrophobicContact CG2-CG1 4.47Å
84I92.3Very high90.7Very high0 Ų054.9 Ų54.90%032%0.319CS..Hα-helixtrans-63.1-45.7175.1-69.4163.9000110.1P80 V82 G87 E88 F126 I127 Y209 Y213P80-I84 HydrophobicContact CB-CD1 4.47Å; P80-I84 VanDerWaalsContact O-CB 3.28Å; P80-I84 WeakPolarHBondContact O-CB 3.27Å; P80-I84 WeakPolarHBondContact O-CD1 3.37Å; P80-I84 WeakPolarHBondContact O-CG1 3.48Å; P80-I84 PolarHBondContact O-N 3.36Å; V82-I84 PolarHBondContact O-N 2.91Å; I84-G87 PolarHBondContact O-N 2.89Å; I84-E88 HydrophobicContact CG2-CG 4.41Å; I84-E88 WeakPolarHBondContact O-CG 3.15Å; I84-E88 PolarHBondContact O-N 3.26Å; I84-F126 HydrophobicContact CG2-CB 3.85Å; I84-F126 HydrophobicContact CG2-CD2 4.47Å; I84-I127 HydrophobicContact CG2-CG1 4.04Å; I84-Y209 HydrophobicContact CD1-CD1 4.45Å; I84-Y209 HydrophobicContact CD1-CE1 3.91Å; I84-Y213 HydrophobicContact CB-CE1 4.39Å; I84-Y213 HydrophobicContact CB-CE2 4.44Å; I84-Y213 HydrophobicContact CG1-CD1 3.9Å; I84-Y213 HydrophobicContact CG1-CD2 3.98Å; I84-Y213 HydrophobicContact CG1-CE1 4.03Å; I84-Y213 HydrophobicContact CG1-CE2 4.1Å; I84-Y213 HydrophobicContact CG1-CG 3.89Å; I84-Y213 HydrophobicContact CG2-CE2 4.09Å; I84-Y213 PolarHBondContact O-OH 2.76Å
85F92.1Very high89.9Confident112 Ų11257.2 Ų57.249%0.49132%0.321SS..Hα-helixtrans-60.3-51.8178.4-177.8-98.2000111.7T81 V82 G87 E88 V89 I123T81-F85 VanDerWaalsContact O-CB 3.29Å; T81-F85 WeakPolarHBondContact O-CB 3.41Å; T81-F85 PolarHBondContact O-N 3.38Å; V82-F85 PolarHBondContact O-N 2.74Å; F85-G87 VanDerWaalsContact C-N 3.31Å; F85-G87 PolarHBondContact O-N 2.83Å; F85-E88 PolarHBondContact O-N 3.45Å; F85-V89 HydrophobicContact CD1-CG2 4.28Å; F85-V89 HydrophobicContact CD2-CG2 4.5Å; F85-V89 HydrophobicContact CE1-CG2 3.96Å; F85-V89 HydrophobicContact CE2-CG2 4.19Å; F85-V89 HydrophobicContact CZ-CG2 3.91Å; F85-V89 WeakPolarHBondContact O-CB 3.48Å; F85-V89 VanDerWaalsContact O-CG2 3.26Å; F85-V89 WeakPolarHBondContact O-CG2 3.3Å; F85-V89 PolarHBondContact O-N 2.91Å; F85-I123 HydrophobicContact CD2-CD1 3.96Å; F85-I123 HydrophobicContact CD2-CG2 4.39Å; F85-I123 HydrophobicContact CE2-CD1 4.15Å
86I91.4Very high89Confident95 Ų9555.9 Ų55.949%0.48732%0.315SS..Hα-helixtrans-60.4-42.8177.5-66.9170000110.5V82 V89 S90V82-I86 HydrophobicContact CG1-CD1 3.63Å; V82-I86 HydrophobicContact CG1-CG1 4.36Å; V82-I86 WeakPolarHBondContact O-CB 3.26Å; V82-I86 VanDerWaalsContact O-CG1 3.29Å; V82-I86 WeakPolarHBondContact O-CG1 3.42Å; V82-I86 PolarHBondContact O-N 2.89Å; I86-V89 PolarHBondContact O-N 2.93Å; I86-S90 WeakPolarHBondContact O-CB 3.27Å; I86-S90 PolarHBondContact O-N 3Å; I86-S90 PolarHBondContact O-OG 2.88Å
87G88.5Confident88Confident18 Ų1859.3 Ų59.319%0.18634%0.336CS..Hα-helixtrans-61.1-46.8179.200000112.7I83 I84 F85 M91I83-G87 PolarHBondContact O-N 3.33Å; I84-G87 PolarHBondContact O-N 2.89Å; F85-G87 VanDerWaalsContact C-N 3.31Å; F85-G87 PolarHBondContact O-N 2.83Å; G87-M91 WeakPolarHBondContact O-CB 3.29Å; G87-M91 VanDerWaalsContact O-CG 3.23Å; G87-M91 WeakPolarHBondContact O-CG 3.48Å; G87-M91 PolarHBondContact O-N 2.84Å
88E87.9Confident86.9Confident6 Ų665.9 Ų65.93%0.02835%0.352CS..Hα-helixtrans-68.8-41.9178.1-68.9-51.3132.700112.6I84 F85 M91 Y92 R122 I123 F126 Y213I84-E88 HydrophobicContact CG2-CG 4.41Å; I84-E88 WeakPolarHBondContact O-CG 3.15Å; I84-E88 PolarHBondContact O-N 3.26Å; F85-E88 PolarHBondContact O-N 3.45Å; E88-M91 PolarHBondContact O-N 3.04Å; E88-Y92 WeakPolarHBondContact O-CB 3.29Å; E88-Y92 PolarHBondContact O-N 2.79Å; E88-R122 IonicContact OE1-CZ 2.86Å; E88-R122 IonicContact OE1-NE 2.98Å; E88-R122 IonicContact OE1-NH1 3.56Å; E88-R122 IonicContact OE1-NH2 3.38Å; E88-R122 WeakPolarHBondContact OE2-CD 3.15Å; E88-R122 WeakPolarHBondContact OE2-CG 3.22Å; E88-R122 IonicContact OE2-CZ 2.79Å; E88-R122 IonicContact OE2-NE 3.63Å; E88-R122 PolarHBondContact OE2-NE 3.34Å; E88-R122 IonicContact OE2-NH1 3.84Å; E88-R122 PolarHBondContact OE2-NH1 3.32Å; E88-I123 HydrophobicContact CB-CD1 4.09Å; E88-I123 HydrophobicContact CB-CG1 3.63Å; E88-I123 HydrophobicContact CG-CG1 3.88Å; E88-F126 HydrophobicContact CG-CD2 4.28Å; E88-F126 VanDerWaalsContact OE1-CE2 3.27Å; E88-F126 WeakPolarHBondContact OE1-CE2 3.22Å; E88-Y213 PolarHBondContact N-OH 2.72Å; E88-Y213 WeakPolarHBondContact OE1-CE2 3.31Å; E88-Y213 PolarHBondContact OE1-OH 3.01Å
89V87.7Confident85.8Confident47 Ų4768.5 Ų68.529%0.28536%0.356SS..Hα-helixtrans-62.6-46.2175.6172.10000110.5F85 I86 M91 Y92 V93 L119F85-V89 HydrophobicContact CD1-CG2 4.28Å; F85-V89 HydrophobicContact CD2-CG2 4.5Å; F85-V89 HydrophobicContact CE1-CG2 3.96Å; F85-V89 HydrophobicContact CE2-CG2 4.19Å; F85-V89 HydrophobicContact CZ-CG2 3.91Å; F85-V89 WeakPolarHBondContact O-CB 3.48Å; F85-V89 VanDerWaalsContact O-CG2 3.26Å; F85-V89 WeakPolarHBondContact O-CG2 3.3Å; F85-V89 PolarHBondContact O-N 2.91Å; I86-V89 PolarHBondContact O-N 2.93Å; V89-M91 PolarHBondContact O-N 3.46Å; V89-Y92 PolarHBondContact O-N 2.92Å; V89-V93 HydrophobicContact CG1-CG2 4.39Å; V89-V93 WeakPolarHBondContact O-CG2 3.42Å; V89-V93 PolarHBondContact O-N 3.45Å; V89-L119 HydrophobicContact CG2-CD1 4.29Å
90S85.3Confident84.5Confident55 Ų5569.6 Ų69.639%0.38537%0.366SS..Hα-helixtrans-61.1-45.3178.6-590000111.5I86 Y92 V93 M94I86-S90 WeakPolarHBondContact O-CB 3.27Å; I86-S90 PolarHBondContact O-N 3Å; I86-S90 PolarHBondContact O-OG 2.88Å; S90-Y92 VanDerWaalsContact C-N 3.34Å; S90-Y92 PolarHBondContact O-N 3.11Å; S90-V93 PolarHBondContact O-N 2.96Å; S90-M94 WeakPolarHBondContact O-CB 3.29Å; S90-M94 VanDerWaalsContact O-CG 3.27Å; S90-M94 WeakPolarHBondContact O-CG 3.5Å; S90-M94 PolarHBondContact O-N 3.13Å
91M81.9Confident82.9Confident77 Ų7775.8 Ų75.838%0.37940%0.398SS..Hα-helixtrans-64.1-38.6177.2-75.6-65.4-64.400112.3G87 E88 V89 K95G87-M91 WeakPolarHBondContact O-CB 3.29Å; G87-M91 VanDerWaalsContact O-CG 3.23Å; G87-M91 WeakPolarHBondContact O-CG 3.48Å; G87-M91 PolarHBondContact O-N 2.84Å; E88-M91 PolarHBondContact O-N 3.04Å; V89-M91 PolarHBondContact O-N 3.46Å; M91-K95 VanDerWaalsContact O-CB 3.27Å; M91-K95 WeakPolarHBondContact O-CB 3.45Å; M91-K95 PolarHBondContact O-N 3.23Å
92Y82.9Confident81.3Confident98 Ų9879.7 Ų79.738%0.38442%0.417SS..Hα-helixtrans-65.6-46.4175.2175.2-96.5000112E88 V89 S90 K95 S96 L119E88-Y92 WeakPolarHBondContact O-CB 3.29Å; E88-Y92 PolarHBondContact O-N 2.79Å; V89-Y92 PolarHBondContact O-N 2.92Å; S90-Y92 VanDerWaalsContact C-N 3.34Å; S90-Y92 PolarHBondContact O-N 3.11Å; Y92-K95 PolarHBondContact O-N 3.3Å; Y92-S96 VanDerWaalsContact O-CB 3.29Å; Y92-S96 WeakPolarHBondContact O-CB 3.11Å; Y92-S96 PolarHBondContact O-N 2.87Å; Y92-L119 HydrophobicContact CD1-CD1 3.79Å; Y92-L119 HydrophobicContact CD2-CB 3.96Å; Y92-L119 HydrophobicContact CD2-CD1 4.03Å; Y92-L119 HydrophobicContact CE2-CB 4.42Å; Y92-L119 HydrophobicContact CG-CB 4.27Å; Y92-L119 HydrophobicContact CG-CD1 3.44Å; Y92-L119 VanDerWaalsContact CG-CD1 3.44Å; Y92-L119 HydrophobicContact CG-CG 4.48Å
93V83.2Confident79.4Confident76 Ų7678.2 Ų78.246%0.46141%0.413SS..Hα-helixtrans-60.5-48.7175.9172.60000110.2V89 S90 K95 S96 T97V89-V93 HydrophobicContact CG1-CG2 4.39Å; V89-V93 WeakPolarHBondContact O-CG2 3.42Å; V89-V93 PolarHBondContact O-N 3.45Å; S90-V93 PolarHBondContact O-N 2.96Å; V93-K95 VanDerWaalsContact C-N 3.31Å; V93-K95 PolarHBondContact O-N 3.5Å; V93-S96 PolarHBondContact O-N 2.85Å; V93-T97 WeakPolarHBondContact O-CB 3.47Å; V93-T97 PolarHBondContact O-N 3.47Å; V93-T97 PolarHBondContact O-OG1 3.5Å
94M79.4Confident77.3Confident100 Ų10084 Ų8449%0.49344%0.439SS..Hα-helixtrans-59-41.3177-72.918071.400112.7S90 R98S90-M94 WeakPolarHBondContact O-CB 3.29Å; S90-M94 VanDerWaalsContact O-CG 3.27Å; S90-M94 WeakPolarHBondContact O-CG 3.5Å; S90-M94 PolarHBondContact O-N 3.13Å; M94-R98 WeakPolarHBondContact O-CB 3.2Å; M94-R98 VanDerWaalsContact O-CG 3.26Å; M94-R98 WeakPolarHBondContact O-CG 3.15Å; M94-R98 PolarHBondContact O-N 3.38Å
95K78.1Confident75.3Confident124 Ų12492.3 Ų92.354%0.53948%0.478SS..Hα-helixtrans-67-46.5177-177.6179.2169.3-174.70111M91 Y92 V93 T97 R98 E99M91-K95 VanDerWaalsContact O-CB 3.27Å; M91-K95 WeakPolarHBondContact O-CB 3.45Å; M91-K95 PolarHBondContact O-N 3.23Å; Y92-K95 PolarHBondContact O-N 3.3Å; V93-K95 VanDerWaalsContact C-N 3.31Å; V93-K95 PolarHBondContact O-N 3.5Å; K95-T97 VanDerWaalsContact C-N 3.32Å; K95-T97 PolarHBondContact O-N 3.29Å; K95-R98 WeakPolarHBondContact O-CB 3.34Å; K95-R98 PolarHBondContact O-N 2.5Å; K95-R98 VanDerWaalsContact O-N 3.16Å; K95-E99 WeakPolarHBondContact CE-OE1 3.46Å; K95-E99 HydrophobicContact CG-CG 4.43Å; K95-E99 IonicContact NZ-OE1 2.85Å; K95-E99 WeakPolarHBondContact O-CB 3.39Å; K95-E99 WeakPolarHBondContact O-CG 3.12Å; K95-E99 PolarHBondContact O-N 2.88Å
96S78.3Confident72.6Confident56 Ų5695.3 Ų95.339%0.39249%0.491SS..Hα-helixtrans-60.3-41.2177.3-1730000111.5Y92 V93 E99 A100Y92-S96 VanDerWaalsContact O-CB 3.29Å; Y92-S96 WeakPolarHBondContact O-CB 3.11Å; Y92-S96 PolarHBondContact O-N 2.87Å; V93-S96 PolarHBondContact O-N 2.85Å; S96-E99 PolarHBondContact O-N 2.57Å; S96-A100 VanDerWaalsContact O-CB 3.26Å; S96-A100 WeakPolarHBondContact O-CB 3.33Å; S96-A100 PolarHBondContact O-N 3.07Å
97T75.8Confident70Confident83 Ų8397.3 Ų97.351%0.50951%0.507SS..Hα-helixtrans-67.3-39.4175.5-550000111.4V93 K95 A100 L101V93-T97 WeakPolarHBondContact O-CB 3.47Å; V93-T97 PolarHBondContact O-N 3.47Å; V93-T97 PolarHBondContact O-OG1 3.5Å; K95-T97 VanDerWaalsContact C-N 3.32Å; K95-T97 PolarHBondContact O-N 3.29Å; T97-A100 PolarHBondContact O-N 3.5Å; T97-L101 VanDerWaalsContact O-CB 3.28Å; T97-L101 WeakPolarHBondContact O-CB 3.28Å; T97-L101 PolarHBondContact O-N 2.83Å
98R71.4Confident67.8Low179 Ų179103.6 Ų103.668%0.67554%0.535SS*.Hα-helixtrans-65.6-42.4174.8-76.8179.468.9151.95.6112.3M94 K95 L101 L102M94-R98 WeakPolarHBondContact O-CB 3.2Å; M94-R98 VanDerWaalsContact O-CG 3.26Å; M94-R98 WeakPolarHBondContact O-CG 3.15Å; M94-R98 PolarHBondContact O-N 3.38Å; K95-R98 WeakPolarHBondContact O-CB 3.34Å; K95-R98 PolarHBondContact O-N 2.5Å; K95-R98 VanDerWaalsContact O-N 3.16Å; R98-L101 PolarHBondContact O-N 3.47Å; R98-L102 WeakPolarHBondContact O-CB 3.27Å; R98-L102 WeakPolarHBondContact O-CD1 3.34Å; R98-L102 VanDerWaalsContact O-CG 3.27Å; R98-L102 WeakPolarHBondContact O-CG 3.23Å; R98-L102 PolarHBondContact O-N 2.94Å
99E72.9Confident66Low102 Ų102110 Ų11048%0.47757%0.574SS.*Hα-helixtrans-66.3-39.2175.5-74.7177.6171.500110.6K95 S96 L102 A103K95-E99 WeakPolarHBondContact CE-OE1 3.46Å; K95-E99 HydrophobicContact CG-CG 4.43Å; K95-E99 IonicContact NZ-OE1 2.85Å; K95-E99 WeakPolarHBondContact O-CB 3.39Å; K95-E99 WeakPolarHBondContact O-CG 3.12Å; K95-E99 PolarHBondContact O-N 2.88Å; S96-E99 PolarHBondContact O-N 2.57Å; E99-L102 CarbonylContact O-C 3.59Å; E99-L102 PolarHBondContact O-N 2.69Å; E99-A103 WeakPolarHBondContact O-CA 3.27Å; E99-A103 WeakPolarHBondContact O-CB 3.23Å; E99-A103 PolarHBondContact O-N 3.31Å
100A67.2Low63.6Low62 Ų62113.7 Ų113.751%0.51260%0.597SS.*Hα-helixtrans-64.4-40.4172.600000112.6S96 T97 L102 A103 Q104S96-A100 VanDerWaalsContact O-CB 3.26Å; S96-A100 WeakPolarHBondContact O-CB 3.33Å; S96-A100 PolarHBondContact O-N 3.07Å; T97-A100 PolarHBondContact O-N 3.5Å; A100-L102 VanDerWaalsContact C-N 3.32Å; A100-L102 PolarHBondContact O-N 2.9Å; A100-A103 PolarHBondContact O-N 2.91Å; A100-Q104 PolarHBondContact O-N 2.92Å
101L61Low61.9Low129 Ų129113.4 Ų113.468%0.67560%0.603SS**Hα-helixtrans-67.5-32.1176.6-161114.1000112.1T97 R98T97-L101 VanDerWaalsContact O-CB 3.28Å; T97-L101 WeakPolarHBondContact O-CB 3.28Å; T97-L101 PolarHBondContact O-N 2.83Å; R98-L101 PolarHBondContact O-N 3.47Å
102L60.8Low59.8Low121 Ų121117.4 Ų117.463%0.63463%0.626SS**Hα-helixtrans-82.4-32.1173.9-72165.6000112.6R98 E99 A100 Q104 E105R98-L102 WeakPolarHBondContact O-CB 3.27Å; R98-L102 WeakPolarHBondContact O-CD1 3.34Å; R98-L102 VanDerWaalsContact O-CG 3.27Å; R98-L102 WeakPolarHBondContact O-CG 3.23Å; R98-L102 PolarHBondContact O-N 2.94Å; E99-L102 CarbonylContact O-C 3.59Å; E99-L102 PolarHBondContact O-N 2.69Å; A100-L102 VanDerWaalsContact C-N 3.32Å; A100-L102 PolarHBondContact O-N 2.9Å; L102-Q104 PolarHBondContact O-N 2.91Å; L102-E105 PolarHBondContact O-N 3.4Å; L102-E105 VanDerWaalsContact O-N 3.15Å
103A56.4Low58.3Low50 Ų50118.6 Ų118.641%0.41365%0.647SS.*Hα-helixtrans-74.8-10.4178.500000112.9E99 A100 E105 K106E99-A103 WeakPolarHBondContact O-CA 3.27Å; E99-A103 WeakPolarHBondContact O-CB 3.23Å; E99-A103 PolarHBondContact O-N 3.31Å; A100-A103 PolarHBondContact O-N 2.91Å; A103-E105 PolarHBondContact O-N 3.37Å; A103-K106 CarbonylContact O-C 3.5Å; A103-K106 PolarHBondContact O-N 3.17Å
104Q49.3Very low56.4Low175 Ų175120.3 Ų120.382%0.81866%0.661SS**THydrogen-bonded Turntrans-58.2-11.8163.2-162.5177.4-2900112.1A100 L102A100-Q104 PolarHBondContact O-N 2.92Å; L102-Q104 PolarHBondContact O-N 2.91Å
105E49Very low55.2Low174 Ų174124.2 Ų124.281%0.81367%0.672SS**SBendtrans-104.7-19.8173.5-141.5178.1-171.200115.5L102 A103L102-E105 PolarHBondContact O-N 3.4Å; L102-E105 VanDerWaalsContact O-N 3.15Å; A103-E105 PolarHBondContact O-N 3.37Å
106K36.4Very low54Low175 Ų175121.9 Ų121.976%0.76167%0.665SS**  trans-150.2118.9172.6-68.3-170-178.8176.40112A103 I108A103-K106 CarbonylContact O-C 3.5Å; A103-K106 PolarHBondContact O-N 3.17Å; K106-I108 PolarHBondContact O-N 3.38Å
107T36.3Very low53.6Low136 Ų136123.1 Ų123.183%0.83467%0.667SS**  trans-73113.2172.640.20000111.1
108I42.7Very low53.5Low151 Ų151123.4 Ų123.477%0.77467%0.67SS**  trans-138.4111.6153.3-54.3180000109.4K106K106-I108 PolarHBondContact O-N 3.38Å
109V50.3Low53.8Low139 Ų139116.4 Ų116.484%0.84265%0.646SS**  trans-75.4131166.31730000107.9
110T36.2Very low54Low125 Ų125114.8 Ų114.877%0.76764%0.64SS**  trans-146.8105.2160.9-52.20000108.8
111G49.7Very low54.5Low49 Ų49116.9 Ų116.951%0.50564%0.635SS.*  trans-83.4155.4155.400000109.4
112D37.6Very low55.5Low162 Ų162113.5 Ų113.587%0.86661%0.613SS**  -177.5150.7129-86.7-21.8000112.5
113C52.4Low56.7Low122 Ų122108.6 Ų108.682%0.82459%0.587SS**THydrogen-bonded Turntrans-68.2150.2-166-1620000113.6
114C43.9Very low58Low113 Ų113110.1 Ų110.176%0.76459%0.587SS**THydrogen-bonded Turntrans77.619.3179.5-57.70000118.3
115Y52.4Low59.8Low182 Ų182107.3 Ų107.371%0.71457%0.569SS**  trans-93.5114.5158.9-119.8-102.8000108.9N117Y115-N117 PolarHBondContact O-N 3.28Å; Y115-N117 VanDerWaalsContact O-N 3.15Å
116L54.7Low61.7Low74 Ų7499.3 Ų99.339%0.38753%0.532SS..  trans-53.7127.1163.5-78.5175.3000107.4I17 I120I17-L116 HydrophobicContact CD1-CD1 4.24Å; L116-I120 HydrophobicContact CD2-CG2 4.37Å
117N69.8Low64.4Low82 Ų8293.2 Ų93.244%0.43951%0.507SS..  trans-48.5130.5177.2-101.8-15.4000108.3Y115 L119 I120 R121Y115-N117 PolarHBondContact O-N 3.28Å; Y115-N117 VanDerWaalsContact O-N 3.15Å; N117-L119 CarbonylContact O-C 3.55Å; N117-L119 PolarHBondContact O-N 2.95Å; N117-I120 HydrophobicContact CB-CB 4.49Å; N117-I120 HydrophobicContact CB-CD1 4.03Å; N117-I120 HydrophobicContact CB-CG1 4Å; N117-I120 PolarHBondContact O-N 2.95Å; N117-R121 PolarHBondContact O-N 3.09Å
118P72.8Confident67Low89 Ų8988 Ų8858%0.57848%0.481SS*.Hα-helixtrans-55.2-26-17819.6-31.4000112.3R122P118-R122 WeakPolarHBondContact O-CB 3.45Å; P118-R122 PolarHBondContact O-N 3.38Å
119L77.5Confident69.4Low32 Ų3281.7 Ų81.717%0.16845%0.449CS..Hα-helixtrans-58.9-52.7167.6173.1140.7000112.8V89 Y92 N117 R121 R122 I123V89-L119 HydrophobicContact CG2-CD1 4.29Å; Y92-L119 HydrophobicContact CD1-CD1 3.79Å; Y92-L119 HydrophobicContact CD2-CB 3.96Å; Y92-L119 HydrophobicContact CD2-CD1 4.03Å; Y92-L119 HydrophobicContact CE2-CB 4.42Å; Y92-L119 HydrophobicContact CG-CB 4.27Å; Y92-L119 HydrophobicContact CG-CD1 3.44Å; Y92-L119 VanDerWaalsContact CG-CD1 3.44Å; Y92-L119 HydrophobicContact CG-CG 4.48Å; N117-L119 CarbonylContact O-C 3.55Å; N117-L119 PolarHBondContact O-N 2.95Å; L119-R121 VanDerWaalsContact C-N 3.33Å; L119-R121 PolarHBondContact O-N 2.84Å; L119-R122 PolarHBondContact O-N 3.29Å; L119-R122 VanDerWaalsContact O-N 3.15Å; L119-I123 HydrophobicContact CD2-CD1 3.49Å; L119-I123 VanDerWaalsContact CD2-CD1 3.49Å; L119-I123 HydrophobicContact CG-CD1 3.75Å; L119-I123 WeakPolarHBondContact O-CG1 3.4Å; L119-I123 PolarHBondContact O-N 2.83Å
120I77.4Confident71.6Confident68 Ų6875.2 Ų75.235%0.34941%0.41SS..Hα-helixtrans-62.3-44.2-177.2-63176.4000110L116 N117 R122 I123 I124L116-I120 HydrophobicContact CD2-CG2 4.37Å; N117-I120 HydrophobicContact CB-CB 4.49Å; N117-I120 HydrophobicContact CB-CD1 4.03Å; N117-I120 HydrophobicContact CB-CG1 4Å; N117-I120 PolarHBondContact O-N 2.95Å; I120-R122 VanDerWaalsContact C-N 3.29Å; I120-R122 PolarHBondContact O-N 3.39Å; I120-I123 PolarHBondContact O-N 3.23Å; I120-I124 HydrophobicContact CG2-CD1 3.64Å; I120-I124 HydrophobicContact CG2-CG1 4.26Å; I120-I124 WeakPolarHBondContact O-CB 3.49Å; I120-I124 VanDerWaalsContact O-CG1 3.29Å; I120-I124 WeakPolarHBondContact O-CG1 3.34Å; I120-I124 PolarHBondContact O-N 3.38Å
121R78.2Confident74.4Confident106 Ų10670.4 Ų70.440%0.438%0.383SS..Hα-helixtrans-57.6-42.3176.4-175.3-171.6-62.3-116.42.4112.2N117 L119 R125N117-R121 PolarHBondContact O-N 3.09Å; L119-R121 VanDerWaalsContact C-N 3.33Å; L119-R121 PolarHBondContact O-N 2.84Å; R121-R125 WeakPolarHBondContact O-CB 3.33Å; R121-R125 PolarHBondContact O-N 2.89Å; R121-R125 VanDerWaalsContact O-N 3.09Å
122R80.9Confident76.6Confident59 Ų5971.2 Ų71.222%0.22337%0.372CS..Hα-helixtrans-72.3-40-178.6-170.9163.9-176.8-133.80.3112.1E88 P118 L119 I120 R125 F126 F278E88-R122 IonicContact OE1-CZ 2.86Å; E88-R122 IonicContact OE1-NE 2.98Å; E88-R122 IonicContact OE1-NH1 3.56Å; E88-R122 IonicContact OE1-NH2 3.38Å; E88-R122 WeakPolarHBondContact OE2-CD 3.15Å; E88-R122 WeakPolarHBondContact OE2-CG 3.22Å; E88-R122 IonicContact OE2-CZ 2.79Å; E88-R122 IonicContact OE2-NE 3.63Å; E88-R122 PolarHBondContact OE2-NE 3.34Å; E88-R122 IonicContact OE2-NH1 3.84Å; E88-R122 PolarHBondContact OE2-NH1 3.32Å; P118-R122 WeakPolarHBondContact O-CB 3.45Å; P118-R122 PolarHBondContact O-N 3.38Å; L119-R122 PolarHBondContact O-N 3.29Å; L119-R122 VanDerWaalsContact O-N 3.15Å; I120-R122 VanDerWaalsContact C-N 3.29Å; I120-R122 PolarHBondContact O-N 3.39Å; R122-R125 PolarHBondContact O-N 3.42Å; R122-F126 HydrophobicContact CG-CD2 3.79Å; R122-F126 HydrophobicContact CG-CE2 3.31Å; R122-F126 HydrophobicContact CG-CZ 4Å; R122-F126 VanDerWaalsContact NE-CE2 3.25Å; R122-F126 WeakPolarHBondContact O-CD2 3.42Å; R122-F126 PolarHBondContact O-N 2.77Å; R122-F278 PolarHBondContact NH2-O 3.34Å
123I85.9Confident79.4Confident18 Ų1863.5 Ų63.59%0.09233%0.331CS..Hα-helixtrans-61-50.9174.1-69.4171.7000110.3F85 E88 L119 I120 R125 F126 I127F85-I123 HydrophobicContact CD2-CD1 3.96Å; F85-I123 HydrophobicContact CD2-CG2 4.39Å; F85-I123 HydrophobicContact CE2-CD1 4.15Å; E88-I123 HydrophobicContact CB-CD1 4.09Å; E88-I123 HydrophobicContact CB-CG1 3.63Å; E88-I123 HydrophobicContact CG-CG1 3.88Å; L119-I123 HydrophobicContact CD2-CD1 3.49Å; L119-I123 VanDerWaalsContact CD2-CD1 3.49Å; L119-I123 HydrophobicContact CG-CD1 3.75Å; L119-I123 WeakPolarHBondContact O-CG1 3.4Å; L119-I123 PolarHBondContact O-N 2.83Å; I120-I123 PolarHBondContact O-N 3.23Å; I123-R125 VanDerWaalsContact C-N 3.28Å; I123-R125 PolarHBondContact O-N 3.47Å; I123-F126 PolarHBondContact O-N 3.45Å; I123-I127 HydrophobicContact CG2-CD1 3.56Å; I123-I127 HydrophobicContact CG2-CG1 4.24Å; I123-I127 WeakPolarHBondContact O-CB 3.4Å; I123-I127 WeakPolarHBondContact O-CG1 3.05Å; I123-I127 PolarHBondContact O-N 3.36Å
124I84.8Confident81.5Confident81 Ų8158.8 Ų58.842%0.41530%0.298SS..Hα-helixtrans-57.2-43.4178.4-69.3170.6000110.6I120 G128I120-I124 HydrophobicContact CG2-CD1 3.64Å; I120-I124 HydrophobicContact CG2-CG1 4.26Å; I120-I124 WeakPolarHBondContact O-CB 3.49Å; I120-I124 VanDerWaalsContact O-CG1 3.29Å; I120-I124 WeakPolarHBondContact O-CG1 3.34Å; I120-I124 PolarHBondContact O-N 3.38Å; I124-G128 VanDerWaalsContact O-CA 3.31Å; I124-G128 WeakPolarHBondContact O-CA 3.3Å; I124-G128 PolarHBondContact O-N 2.68Å
125R86.3Confident84.1Confident116 Ų11656.9 Ų56.944%0.43828%0.277SS..Hα-helixtrans-61.9-49.4178.4-175.8179.1177.2-172.1-3.8112.5R121 R122 I123 V129 V274 V275R121-R125 WeakPolarHBondContact O-CB 3.33Å; R121-R125 PolarHBondContact O-N 2.89Å; R121-R125 VanDerWaalsContact O-N 3.09Å; R122-R125 PolarHBondContact O-N 3.42Å; I123-R125 VanDerWaalsContact C-N 3.28Å; I123-R125 PolarHBondContact O-N 3.47Å; R125-V129 WeakPolarHBondContact O-CB 3.38Å; R125-V129 VanDerWaalsContact O-CG2 3.25Å; R125-V129 WeakPolarHBondContact O-CG2 3.38Å; R125-V129 PolarHBondContact O-N 2.95Å; R125-V129 VanDerWaalsContact O-N 3.08Å; R125-V274 PolarHBondContact NH2-O 3.13Å; R125-V275 PolarHBondContact NH2-O 3.23Å
126F89.9Confident86.2Confident7 Ų748.8 Ų48.83%0.03125%0.248CC..Hα-helixtrans-73.2-39.9-176.2-66.6-43000113.1I84 E88 R122 I123 F130 Y209 Y213 V275 F278I84-F126 HydrophobicContact CG2-CB 3.85Å; I84-F126 HydrophobicContact CG2-CD2 4.47Å; E88-F126 HydrophobicContact CG-CD2 4.28Å; E88-F126 VanDerWaalsContact OE1-CE2 3.27Å; E88-F126 WeakPolarHBondContact OE1-CE2 3.22Å; R122-F126 HydrophobicContact CG-CD2 3.79Å; R122-F126 HydrophobicContact CG-CE2 3.31Å; R122-F126 HydrophobicContact CG-CZ 4Å; R122-F126 VanDerWaalsContact NE-CE2 3.25Å; R122-F126 WeakPolarHBondContact O-CD2 3.42Å; R122-F126 PolarHBondContact O-N 2.77Å; I123-F126 PolarHBondContact O-N 3.45Å; F126-F130 VanDerWaalsContact O-CB 3.25Å; F126-F130 WeakPolarHBondContact O-CB 3.26Å; F126-F130 PolarHBondContact O-N 3.48Å; F126-F130 VanDerWaalsContact O-N 3.11Å; F126-Y209 PolarHBondContact O-OH 3Å; F126-Y213 HydrophobicContact CD2-CD2 4.47Å; F126-Y213 AromaticContact CD2-CE2 3.92Å; F126-Y213 HydrophobicContact CD2-CE2 3.92Å; F126-Y213 HydrophobicContact CE2-CE2 4.08Å; F126-Y213 HydrophobicContact CG-CE2 4.49Å; F126-V275 HydrophobicContact CD1-CG1 3.77Å; F126-V275 HydrophobicContact CE1-CG1 3.41Å; F126-V275 VanDerWaalsContact CE1-CG1 3.41Å; F126-F278 AromaticContact CD1-CD1 3.54Å; F126-F278 HydrophobicContact CD1-CD1 3.54Å; F126-F278 AromaticContact CD1-CE1 3.59Å; F126-F278 HydrophobicContact CD1-CE1 3.59Å; F126-F278 HydrophobicContact CE1-CB 4.45Å; F126-F278 AromaticContact CE1-CD1 3.28Å; F126-F278 HydrophobicContact CE1-CD1 3.28Å; F126-F278 AromaticContact CE1-CE1 3.85Å; F126-F278 HydrophobicContact CE1-CE1 3.85Å; F126-F278 HydrophobicContact CE1-CG 4.18Å; F126-F278 HydrophobicContact CG-CD1 4.33Å; F126-F278 HydrophobicContact CG-CE1 4.32Å; F126-F278 AromaticContact CZ-CD1 3.85Å; F126-F278 HydrophobicContact CZ-CD1 3.85Å
127I92.3Very high88.2Confident46 Ų4645.3 Ų45.324%0.23623%0.229CC..Hα-helixtrans-70.6-40.3176.2-67-177.2000110.4T81 I84 I123 F130 A131T81-I127 HydrophobicContact CG2-CD1 4.24Å; T81-I127 HydrophobicContact CG2-CG1 4.2Å; T81-I127 HydrophobicContact CG2-CG2 3.79Å; I84-I127 HydrophobicContact CG2-CG1 4.04Å; I123-I127 HydrophobicContact CG2-CD1 3.56Å; I123-I127 HydrophobicContact CG2-CG1 4.24Å; I123-I127 WeakPolarHBondContact O-CB 3.4Å; I123-I127 WeakPolarHBondContact O-CG1 3.05Å; I123-I127 PolarHBondContact O-N 3.36Å; I127-F130 WeakPolarHBondContact O-CB 3.35Å; I127-F130 PolarHBondContact O-N 3.31Å; I127-A131 WeakPolarHBondContact O-CB 3.48Å; I127-A131 PolarHBondContact O-N 3.34Å
128G91.6Very high89.5Confident28 Ų2842.3 Ų42.329%0.28921%0.213SC..Hα-helixtrans-62-48.1178.100000112.3I124 F130 A131 F132I124-G128 VanDerWaalsContact O-CA 3.31Å; I124-G128 WeakPolarHBondContact O-CA 3.3Å; I124-G128 PolarHBondContact O-N 2.68Å; G128-F130 VanDerWaalsContact C-N 3.32Å; G128-F130 PolarHBondContact O-N 2.93Å; G128-A131 PolarHBondContact O-N 3.48Å; G128-F132 WeakPolarHBondContact O-CB 3.26Å; G128-F132 PolarHBondContact O-N 2.9Å
129V92.9Very high90.6Very high17 Ų1739.4 Ų39.410%0.10319%0.193CC..Hα-helixtrans-66.1-35.9176.6176.60000112R125 G133 Y209 L270 V274 V275R125-V129 WeakPolarHBondContact O-CB 3.38Å; R125-V129 VanDerWaalsContact O-CG2 3.25Å; R125-V129 WeakPolarHBondContact O-CG2 3.38Å; R125-V129 PolarHBondContact O-N 2.95Å; R125-V129 VanDerWaalsContact O-N 3.08Å; V129-G133 PolarHBondContact O-N 3.01Å; V129-Y209 HydrophobicContact CG1-CE2 4.25Å; V129-L270 HydrophobicContact CG1-CB 4.01Å; V129-L270 HydrophobicContact CG1-CD1 4.5Å; V129-L270 HydrophobicContact CG1-CD2 4.47Å; V129-V274 HydrophobicContact CG1-CG1 4.4Å; V129-V274 HydrophobicContact CG2-CG1 4.2Å; V129-V275 HydrophobicContact CB-CG2 4.13Å; V129-V275 HydrophobicContact CG1-CG2 3.68Å; V129-V275 HydrophobicContact CG2-CG2 4.27Å
130F95.6Very high91.5Very high3 Ų343.9 Ų43.91%0.01321%0.211CC..Hα-helixtrans-63-49.6173.8173-109.5000112V76 P80 T81 F126 I127 G128 F132 G133 L134 Y205 Y209V76-F130 WeakPolarHBondContact O-CZ 2.91Å; P80-F130 HydrophobicContact CB-CD1 4.45Å; P80-F130 HydrophobicContact CB-CD2 4.33Å; P80-F130 HydrophobicContact CB-CE1 3.95Å; P80-F130 HydrophobicContact CB-CE2 3.81Å; P80-F130 HydrophobicContact CB-CZ 3.61Å; P80-F130 HydrophobicContact CG-CE1 4.19Å; P80-F130 HydrophobicContact CG-CE2 3.82Å; P80-F130 HydrophobicContact CG-CZ 3.48Å; P80-F130 VanDerWaalsContact CG-CZ 3.48Å; T81-F130 HydrophobicContact CG2-CD1 4.18Å; T81-F130 HydrophobicContact CG2-CE1 4.33Å; F126-F130 VanDerWaalsContact O-CB 3.25Å; F126-F130 WeakPolarHBondContact O-CB 3.26Å; F126-F130 PolarHBondContact O-N 3.48Å; F126-F130 VanDerWaalsContact O-N 3.11Å; I127-F130 WeakPolarHBondContact O-CB 3.35Å; I127-F130 PolarHBondContact O-N 3.31Å; G128-F130 VanDerWaalsContact C-N 3.32Å; G128-F130 PolarHBondContact O-N 2.93Å; F130-F132 VanDerWaalsContact C-N 3.35Å; F130-F132 PolarHBondContact O-N 3.47Å; F130-G133 PolarHBondContact O-N 2.95Å; F130-L134 HydrophobicContact CD1-CD1 4.17Å; F130-L134 HydrophobicContact CE1-CD1 3.4Å; F130-L134 VanDerWaalsContact CE1-CD1 3.4Å; F130-L134 HydrophobicContact CE1-CG 4.13Å; F130-L134 HydrophobicContact CE2-CD1 4.18Å; F130-L134 HydrophobicContact CE2-CD2 4.35Å; F130-L134 HydrophobicContact CE2-CG 4.05Å; F130-L134 HydrophobicContact CZ-CD1 3.4Å; F130-L134 HydrophobicContact CZ-CD2 4.13Å; F130-L134 HydrophobicContact CZ-CG 3.77Å; F130-L134 PolarHBondContact O-N 2.96Å; F130-Y205 WeakPolarHBondContact CA-OH 3.39Å; F130-Y205 AromaticContact CD2-CE1 3.79Å; F130-Y205 HydrophobicContact CD2-CE1 3.79Å; F130-Y205 HydrophobicContact CE2-CD1 4.33Å; F130-Y205 AromaticContact CE2-CE1 3.68Å; F130-Y205 HydrophobicContact CE2-CE1 3.68Å; F130-Y205 PolarHBondContact O-OH 3.37Å; F130-Y209 HydrophobicContact CB-CD1 4.13Å; F130-Y209 HydrophobicContact CB-CE1 3.61Å; F130-Y209 AromaticContact CD2-CD1 3.56Å; F130-Y209 HydrophobicContact CD2-CD1 3.56Å; F130-Y209 AromaticContact CD2-CE1 3.97Å; F130-Y209 HydrophobicContact CD2-CE1 3.97Å; F130-Y209 AromaticContact CD2-CG 3.92Å; F130-Y209 HydrophobicContact CD2-CG 3.92Å; F130-Y209 HydrophobicContact CE2-CD1 4.43Å; F130-Y209 HydrophobicContact CG-CD1 4.2Å; F130-Y209 HydrophobicContact CG-CE1 4.15Å
131A96Very high92.4Very high25 Ų2540.6 Ų40.621%0.20719%0.194CC..Hα-helixtrans-61.8-44.1178.400000111.2M24 I127 G128 G133 L134 F135M24-A131 HydrophobicContact CE-CB 3.78Å; I127-A131 WeakPolarHBondContact O-CB 3.48Å; I127-A131 PolarHBondContact O-N 3.34Å; G128-A131 PolarHBondContact O-N 3.48Å; A131-G133 VanDerWaalsContact C-N 3.31Å; A131-G133 PolarHBondContact O-N 2.7Å; A131-L134 WeakPolarHBondContact O-CB 3.41Å; A131-L134 PolarHBondContact O-N 3.24Å; A131-F135 WeakPolarHBondContact O-CD2 3.02Å; A131-F135 PolarHBondContact O-N 3.03Å; A131-F135 VanDerWaalsContact O-N 3.09Å
132F95.5Very high93.2Very high65 Ų6535.8 Ų35.829%0.28518%0.176SC..Hα-helixtrans-54.4-48.5174.4176.6-102.5000111.4I23 M24 T27 G128 F130 F135 A136 L270I23-F132 HydrophobicContact CG2-CD2 4.3Å; I23-F132 HydrophobicContact CG2-CE2 3.92Å; M24-F132 HydrophobicContact CE-CB 4.39Å; M24-F132 HydrophobicContact SD-CB 3.52Å; M24-F132 VanDerWaalsContact SD-CB 3.52Å; M24-F132 HydrophobicContact SD-CD2 3.96Å; M24-F132 HydrophobicContact SD-CG 4.23Å; T27-F132 HydrophobicContact CG2-CD2 4.03Å; T27-F132 HydrophobicContact CG2-CE2 3.67Å; G128-F132 WeakPolarHBondContact O-CB 3.26Å; G128-F132 PolarHBondContact O-N 2.9Å; F130-F132 VanDerWaalsContact C-N 3.35Å; F130-F132 PolarHBondContact O-N 3.47Å; F132-F135 PolarHBondContact O-N 3.02Å; F132-A136 VanDerWaalsContact O-CB 3.3Å; F132-A136 WeakPolarHBondContact O-CB 3.12Å; F132-A136 PolarHBondContact O-N 2.98Å; F132-L270 HydrophobicContact CD1-CD1 4.14Å; F132-L270 HydrophobicContact CD1-CD2 4.05Å; F132-L270 HydrophobicContact CE1-CD2 4.08Å
133G96.6Very high93.8Very high0 Ų034.7 Ų34.70%018%0.18CC..Hα-helixtrans-70-30.7-179.200000114.1V129 F130 A131 T137 Y205V129-G133 PolarHBondContact O-N 3.01Å; F130-G133 PolarHBondContact O-N 2.95Å; A131-G133 VanDerWaalsContact C-N 3.31Å; A131-G133 PolarHBondContact O-N 2.7Å; G133-T137 WeakPolarHBondContact O-CB 3.41Å; G133-T137 PolarHBondContact O-N 3.49Å; G133-T137 PolarHBondContact O-OG1 3.3Å; G133-Y205 VanDerWaalsContact C-CZ 3.43Å; G133-Y205 VanDerWaalsContact CA-OH 3.27Å; G133-Y205 WeakPolarHBondContact CA-OH 3.22Å
134L97.1Very high94.2Very high24 Ų2434.7 Ų34.713%0.12618%0.184CC..Hα-helixtrans-60.2-53.3170.1-81.1178.4000111V76 A77 F130 A131 A136 T137 D138 L202 Y205V76-L134 HydrophobicContact CG1-CD2 3.75Å; A77-L134 HydrophobicContact CB-CD1 4.14Å; F130-L134 HydrophobicContact CD1-CD1 4.17Å; F130-L134 HydrophobicContact CE1-CD1 3.4Å; F130-L134 VanDerWaalsContact CE1-CD1 3.4Å; F130-L134 HydrophobicContact CE1-CG 4.13Å; F130-L134 HydrophobicContact CE2-CD1 4.18Å; F130-L134 HydrophobicContact CE2-CD2 4.35Å; F130-L134 HydrophobicContact CE2-CG 4.05Å; F130-L134 HydrophobicContact CZ-CD1 3.4Å; F130-L134 HydrophobicContact CZ-CD2 4.13Å; F130-L134 HydrophobicContact CZ-CG 3.77Å; F130-L134 PolarHBondContact O-N 2.96Å; A131-L134 WeakPolarHBondContact O-CB 3.41Å; A131-L134 PolarHBondContact O-N 3.24Å; L134-A136 VanDerWaalsContact C-N 3.35Å; L134-A136 PolarHBondContact O-N 3.48Å; L134-T137 PolarHBondContact O-N 2.8Å; L134-D138 PolarHBondContact O-N 2.87Å; L134-L202 HydrophobicContact CD2-CD2 4.37Å; L134-Y205 HydrophobicContact CB-CE1 4.35Å; L134-Y205 HydrophobicContact CD2-CD1 3.51Å; L134-Y205 HydrophobicContact CD2-CE1 3.73Å; L134-Y205 HydrophobicContact CG-CD1 4.05Å; L134-Y205 HydrophobicContact CG-CE1 3.71Å
135F97Very high94.7Very high72 Ų7231.6 Ų31.632%0.31617%0.168SC..Hα-helixtrans-65.2-38.1179.1-71.2-65.9000112.3M24 V28 A31 A131 F132 T137 D138 I139M24-F135 HydrophobicContact CE-CD2 4.18Å; V28-F135 HydrophobicContact CG2-CD1 4.3Å; V28-F135 HydrophobicContact CG2-CD2 3.77Å; V28-F135 HydrophobicContact CG2-CE1 4.07Å; V28-F135 HydrophobicContact CG2-CE2 3.53Å; V28-F135 HydrophobicContact CG2-CG 4.18Å; V28-F135 HydrophobicContact CG2-CZ 3.69Å; A31-F135 HydrophobicContact CB-CD1 3.93Å; A131-F135 WeakPolarHBondContact O-CD2 3.02Å; A131-F135 PolarHBondContact O-N 3.03Å; A131-F135 VanDerWaalsContact O-N 3.09Å; F132-F135 PolarHBondContact O-N 3.02Å; F135-T137 VanDerWaalsContact C-N 3.34Å; F135-T137 PolarHBondContact O-N 3.34Å; F135-D138 WeakPolarHBondContact O-CB 3.46Å; F135-D138 PolarHBondContact O-N 3.38Å; F135-I139 WeakPolarHBondContact O-CD1 3.38Å; F135-I139 VanDerWaalsContact O-CG1 3.23Å; F135-I139 WeakPolarHBondContact O-CG1 3.37Å; F135-I139 PolarHBondContact O-N 3.31Å
136A96.8Very high95Very high13 Ų1327 Ų2711%0.10715%0.153CC..Hα-helixtrans-61.1-44.7174.300000111.3F132 L134 D138 I139 F140F132-A136 VanDerWaalsContact O-CB 3.3Å; F132-A136 WeakPolarHBondContact O-CB 3.12Å; F132-A136 PolarHBondContact O-N 2.98Å; L134-A136 VanDerWaalsContact C-N 3.35Å; L134-A136 PolarHBondContact O-N 3.48Å; A136-D138 VanDerWaalsContact C-N 3.34Å; A136-D138 PolarHBondContact O-N 2.95Å; A136-I139 PolarHBondContact O-N 3.01Å; A136-F140 WeakPolarHBondContact O-CD2 3.42Å; A136-F140 PolarHBondContact O-N 3.3Å
137T97.8Very high95.2Very high0 Ų031.9 Ų31.90%018%0.183CC..Hα-helixtrans-60.7-44.9177-56.60000111G133 L134 F135 F140 V141 L202 I266G133-T137 WeakPolarHBondContact O-CB 3.41Å; G133-T137 PolarHBondContact O-N 3.49Å; G133-T137 PolarHBondContact O-OG1 3.3Å; L134-T137 PolarHBondContact O-N 2.8Å; F135-T137 VanDerWaalsContact C-N 3.34Å; F135-T137 PolarHBondContact O-N 3.34Å; T137-F140 PolarHBondContact O-N 2.91Å; T137-V141 VanDerWaalsContact O-CG2 3.3Å; T137-V141 WeakPolarHBondContact O-CG2 3.3Å; T137-V141 PolarHBondContact O-N 3.11Å; T137-L202 HydrophobicContact CG2-CD2 3.94Å; T137-I266 HydrophobicContact CG2-CD1 4.29Å; T137-I266 WeakPolarHBondContact OG1-CD1 3.24Å
138D96.2Very high95.2Very high20 Ų2032 Ų3211%0.10719%0.186CC..Hα-helixtrans-57.3-48.9175.1-175.366.8000112.1L134 F135 A136 F140 V141 N142 K198 L202L134-D138 PolarHBondContact O-N 2.87Å; F135-D138 WeakPolarHBondContact O-CB 3.46Å; F135-D138 PolarHBondContact O-N 3.38Å; A136-D138 VanDerWaalsContact C-N 3.34Å; A136-D138 PolarHBondContact O-N 2.95Å; D138-F140 PolarHBondContact O-N 3.48Å; D138-V141 PolarHBondContact O-N 2.91Å; D138-N142 WeakPolarHBondContact O-CB 3.45Å; D138-N142 PolarHBondContact O-N 3.49Å; D138-N142 PolarHBondContact OD2-ND2 3.34Å; D138-K198 WeakPolarHBondContact OD1-CE 3.18Å; D138-K198 IonicContact OD1-NZ 3.85Å; D138-K198 PolarHBondContact OD1-NZ 3.38Å; D138-L202 HydrophobicContact CB-CD2 4.36Å
139I95.8Very high95.3Very high28 Ų2830.7 Ų30.714%0.14417%0.172CC..Hα-helixtrans-59.9-46.9177.6-68.4160.5000111.5L30 A31 F135 A136 V141 N142 A143L30-I139 HydrophobicContact CB-CD1 4.27Å; L30-I139 HydrophobicContact CD2-CD1 4.06Å; L30-I139 HydrophobicContact CD2-CG2 4.27Å; L30-I139 HydrophobicContact CG-CD1 4.15Å; L30-I139 HydrophobicContact CG-CG1 4.4Å; A31-I139 HydrophobicContact CB-CD1 4.32Å; A31-I139 HydrophobicContact CB-CG1 3.97Å; F135-I139 WeakPolarHBondContact O-CD1 3.38Å; F135-I139 VanDerWaalsContact O-CG1 3.23Å; F135-I139 WeakPolarHBondContact O-CG1 3.37Å; F135-I139 PolarHBondContact O-N 3.31Å; A136-I139 PolarHBondContact O-N 3.01Å; I139-V141 VanDerWaalsContact C-N 3.34Å; I139-V141 PolarHBondContact O-N 2.72Å; I139-N142 PolarHBondContact O-N 3.08Å; I139-A143 VanDerWaalsContact O-CB 3.27Å; I139-A143 WeakPolarHBondContact O-CB 3.37Å; I139-A143 PolarHBondContact O-N 3.22Å
140F96.7Very high95.3Very high125 Ų12530.2 Ų30.255%0.54817%0.171SC..Hα-helixtrans-63.9-39.9-179.6-84.1-68000112.3A136 T137 D138 G144 L262 I266A136-F140 WeakPolarHBondContact O-CD2 3.42Å; A136-F140 PolarHBondContact O-N 3.3Å; T137-F140 PolarHBondContact O-N 2.91Å; D138-F140 PolarHBondContact O-N 3.48Å; F140-G144 PolarHBondContact O-N 3.46Å; F140-L262 HydrophobicContact CB-CD1 4.29Å; F140-L262 HydrophobicContact CB-CD2 4.16Å; F140-I266 HydrophobicContact CD2-CD1 3.87Å
141V96.5Very high95.3Very high0 Ų030.8 Ų30.80%017%0.174CC..Hα-helixtrans-64.7-52.4175.2169.20000110.5T137 D138 I139 A143 G144 Q145 P196 K198 S201 L262T137-V141 VanDerWaalsContact O-CG2 3.3Å; T137-V141 WeakPolarHBondContact O-CG2 3.3Å; T137-V141 PolarHBondContact O-N 3.11Å; D138-V141 PolarHBondContact O-N 2.91Å; I139-V141 VanDerWaalsContact C-N 3.34Å; I139-V141 PolarHBondContact O-N 2.72Å; V141-A143 VanDerWaalsContact C-N 3.28Å; V141-A143 PolarHBondContact O-N 3.36Å; V141-G144 CarbonylContact O-C 3.54Å; V141-G144 WeakPolarHBondContact O-CA 3.43Å; V141-G144 PolarHBondContact O-N 2.9Å; V141-Q145 HydrophobicContact CG1-CG 4.24Å; V141-Q145 WeakPolarHBondContact O-CG 3.38Å; V141-Q145 PolarHBondContact O-N 3.49Å; V141-P196 HydrophobicContact CB-CG 4.45Å; V141-P196 HydrophobicContact CG1-CG 4.28Å; V141-P196 HydrophobicContact CG2-CG 4.29Å; V141-K198 HydrophobicContact CG1-CB 3.66Å; V141-K198 HydrophobicContact CG1-CG 4.1Å; V141-S201 WeakPolarHBondContact CG2-OG 3.48Å; V141-L262 HydrophobicContact CG2-CD2 3.69Å
142N94.6Very high95.3Very high5 Ų529.7 Ų29.73%0.02717%0.165CC..Hα-helixtrans-59-42-178.4-80.9-21.5000111.2M34 E35 D138 I139 G144 Q145 V146M34-N142 HydrophobicContact CB-CB 4.2Å; M34-N142 HydrophobicContact CE-CB 3.96Å; E35-N142 PolarHBondContact OE2-ND2 2.9Å; E35-N142 PolarHBondContact OE2-OD1 3.44Å; D138-N142 WeakPolarHBondContact O-CB 3.45Å; D138-N142 PolarHBondContact O-N 3.49Å; D138-N142 PolarHBondContact OD2-ND2 3.34Å; I139-N142 PolarHBondContact O-N 3.08Å; N142-G144 PolarHBondContact O-N 2.83Å; N142-Q145 PolarHBondContact O-N 3.04Å; N142-V146 WeakPolarHBondContact O-CG2 3.46Å; N142-V146 PolarHBondContact O-N 3.02Å
143A93.9Very high95.4Very high36 Ų3626.9 Ų26.930%0.29815%0.153SC..Hα-helixtrans-60.7-44.3172.500000111.7M34 I139 V141 Q145 V146 V147M34-A143 HydrophobicContact CE-CB 4.04Å; I139-A143 VanDerWaalsContact O-CB 3.27Å; I139-A143 WeakPolarHBondContact O-CB 3.37Å; I139-A143 PolarHBondContact O-N 3.22Å; V141-A143 VanDerWaalsContact C-N 3.28Å; V141-A143 PolarHBondContact O-N 3.36Å; A143-Q145 PolarHBondContact O-N 2.78Å; A143-V146 PolarHBondContact O-N 3.45Å; A143-V147 VanDerWaalsContact O-CB 3.29Å; A143-V147 WeakPolarHBondContact O-CB 3.13Å; A143-V147 WeakPolarHBondContact O-CG2 3.38Å; A143-V147 PolarHBondContact O-N 3.46Å
144G94.8Very high95.3Very high17 Ų1727.4 Ų27.418%0.17516%0.155CC..Hα-helixtrans-59.8-43.9175.500000113.1F140 V141 N142 V147 T148 F195F140-G144 PolarHBondContact O-N 3.46Å; V141-G144 CarbonylContact O-C 3.54Å; V141-G144 WeakPolarHBondContact O-CA 3.43Å; V141-G144 PolarHBondContact O-N 2.9Å; N142-G144 PolarHBondContact O-N 2.83Å; G144-V147 PolarHBondContact O-N 3.05Å; G144-T148 WeakPolarHBondContact O-CB 3.24Å; G144-T148 WeakPolarHBondContact O-CG2 3.4Å; G144-T148 PolarHBondContact O-N 2.7Å; G144-T148 PolarHBondContact O-OG1 2.87Å; G144-F195 CarbonylContact C-O 3.03Å
145Q94.9Very high95.2Very high17 Ų1726.3 Ų26.38%0.07915%0.149CC..Hα-helixtrans-62.8-45.6178.9-71.8178.9-11.400112.1V141 N142 A143 G149 R193 F195 P196V141-Q145 HydrophobicContact CG1-CG 4.24Å; V141-Q145 WeakPolarHBondContact O-CG 3.38Å; V141-Q145 PolarHBondContact O-N 3.49Å; N142-Q145 PolarHBondContact O-N 3.04Å; A143-Q145 PolarHBondContact O-N 2.78Å; Q145-G149 WeakPolarHBondContact O-CA 3.18Å; Q145-G149 PolarHBondContact O-N 3.49Å; Q145-R193 HydrophobicContact CB-CB 4.04Å; Q145-R193 HydrophobicContact CB-CG 4.39Å; Q145-R193 HydrophobicContact CG-CB 4.3Å; Q145-R193 WeakPolarHBondContact CG-O 3.14Å; Q145-R193 PolarHBondContact NE2-O 3.35Å; Q145-F195 WeakPolarHBondContact CA-O 3.41Å; Q145-F195 WeakPolarHBondContact CG-O 3.41Å; Q145-F195 PolarHBondContact N-O 2.78Å; Q145-P196 PolarHBondContact NE2-O 2.85Å; Q145-P196 VanDerWaalsContact NE2-O 3.1Å
146V93.3Very high95.1Very high20 Ų2023 Ų2312%0.12114%0.135CC..Hα-helixtrans-68.9-42.2179.2173.90000111.6F40 G41 H43 N142 A143F40-V146 HydrophobicContact CB-CG1 3.67Å; G41-V146 WeakPolarHBondContact O-CG1 3.46Å; H43-V146 WeakPolarHBondContact CB-O 3.27Å; H43-V146 PolarHBondContact N-O 3.19Å; N142-V146 WeakPolarHBondContact O-CG2 3.46Å; N142-V146 PolarHBondContact O-N 3.02Å; A143-V146 PolarHBondContact O-N 3.45Å
147V93.1Very high94.9Very high108 Ų10824.3 Ų24.366%0.65514%0.143SC*.Hα-helixtrans-70.9-41.2-177.8169.70000112H43 A143 G144H43-V147 WeakPolarHBondContact CB-O 3.46Å; A143-V147 VanDerWaalsContact O-CB 3.29Å; A143-V147 WeakPolarHBondContact O-CB 3.13Å; A143-V147 WeakPolarHBondContact O-CG2 3.38Å; A143-V147 PolarHBondContact O-N 3.46Å; G144-V147 PolarHBondContact O-N 3.05Å
148T93.2Very high94.8Very high49 Ų4924.9 Ų24.930%0.30115%0.147SC..Hα-helixtrans-84.4-35.2-176.7620000112.7G144 G150 F195G144-T148 WeakPolarHBondContact O-CB 3.24Å; G144-T148 WeakPolarHBondContact O-CG2 3.4Å; G144-T148 PolarHBondContact O-N 2.7Å; G144-T148 PolarHBondContact O-OG1 2.87Å; T148-G150 PolarHBondContact O-N 3.34Å; T148-F195 HydrophobicContact CG2-CD1 3.82Å; T148-F195 HydrophobicContact CG2-CE1 4.16Å; T148-F195 PolarHBondContact OG1-O 3.34Å; T148-F195 VanDerWaalsContact OG1-O 3.08Å
149G92.6Very high94.6Very high0 Ų024 Ų240%014%0.142CC..  trans63.928.3-176.800000113.7H43 Q145 L151 R192H43-G149 VanDerWaalsContact O-CA 3.27Å; H43-G149 WeakPolarHBondContact O-CA 3.47Å; Q145-G149 WeakPolarHBondContact O-CA 3.18Å; Q145-G149 PolarHBondContact O-N 3.49Å; G149-L151 PolarHBondContact O-N 2.89Å; G149-R192 CarbonylContact C-O 3.46Å; G149-R192 WeakPolarHBondContact CA-O 3.4Å
150G94.1Very high94.4Very high8 Ų828.8 Ų28.88%0.08216%0.162CC..PPolyproline II helixtrans-57.9127-173.200000112.8T148 R192 S194T148-G150 PolarHBondContact O-N 3.34Å; G150-R192 PolarHBondContact N-O 3.44Å; G150-R192 CarbonylContact O-C 3.41Å; G150-R192 WeakPolarHBondContact O-CA 3.39Å; G150-S194 VanDerWaalsContact O-CB 3.25Å; G150-S194 WeakPolarHBondContact O-CB 3.35Å; G150-S194 PolarHBondContact O-N 3.2Å
151L95.3Very high94.1Very high14 Ų1423.1 Ų23.17%0.07314%0.138CC..PPolyproline II helixtrans-77.6135-178.5-53.1178000111F47 L54 G149 F155 R192 H252F47-L151 HydrophobicContact CB-CD1 3.59Å; F47-L151 HydrophobicContact CD1-CD1 4.17Å; F47-L151 HydrophobicContact CG-CD1 4.21Å; L54-L151 HydrophobicContact CD1-CB 4.4Å; L54-L151 HydrophobicContact CD1-CD1 3.83Å; L54-L151 HydrophobicContact CD2-CB 3.87Å; G149-L151 PolarHBondContact O-N 2.89Å; L151-F155 HydrophobicContact CB-CB 4.24Å; L151-F155 HydrophobicContact CB-CG 4.25Å; L151-F155 HydrophobicContact CD1-CD1 4.13Å; L151-F155 HydrophobicContact CD1-CE1 4.28Å; L151-F155 HydrophobicContact CD2-CD1 4.24Å; L151-F155 HydrophobicContact CD2-CD2 3.89Å; L151-F155 HydrophobicContact CD2-CE1 4.27Å; L151-F155 HydrophobicContact CD2-CE2 3.92Å; L151-F155 HydrophobicContact CD2-CG 4.06Å; L151-F155 HydrophobicContact CD2-CZ 4.13Å; L151-R192 HydrophobicContact CD2-CB 4.45Å; L151-R192 HydrophobicContact CD2-CG 3.82Å; L151-H252 PolarHBondContact O-CD2 2.83Å; L151-H252 PolarHBondContact O-NE2 2.98Å
152S95.7Very high93.6Very high2 Ų227.4 Ų27.41%0.01416%0.161CC..PPolyproline II helixtrans-76.8155.3173.857.80000111.5L54 Y154 F155 A191 R250L54-S152 WeakPolarHBondContact CD2-O 3.29Å; S152-Y154 PolarHBondContact O-N 3Å; S152-Y154 WeakPolarHBondContact OG-CE1 3.33Å; S152-F155 WeakPolarHBondContact O-CB 3.34Å; S152-F155 PolarHBondContact O-N 3.1Å; S152-A191 WeakPolarHBondContact CB-O 2.99Å; S152-A191 PolarHBondContact N-O 3.29Å; S152-A191 WeakPolarHBondContact OG-CA 3.49Å; S152-A191 WeakPolarHBondContact OG-CB 3.27Å; S152-A191 PolarHBondContact OG-O 2.95Å; S152-R250 WeakPolarHBondContact CB-O 3.27Å
153P96.8Very high93Very high7 Ų731.5 Ų31.55%0.04518%0.176CC..THydrogen-bonded Turntrans-58.2-20.4178.6-22.727.7000115.2E53 L54 M55 K56 Y249E53-P153 VanDerWaalsContact O-CA 3.3Å; E53-P153 WeakPolarHBondContact O-CA 3.33Å; E53-P153 VanDerWaalsContact O-O 3.12Å; L54-P153 CarbonylContact C-O 3.04Å; L54-P153 WeakPolarHBondContact CA-O 3.33Å; M55-P153 PolarHBondContact N-O 3.32Å; K56-P153 HydrophobicContact CB-CB 4.17Å; K56-P153 WeakPolarHBondContact CB-O 3.27Å; K56-P153 HydrophobicContact CG-CB 3.72Å; K56-P153 WeakPolarHBondContact CG-O 3.44Å; K56-P153 PolarHBondContact N-O 3.33Å; P153-Y249 WeakPolarHBondContact CB-O 3.49Å; P153-Y249 WeakPolarHBondContact CD-O 3.38Å; P153-Y249 VanDerWaalsContact CG-O 3.27Å; P153-Y249 WeakPolarHBondContact CG-O 3.33Å
154Y95.5Very high92.3Very high11 Ų1136 Ų364%0.04320%0.2CC..THydrogen-bonded Turntrans-96.43.5177.368-95.1000113.7L54 K56 Y58 P59 S152 L156 S157 V158 A191 Y249 R250L54-Y154 CarbonylContact O-C 2.89Å; K56-Y154 WeakPolarHBondContact O-CA 3.24Å; Y58-Y154 AromaticContact CD2-CD2 3.58Å; Y58-Y154 HydrophobicContact CD2-CD2 3.58Å; Y58-Y154 AromaticContact CD2-CE2 3.75Å; Y58-Y154 HydrophobicContact CD2-CE2 3.75Å; Y58-Y154 HydrophobicContact CD2-CG 4.29Å; Y58-Y154 HydrophobicContact CE2-CD2 4.19Å; Y58-Y154 AromaticContact CE2-CE2 3.86Å; Y58-Y154 HydrophobicContact CE2-CE2 3.86Å; P59-Y154 HydrophobicContact CG-CD1 4.11Å; P59-Y154 HydrophobicContact CG-CE1 4.33Å; S152-Y154 PolarHBondContact O-N 3Å; S152-Y154 WeakPolarHBondContact OG-CE1 3.33Å; Y154-L156 PolarHBondContact O-N 2.95Å; Y154-S157 WeakPolarHBondContact O-CB 3.29Å; Y154-S157 PolarHBondContact O-N 3.48Å; Y154-S157 VanDerWaalsContact O-N 3.07Å; Y154-S157 PolarHBondContact O-OG 3.41Å; Y154-V158 HydrophobicContact CD2-CG1 3.84Å; Y154-V158 HydrophobicContact CD2-CG2 4.01Å; Y154-V158 HydrophobicContact CE2-CG1 4.14Å; Y154-V158 HydrophobicContact CE2-CG2 4.12Å; Y154-V158 PolarHBondContact O-N 3Å; Y154-A191 HydrophobicContact CD2-CB 4.34Å; Y154-A191 HydrophobicContact CE2-CB 3.65Å; Y154-Y249 WeakPolarHBondContact CD1-O 3.21Å; Y154-R250 HydrophobicContact CE1-CG 4.4Å
155F95.7Very high91.3Very high0 Ų036.1 Ų36.10%020%0.201CC..Hα-helixtrans-53-46.4-170.5171-98.4000114.3F47 L54 L151 S152 S157 V158 C159 V188 A191 R192F47-F155 AromaticContact CD1-CE1 3.67Å; F47-F155 HydrophobicContact CD1-CE1 3.67Å; F47-F155 HydrophobicContact CD1-CZ 4.14Å; F47-F155 HydrophobicContact CD2-CE1 4.15Å; F47-F155 AromaticContact CE1-CE1 3.52Å; F47-F155 HydrophobicContact CE1-CE1 3.52Å; F47-F155 AromaticContact CE1-CZ 3.72Å; F47-F155 HydrophobicContact CE1-CZ 3.72Å; F47-F155 HydrophobicContact CE2-CE1 4.01Å; F47-F155 AromaticContact CG-CE1 3.96Å; F47-F155 HydrophobicContact CG-CE1 3.96Å; F47-F155 AromaticContact CZ-CE1 3.66Å; F47-F155 HydrophobicContact CZ-CE1 3.66Å; F47-F155 HydrophobicContact CZ-CZ 4.05Å; L54-F155 PolarHBondContact O-N 3Å; L151-F155 HydrophobicContact CB-CB 4.24Å; L151-F155 HydrophobicContact CB-CG 4.25Å; L151-F155 HydrophobicContact CD1-CD1 4.13Å; L151-F155 HydrophobicContact CD1-CE1 4.28Å; L151-F155 HydrophobicContact CD2-CD1 4.24Å; L151-F155 HydrophobicContact CD2-CD2 3.89Å; L151-F155 HydrophobicContact CD2-CE1 4.27Å; L151-F155 HydrophobicContact CD2-CE2 3.92Å; L151-F155 HydrophobicContact CD2-CG 4.06Å; L151-F155 HydrophobicContact CD2-CZ 4.13Å; S152-F155 WeakPolarHBondContact O-CB 3.34Å; S152-F155 PolarHBondContact O-N 3.1Å; F155-S157 VanDerWaalsContact C-N 3.29Å; F155-S157 PolarHBondContact O-N 3.43Å; F155-V158 WeakPolarHBondContact O-CG2 3.22Å; F155-V158 PolarHBondContact O-N 3.31Å; F155-C159 HydrophobicContact CE1-CB 4.06Å; F155-C159 HydrophobicContact CE2-CB 4.3Å; F155-C159 HydrophobicContact CZ-CB 3.94Å; F155-C159 VanDerWaalsContact O-CB 3.24Å; F155-C159 WeakPolarHBondContact O-CB 3.37Å; F155-C159 PolarHBondContact O-N 3.44Å; F155-V188 HydrophobicContact CE2-CG1 4.03Å; F155-A191 HydrophobicContact CB-CB 4.38Å; F155-A191 HydrophobicContact CD2-CB 3.88Å; F155-R192 HydrophobicContact CD2-CG 4.21Å; F155-R192 HydrophobicContact CE2-CG 3.81Å
156L93.9Very high90.3Very high4 Ų440.4 Ų40.42%0.02123%0.229CC..Hα-helixtrans-68-30.5-178-71.4174.2000112.3F47 D51 L54 M55 Y154 V158 K160 P161F47-L156 HydrophobicContact CD2-CD2 3.69Å; F47-L156 HydrophobicContact CE2-CD2 3.56Å; F47-L156 HydrophobicContact CZ-CD2 4.5Å; D51-L156 HydrophobicContact CB-CD1 4.19Å; L54-L156 HydrophobicContact CB-CB 4.49Å; L54-L156 HydrophobicContact CB-CD1 3.8Å; L54-L156 HydrophobicContact CB-CG 3.83Å; L54-L156 WeakPolarHBondContact O-CB 3.21Å; L54-L156 PolarHBondContact O-N 3.38Å; M55-L156 HydrophobicContact CG-CB 3.98Å; M55-L156 HydrophobicContact CG-CD1 3.64Å; M55-L156 HydrophobicContact CG-CG 4.46Å; Y154-L156 PolarHBondContact O-N 2.95Å; L156-V158 VanDerWaalsContact C-N 3.28Å; L156-V158 PolarHBondContact O-N 3.5Å; L156-K160 PolarHBondContact O-N 3.21Å; L156-K160 VanDerWaalsContact O-N 3.09Å; L156-P161 HydrophobicContact CD2-CG 4.3Å
157S93.4Very high89.3Confident39 Ų3944.6 Ų44.627%0.27325%0.247SC..Hα-helixtrans-65.3-32.1177.878.90000112.7K56 Y154 F155 K160K56-S157 WeakPolarHBondContact O-CB 3.17Å; K56-S157 PolarHBondContact O-OG 2.94Å; Y154-S157 WeakPolarHBondContact O-CB 3.29Å; Y154-S157 PolarHBondContact O-N 3.48Å; Y154-S157 VanDerWaalsContact O-N 3.07Å; Y154-S157 PolarHBondContact O-OG 3.41Å; F155-S157 VanDerWaalsContact C-N 3.29Å; F155-S157 PolarHBondContact O-N 3.43Å; S157-K160 WeakPolarHBondContact O-CG 3.42Å
158V94.8Very high88.6Confident13 Ų1339.7 Ų39.78%0.07922%0.217CC..Hα-helixtrans-93.5-34.1177.8-63.20000112.5Y58 Y154 F155 L156 K160 G183 V187 V188 A191Y58-V158 HydrophobicContact CD1-CG1 4.4Å; Y58-V158 HydrophobicContact CD2-CG1 3.37Å; Y58-V158 HydrophobicContact CE2-CG1 3.88Å; Y58-V158 HydrophobicContact CG-CG1 3.68Å; Y154-V158 HydrophobicContact CD2-CG1 3.84Å; Y154-V158 HydrophobicContact CD2-CG2 4.01Å; Y154-V158 HydrophobicContact CE2-CG1 4.14Å; Y154-V158 HydrophobicContact CE2-CG2 4.12Å; Y154-V158 PolarHBondContact O-N 3Å; F155-V158 WeakPolarHBondContact O-CG2 3.22Å; F155-V158 PolarHBondContact O-N 3.31Å; L156-V158 VanDerWaalsContact C-N 3.28Å; L156-V158 PolarHBondContact O-N 3.5Å; V158-K160 VanDerWaalsContact C-N 3.35Å; V158-K160 PolarHBondContact O-N 2.94Å; V158-G183 WeakPolarHBondContact O-CA 3.17Å; V158-V187 HydrophobicContact CB-CG1 4Å; V158-V187 HydrophobicContact CG1-CG1 3.75Å; V158-V187 HydrophobicContact CG2-CG1 4.41Å; V158-V188 HydrophobicContact CG2-CG2 4.45Å; V158-A191 HydrophobicContact CG2-CB 3.73Å
159C92.5Very high87.7Confident0 Ų045.7 Ų45.70%024%0.235CC..Hα-helixtrans-63.1-40.2177173.70000111.7F155 C181 T182 G183F155-C159 HydrophobicContact CE1-CB 4.06Å; F155-C159 HydrophobicContact CE2-CB 4.3Å; F155-C159 HydrophobicContact CZ-CB 3.94Å; F155-C159 VanDerWaalsContact O-CB 3.24Å; F155-C159 WeakPolarHBondContact O-CB 3.37Å; F155-C159 PolarHBondContact O-N 3.44Å; C159-C181 HydrophobicContact CB-CB 3.92Å; C159-C181 WeakPolarHBondContact CB-SG 3.46Å; C159-C181 CarbonylContact O-C 3.47Å; C159-C181 WeakPolarHBondContact O-CA 3.45Å; C159-C181 WeakPolarHBondContact O-CB 3.19Å; C159-C181 WeakPolarHBondContact SG-CA 3.4Å; C159-C181 WeakPolarHBondContact SG-CB 3.44Å; C159-C181 CovalentContact SG-SG 2.04Å; C159-C181 PolarHBondContact SG-SG 2.97Å; C159-T182 PolarHBondContact O-N 2.9Å; C159-G183 PolarHBondContact O-N 3Å; C159-G183 VanDerWaalsContact O-N 3.16Å
160K91.1Very high86.9Confident130 Ų13052.4 Ų52.457%0.56526%0.264SS*.  trans49.163.9-179-61.4-179.4179.1177.70112.1L156 S157 V158 T182L156-K160 PolarHBondContact O-N 3.21Å; L156-K160 VanDerWaalsContact O-N 3.09Å; S157-K160 WeakPolarHBondContact O-CG 3.42Å; V158-K160 VanDerWaalsContact C-N 3.35Å; V158-K160 PolarHBondContact O-N 2.94Å; K160-T182 PolarHBondContact O-OG1 3.21Å
161P89.9Confident85.7Confident6 Ų656.9 Ų56.94%0.03929%0.286CS..BIsolated β-bridgetrans-66.4151.9177.831.1-35.7000111L156 Y163 I180L156-P161 HydrophobicContact CD2-CG 4.3Å; P161-Y163 HydrophobicContact CG-CE1 3.99Å; P161-Y163 HydrophobicContact CG-CE2 3.89Å; P161-Y163 VanDerWaalsContact O-CD2 3.25Å; P161-Y163 WeakPolarHBondContact O-CD2 3.36Å; P161-Y163 PolarHBondContact O-N 3.46Å; P161-I180 HydrophobicContact CB-CD1 4.02Å
162N87.1Confident84.6Confident90 Ų9064.1 Ų64.148%0.48132%0.319SS..  trans-7893.2176.6-173.7-2.2000111.1T164 G165N162-T164 PolarHBondContact O-N 3.31Å; N162-T164 PolarHBondContact OD1-N 2.7Å; N162-T164 PolarHBondContact OD1-OG1 2.89Å; N162-G165 PolarHBondContact O-N 2.97Å; N162-G165 PolarHBondContact OD1-N 3Å
163Y82.2Confident83.8Confident91 Ų9166.7 Ų66.736%0.35733%0.331SS..THydrogen-bonded Turntrans-62.9-19.4177.4-64.4-74000114.7C49 N50 P161C49-Y163 HydrophobicContact CB-CE1 4.49Å; C49-Y163 WeakPolarHBondContact O-CE1 3.5Å; C49-Y163 PolarHBondContact O-OH 3.49Å; N50-Y163 WeakPolarHBondContact OD1-CE1 3.49Å; P161-Y163 HydrophobicContact CG-CE1 3.99Å; P161-Y163 HydrophobicContact CG-CE2 3.89Å; P161-Y163 VanDerWaalsContact O-CD2 3.25Å; P161-Y163 WeakPolarHBondContact O-CD2 3.36Å; P161-Y163 PolarHBondContact O-N 3.46Å
164T79.2Confident83.2Confident129 Ų12971.5 Ų71.579%0.79135%0.351SS*.THydrogen-bonded Turntrans-87.2-11.8175.765.50000112.9N162N162-T164 PolarHBondContact O-N 3.31Å; N162-T164 PolarHBondContact OD1-N 2.7Å; N162-T164 PolarHBondContact OD1-OG1 2.89Å
165G74.4Confident82.7Confident20 Ų2071.4 Ų71.421%0.20635%0.351CS..SBendtrans-76.5166.1177.600000113.1N162 E167 C168 R169N162-G165 PolarHBondContact O-N 2.97Å; N162-G165 PolarHBondContact OD1-N 3Å; G165-E167 PolarHBondContact O-N 3.09Å; G165-C168 PolarHBondContact O-N 3.46Å; G165-R169 PolarHBondContact O-N 3.26Å
166T72.5Confident82Confident107 Ų10775.7 Ų75.766%0.65638%0.378SS*.G310 helixtrans-65.2-27.1178.548.60000113.5
167E73.3Confident80.9Confident108 Ų10881 Ų8151%0.50541%0.406SS..G310 helixtrans-77.8-17.5-175.6-58.2-55.3125.200114G165 Q173 I180G165-E167 PolarHBondContact O-N 3.09Å; E167-Q173 PolarHBondContact O-NE2 3.42Å; E167-Q173 VanDerWaalsContact O-NE2 3.13Å; E167-Q173 PolarHBondContact O-OE1 3.04Å; E167-I180 HydrophobicContact CB-CG2 4.44Å
168C78.8Confident79.8Confident5 Ų580.1 Ų80.13%0.03440%0.403CS..G310 helixtrans-138.929-172.7-157.60000112.8C49 G165C49-C168 HydrophobicContact CB-CB 4.3Å; C49-C168 WeakPolarHBondContact CB-SG 3.31Å; C49-C168 WeakPolarHBondContact SG-CA 3.27Å; C49-C168 WeakPolarHBondContact SG-CB 3.45Å; C49-C168 CovalentContact SG-SG 2.01Å; C49-C168 PolarHBondContact SG-SG 2.85Å; G165-C168 PolarHBondContact O-N 3.46Å
169R73.4Confident78.8Confident175 Ų17587.1 Ų87.166%0.6644%0.44SS*.SBendtrans-78.4-27.9-174.2-169.8173.4177.3-178-0.4113G165G165-R169 PolarHBondContact O-N 3.26Å
170F76Confident78.5Confident142 Ų14288.5 Ų88.562%0.62345%0.447SS*.SBendtrans-113.4140.2-176.9-59.4-74.5000111.5H172 Q173F170-H172 PolarHBondContact O-N 2.89Å; F170-H172 VanDerWaalsContact O-N 3.07Å; F170-Q173 WeakPolarHBondContact O-CB 3.19Å; F170-Q173 PolarHBondContact O-N 3.23Å; F170-Q173 VanDerWaalsContact O-N 3.16Å
171N68.4Low78.4Confident102 Ų10283.8 Ų83.855%0.54543%0.43SS..THydrogen-bonded Turntrans-59.5-24.3-175.2-65.7-13.1000114.5N50N50-N171 HydrophobicContact CB-CB 4.48Å; N50-N171 PolarHBondContact ND2-OD1 3.26Å
172H71.4Confident78.4Confident166 Ų16688.5 Ų88.577%0.76946%0.459SS*.THydrogen-bonded Turntrans-108.815.4-176.5-58.6-63.7000113.6F170 F174F170-H172 PolarHBondContact O-N 2.89Å; F170-H172 VanDerWaalsContact O-N 3.07Å; H172-F174 PolarHBondContact O-N 2.86Å
173Q80.3Confident78.6Confident55 Ų5585.2 Ų85.226%0.25745%0.447SS..  trans-74.6121.2177.4-169.2163.1-3.100109.8C49 E167 F170C49-Q173 PolarHBondContact N-O 2.86Å; E167-Q173 PolarHBondContact O-NE2 3.42Å; E167-Q173 VanDerWaalsContact O-NE2 3.13Å; E167-Q173 PolarHBondContact O-OE1 3.04Å; F170-Q173 WeakPolarHBondContact O-CB 3.19Å; F170-Q173 PolarHBondContact O-N 3.23Å; F170-Q173 VanDerWaalsContact O-N 3.16Å
174F84.5Confident79.1Confident108 Ų10885.4 Ų85.447%0.47445%0.454SS..EExtended strand (participates in β ladder)trans-90.1124.3174.9-172.9-106.8000109.6G46 F48 H172 V176G46-F174 VanDerWaalsContact C-CE2 3.5Å; F48-F174 HydrophobicContact CD1-CB 4.07Å; F48-F174 HydrophobicContact CD1-CD2 4.07Å; F48-F174 HydrophobicContact CD2-CD2 4.09Å; F48-F174 HydrophobicContact CE1-CB 3.71Å; F48-F174 AromaticContact CE1-CD2 3.77Å; F48-F174 HydrophobicContact CE1-CD2 3.77Å; F48-F174 HydrophobicContact CE1-CG 4.18Å; F48-F174 AromaticContact CE2-CD2 3.77Å; F48-F174 HydrophobicContact CE2-CD2 3.77Å; F48-F174 HydrophobicContact CE2-CE2 4.2Å; F48-F174 HydrophobicContact CG-CD2 4.23Å; F48-F174 HydrophobicContact CZ-CB 4.29Å; F48-F174 AromaticContact CZ-CD2 3.61Å; F48-F174 HydrophobicContact CZ-CD2 3.61Å; F48-F174 HydrophobicContact CZ-CE2 4.36Å; F48-F174 HydrophobicContact CZ-CG 4.31Å; H172-F174 PolarHBondContact O-N 2.86Å; F174-V176 HydrophobicContact CD1-CG2 3.94Å; F174-V176 HydrophobicContact CE1-CG2 3.83Å
175I84.6Confident79.7Confident9 Ų984 Ų845%0.04645%0.447CS..EExtended strand (participates in β ladder)trans-107.5129.3-179.9-65.3134.8000109.2G46 F47 C49 N177 I180G46-I175 CarbonylContact C-O 3.29Å; G46-I175 WeakPolarHBondContact CA-O 3.35Å; F47-I175 HydrophobicContact CE2-CD1 4.3Å; F47-I175 PolarHBondContact N-O 2.9Å; F47-I175 PolarHBondContact O-N 2.74Å; C49-I175 WeakPolarHBondContact SG-CD1 3.27Å; I175-N177 WeakPolarHBondContact CG2-O 3.21Å; I175-I180 HydrophobicContact CB-CD1 4.14Å; I175-I180 HydrophobicContact CD1-CD1 3.44Å; I175-I180 VanDerWaalsContact CD1-CD1 3.44Å; I175-I180 HydrophobicContact CG1-CD1 4.06Å; I175-I180 HydrophobicContact CG2-CD1 3.71Å; I175-I180 HydrophobicContact CG2-CG1 4.21Å; I175-I180 HydrophobicContact CG2-CG2 4.25Å
176V80.1Confident80.5Confident91 Ų9187.4 Ų87.455%0.55246%0.463SS*.  trans-97.8-21.7177.3-170.40000111.5F174F174-V176 HydrophobicContact CD1-CG2 3.94Å; F174-V176 HydrophobicContact CE1-CG2 3.83Å
177N71.7Confident81.5Confident115 Ų11583.9 Ų83.962%0.61544%0.442SS*.  trans-97.6128.8-172.9-67.2-15.8000111.9I175 N179I175-N177 WeakPolarHBondContact CG2-O 3.21Å; N177-N179 PolarHBondContact O-N 3.2Å
178G68.8Low82.4Confident20 Ų2079.3 Ų79.321%0.20642%0.421CS..G310 helixtrans-73-8-178.300000115.6I180G178-I180 PolarHBondContact O-N 3.27Å; G178-I180 VanDerWaalsContact O-N 3.13Å
179N74.6Confident83Confident161 Ų16182 Ų8286%0.86143%0.433SS*.G310 helixtrans-77.75.4-170.9-64.3-3000114.6N177N177-N179 PolarHBondContact O-N 3.2Å
180I85.8Confident83.9Confident29 Ų2977.6 Ų77.615%0.14942%0.423CS..G310 helixtrans-88.2-13-179.761.3161.3000113.3F47 P161 E167 I175 G178F47-I180 HydrophobicContact CE1-CD1 4.21Å; F47-I180 HydrophobicContact CE2-CD1 3.59Å; F47-I180 HydrophobicContact CZ-CD1 3.23Å; F47-I180 HydrophobicContact CZ-CG1 3.8Å; P161-I180 HydrophobicContact CB-CD1 4.02Å; E167-I180 HydrophobicContact CB-CG2 4.44Å; I175-I180 HydrophobicContact CB-CD1 4.14Å; I175-I180 HydrophobicContact CD1-CD1 3.44Å; I175-I180 VanDerWaalsContact CD1-CD1 3.44Å; I175-I180 HydrophobicContact CG1-CD1 4.06Å; I175-I180 HydrophobicContact CG2-CD1 3.71Å; I175-I180 HydrophobicContact CG2-CG1 4.21Å; I175-I180 HydrophobicContact CG2-CG2 4.25Å; G178-I180 PolarHBondContact O-N 3.27Å; G178-I180 VanDerWaalsContact O-N 3.13Å
181C89.1Confident84.7Confident30 Ų3070.8 Ų70.820%0.20339%0.393CS..BIsolated β-bridgetrans-74.8131.9-179.9-600000110.6C159 V188C159-C181 HydrophobicContact CB-CB 3.92Å; C159-C181 WeakPolarHBondContact CB-SG 3.46Å; C159-C181 CarbonylContact O-C 3.47Å; C159-C181 WeakPolarHBondContact O-CA 3.45Å; C159-C181 WeakPolarHBondContact O-CB 3.19Å; C159-C181 WeakPolarHBondContact SG-CA 3.4Å; C159-C181 WeakPolarHBondContact SG-CB 3.44Å; C159-C181 CovalentContact SG-SG 2.04Å; C159-C181 PolarHBondContact SG-SG 2.97Å; C181-V188 HydrophobicContact CB-CG1 4.15Å; C181-V188 HydrophobicContact CB-CG2 4.33Å
182T90.7Very high86Confident105 Ų10566.7 Ų66.764%0.64437%0.37SS*.  trans-107.6-617765.60000113.2C159 K160C159-T182 PolarHBondContact O-N 2.9Å; K160-T182 PolarHBondContact O-OG1 3.21Å
183G91.5Very high87Confident22 Ų2260.9 Ų60.923%0.22734%0.341CS..SBendtrans-71.5-175.1176.400000114.4V158 C159V158-G183 WeakPolarHBondContact O-CA 3.17Å; C159-G183 PolarHBondContact O-N 3Å; C159-G183 VanDerWaalsContact O-N 3.16Å
184N93.1Very high87.7Confident94 Ų9458.4 Ų58.450%0.50333%0.33SS..  trans-65.4122.6178.7-177.8-40.2000110.1V186 V187 V188N184-V186 VanDerWaalsContact C-N 3.29Å; N184-V186 PolarHBondContact O-N 3.23Å; N184-V186 PolarHBondContact OD1-N 2.83Å; N184-V187 HydrophobicContact CB-CB 4.35Å; N184-V187 HydrophobicContact CB-CG2 4.07Å; N184-V187 PolarHBondContact O-N 3.46Å; N184-V188 WeakPolarHBondContact O-CG2 3.42Å; N184-V188 PolarHBondContact O-N 3.48Å
185P91.4Very high88.3Confident100 Ų10056.8 Ų56.865%0.64932%0.323SS*.Hα-helixtrans-60.1-36.5-173.323.7-34.1000113.1V188 E189P185-V188 PolarHBondContact O-N 3.41Å; P185-E189 WeakPolarHBondContact O-CB 3.48Å; P185-E189 PolarHBondContact O-N 2.75Å
186V90.6Very high88.9Confident91 Ų9156.9 Ų56.955%0.55232%0.324SS*.Hα-helixtrans-66.5-42.9-179.6-179.40000111.1N184 V188 E189 N190N184-V186 VanDerWaalsContact C-N 3.29Å; N184-V186 PolarHBondContact O-N 3.23Å; N184-V186 PolarHBondContact OD1-N 2.83Å; V186-V188 VanDerWaalsContact C-N 3.35Å; V186-E189 PolarHBondContact O-N 2.94Å; V186-N190 VanDerWaalsContact O-CG 3.3Å; V186-N190 PolarHBondContact O-N 3.22Å; V186-N190 PolarHBondContact O-ND2 3.39Å
187V93.4Very high89.7Confident33 Ų3352.5 Ų52.520%0.230%0.297CS..Hα-helixtrans-70-36.6179-176.10000110.7Y58 V158 N184 N190 A191Y58-V187 HydrophobicContact CE2-CG1 3.8Å; V158-V187 HydrophobicContact CB-CG1 4Å; V158-V187 HydrophobicContact CG1-CG1 3.75Å; V158-V187 HydrophobicContact CG2-CG1 4.41Å; N184-V187 HydrophobicContact CB-CB 4.35Å; N184-V187 HydrophobicContact CB-CG2 4.07Å; N184-V187 PolarHBondContact O-N 3.46Å; V187-N190 PolarHBondContact O-N 2.89Å; V187-A191 WeakPolarHBondContact O-CB 3.34Å; V187-A191 PolarHBondContact O-N 3.06Å
188V93.3Very high90.9Very high12 Ų1248 Ų487%0.07327%0.272CS..Hα-helixtrans-66.1-41.4175.9172.10000111.1F155 V158 C181 N184 P185 V186 A191 R192F155-V188 HydrophobicContact CE2-CG1 4.03Å; V158-V188 HydrophobicContact CG2-CG2 4.45Å; C181-V188 HydrophobicContact CB-CG1 4.15Å; C181-V188 HydrophobicContact CB-CG2 4.33Å; N184-V188 WeakPolarHBondContact O-CG2 3.42Å; N184-V188 PolarHBondContact O-N 3.48Å; P185-V188 PolarHBondContact O-N 3.41Å; V186-V188 VanDerWaalsContact C-N 3.35Å; V188-A191 WeakPolarHBondContact O-CB 3.25Å; V188-A191 PolarHBondContact O-N 3.47Å; V188-R192 WeakPolarHBondContact O-CG 3.27Å; V188-R192 PolarHBondContact O-N 3.5Å
189E91.3Very high92.2Very high61 Ų6147.3 Ų47.329%0.28526%0.264SS..Hα-helixtrans-64.2-44.7176.2-171.8178.5163.100111.7V42 P185 V186 A191 R192 R193V42-E189 HydrophobicContact CG2-CG 3.96Å; P185-E189 WeakPolarHBondContact O-CB 3.48Å; P185-E189 PolarHBondContact O-N 2.75Å; V186-E189 PolarHBondContact O-N 2.94Å; E189-A191 PolarHBondContact O-N 3.1Å; E189-R192 WeakPolarHBondContact O-CB 3.14Å; E189-R192 PolarHBondContact O-N 2.79Å; E189-R193 IonicContact OE1-CZ 3.98Å; E189-R193 IonicContact OE1-NE 2.67Å; E189-R193 IonicContact OE1-NH2 3.67Å; E189-R193 PolarHBondContact OE1-NH2 2.82Å
190N91.1Very high93.3Very high83 Ų8339.7 Ų39.744%0.44422%0.223SC..Hα-helixtrans-59.3-37.5174.6-71.8-16.8000111.9V186 V187 R192 R193V186-N190 VanDerWaalsContact O-CG 3.3Å; V186-N190 PolarHBondContact O-N 3.22Å; V186-N190 PolarHBondContact O-ND2 3.39Å; V187-N190 PolarHBondContact O-N 2.89Å; N190-R192 PolarHBondContact O-N 3.39Å; N190-R192 VanDerWaalsContact O-N 3.15Å; N190-R193 PolarHBondContact O-N 3.1Å; N190-R193 VanDerWaalsContact O-N 3.13Å
191A94.1Very high93.9Very high0 Ų038.3 Ų38.30%022%0.216CC..THydrogen-bonded Turntrans-67.4-9.7176.300000114S152 Y154 F155 V158 V187 V188 E189S152-A191 WeakPolarHBondContact CB-O 2.99Å; S152-A191 PolarHBondContact N-O 3.29Å; S152-A191 WeakPolarHBondContact OG-CA 3.49Å; S152-A191 WeakPolarHBondContact OG-CB 3.27Å; S152-A191 PolarHBondContact OG-O 2.95Å; Y154-A191 HydrophobicContact CD2-CB 4.34Å; Y154-A191 HydrophobicContact CE2-CB 3.65Å; F155-A191 HydrophobicContact CB-CB 4.38Å; F155-A191 HydrophobicContact CD2-CB 3.88Å; V158-A191 HydrophobicContact CG2-CB 3.73Å; V187-A191 WeakPolarHBondContact O-CB 3.34Å; V187-A191 PolarHBondContact O-N 3.06Å; V188-A191 WeakPolarHBondContact O-CB 3.25Å; V188-A191 PolarHBondContact O-N 3.47Å; E189-A191 PolarHBondContact O-N 3.1Å
192R94Very high94.3Very high15 Ų1537.4 Ų37.46%0.05721%0.209CC..THydrogen-bonded Turntrans-98.25.7174.4-64176173.9-802113.7V42 Q45 G149 G150 L151 F155 V188 E189 N190V42-R192 HydrophobicContact CG1-CB 3.85Å; Q45-R192 PolarHBondContact O-NH1 2.7Å; G149-R192 CarbonylContact C-O 3.46Å; G149-R192 WeakPolarHBondContact CA-O 3.4Å; G150-R192 PolarHBondContact N-O 3.44Å; G150-R192 CarbonylContact O-C 3.41Å; G150-R192 WeakPolarHBondContact O-CA 3.39Å; L151-R192 HydrophobicContact CD2-CB 4.45Å; L151-R192 HydrophobicContact CD2-CG 3.82Å; F155-R192 HydrophobicContact CD2-CG 4.21Å; F155-R192 HydrophobicContact CE2-CG 3.81Å; V188-R192 WeakPolarHBondContact O-CG 3.27Å; V188-R192 PolarHBondContact O-N 3.5Å; E189-R192 WeakPolarHBondContact O-CB 3.14Å; E189-R192 PolarHBondContact O-N 2.79Å; N190-R192 PolarHBondContact O-N 3.39Å; N190-R192 VanDerWaalsContact O-N 3.15Å
193R93.3Very high94.7Very high45 Ų4532.7 Ų32.717%0.1718%0.181CC..  trans-109.335.5-179.4-62.4-175-176.3-169.13.3111.9V42 Q145 E189 N190V42-R193 HydrophobicContact CG1-CG 4.48Å; V42-R193 HydrophobicContact CG2-CG 3.98Å; V42-R193 VanDerWaalsContact CG2-NE 3.3Å; Q145-R193 HydrophobicContact CB-CB 4.04Å; Q145-R193 HydrophobicContact CB-CG 4.39Å; Q145-R193 HydrophobicContact CG-CB 4.3Å; Q145-R193 WeakPolarHBondContact CG-O 3.14Å; Q145-R193 PolarHBondContact NE2-O 3.35Å; E189-R193 IonicContact OE1-CZ 3.98Å; E189-R193 IonicContact OE1-NE 2.67Å; E189-R193 IonicContact OE1-NH2 3.67Å; E189-R193 PolarHBondContact OE1-NH2 2.82Å; N190-R193 PolarHBondContact O-N 3.1Å; N190-R193 VanDerWaalsContact O-N 3.13Å
194S94.9Very high95Very high3 Ų332.3 Ų32.32%0.02117%0.174CC..  trans-74-40-175.2-166.90000113.3G150 P196 N251 D255G150-S194 VanDerWaalsContact O-CB 3.25Å; G150-S194 WeakPolarHBondContact O-CB 3.35Å; G150-S194 PolarHBondContact O-N 3.2Å; S194-P196 CarbonylContact O-C 3.41Å; S194-P196 VanDerWaalsContact O-C 3.29Å; S194-N251 PolarHBondContact O-ND2 2.96Å; S194-N251 PolarHBondContact OG-ND2 2.89Å; S194-N251 VanDerWaalsContact OG-ND2 3.1Å; S194-D255 PolarHBondContact OG-OD2 2.93Å
195F96.2Very high95.3Very high74 Ų7427.9 Ų27.933%0.32515%0.15SC..SBendtrans-107131.6-170.6-177.7-86.9000112.7G144 Q145 T148 D255 A258G144-F195 CarbonylContact C-O 3.03Å; Q145-F195 WeakPolarHBondContact CA-O 3.41Å; Q145-F195 WeakPolarHBondContact CG-O 3.41Å; Q145-F195 PolarHBondContact N-O 2.78Å; T148-F195 HydrophobicContact CG2-CD1 3.82Å; T148-F195 HydrophobicContact CG2-CE1 4.16Å; T148-F195 PolarHBondContact OG1-O 3.34Å; T148-F195 VanDerWaalsContact OG1-O 3.08Å; F195-D255 HydrophobicContact CD2-CB 4.13Å; F195-D255 WeakPolarHBondContact CD2-OD1 3.17Å; F195-A258 HydrophobicContact CD2-CB 4.39Å; F195-A258 HydrophobicContact CE2-CB 3.43Å; F195-A258 VanDerWaalsContact CE2-CB 3.43Å; F195-A258 HydrophobicContact CZ-CB 3.7Å
196P97.6Very high95.6Very high10 Ų1023.5 Ų23.57%0.06512%0.122CC..SBendcis-75.8167.4-15.232.1-33.8000111.7V141 Q145 S194 K198 A258 L262V141-P196 HydrophobicContact CB-CG 4.45Å; V141-P196 HydrophobicContact CG1-CG 4.28Å; V141-P196 HydrophobicContact CG2-CG 4.29Å; Q145-P196 PolarHBondContact NE2-O 2.85Å; Q145-P196 VanDerWaalsContact NE2-O 3.1Å; S194-P196 CarbonylContact O-C 3.41Å; S194-P196 VanDerWaalsContact O-C 3.29Å; P196-K198 PolarHBondContact O-N 3.25Å; P196-A258 HydrophobicContact CB-CB 4.32Å; P196-L262 HydrophobicContact CG-CD2 4.31Å
197S97.4Very high95.9Very high0 Ų019.4 Ų19.40%010%0.098CC..  trans-74.5115178.6-178.60000111.9A200 S201 N251 D255S197-A200 PolarHBondContact O-N 3.06Å; S197-S201 PolarHBondContact O-N 3.49Å; S197-S201 PolarHBondContact O-OG 3.06Å; S197-N251 PolarHBondContact OG-OD1 2.6Å; S197-N251 VanDerWaalsContact OG-OD1 3.06Å; S197-D255 PolarHBondContact N-O 3.12Å
198K96.1Very high96.1Very high19 Ų1918.9 Ų18.98%0.0839%0.094CC..Hα-helixtrans-58-50.9178.6-174.6169173.8154.60113.5E35 D138 V141 P196 A200 S201 L202E35-K198 IonicContact OE1-NZ 3.31Å; E35-K198 PolarHBondContact OE1-NZ 2.9Å; E35-K198 IonicContact OE2-NZ 3.75Å; E35-K198 PolarHBondContact OE2-NZ 3.33Å; D138-K198 WeakPolarHBondContact OD1-CE 3.18Å; D138-K198 IonicContact OD1-NZ 3.85Å; D138-K198 PolarHBondContact OD1-NZ 3.38Å; V141-K198 HydrophobicContact CG1-CB 3.66Å; V141-K198 HydrophobicContact CG1-CG 4.1Å; P196-K198 PolarHBondContact O-N 3.25Å; K198-A200 VanDerWaalsContact C-N 3.31Å; K198-A200 PolarHBondContact O-N 3.42Å; K198-S201 PolarHBondContact O-N 2.91Å; K198-L202 HydrophobicContact CG-CD1 3.9Å; K198-L202 HydrophobicContact CG-CG 4.48Å; K198-L202 WeakPolarHBondContact O-CG 3.35Å; K198-L202 PolarHBondContact O-N 3.4Å
199D96.3Very high96.3Very high7 Ų718.3 Ų18.34%0.0379%0.091CC..Hα-helixtrans-62.9-39.1-178-77.921.6000111.9L72 Y73 S203 R245L72-D199 HydrophobicContact CD2-CB 3.49Å; L72-D199 VanDerWaalsContact CD2-CB 3.49Å; L72-D199 WeakPolarHBondContact CD2-OD2 3.4Å; Y73-D199 VanDerWaalsContact CE1-OD1 3.31Å; Y73-D199 WeakPolarHBondContact CE1-OD1 3.21Å; Y73-D199 PolarHBondContact OH-OD1 2.92Å; D199-S203 WeakPolarHBondContact O-CB 3.27Å; D199-S203 PolarHBondContact O-N 2.78Å; D199-S203 VanDerWaalsContact O-N 3.1Å; D199-S203 PolarHBondContact O-OG 3.2Å; D199-R245 HydrophobicContact CB-CG 4.12Å; D199-R245 IonicContact OD2-CZ 2.72Å; D199-R245 IonicContact OD2-NE 2.7Å; D199-R245 PolarHBondContact OD2-NE 3.46Å; D199-R245 IonicContact OD2-NH1 3.85Å; D199-R245 IonicContact OD2-NH2 3.54Å; D199-R245 PolarHBondContact OD2-NH2 3.13Å
200A98.1Very high96.5Very high0 Ų015.6 Ų15.60%08%0.078CC..Hα-helixtrans-65.1-45.9174.600000111.7S197 K198 S203 V204 V256 F260S197-A200 PolarHBondContact O-N 3.06Å; K198-A200 VanDerWaalsContact C-N 3.31Å; K198-A200 PolarHBondContact O-N 3.42Å; A200-S203 PolarHBondContact O-OG 3.26Å; A200-S203 VanDerWaalsContact O-OG 3.06Å; A200-V204 PolarHBondContact O-N 3.14Å; A200-V204 VanDerWaalsContact O-N 3.12Å; A200-V256 HydrophobicContact CB-CB 4.36Å; A200-V256 HydrophobicContact CB-CG1 3.88Å; A200-F260 HydrophobicContact CB-CD1 3.86Å; A200-F260 HydrophobicContact CB-CE1 3.73Å; A200-F260 HydrophobicContact CB-CZ 4.38Å; A200-F260 WeakPolarHBondContact O-CD1 3.41Å
201S98.4Very high96.6Very high0 Ų012.7 Ų12.70%06%0.064CC..Hα-helixtrans-62.6-50.1179.2-700000113.2V141 S197 K198 Y205 G259V141-S201 WeakPolarHBondContact CG2-OG 3.48Å; S197-S201 PolarHBondContact O-N 3.49Å; S197-S201 PolarHBondContact O-OG 3.06Å; K198-S201 PolarHBondContact O-N 2.91Å; S201-Y205 VanDerWaalsContact O-CB 3.24Å; S201-Y205 WeakPolarHBondContact O-CB 3.36Å; S201-Y205 PolarHBondContact O-N 3.24Å; S201-G259 VanDerWaalsContact CA-O 3.27Å; S201-G259 WeakPolarHBondContact CA-O 3.48Å; S201-G259 WeakPolarHBondContact CB-O 3.3Å; S201-G259 VanDerWaalsContact OG-C 3.23Å; S201-G259 WeakPolarHBondContact OG-CA 3.41Å; S201-G259 PolarHBondContact OG-O 3.38Å
202L98.1Very high96.6Very high12 Ų1214 Ų146%0.0637%0.07CC..Hα-helixtrans-66.5-42.1-177.5-68176.3000111.6Y73 V76 L134 T137 D138 K198 S206Y73-L202 HydrophobicContact CD1-CD1 4.02Å; Y73-L202 HydrophobicContact CE1-CD1 3.8Å; V76-L202 HydrophobicContact CG1-CB 4.22Å; V76-L202 WeakPolarHBondContact CG1-O 3.45Å; L134-L202 HydrophobicContact CD2-CD2 4.37Å; T137-L202 HydrophobicContact CG2-CD2 3.94Å; D138-L202 HydrophobicContact CB-CD2 4.36Å; K198-L202 HydrophobicContact CG-CD1 3.9Å; K198-L202 HydrophobicContact CG-CG 4.48Å; K198-L202 WeakPolarHBondContact O-CG 3.35Å; K198-L202 PolarHBondContact O-N 3.4Å; L202-S206 WeakPolarHBondContact O-CB 3.32Å; L202-S206 PolarHBondContact O-N 2.93Å; L202-S206 VanDerWaalsContact O-N 3.1Å
203S98.1Very high96.4Very high6 Ų613.3 Ų13.34%0.0427%0.068CC..Hα-helixtrans-64.3-46.2179.260.70000112.5D199 A200 S206 A207 A238D199-S203 WeakPolarHBondContact O-CB 3.27Å; D199-S203 PolarHBondContact O-N 2.78Å; D199-S203 VanDerWaalsContact O-N 3.1Å; D199-S203 PolarHBondContact O-OG 3.2Å; A200-S203 PolarHBondContact O-OG 3.26Å; A200-S203 VanDerWaalsContact O-OG 3.06Å; S203-S206 PolarHBondContact O-N 3.23Å; S203-A207 WeakPolarHBondContact O-CB 3.24Å; S203-A207 PolarHBondContact O-N 3.06Å; S203-A238 WeakPolarHBondContact O-CB 3.47Å; S203-A238 PolarHBondContact OG-O 2.95Å
204V98.6Very high96.3Very high14 Ų1411.2 Ų11.29%0.0856%0.06CC..Hα-helixtrans-70.9-37.1179.282.80000112.2A200 S206 A207 V208 A238 F260A200-V204 PolarHBondContact O-N 3.14Å; A200-V204 VanDerWaalsContact O-N 3.12Å; V204-S206 VanDerWaalsContact C-N 3.27Å; V204-S206 PolarHBondContact O-N 3.41Å; V204-A207 PolarHBondContact O-N 3.03Å; V204-V208 HydrophobicContact CG2-CG2 3.97Å; V204-V208 WeakPolarHBondContact O-CB 3.44Å; V204-V208 VanDerWaalsContact O-CG2 3.24Å; V204-V208 WeakPolarHBondContact O-CG2 3.45Å; V204-V208 PolarHBondContact O-N 3.26Å; V204-A238 HydrophobicContact CB-CB 4.45Å; V204-F260 HydrophobicContact CB-CD1 3.71Å; V204-F260 HydrophobicContact CB-CE1 4.27Å; V204-F260 HydrophobicContact CG1-CB 4.4Å; V204-F260 HydrophobicContact CG1-CD1 3.95Å; V204-F260 WeakPolarHBondContact CG1-O 3.47Å; V204-F260 HydrophobicContact CG2-CD1 4.2Å
205Y98.6Very high96Very high0 Ų014 Ų140%08%0.077CC..Hα-helixtrans-55.4-49.6175.4165.5-90.4000109.7F130 G133 L134 S201 V208 Y209 I266 A267 L270F130-Y205 WeakPolarHBondContact CA-OH 3.39Å; F130-Y205 AromaticContact CD2-CE1 3.79Å; F130-Y205 HydrophobicContact CD2-CE1 3.79Å; F130-Y205 HydrophobicContact CE2-CD1 4.33Å; F130-Y205 AromaticContact CE2-CE1 3.68Å; F130-Y205 HydrophobicContact CE2-CE1 3.68Å; F130-Y205 PolarHBondContact O-OH 3.37Å; G133-Y205 VanDerWaalsContact C-CZ 3.43Å; G133-Y205 VanDerWaalsContact CA-OH 3.27Å; G133-Y205 WeakPolarHBondContact CA-OH 3.22Å; L134-Y205 HydrophobicContact CB-CE1 4.35Å; L134-Y205 HydrophobicContact CD2-CD1 3.51Å; L134-Y205 HydrophobicContact CD2-CE1 3.73Å; L134-Y205 HydrophobicContact CG-CD1 4.05Å; L134-Y205 HydrophobicContact CG-CE1 3.71Å; S201-Y205 VanDerWaalsContact O-CB 3.24Å; S201-Y205 WeakPolarHBondContact O-CB 3.36Å; S201-Y205 PolarHBondContact O-N 3.24Å; Y205-V208 PolarHBondContact O-N 2.95Å; Y205-Y209 WeakPolarHBondContact O-CB 3.36Å; Y205-Y209 PolarHBondContact O-N 3.08Å; Y205-I266 HydrophobicContact CD2-CB 4.21Å; Y205-I266 HydrophobicContact CD2-CG2 4Å; Y205-I266 HydrophobicContact CE2-CG2 3.87Å; Y205-A267 HydrophobicContact CD2-CB 3.68Å; Y205-A267 HydrophobicContact CE2-CB 3.99Å; Y205-A267 HydrophobicContact CG-CB 4.46Å; Y205-L270 HydrophobicContact CE2-CD1 4.2Å
206S97.9Very high95.3Very high9 Ų912 Ų126%0.0637%0.072CC..Hα-helixtrans-62-47.9179.4172.70000112.2V76 P80 L202 S203 V204 V208 L210V76-S206 PolarHBondContact O-OG 3.24Å; P80-S206 WeakPolarHBondContact CG-OG 3.38Å; L202-S206 WeakPolarHBondContact O-CB 3.32Å; L202-S206 PolarHBondContact O-N 2.93Å; L202-S206 VanDerWaalsContact O-N 3.1Å; S203-S206 PolarHBondContact O-N 3.23Å; V204-S206 VanDerWaalsContact C-N 3.27Å; V204-S206 PolarHBondContact O-N 3.41Å; S206-V208 PolarHBondContact O-N 3.28Å; S206-L210 WeakPolarHBondContact O-CB 3.46Å; S206-L210 PolarHBondContact O-N 3.24Å
207A97.9Very high94.4Very high5 Ų512 Ų124%0.0417%0.071CC..Hα-helixtrans-63.5-42.417900000113.3S203 V204 T211 T234 L235 A238S203-A207 WeakPolarHBondContact O-CB 3.24Å; S203-A207 PolarHBondContact O-N 3.06Å; V204-A207 PolarHBondContact O-N 3.03Å; A207-T211 WeakPolarHBondContact O-CB 3.47Å; A207-T211 PolarHBondContact O-N 2.84Å; A207-T211 PolarHBondContact O-OG1 3.46Å; A207-T234 WeakPolarHBondContact CB-O 3.38Å; A207-L235 HydrophobicContact CB-CD2 4.14Å; A207-A238 HydrophobicContact CB-CB 3.69Å
208V97.6Very high93.3Very high21 Ų2115 Ų1513%0.1279%0.087CC..Hα-helixtrans-68-47.7179.1172.30000110.5V204 Y205 S206 L210 T211 M212 L235 A267 L268V204-V208 HydrophobicContact CG2-CG2 3.97Å; V204-V208 WeakPolarHBondContact O-CB 3.44Å; V204-V208 VanDerWaalsContact O-CG2 3.24Å; V204-V208 WeakPolarHBondContact O-CG2 3.45Å; V204-V208 PolarHBondContact O-N 3.26Å; Y205-V208 PolarHBondContact O-N 2.95Å; S206-V208 PolarHBondContact O-N 3.28Å; V208-L210 VanDerWaalsContact C-N 3.33Å; V208-L210 PolarHBondContact O-N 2.85Å; V208-T211 PolarHBondContact O-N 3.16Å; V208-M212 HydrophobicContact CG1-SD 4.13Å; V208-M212 VanDerWaalsContact O-CG 3.3Å; V208-M212 WeakPolarHBondContact O-CG 3.48Å; V208-M212 PolarHBondContact O-N 2.8Å; V208-L235 HydrophobicContact CG2-CD2 3.96Å; V208-A267 HydrophobicContact CB-CB 3.86Å; V208-A267 HydrophobicContact CG1-CB 3.66Å; V208-L268 HydrophobicContact CG1-CD2 4.33Å; V208-L268 HydrophobicContact CG1-CG 4.39Å
209Y96.2Very high92Very high0 Ų021.6 Ų21.60%012%0.115CC..Hα-helixtrans-59.7-45.2177.7-171.8-85.9000111.4I84 F126 V129 F130 Y205 M212 Y213 F278I84-Y209 HydrophobicContact CD1-CD1 4.45Å; I84-Y209 HydrophobicContact CD1-CE1 3.91Å; F126-Y209 PolarHBondContact O-OH 3Å; V129-Y209 HydrophobicContact CG1-CE2 4.25Å; F130-Y209 HydrophobicContact CB-CD1 4.13Å; F130-Y209 HydrophobicContact CB-CE1 3.61Å; F130-Y209 AromaticContact CD2-CD1 3.56Å; F130-Y209 HydrophobicContact CD2-CD1 3.56Å; F130-Y209 AromaticContact CD2-CE1 3.97Å; F130-Y209 HydrophobicContact CD2-CE1 3.97Å; F130-Y209 AromaticContact CD2-CG 3.92Å; F130-Y209 HydrophobicContact CD2-CG 3.92Å; F130-Y209 HydrophobicContact CE2-CD1 4.43Å; F130-Y209 HydrophobicContact CG-CD1 4.2Å; F130-Y209 HydrophobicContact CG-CE1 4.15Å; Y205-Y209 WeakPolarHBondContact O-CB 3.36Å; Y205-Y209 PolarHBondContact O-N 3.08Å; Y209-M212 PolarHBondContact O-N 3.38Å; Y209-Y213 PolarHBondContact O-N 3.32Å; Y209-F278 HydrophobicContact CD1-CZ 4.45Å; Y209-F278 HydrophobicContact CD2-CZ 4.31Å; Y209-F278 HydrophobicContact CE1-CE1 4.12Å; Y209-F278 AromaticContact CE1-CZ 3.93Å; Y209-F278 HydrophobicContact CE1-CZ 3.93Å; Y209-F278 AromaticContact CE2-CZ 3.77Å; Y209-F278 HydrophobicContact CE2-CZ 3.77Å; Y209-F278 AromaticContact CZ-CE1 3.9Å; Y209-F278 AromaticContact CZ-CZ 3.58Å
210L95.3Very high90.2Very high4 Ų425.1 Ų25.12%0.02114%0.137CC..Hα-helixtrans-62.6-43.8176.6179.754.5000111.9P80 I83 S206 V208 M212 Y213 I214 T234P80-L210 HydrophobicContact CB-CB 4.37Å; P80-L210 HydrophobicContact CB-CD1 4.39Å; P80-L210 HydrophobicContact CG-CB 4.41Å; P80-L210 HydrophobicContact CG-CD2 4.28Å; I83-L210 HydrophobicContact CB-CD1 3.84Å; I83-L210 HydrophobicContact CD1-CD1 3.96Å; I83-L210 HydrophobicContact CD1-CD2 3.59Å; I83-L210 HydrophobicContact CD1-CG 4.34Å; I83-L210 HydrophobicContact CG2-CD1 3.65Å; S206-L210 WeakPolarHBondContact O-CB 3.46Å; S206-L210 PolarHBondContact O-N 3.24Å; V208-L210 VanDerWaalsContact C-N 3.33Å; V208-L210 PolarHBondContact O-N 2.85Å; L210-M212 VanDerWaalsContact C-N 3.33Å; L210-M212 PolarHBondContact O-N 3.41Å; L210-Y213 WeakPolarHBondContact O-CB 3.43Å; L210-Y213 PolarHBondContact O-N 3.03Å; L210-I214 HydrophobicContact CD1-CD1 3.83Å; L210-I214 HydrophobicContact CD1-CG1 4.11Å; L210-I214 HydrophobicContact CG-CD1 3.7Å; L210-I214 HydrophobicContact CG-CG1 4.46Å; L210-I214 WeakPolarHBondContact O-CB 3.4Å; L210-I214 WeakPolarHBondContact O-CD1 3.5Å; L210-I214 VanDerWaalsContact O-CG1 3.27Å; L210-I214 WeakPolarHBondContact O-CG1 3.3Å; L210-I214 PolarHBondContact O-N 3.26Å; L210-T234 HydrophobicContact CD2-CG2 3.68Å; L210-T234 HydrophobicContact CG-CG2 4.38Å
211T94.6Very high88.3Confident22 Ų2235 Ų3514%0.13518%0.18CC..Hα-helixtrans-59.9-42.5175.2-71.50000111.7A207 V208 T215 C231 T234A207-T211 WeakPolarHBondContact O-CB 3.47Å; A207-T211 PolarHBondContact O-N 2.84Å; A207-T211 PolarHBondContact O-OG1 3.46Å; V208-T211 PolarHBondContact O-N 3.16Å; T211-T215 WeakPolarHBondContact O-CB 3.21Å; T211-T215 PolarHBondContact O-N 3.37Å; T211-T215 PolarHBondContact O-OG1 3.06Å; T211-C231 HydrophobicContact CG2-CB 3.79Å; T211-T234 PolarHBondContact OG1-OG1 2.81Å
212M92.6Very high86.2Confident27 Ų2740.6 Ų40.613%0.13322%0.219CC..Hα-helixtrans-63.9-42175.6-69.8174.472.900111.8V208 Y209 L210 T215 S216 L268 I272 F278V208-M212 HydrophobicContact CG1-SD 4.13Å; V208-M212 VanDerWaalsContact O-CG 3.3Å; V208-M212 WeakPolarHBondContact O-CG 3.48Å; V208-M212 PolarHBondContact O-N 2.8Å; Y209-M212 PolarHBondContact O-N 3.38Å; L210-M212 VanDerWaalsContact C-N 3.33Å; L210-M212 PolarHBondContact O-N 3.41Å; M212-T215 PolarHBondContact O-N 3.27Å; M212-S216 WeakPolarHBondContact O-CB 3.25Å; M212-S216 PolarHBondContact O-N 3.47Å; M212-S216 VanDerWaalsContact O-N 3.11Å; M212-S216 PolarHBondContact O-OG 2.88Å; M212-L268 HydrophobicContact CE-CD2 4.48Å; M212-L268 HydrophobicContact SD-CD2 3.99Å; M212-I272 HydrophobicContact CE-CG1 3.67Å; M212-F278 HydrophobicContact CB-CD2 4.35Å; M212-F278 HydrophobicContact CB-CE2 3.85Å; M212-F278 HydrophobicContact CE-CE2 4.42Å
213Y91.5Very high84.7Confident2 Ų243 Ų431%0.00824%0.238CC..Hα-helixtrans-60.2-58.4175.2175.7-96.6000111I84 E88 F126 Y209 L210 T215 S216 T217 F278I84-Y213 HydrophobicContact CB-CE1 4.39Å; I84-Y213 HydrophobicContact CB-CE2 4.44Å; I84-Y213 HydrophobicContact CG1-CD1 3.9Å; I84-Y213 HydrophobicContact CG1-CD2 3.98Å; I84-Y213 HydrophobicContact CG1-CE1 4.03Å; I84-Y213 HydrophobicContact CG1-CE2 4.1Å; I84-Y213 HydrophobicContact CG1-CG 3.89Å; I84-Y213 HydrophobicContact CG2-CE2 4.09Å; I84-Y213 PolarHBondContact O-OH 2.76Å; E88-Y213 PolarHBondContact N-OH 2.72Å; E88-Y213 WeakPolarHBondContact OE1-CE2 3.31Å; E88-Y213 PolarHBondContact OE1-OH 3.01Å; F126-Y213 HydrophobicContact CD2-CD2 4.47Å; F126-Y213 AromaticContact CD2-CE2 3.92Å; F126-Y213 HydrophobicContact CD2-CE2 3.92Å; F126-Y213 HydrophobicContact CE2-CE2 4.08Å; F126-Y213 HydrophobicContact CG-CE2 4.49Å; Y209-Y213 PolarHBondContact O-N 3.32Å; L210-Y213 WeakPolarHBondContact O-CB 3.43Å; L210-Y213 PolarHBondContact O-N 3.03Å; Y213-T215 PolarHBondContact O-N 2.96Å; Y213-S216 PolarHBondContact O-N 3.05Å; Y213-T217 HydrophobicContact CD1-CG2 4.49Å; Y213-T217 HydrophobicContact CD2-CG2 3.82Å; Y213-T217 HydrophobicContact CE1-CG2 4.14Å; Y213-T217 HydrophobicContact CE2-CG2 3.41Å; Y213-T217 VanDerWaalsContact CE2-CG2 3.41Å; Y213-T217 HydrophobicContact CG-CG2 4.33Å; Y213-T217 WeakPolarHBondContact O-CG2 3.44Å; Y213-T217 PolarHBondContact O-N 3.09Å; Y213-T217 PolarHBondContact O-OG1 3.11Å; Y213-F278 AromaticContact CD2-CD1 3.76Å; Y213-F278 HydrophobicContact CD2-CD1 3.76Å; Y213-F278 AromaticContact CD2-CE1 3.91Å; Y213-F278 HydrophobicContact CD2-CE1 3.91Å
214I90.3Very high83.7Confident1 Ų154 Ų541%0.00528%0.278CS..Hα-helixtrans-51.5-46178.2-71.1159.5000110.4I83 L210 S216 I218 K227 L230I83-I214 HydrophobicContact CG2-CG1 4.47Å; L210-I214 HydrophobicContact CD1-CD1 3.83Å; L210-I214 HydrophobicContact CD1-CG1 4.11Å; L210-I214 HydrophobicContact CG-CD1 3.7Å; L210-I214 HydrophobicContact CG-CG1 4.46Å; L210-I214 WeakPolarHBondContact O-CB 3.4Å; L210-I214 WeakPolarHBondContact O-CD1 3.5Å; L210-I214 VanDerWaalsContact O-CG1 3.27Å; L210-I214 WeakPolarHBondContact O-CG1 3.3Å; L210-I214 PolarHBondContact O-N 3.26Å; I214-S216 PolarHBondContact O-N 3.43Å; I214-I218 HydrophobicContact CG2-CD1 3.81Å; I214-I218 HydrophobicContact CG2-CG1 4.34Å; I214-I218 WeakPolarHBondContact O-CB 3.28Å; I214-I218 WeakPolarHBondContact O-CG1 2.9Å; I214-I218 PolarHBondContact O-N 3.45Å; I214-I218 VanDerWaalsContact O-N 3.08Å; I214-K227 HydrophobicContact CG2-CG 4.24Å; I214-L230 HydrophobicContact CB-CD2 4.48Å; I214-L230 HydrophobicContact CD1-CD2 3.33Å; I214-L230 HydrophobicContact CD1-CG 3.75Å; I214-L230 HydrophobicContact CG1-CD2 3.73Å; I214-L230 HydrophobicContact CG2-CD2 3.89Å
215T88.3Confident83Confident62 Ų6259.2 Ų59.238%0.3831%0.305SS..Hα-helixtrans-65.4-31.7-176.2-62.50000112.3T211 M212 Y213 K227T211-T215 WeakPolarHBondContact O-CB 3.21Å; T211-T215 PolarHBondContact O-N 3.37Å; T211-T215 PolarHBondContact O-OG1 3.06Å; M212-T215 PolarHBondContact O-N 3.27Å; Y213-T215 PolarHBondContact O-N 2.96Å; T215-K227 PolarHBondContact O-NZ 3.2Å
216S82.9Confident82.3Confident31 Ų3161.9 Ų61.922%0.21733%0.327CS..Hα-helixtrans-90.2-31-176.8-57.60000113.6M212 Y213 I214M212-S216 WeakPolarHBondContact O-CB 3.25Å; M212-S216 PolarHBondContact O-N 3.47Å; M212-S216 VanDerWaalsContact O-N 3.11Å; M212-S216 PolarHBondContact O-OG 2.88Å; Y213-S216 PolarHBondContact O-N 3.05Å; I214-S216 PolarHBondContact O-N 3.43Å
217T78.2Confident81.7Confident9 Ų964.5 Ų64.56%0.05534%0.337CS..Hα-helixtrans-91.4-39.8-175.457.60000113.2Y213 K219Y213-T217 HydrophobicContact CD1-CG2 4.49Å; Y213-T217 HydrophobicContact CD2-CG2 3.82Å; Y213-T217 HydrophobicContact CE1-CG2 4.14Å; Y213-T217 HydrophobicContact CE2-CG2 3.41Å; Y213-T217 VanDerWaalsContact CE2-CG2 3.41Å; Y213-T217 HydrophobicContact CG-CG2 4.33Å; Y213-T217 WeakPolarHBondContact O-CG2 3.44Å; Y213-T217 PolarHBondContact O-N 3.09Å; Y213-T217 PolarHBondContact O-OG1 3.11Å; T217-K219 PolarHBondContact O-N 3.19Å
218I74.4Confident81.3Confident63 Ų6367.6 Ų67.632%0.32336%0.357SS..  trans-78.595.2-179.2-53.4-170.1000109.5I214 T220I214-I218 HydrophobicContact CG2-CD1 3.81Å; I214-I218 HydrophobicContact CG2-CG1 4.34Å; I214-I218 WeakPolarHBondContact O-CB 3.28Å; I214-I218 WeakPolarHBondContact O-CG1 2.9Å; I214-I218 PolarHBondContact O-N 3.45Å; I214-I218 VanDerWaalsContact O-N 3.08Å; I218-T220 WeakPolarHBondContact CG2-OG1 3.42Å
219K67.8Low81Confident158 Ų15871 Ų7169%0.68738%0.377SS*.  trans-98.38.1172.3-64.9-174.5180-178.80113.3T217 K221T217-K219 PolarHBondContact O-N 3.19Å; K219-K221 PolarHBondContact O-N 2.89Å
220T59.4Low80.7Confident81 Ų8174.4 Ų74.450%0.49740%0.395SS..  trans-66.9122.8-173.130.80000111.3I218 S222I218-T220 WeakPolarHBondContact CG2-OG1 3.42Å; T220-S222 PolarHBondContact O-N 3.38Å
221K56.7Low80.6Confident208 Ų20874.8 Ų74.890%0.90440%0.398SS*.THydrogen-bonded Turntrans-69.8-6.1177-65.8-178.3178-178.10113.6K219K219-K221 PolarHBondContact O-N 2.89Å
222S56.1Low80.6Confident117 Ų11778.8 Ų78.882%0.81842%0.418SS*.THydrogen-bonded Turntrans-85.8-23-162.9-164.50000115.2T220T220-S222 PolarHBondContact O-N 3.38Å
223S65.9Low80.7Confident64 Ų6479.5 Ų79.545%0.44843%0.432SS..  trans-137109.9173.5-177.80000110.5L225 A226S223-L225 VanDerWaalsContact C-N 3.27Å; S223-L225 PolarHBondContact O-N 3.36Å; S223-A226 VanDerWaalsContact OG-CB 3.25Å; S223-A226 WeakPolarHBondContact OG-CB 3.32Å; S223-A226 PolarHBondContact OG-N 3.28Å; S223-A226 VanDerWaalsContact OG-N 3.14Å
224R76.9Confident80.9Confident235 Ų23580.5 Ų80.589%0.88744%0.438SS*.THydrogen-bonded Turntrans-71.1-23179.2-63.3-175.3-179.5-170.60.8112.4
225L83.3Confident81.3Confident124 Ų12483.5 Ų83.565%0.64945%0.454SS*.THydrogen-bonded Turntrans-101.6-26.9-177.1-104.379.3000114.8S223 K227 P228 V229S223-L225 VanDerWaalsContact C-N 3.27Å; S223-L225 PolarHBondContact O-N 3.36Å; L225-K227 VanDerWaalsContact C-N 3.31Å; L225-K227 PolarHBondContact O-N 3.3Å; L225-P228 WeakPolarHBondContact O-CD 3.44Å; L225-P228 VanDerWaalsContact O-CG 3.27Å; L225-P228 WeakPolarHBondContact O-CG 3.33Å; L225-V229 WeakPolarHBondContact O-CB 3.34Å; L225-V229 WeakPolarHBondContact O-CG2 3.38Å; L225-V229 PolarHBondContact O-N 3Å
226A84.1Confident81.7Confident56 Ų5683.4 Ų83.446%0.46346%0.455SS..Hα-helixtrans-60.6-40-173.400000113S223 L230S223-A226 VanDerWaalsContact OG-CB 3.25Å; S223-A226 WeakPolarHBondContact OG-CB 3.32Å; S223-A226 PolarHBondContact OG-N 3.28Å; S223-A226 VanDerWaalsContact OG-N 3.14Å; A226-L230 WeakPolarHBondContact O-CB 3.5Å; A226-L230 PolarHBondContact O-N 2.79Å
227K85.7Confident82.3Confident65 Ų6585.3 Ų85.328%0.28347%0.469SS..Hα-helixtrans-63.6-56.4178.5171.1170.3158.5170.50113.1I214 T215 L225 V229 L230 C231I214-K227 HydrophobicContact CG2-CG 4.24Å; T215-K227 PolarHBondContact O-NZ 3.2Å; L225-K227 VanDerWaalsContact C-N 3.31Å; L225-K227 PolarHBondContact O-N 3.3Å; K227-V229 VanDerWaalsContact C-N 3.27Å; K227-V229 PolarHBondContact O-N 3.49Å; K227-L230 PolarHBondContact O-N 3.31Å; K227-C231 PolarHBondContact O-N 2.71Å; K227-C231 PolarHBondContact O-SG 2.92Å
228P89.1Confident83.2Confident70 Ų7085 Ų8546%0.45547%0.467SS..Hα-helixtrans-62.7-34178.321.8-32.1000112.6L225 L232L225-P228 WeakPolarHBondContact O-CD 3.44Å; L225-P228 VanDerWaalsContact O-CG 3.27Å; L225-P228 WeakPolarHBondContact O-CG 3.33Å; P228-L232 WeakPolarHBondContact O-CB 3.44Å; P228-L232 PolarHBondContact O-N 3.26Å
229V91.6Very high84.3Confident91 Ų9187.4 Ų87.455%0.55248%0.475SS*.Hα-helixtrans-64.7-44175.2171.30000111.5L225 K227 G233L225-V229 WeakPolarHBondContact O-CB 3.34Å; L225-V229 WeakPolarHBondContact O-CG2 3.38Å; L225-V229 PolarHBondContact O-N 3Å; K227-V229 VanDerWaalsContact C-N 3.27Å; K227-V229 PolarHBondContact O-N 3.49Å; V229-G233 PolarHBondContact O-N 2.95Å
230L90.5Very high85.7Confident72 Ų7284.5 Ų84.538%0.37747%0.467SS..Hα-helixtrans-63-47.2177.4-170.674.8000111.3I214 A226 K227 G233 T234I214-L230 HydrophobicContact CB-CD2 4.48Å; I214-L230 HydrophobicContact CD1-CD2 3.33Å; I214-L230 HydrophobicContact CD1-CG 3.75Å; I214-L230 HydrophobicContact CG1-CD2 3.73Å; I214-L230 HydrophobicContact CG2-CD2 3.89Å; A226-L230 WeakPolarHBondContact O-CB 3.5Å; A226-L230 PolarHBondContact O-N 2.79Å; K227-L230 PolarHBondContact O-N 3.31Å; L230-G233 PolarHBondContact O-N 2.67Å; L230-T234 WeakPolarHBondContact O-CG2 3.49Å; L230-T234 PolarHBondContact O-N 3.4Å; L230-T234 PolarHBondContact O-OG1 2.89Å
231C93.3Very high87.4Confident12 Ų1281.3 Ų81.38%0.08145%0.449CS..Hα-helixtrans-61.7-49.9177.5-62.80000111.4T211 K227 G233 T234 L235T211-C231 HydrophobicContact CG2-CB 3.79Å; K227-C231 PolarHBondContact O-N 2.71Å; K227-C231 PolarHBondContact O-SG 2.92Å; C231-G233 VanDerWaalsContact C-N 3.31Å; C231-G233 PolarHBondContact O-N 2.96Å; C231-T234 PolarHBondContact O-N 3.13Å; C231-T234 PolarHBondContact O-OG1 3.06Å; C231-L235 WeakPolarHBondContact O-CG 3.36Å; C231-L235 PolarHBondContact O-N 3.1Å
232L94.5Very high89.3Confident107 Ų10771.4 Ų71.456%0.5641%0.406SS*.Hα-helixtrans-61.3-42.2178.9-175.862.7000111P228 T234 L235 C236P228-L232 WeakPolarHBondContact O-CB 3.44Å; P228-L232 PolarHBondContact O-N 3.26Å; L232-T234 VanDerWaalsContact C-N 3.35Å; L232-T234 PolarHBondContact O-N 3.31Å; L232-L235 PolarHBondContact O-N 2.83Å; L232-C236 VanDerWaalsContact O-CB 3.28Å; L232-C236 WeakPolarHBondContact O-CB 3.08Å; L232-C236 PolarHBondContact O-N 3.18Å; L232-C236 PolarHBondContact O-SG 3.29Å
233G95.3Very high91.2Very high42 Ų4269.3 Ų69.343%0.43339%0.385SS..Hα-helixtrans-57.2-46175.900000112.5V229 L230 C231 C236 S237V229-G233 PolarHBondContact O-N 2.95Å; L230-G233 PolarHBondContact O-N 2.67Å; C231-G233 VanDerWaalsContact C-N 3.31Å; C231-G233 PolarHBondContact O-N 2.96Å; G233-C236 PolarHBondContact O-N 3.13Å; G233-S237 PolarHBondContact O-N 3.47Å; G233-S237 PolarHBondContact O-OG 3.49Å
234T95.3Very high92.6Very high22 Ų2268 Ų6814%0.13537%0.373CS..Hα-helixtrans-67-37177.557.80000113.2A207 L210 T211 L230 C231 L232 S237 A238A207-T234 WeakPolarHBondContact CB-O 3.38Å; L210-T234 HydrophobicContact CD2-CG2 3.68Å; L210-T234 HydrophobicContact CG-CG2 4.38Å; T211-T234 PolarHBondContact OG1-OG1 2.81Å; L230-T234 WeakPolarHBondContact O-CG2 3.49Å; L230-T234 PolarHBondContact O-N 3.4Å; L230-T234 PolarHBondContact O-OG1 2.89Å; C231-T234 PolarHBondContact O-N 3.13Å; C231-T234 PolarHBondContact O-OG1 3.06Å; L232-T234 VanDerWaalsContact C-N 3.35Å; L232-T234 PolarHBondContact O-N 3.31Å; T234-S237 PolarHBondContact O-OG 3.15Å; T234-A238 PolarHBondContact O-N 2.93Å
235L97.3Very high93.5Very high65 Ų6557.3 Ų57.334%0.3433%0.332SS..Hα-helixtrans-71.9-39.8177-68.7170.6000111.6A207 V208 C231 L232 A238 F239A207-L235 HydrophobicContact CB-CD2 4.14Å; V208-L235 HydrophobicContact CG2-CD2 3.96Å; C231-L235 WeakPolarHBondContact O-CG 3.36Å; C231-L235 PolarHBondContact O-N 3.1Å; L232-L235 PolarHBondContact O-N 2.83Å; L235-A238 PolarHBondContact O-N 3.41Å; L235-F239 WeakPolarHBondContact O-CB 3.38Å; L235-F239 PolarHBondContact O-N 3.43Å
236C97.5Very high94.1Very high59 Ų5953.1 Ų53.140%0.39931%0.312SS..Hα-helixtrans-63.8-41.6175.6-73.80000111.7L232 G233 F239 L240L232-C236 VanDerWaalsContact O-CB 3.28Å; L232-C236 WeakPolarHBondContact O-CB 3.08Å; L232-C236 PolarHBondContact O-N 3.18Å; L232-C236 PolarHBondContact O-SG 3.29Å; G233-C236 PolarHBondContact O-N 3.13Å; C236-F239 PolarHBondContact O-N 3.42Å; C236-L240 WeakPolarHBondContact O-CB 3.16Å; C236-L240 VanDerWaalsContact O-CG 3.3Å; C236-L240 WeakPolarHBondContact O-CG 3.44Å; C236-L240 PolarHBondContact O-N 3.25Å
237S95.8Very high94.7Very high71 Ų7154.1 Ų54.150%0.49732%0.316SS..Hα-helixtrans-64.3-40.6177.262.50000112.1G233 T234 L240 A241G233-S237 PolarHBondContact O-N 3.47Å; G233-S237 PolarHBondContact O-OG 3.49Å; T234-S237 PolarHBondContact O-OG 3.15Å; S237-L240 PolarHBondContact O-N 2.98Å; S237-A241 PolarHBondContact O-N 2.92Å
238A97.1Very high95.1Very high3 Ų352.4 Ų52.43%0.02531%0.309CS..Hα-helixtrans-63.4-42.3173.500000112.4S203 V204 A207 T234 L235 L240 A241 G242S203-A238 WeakPolarHBondContact O-CB 3.47Å; S203-A238 PolarHBondContact OG-O 2.95Å; V204-A238 HydrophobicContact CB-CB 4.45Å; A207-A238 HydrophobicContact CB-CB 3.69Å; T234-A238 PolarHBondContact O-N 2.93Å; L235-A238 PolarHBondContact O-N 3.41Å; A238-L240 PolarHBondContact O-N 3.35Å; A238-A241 PolarHBondContact O-N 3.3Å; A238-G242 PolarHBondContact O-N 2.82Å
239F97.5Very high95.4Very high113 Ų11353.9 Ų53.950%0.49631%0.306SS..Hα-helixtrans-61.1-45.5176.5-175.9-108.4000112L235 C236 A241 G242 L243 F260L235-F239 WeakPolarHBondContact O-CB 3.38Å; L235-F239 PolarHBondContact O-N 3.43Å; C236-F239 PolarHBondContact O-N 3.42Å; F239-A241 VanDerWaalsContact C-N 3.35Å; F239-A241 PolarHBondContact O-N 3.47Å; F239-G242 PolarHBondContact O-N 3.37Å; F239-L243 HydrophobicContact CD1-CD1 3.86Å; F239-L243 HydrophobicContact CD1-CG 4.28Å; F239-L243 HydrophobicContact CE1-CD1 3.38Å; F239-L243 HydrophobicContact CE1-CD2 4.42Å; F239-L243 HydrophobicContact CE1-CG 3.93Å; F239-L243 HydrophobicContact CZ-CD1 3.95Å; F239-L243 HydrophobicContact CZ-CD2 4.16Å; F239-L243 HydrophobicContact CZ-CG 4.11Å; F239-L243 PolarHBondContact O-N 2.97Å; F239-F260 AromaticContact CD2-CE2 3.69Å; F239-F260 HydrophobicContact CD2-CE2 3.69Å; F239-F260 HydrophobicContact CD2-CZ 4.12Å; F239-F260 HydrophobicContact CE2-CE2 4.11Å
240L96.8Very high95.5Very high98 Ų9850.1 Ų50.151%0.51328%0.282SS..Hα-helixtrans-63.9-37.4176.7-70173.3000112.4C236 S237 A238 G242 L243 N244C236-L240 WeakPolarHBondContact O-CB 3.16Å; C236-L240 VanDerWaalsContact O-CG 3.3Å; C236-L240 WeakPolarHBondContact O-CG 3.44Å; C236-L240 PolarHBondContact O-N 3.25Å; S237-L240 PolarHBondContact O-N 2.98Å; A238-L240 PolarHBondContact O-N 3.35Å; L240-G242 VanDerWaalsContact C-N 3.3Å; L240-G242 PolarHBondContact O-N 2.6Å; L240-L243 HydrophobicContact CD2-CD1 4.4Å; L240-L243 PolarHBondContact O-N 2.98Å; L240-N244 VanDerWaalsContact O-CG 3.24Å; L240-N244 PolarHBondContact O-N 3.5Å; L240-N244 PolarHBondContact O-ND2 3.42Å
241A95.5Very high95.8Very high13 Ų1347.4 Ų47.411%0.10727%0.267CS..Hα-helixtrans-59.7-41.2174.800000111.9L72 S237 A238 F239L72-A241 HydrophobicContact CD1-CB 4.08Å; S237-A241 PolarHBondContact O-N 2.92Å; A238-A241 PolarHBondContact O-N 3.3Å; F239-A241 VanDerWaalsContact C-N 3.35Å; F239-A241 PolarHBondContact O-N 3.47Å
242G95.8Very high96Very high0 Ų048.8 Ų48.80%027%0.273CS..Hα-helixtrans-67.8-41.9173.400000113.2A238 F239 L240 N244 R245A238-G242 PolarHBondContact O-N 2.82Å; F239-G242 PolarHBondContact O-N 3.37Å; L240-G242 VanDerWaalsContact C-N 3.3Å; L240-G242 PolarHBondContact O-N 2.6Å; G242-N244 VanDerWaalsContact C-N 3.29Å; G242-N244 PolarHBondContact O-N 3.37Å; G242-R245 WeakPolarHBondContact O-CB 3.24Å; G242-R245 PolarHBondContact O-N 3.37Å; G242-R245 VanDerWaalsContact O-N 3.14Å
243L96.6Very high96.1Very high73 Ų7347.6 Ų47.638%0.38227%0.273SS..Hα-helixtrans-62-36.2176.7-72.8-175.7000112.9F239 L240 R245 V246 S247F239-L243 HydrophobicContact CD1-CD1 3.86Å; F239-L243 HydrophobicContact CD1-CG 4.28Å; F239-L243 HydrophobicContact CE1-CD1 3.38Å; F239-L243 HydrophobicContact CE1-CD2 4.42Å; F239-L243 HydrophobicContact CE1-CG 3.93Å; F239-L243 HydrophobicContact CZ-CD1 3.95Å; F239-L243 HydrophobicContact CZ-CD2 4.16Å; F239-L243 HydrophobicContact CZ-CG 4.11Å; F239-L243 PolarHBondContact O-N 2.97Å; L240-L243 HydrophobicContact CD2-CD1 4.4Å; L240-L243 PolarHBondContact O-N 2.98Å; L243-R245 PolarHBondContact O-N 2.98Å; L243-V246 WeakPolarHBondContact O-CB 3.17Å; L243-V246 PolarHBondContact O-N 3.22Å; L243-S247 PolarHBondContact O-N 3.3Å
244N95.8Very high96.2Very high37 Ų3749.1 Ų49.120%0.19828%0.276CS..Hα-helixtrans-59-33.8176.4-72.9-22.2000112V67 L240 G242 V246 S247 E248V67-N244 WeakPolarHBondContact CG2-ND2 3.11Å; L240-N244 VanDerWaalsContact O-CG 3.24Å; L240-N244 PolarHBondContact O-N 3.5Å; L240-N244 PolarHBondContact O-ND2 3.42Å; G242-N244 VanDerWaalsContact C-N 3.29Å; G242-N244 PolarHBondContact O-N 3.37Å; N244-V246 VanDerWaalsContact C-N 3.32Å; N244-V246 PolarHBondContact O-N 3.34Å; N244-S247 WeakPolarHBondContact CA-OG 3.41Å; N244-S247 PolarHBondContact O-N 2.94Å; N244-S247 PolarHBondContact O-OG 2.79Å; N244-E248 WeakPolarHBondContact O-CB 3.4Å; N244-E248 WeakPolarHBondContact O-CG 3.15Å; N244-E248 PolarHBondContact O-N 3.24Å
245R95.3Very high96.3Very high10 Ų1048.4 Ų48.44%0.03827%0.272CS..Hα-helixtrans-67.4-34.3176.5-66.6-71.2143.6176.3-4.6112.8E62 V67 D199 G242 L243 R250 N251 V256E62-R245 IonicContact OE1-NH1 3.52Å; E62-R245 IonicContact OE2-CZ 3.21Å; E62-R245 IonicContact OE2-NH1 3.34Å; E62-R245 PolarHBondContact OE2-NH1 3.02Å; E62-R245 IonicContact OE2-NH2 3.56Å; V67-R245 PolarHBondContact O-NH2 3.3Å; D199-R245 HydrophobicContact CB-CG 4.12Å; D199-R245 IonicContact OD2-CZ 2.72Å; D199-R245 IonicContact OD2-NE 2.7Å; D199-R245 PolarHBondContact OD2-NE 3.46Å; D199-R245 IonicContact OD2-NH1 3.85Å; D199-R245 IonicContact OD2-NH2 3.54Å; D199-R245 PolarHBondContact OD2-NH2 3.13Å; G242-R245 WeakPolarHBondContact O-CB 3.24Å; G242-R245 PolarHBondContact O-N 3.37Å; G242-R245 VanDerWaalsContact O-N 3.14Å; L243-R245 PolarHBondContact O-N 2.98Å; R245-R250 PolarHBondContact O-N 2.82Å; R245-N251 HydrophobicContact CB-CB 4.17Å; R245-N251 WeakPolarHBondContact CB-OD1 3.42Å; R245-N251 PolarHBondContact O-N 2.78Å; R245-V256 HydrophobicContact CB-CG2 4.34Å
246V96.4Very high96.4Very high36 Ų3645.6 Ų45.622%0.21826%0.257CS..Hα-helixtrans-72.5-44.2174.5-175.90000110.6L243 N244 E248 Y249 C253 V256L243-V246 WeakPolarHBondContact O-CB 3.17Å; L243-V246 PolarHBondContact O-N 3.22Å; N244-V246 VanDerWaalsContact C-N 3.32Å; N244-V246 PolarHBondContact O-N 3.34Å; V246-E248 VanDerWaalsContact C-N 3.25Å; V246-E248 PolarHBondContact O-N 3.08Å; V246-Y249 PolarHBondContact O-N 2.85Å; V246-C253 VanDerWaalsContact CG1-SG 3.51Å; V246-V256 HydrophobicContact CG2-CB 4.39Å; V246-V256 HydrophobicContact CG2-CG2 3.76Å
247S95.2Very high96.4Very high77 Ų7746.6 Ų46.654%0.53826%0.262SS..Hα-helixtrans-66-29.2-178.364.70000113L243 N244 Y249L243-S247 PolarHBondContact O-N 3.3Å; N244-S247 WeakPolarHBondContact CA-OG 3.41Å; N244-S247 PolarHBondContact O-N 2.94Å; N244-S247 PolarHBondContact O-OG 2.79Å; S247-Y249 VanDerWaalsContact C-N 3.28Å
248E94.7Very high96.5Very high29 Ų2944.5 Ų44.514%0.13625%0.248CC..THydrogen-bonded Turntrans-85.85.6173.2-69.1-177.8-17600113.8P59 S65 F66 N244 V246 R250P59-E248 HydrophobicContact CB-CB 4.48Å; P59-E248 VanDerWaalsContact CB-O 3.3Å; P59-E248 WeakPolarHBondContact CB-O 3.44Å; P59-E248 WeakPolarHBondContact CG-O 3.28Å; S65-E248 WeakPolarHBondContact CA-OE1 3.26Å; S65-E248 WeakPolarHBondContact CB-OE2 3.44Å; S65-E248 PolarHBondContact OG-OE2 3.2Å; F66-E248 WeakPolarHBondContact CB-OE1 3.36Å; F66-E248 PolarHBondContact N-OE1 3.39Å; N244-E248 WeakPolarHBondContact O-CB 3.4Å; N244-E248 WeakPolarHBondContact O-CG 3.15Å; N244-E248 PolarHBondContact O-N 3.24Å; V246-E248 VanDerWaalsContact C-N 3.25Å; V246-E248 PolarHBondContact O-N 3.08Å; E248-R250 HydrophobicContact CB-CG 4.08Å; E248-R250 PolarHBondContact O-N 2.7Å; E248-R250 VanDerWaalsContact O-N 3.09Å; E248-R250 IonicContact OE2-CZ 2.87Å; E248-R250 IonicContact OE2-NE 3.71Å; E248-R250 PolarHBondContact OE2-NE 3.16Å; E248-R250 IonicContact OE2-NH2 2.78Å
249Y95.1Very high96.6Very high102 Ų10244.3 Ų44.340%0.425%0.247SC..THydrogen-bonded Turntrans59.318-176.6-50.9-56.1000114.7K56 P57 P153 Y154 V246 S247K56-Y249 HydrophobicContact CB-CD1 4.17Å; K56-Y249 HydrophobicContact CB-CD2 4.09Å; K56-Y249 HydrophobicContact CB-CG 3.76Å; K56-Y249 HydrophobicContact CD-CD1 4.32Å; K56-Y249 HydrophobicContact CD-CE1 4.39Å; K56-Y249 HydrophobicContact CG-CD1 3.94Å; K56-Y249 HydrophobicContact CG-CE1 4.49Å; K56-Y249 HydrophobicContact CG-CG 4.06Å; P57-Y249 HydrophobicContact CG-CD2 4.01Å; P57-Y249 HydrophobicContact CG-CE2 3.93Å; P153-Y249 WeakPolarHBondContact CB-O 3.49Å; P153-Y249 WeakPolarHBondContact CD-O 3.38Å; P153-Y249 VanDerWaalsContact CG-O 3.27Å; P153-Y249 WeakPolarHBondContact CG-O 3.33Å; Y154-Y249 WeakPolarHBondContact CD1-O 3.21Å; V246-Y249 PolarHBondContact O-N 2.85Å; S247-Y249 VanDerWaalsContact C-N 3.28Å
250R95Very high96.6Very high11 Ų1140.4 Ų40.44%0.04223%0.23CC..SBendtrans-76.8-29.4179.6-67.4-170.5-171.3-106.6-0.1112.8P59 T61 E62 S65 S152 Y154 R245 E248P59-R250 HydrophobicContact CG-CG 3.87Å; T61-R250 PolarHBondContact O-NH2 3.05Å; E62-R250 IonicContact OE1-CZ 3.95Å; E62-R250 IonicContact OE1-NH1 3.87Å; E62-R250 PolarHBondContact OE1-NH1 3.2Å; E62-R250 IonicContact OE2-CZ 2.71Å; E62-R250 IonicContact OE2-NH1 2.92Å; E62-R250 PolarHBondContact OE2-NH1 2.79Å; S65-R250 PolarHBondContact OG-NE 3.31Å; S65-R250 PolarHBondContact OG-NH2 2.84Å; S152-R250 WeakPolarHBondContact CB-O 3.27Å; Y154-R250 HydrophobicContact CE1-CG 4.4Å; R245-R250 PolarHBondContact O-N 2.82Å; E248-R250 HydrophobicContact CB-CG 4.08Å; E248-R250 PolarHBondContact O-N 2.7Å; E248-R250 VanDerWaalsContact O-N 3.09Å; E248-R250 IonicContact OE2-CZ 2.87Å; E248-R250 IonicContact OE2-NE 3.71Å; E248-R250 PolarHBondContact OE2-NE 3.16Å; E248-R250 IonicContact OE2-NH2 2.78Å
251N96.6Very high96.7Very high15 Ų1541.1 Ų41.18%0.0823%0.233CC..SBendtrans-137.8151.8179.4-67.2118.8000111.2S194 S197 R245 D255 V256S194-N251 PolarHBondContact O-ND2 2.96Å; S194-N251 PolarHBondContact OG-ND2 2.89Å; S194-N251 VanDerWaalsContact OG-ND2 3.1Å; S197-N251 PolarHBondContact OG-OD1 2.6Å; S197-N251 VanDerWaalsContact OG-OD1 3.06Å; R245-N251 HydrophobicContact CB-CB 4.17Å; R245-N251 WeakPolarHBondContact CB-OD1 3.42Å; R245-N251 PolarHBondContact O-N 2.78Å; N251-D255 HydrophobicContact CB-CB 4.2Å; N251-V256 HydrophobicContact CB-CG2 4.02Å
252H96.6Very high96.9Very high42 Ų4242.6 Ų42.619%0.19424%0.239CC..  trans-73.8157.6165.4-62.8-87.3000110.3L151 S254 D255 V256L151-H252 PolarHBondContact O-CD2 2.83Å; L151-H252 PolarHBondContact O-NE2 2.98Å; H252-S254 WeakPolarHBondContact CB-OG 3.48Å; H252-S254 PolarHBondContact O-N 3.37Å; H252-D255 IonicContact CD2-OD2 3.91Å; H252-D255 IonicContact CG-OD2 2.96Å; H252-D255 PolarHBondContact N-OD2 3.09Å; H252-D255 WeakPolarHBondContact O-CB 3.39Å; H252-D255 PolarHBondContact O-N 2.04Å; H252-D255 VanDerWaalsContact O-N 3.07Å; H252-V256 PolarHBondContact O-N 3.47Å
253C97.3Very high97Very high82 Ų8242.6 Ų42.655%0.55424%0.239SC*.Hα-helixtrans-56.6-37174.5-65.30000112.1V246 D255 V256 V257V246-C253 VanDerWaalsContact CG1-SG 3.51Å; C253-D255 VanDerWaalsContact C-N 3.3Å; C253-D255 PolarHBondContact O-N 3.23Å; C253-V256 PolarHBondContact O-N 3.06Å; C253-V257 WeakPolarHBondContact O-CG2 3.36Å; C253-V257 PolarHBondContact O-N 3.38Å
254S97.2Very high97.1Very high73 Ų7340.6 Ų40.651%0.5123%0.231SC..Hα-helixtrans-57.7-41.7175.7460000112.4H252 V256 V257 A258H252-S254 WeakPolarHBondContact CB-OG 3.48Å; H252-S254 PolarHBondContact O-N 3.37Å; S254-V256 VanDerWaalsContact C-N 3.33Å; S254-V256 PolarHBondContact O-N 3.26Å; S254-V257 PolarHBondContact O-N 2.94Å; S254-A258 WeakPolarHBondContact O-CB 3.36Å; S254-A258 PolarHBondContact O-N 3.14Å
255D97.8Very high97.2Very high8 Ų841.3 Ų41.34%0.04324%0.242CC..Hα-helixtrans-69.4-37.6-175.7-46.3-14.4000110.4S194 F195 S197 N251 H252 C253 G259S194-D255 PolarHBondContact OG-OD2 2.93Å; F195-D255 HydrophobicContact CD2-CB 4.13Å; F195-D255 WeakPolarHBondContact CD2-OD1 3.17Å; S197-D255 PolarHBondContact N-O 3.12Å; N251-D255 HydrophobicContact CB-CB 4.2Å; H252-D255 IonicContact CD2-OD2 3.91Å; H252-D255 IonicContact CG-OD2 2.96Å; H252-D255 PolarHBondContact N-OD2 3.09Å; H252-D255 WeakPolarHBondContact O-CB 3.39Å; H252-D255 PolarHBondContact O-N 2.04Å; H252-D255 VanDerWaalsContact O-N 3.07Å; C253-D255 VanDerWaalsContact C-N 3.3Å; C253-D255 PolarHBondContact O-N 3.23Å; D255-G259 PolarHBondContact O-N 2.96Å
256V98.3Very high97.3Very high5 Ų541.9 Ų41.93%0.0325%0.246CC..Hα-helixtrans-68.9-44.1175.2173.80000111.1A200 R245 V246 N251 H252 C253 S254 G259 F260A200-V256 HydrophobicContact CB-CB 4.36Å; A200-V256 HydrophobicContact CB-CG1 3.88Å; R245-V256 HydrophobicContact CB-CG2 4.34Å; V246-V256 HydrophobicContact CG2-CB 4.39Å; V246-V256 HydrophobicContact CG2-CG2 3.76Å; N251-V256 HydrophobicContact CB-CG2 4.02Å; H252-V256 PolarHBondContact O-N 3.47Å; C253-V256 PolarHBondContact O-N 3.06Å; S254-V256 VanDerWaalsContact C-N 3.33Å; S254-V256 PolarHBondContact O-N 3.26Å; V256-G259 PolarHBondContact O-N 3.38Å; V256-F260 HydrophobicContact CG1-CD2 4.06Å; V256-F260 HydrophobicContact CG1-CE1 4.4Å; V256-F260 HydrophobicContact CG1-CE2 3.58Å; V256-F260 HydrophobicContact CG1-CZ 3.77Å; V256-F260 WeakPolarHBondContact O-CG 3.43Å; V256-F260 PolarHBondContact O-N 2.94Å
257V98.4Very high97.3Very high81 Ų8140.2 Ų40.249%0.49124%0.235SC..Hα-helixtrans-63.2-45.8176.5170.70000111.2C253 S254 G259 F260 I261C253-V257 WeakPolarHBondContact O-CG2 3.36Å; C253-V257 PolarHBondContact O-N 3.38Å; S254-V257 PolarHBondContact O-N 2.94Å; V257-G259 VanDerWaalsContact C-N 3.27Å; V257-G259 PolarHBondContact O-N 3.04Å; V257-F260 PolarHBondContact O-N 3.24Å; V257-F260 VanDerWaalsContact O-N 3.16Å; V257-I261 HydrophobicContact CG1-CD1 3.96Å; V257-I261 WeakPolarHBondContact O-CG1 3.17Å; V257-I261 PolarHBondContact O-N 3.47Å
258A98.4Very high97.3Very high26 Ų2640.2 Ų40.222%0.21523%0.229CC..Hα-helixtrans-59.4-42174.400000111.1F195 P196 S254 F260 I261 L262F195-A258 HydrophobicContact CD2-CB 4.39Å; F195-A258 HydrophobicContact CE2-CB 3.43Å; F195-A258 VanDerWaalsContact CE2-CB 3.43Å; F195-A258 HydrophobicContact CZ-CB 3.7Å; P196-A258 HydrophobicContact CB-CB 4.32Å; S254-A258 WeakPolarHBondContact O-CB 3.36Å; S254-A258 PolarHBondContact O-N 3.14Å; A258-F260 VanDerWaalsContact C-N 3.34Å; A258-F260 PolarHBondContact O-N 3.26Å; A258-I261 PolarHBondContact O-N 3.25Å; A258-L262 WeakPolarHBondContact O-CB 3.42Å; A258-L262 PolarHBondContact O-N 3Å
259G98.4Very high97.3Very high0 Ų044.7 Ų44.70%025%0.248CC..Hα-helixtrans-59.2-44.4174.500000112.5S201 D255 V256 V257 L262 G263S201-G259 VanDerWaalsContact CA-O 3.27Å; S201-G259 WeakPolarHBondContact CA-O 3.48Å; S201-G259 WeakPolarHBondContact CB-O 3.3Å; S201-G259 VanDerWaalsContact OG-C 3.23Å; S201-G259 WeakPolarHBondContact OG-CA 3.41Å; S201-G259 PolarHBondContact OG-O 3.38Å; D255-G259 PolarHBondContact O-N 2.96Å; V256-G259 PolarHBondContact O-N 3.38Å; V257-G259 VanDerWaalsContact C-N 3.27Å; V257-G259 PolarHBondContact O-N 3.04Å; G259-L262 PolarHBondContact O-N 2.94Å; G259-G263 PolarHBondContact O-N 2.69Å
260F98.6Very high97.2Very high30 Ų3040 Ų4013%0.13223%0.23CC..Hα-helixtrans-64.5-40.5177.6-72.2-27.6000113.3A200 V204 F239 V256 V257 A258 S264A200-F260 HydrophobicContact CB-CD1 3.86Å; A200-F260 HydrophobicContact CB-CE1 3.73Å; A200-F260 HydrophobicContact CB-CZ 4.38Å; A200-F260 WeakPolarHBondContact O-CD1 3.41Å; V204-F260 HydrophobicContact CB-CD1 3.71Å; V204-F260 HydrophobicContact CB-CE1 4.27Å; V204-F260 HydrophobicContact CG1-CB 4.4Å; V204-F260 HydrophobicContact CG1-CD1 3.95Å; V204-F260 WeakPolarHBondContact CG1-O 3.47Å; V204-F260 HydrophobicContact CG2-CD1 4.2Å; F239-F260 AromaticContact CD2-CE2 3.69Å; F239-F260 HydrophobicContact CD2-CE2 3.69Å; F239-F260 HydrophobicContact CD2-CZ 4.12Å; F239-F260 HydrophobicContact CE2-CE2 4.11Å; V256-F260 HydrophobicContact CG1-CD2 4.06Å; V256-F260 HydrophobicContact CG1-CE1 4.4Å; V256-F260 HydrophobicContact CG1-CE2 3.58Å; V256-F260 HydrophobicContact CG1-CZ 3.77Å; V256-F260 WeakPolarHBondContact O-CG 3.43Å; V256-F260 PolarHBondContact O-N 2.94Å; V257-F260 PolarHBondContact O-N 3.24Å; V257-F260 VanDerWaalsContact O-N 3.16Å; A258-F260 VanDerWaalsContact C-N 3.34Å; A258-F260 PolarHBondContact O-N 3.26Å; F260-S264 VanDerWaalsContact O-CB 3.22Å; F260-S264 WeakPolarHBondContact O-CB 3.35Å; F260-S264 PolarHBondContact O-N 3.49Å; F260-S264 PolarHBondContact O-OG 2.85Å
261I98.6Very high96.9Very high113 Ų11339.5 Ų39.558%0.57923%0.228SC*.Hα-helixtrans-62.9-48.2176.6-68.4166.5000109.9V257 A258 S264 A265V257-I261 HydrophobicContact CG1-CD1 3.96Å; V257-I261 WeakPolarHBondContact O-CG1 3.17Å; V257-I261 PolarHBondContact O-N 3.47Å; A258-I261 PolarHBondContact O-N 3.25Å; I261-S264 PolarHBondContact O-N 3.09Å; I261-A265 VanDerWaalsContact O-CB 3.29Å; I261-A265 WeakPolarHBondContact O-CB 3.4Å; I261-A265 PolarHBondContact O-N 3.07Å
262L98.5Very high96.5Very high45 Ų4542.6 Ų42.624%0.23624%0.244CC..Hα-helixtrans-59.3-53.5-179.8178.864.7000111.9F140 V141 P196 A258 G259 S264 A265 I266F140-L262 HydrophobicContact CB-CD1 4.29Å; F140-L262 HydrophobicContact CB-CD2 4.16Å; V141-L262 HydrophobicContact CG2-CD2 3.69Å; P196-L262 HydrophobicContact CG-CD2 4.31Å; A258-L262 WeakPolarHBondContact O-CB 3.42Å; A258-L262 PolarHBondContact O-N 3Å; G259-L262 PolarHBondContact O-N 2.94Å; L262-S264 VanDerWaalsContact C-N 3.34Å; L262-S264 PolarHBondContact O-N 2.96Å; L262-A265 PolarHBondContact O-N 2.87Å; L262-I266 HydrophobicContact CD1-CD1 4.02Å; L262-I266 HydrophobicContact CG-CD1 4.18Å; L262-I266 WeakPolarHBondContact O-CG1 3.4Å; L262-I266 PolarHBondContact O-N 3.22Å; L262-I266 VanDerWaalsContact O-N 3.09Å
263G98.3Very high95.9Very high0 Ų044.6 Ų44.60%026%0.262CS..Hα-helixtrans-62.1-41.4-178.800000112.5G259 A267G259-G263 PolarHBondContact O-N 2.69Å; G263-A267 WeakPolarHBondContact O-CB 3.41Å; G263-A267 PolarHBondContact O-N 2.63Å
264S98.2Very high95.3Very high30 Ų3043.9 Ų43.921%0.2126%0.255CS..Hα-helixtrans-65-42.5176.6-59.30000111.9F260 I261 L262 I266 A267 L268F260-S264 VanDerWaalsContact O-CB 3.22Å; F260-S264 WeakPolarHBondContact O-CB 3.35Å; F260-S264 PolarHBondContact O-N 3.49Å; F260-S264 PolarHBondContact O-OG 2.85Å; I261-S264 PolarHBondContact O-N 3.09Å; L262-S264 VanDerWaalsContact C-N 3.34Å; L262-S264 PolarHBondContact O-N 2.96Å; S264-I266 PolarHBondContact O-N 3.39Å; S264-A267 PolarHBondContact O-N 3.32Å; S264-L268 WeakPolarHBondContact O-CB 3.19Å; S264-L268 VanDerWaalsContact O-CG 3.22Å; S264-L268 WeakPolarHBondContact O-CG 2.99Å; S264-L268 PolarHBondContact O-N 3.27Å
265A98.1Very high94.4Very high53 Ų5340.6 Ų40.644%0.43823%0.232SC..Hα-helixtrans-61.1-45.3178.900000111.8I261 L262 L268 F269I261-A265 VanDerWaalsContact O-CB 3.29Å; I261-A265 WeakPolarHBondContact O-CB 3.4Å; I261-A265 PolarHBondContact O-N 3.07Å; L262-A265 PolarHBondContact O-N 2.87Å; A265-L268 PolarHBondContact O-N 2.89Å; A265-F269 VanDerWaalsContact O-CB 3.31Å; A265-F269 WeakPolarHBondContact O-CB 3.25Å; A265-F269 PolarHBondContact O-N 3.36Å
266I97.6Very high93Very high22 Ų2246 Ų4611%0.11326%0.26CS..Hα-helixtrans-64.5-44.7177.4-62.9170.4000110.6T137 F140 Y205 L262 S264 L268 F269 L270T137-I266 HydrophobicContact CG2-CD1 4.29Å; T137-I266 WeakPolarHBondContact OG1-CD1 3.24Å; F140-I266 HydrophobicContact CD2-CD1 3.87Å; Y205-I266 HydrophobicContact CD2-CB 4.21Å; Y205-I266 HydrophobicContact CD2-CG2 4Å; Y205-I266 HydrophobicContact CE2-CG2 3.87Å; L262-I266 HydrophobicContact CD1-CD1 4.02Å; L262-I266 HydrophobicContact CG-CD1 4.18Å; L262-I266 WeakPolarHBondContact O-CG1 3.4Å; L262-I266 PolarHBondContact O-N 3.22Å; L262-I266 VanDerWaalsContact O-N 3.09Å; S264-I266 PolarHBondContact O-N 3.39Å; I266-L268 PolarHBondContact O-N 3.27Å; I266-F269 PolarHBondContact O-N 3.46Å; I266-L270 HydrophobicContact CG2-CD1 3.97Å; I266-L270 HydrophobicContact CG2-CG 4.43Å; I266-L270 WeakPolarHBondContact O-CG 3.17Å; I266-L270 PolarHBondContact O-N 3.02Å
267A96.6Very high91.3Very high0 Ų049.2 Ų49.20%028%0.278CS..Hα-helixtrans-61.3-45.1178.600000112.2Y205 V208 G263 S264 G271Y205-A267 HydrophobicContact CD2-CB 3.68Å; Y205-A267 HydrophobicContact CE2-CB 3.99Å; Y205-A267 HydrophobicContact CG-CB 4.46Å; V208-A267 HydrophobicContact CB-CB 3.86Å; V208-A267 HydrophobicContact CG1-CB 3.66Å; G263-A267 WeakPolarHBondContact O-CB 3.41Å; G263-A267 PolarHBondContact O-N 2.63Å; S264-A267 PolarHBondContact O-N 3.32Å; A267-G271 PolarHBondContact O-N 3.34Å
268L95.2Very high89.7Confident78 Ų7845.6 Ų45.641%0.40826%0.255SS..Hα-helixtrans-65.1-44.7177.3-70.2171.7000111.5V208 M212 S264 A265 I266 G271 I272V208-L268 HydrophobicContact CG1-CD2 4.33Å; V208-L268 HydrophobicContact CG1-CG 4.39Å; M212-L268 HydrophobicContact CE-CD2 4.48Å; M212-L268 HydrophobicContact SD-CD2 3.99Å; S264-L268 WeakPolarHBondContact O-CB 3.19Å; S264-L268 VanDerWaalsContact O-CG 3.22Å; S264-L268 WeakPolarHBondContact O-CG 2.99Å; S264-L268 PolarHBondContact O-N 3.27Å; A265-L268 PolarHBondContact O-N 2.89Å; I266-L268 PolarHBondContact O-N 3.27Å; L268-G271 PolarHBondContact O-N 3.35Å; L268-I272 HydrophobicContact CB-CD1 4.39Å; L268-I272 HydrophobicContact CD2-CD1 4.2Å; L268-I272 WeakPolarHBondContact O-CB 2.9Å; L268-I272 VanDerWaalsContact O-CG1 3.26Å; L268-I272 WeakPolarHBondContact O-CG1 3.34Å; L268-I272 PolarHBondContact O-N 3.25Å
269F94.7Very high87.5Confident122 Ų12251.7 Ų51.754%0.53528%0.277SS..Iπ-helixtrans-57.9-50.7176.7173.5-104.6000111.5A265 I266 C273 V274A265-F269 VanDerWaalsContact O-CB 3.31Å; A265-F269 WeakPolarHBondContact O-CB 3.25Å; A265-F269 PolarHBondContact O-N 3.36Å; I266-F269 PolarHBondContact O-N 3.46Å; F269-C273 HydrophobicContact CD2-CB 4.2Å; F269-C273 HydrophobicContact CE2-CB 4.2Å; F269-C273 WeakPolarHBondContact O-CA 3.15Å; F269-C273 WeakPolarHBondContact O-CB 3.35Å; F269-C273 PolarHBondContact O-N 3.07Å; F269-V274 HydrophobicContact CE1-CG2 4.44Å
270L93.4Very high85.1Confident5 Ų553.4 Ų53.43%0.02630%0.295CS..Iπ-helixtrans-67.8-45.5-179.8-66.9177.9000112.1V129 F132 Y205 I266 V274 V275V129-L270 HydrophobicContact CG1-CB 4.01Å; V129-L270 HydrophobicContact CG1-CD1 4.5Å; V129-L270 HydrophobicContact CG1-CD2 4.47Å; F132-L270 HydrophobicContact CD1-CD1 4.14Å; F132-L270 HydrophobicContact CD1-CD2 4.05Å; F132-L270 HydrophobicContact CE1-CD2 4.08Å; Y205-L270 HydrophobicContact CE2-CD1 4.2Å; I266-L270 HydrophobicContact CG2-CD1 3.97Å; I266-L270 HydrophobicContact CG2-CG 4.43Å; I266-L270 WeakPolarHBondContact O-CG 3.17Å; I266-L270 PolarHBondContact O-N 3.02Å; L270-V274 HydrophobicContact CD2-CB 4.39Å; L270-V274 HydrophobicContact CD2-CG2 3.79Å; L270-V274 WeakPolarHBondContact O-CB 3.24Å; L270-V274 PolarHBondContact O-N 3Å; L270-V274 VanDerWaalsContact O-N 3.13Å; L270-V275 WeakPolarHBondContact O-CG2 3.3Å; L270-V275 PolarHBondContact O-N 2.01Å
271G88.5Confident82.3Confident0 Ų058.4 Ų58.40%033%0.327CS..Iπ-helixtrans-68.8-37-177.400000113.8A267 L268 N277A267-G271 PolarHBondContact O-N 3.34Å; L268-G271 PolarHBondContact O-N 3.35Å; G271-N277 PolarHBondContact O-N 3.5Å
272I87.3Confident79.4Confident79 Ų7960.8 Ų60.841%0.40534%0.336SS..Iπ-helixtrans-85.7-53.9-179.7-59174.8000110.5M212 L268 N276M212-I272 HydrophobicContact CE-CG1 3.67Å; L268-I272 HydrophobicContact CB-CD1 4.39Å; L268-I272 HydrophobicContact CD2-CD1 4.2Å; L268-I272 WeakPolarHBondContact O-CB 2.9Å; L268-I272 VanDerWaalsContact O-CG1 3.26Å; L268-I272 WeakPolarHBondContact O-CG1 3.34Å; L268-I272 PolarHBondContact O-N 3.25Å; I272-N276 WeakPolarHBondContact O-CA 3.47Å; I272-N276 PolarHBondContact O-N 3.47Å
273C84Confident76.2Confident84 Ų8465.1 Ų65.157%0.56836%0.359SS*.Iπ-helixtrans-83.7-37.8-169.5-560000113.3F269F269-C273 HydrophobicContact CD2-CB 4.2Å; F269-C273 HydrophobicContact CE2-CB 4.2Å; F269-C273 WeakPolarHBondContact O-CA 3.15Å; F269-C273 WeakPolarHBondContact O-CB 3.35Å; F269-C273 PolarHBondContact O-N 3.07Å
274V84.4Confident73.1Confident67 Ų6770.7 Ų70.741%0.40640%0.395SS..Iπ-helixtrans-93-47.3-174.6-179.20000111.8R125 V129 F269 L270 N276R125-V274 PolarHBondContact NH2-O 3.13Å; V129-V274 HydrophobicContact CG1-CG1 4.4Å; V129-V274 HydrophobicContact CG2-CG1 4.2Å; F269-V274 HydrophobicContact CE1-CG2 4.44Å; L270-V274 HydrophobicContact CD2-CB 4.39Å; L270-V274 HydrophobicContact CD2-CG2 3.79Å; L270-V274 WeakPolarHBondContact O-CB 3.24Å; L270-V274 PolarHBondContact O-N 3Å; L270-V274 VanDerWaalsContact O-N 3.13Å; V274-N276 PolarHBondContact O-N 3.19Å
275V78.9Confident70.1Confident5 Ų573.7 Ų73.73%0.0342%0.421CS..SBendtrans-76.8-17.1-179.7-175.80000111.7R125 F126 V129 L270 F278R125-V275 PolarHBondContact NH2-O 3.23Å; F126-V275 HydrophobicContact CD1-CG1 3.77Å; F126-V275 HydrophobicContact CE1-CG1 3.41Å; F126-V275 VanDerWaalsContact CE1-CG1 3.41Å; V129-V275 HydrophobicContact CB-CG2 4.13Å; V129-V275 HydrophobicContact CG1-CG2 3.68Å; V129-V275 HydrophobicContact CG2-CG2 4.27Å; L270-V275 WeakPolarHBondContact O-CG2 3.3Å; L270-V275 PolarHBondContact O-N 2.01Å; V275-F278 HydrophobicContact CB-CE2 4.45Å; V275-F278 HydrophobicContact CB-CZ 4.4Å; V275-F278 HydrophobicContact CG1-CD1 3.66Å; V275-F278 HydrophobicContact CG1-CD2 4.13Å; V275-F278 HydrophobicContact CG1-CE1 3.79Å; V275-F278 HydrophobicContact CG1-CE2 4.25Å; V275-F278 HydrophobicContact CG1-CG 3.82Å; V275-F278 HydrophobicContact CG1-CZ 4.09Å; V275-F278 HydrophobicContact CG2-CE1 4.5Å; V275-F278 HydrophobicContact CG2-CZ 4.32Å
276N67.8Low66.8Low121 Ų12177.3 Ų77.365%0.64744%0.439SS*.  trans54.359-178.1-163.915.1000111.7I272 V274I272-N276 WeakPolarHBondContact O-CA 3.47Å; I272-N276 PolarHBondContact O-N 3.47Å; V274-N276 PolarHBondContact O-N 3.19Å
277N63.4Low63.5Low73 Ų7385.8 Ų85.839%0.3948%0.475SS..THydrogen-bonded Turntrans53.457.7177.3-83.8-56.8000114.2G271 K279G271-N277 PolarHBondContact O-N 3.5Å; N277-K279 WeakPolarHBondContact O-CA 3.41Å; N277-K279 VanDerWaalsContact O-CB 3.26Å; N277-K279 WeakPolarHBondContact O-CB 3.25Å; N277-K279 WeakPolarHBondContact O-CG 3.21Å; N277-K279 PolarHBondContact O-N 3.07Å
278F64.7Low60.3Low4 Ų494.9 Ų94.92%0.01852%0.517CS..THydrogen-bonded Turntrans29.110.3165.3-68.3-87000120.8R122 F126 Y209 M212 Y213 V275 G280R122-F278 PolarHBondContact NH2-O 3.34Å; F126-F278 AromaticContact CD1-CD1 3.54Å; F126-F278 HydrophobicContact CD1-CD1 3.54Å; F126-F278 AromaticContact CD1-CE1 3.59Å; F126-F278 HydrophobicContact CD1-CE1 3.59Å; F126-F278 HydrophobicContact CE1-CB 4.45Å; F126-F278 AromaticContact CE1-CD1 3.28Å; F126-F278 HydrophobicContact CE1-CD1 3.28Å; F126-F278 AromaticContact CE1-CE1 3.85Å; F126-F278 HydrophobicContact CE1-CE1 3.85Å; F126-F278 HydrophobicContact CE1-CG 4.18Å; F126-F278 HydrophobicContact CG-CD1 4.33Å; F126-F278 HydrophobicContact CG-CE1 4.32Å; F126-F278 AromaticContact CZ-CD1 3.85Å; F126-F278 HydrophobicContact CZ-CD1 3.85Å; Y209-F278 HydrophobicContact CD1-CZ 4.45Å; Y209-F278 HydrophobicContact CD2-CZ 4.31Å; Y209-F278 HydrophobicContact CE1-CE1 4.12Å; Y209-F278 AromaticContact CE1-CZ 3.93Å; Y209-F278 HydrophobicContact CE1-CZ 3.93Å; Y209-F278 AromaticContact CE2-CZ 3.77Å; Y209-F278 HydrophobicContact CE2-CZ 3.77Å; Y209-F278 AromaticContact CZ-CE1 3.9Å; Y209-F278 AromaticContact CZ-CZ 3.58Å; M212-F278 HydrophobicContact CB-CD2 4.35Å; M212-F278 HydrophobicContact CB-CE2 3.85Å; M212-F278 HydrophobicContact CE-CE2 4.42Å; Y213-F278 AromaticContact CD2-CD1 3.76Å; Y213-F278 HydrophobicContact CD2-CD1 3.76Å; Y213-F278 AromaticContact CD2-CE1 3.91Å; Y213-F278 HydrophobicContact CD2-CE1 3.91Å; V275-F278 HydrophobicContact CB-CE2 4.45Å; V275-F278 HydrophobicContact CB-CZ 4.4Å; V275-F278 HydrophobicContact CG1-CD1 3.66Å; V275-F278 HydrophobicContact CG1-CD2 4.13Å; V275-F278 HydrophobicContact CG1-CE1 3.79Å; V275-F278 HydrophobicContact CG1-CE2 4.25Å; V275-F278 HydrophobicContact CG1-CG 3.82Å; V275-F278 HydrophobicContact CG1-CZ 4.09Å; V275-F278 HydrophobicContact CG2-CE1 4.5Å; V275-F278 HydrophobicContact CG2-CZ 4.32Å; F278-G280 PolarHBondContact O-N 3.19Å
279K53.2Low57Low155 Ų155100.6 Ų100.667%0.67454%0.538SS*.  trans-82.1114.8-170.1-81.3169.5-172.6-177.70103.8N277 V281N277-K279 WeakPolarHBondContact O-CA 3.41Å; N277-K279 VanDerWaalsContact O-CB 3.26Å; N277-K279 WeakPolarHBondContact O-CB 3.25Å; N277-K279 WeakPolarHBondContact O-CG 3.21Å; N277-K279 PolarHBondContact O-N 3.07Å; K279-V281 PolarHBondContact O-N 3.37Å
280G47.2Very low53.9Low36 Ų36101.4 Ų101.437%0.37155%0.554SS.*  trans-50132.4168.800000108.4F278 H282F278-G280 PolarHBondContact O-N 3.19Å; G280-H282 PolarHBondContact O-N 3.49Å
281V39.5Very low50.8Low134 Ų134110.1 Ų110.181%0.81259%0.594SS**  trans-37106.6179.2175.90000108.9K279 N283K279-V281 PolarHBondContact O-N 3.37Å; V281-N283 PolarHBondContact O-N 3.16Å
282H38.9Very low47.8Very low164 Ų164118.6 Ų118.676%0.75963%0.634SS**  trans-65.7128.2166.8-133.9-83.3000105G280G280-H282 PolarHBondContact O-N 3.49Å
283N30.8Very low45.2Very low136 Ų136125.8 Ų125.873%0.72766%0.657SS**  trans-44127.9163.6-74.3-24.4000107.2V281 A285V281-N283 PolarHBondContact O-N 3.16Å; N283-A285 PolarHBondContact O-N 2.93Å
284P32.2Very low42.9Very low116 Ų116133.3 Ų133.375%0.75367%0.674SS**  trans-56.4119.2174.223.3-30.5000106.1T286P284-T286 PolarHBondContact O-N 3.04Å
285A35.8Very low40.3Very low93 Ų93133 Ų13377%0.76968%0.684SS**  trans-50.2122.7168.100000106.4N283 K287N283-A285 PolarHBondContact O-N 2.93Å; A285-K287 PolarHBondContact O-N 3.36Å; A285-K287 VanDerWaalsContact O-N 3.14Å
286T29.2Very low38.3Very low130 Ų130140.7 Ų140.780%0.79872%0.724SS**  trans-37.4121.6170.7-52.60000108.4P284 Q288P284-T286 PolarHBondContact O-N 3.04Å; T286-Q288 PolarHBondContact O-N 3.05Å
287K28.3Very low36.8Very low200 Ų200140.4 Ų140.487%0.8773%0.729SS**  trans-51104.5168.9-71.9-178.6176.6-177.40107.1A285 K289A285-K287 PolarHBondContact O-N 3.36Å; A285-K287 VanDerWaalsContact O-N 3.14Å; K287-K289 VanDerWaalsContact C-N 3.32Å; K287-K289 PolarHBondContact O-N 2.67Å
288Q28.3Very low35.6Very low190 Ų190144 Ų14489%0.88875%0.748SS**  trans-64.6104.9159.4-93178.3-33.800105.2T286 T290T286-Q288 PolarHBondContact O-N 3.05Å; Q288-T290 PolarHBondContact O-N 3.04Å
289K26.9Very low34.2Very low198 Ų198151.7 Ų151.786%0.86179%0.786SS**  trans-52.2126.1163.8-113179.9172.6-175.40106.9K287 E291K287-K289 VanDerWaalsContact C-N 3.32Å; K287-K289 PolarHBondContact O-N 2.67Å; K289-E291 PolarHBondContact O-N 3.21Å
290T28.9Very low33.5Very low139 Ų139150.2 Ų150.285%0.85379%0.79SS**  trans-45.7115.9161.4-53.30000109.1Q288Q288-T290 PolarHBondContact O-N 3.04Å
291E28.5Very low32.9Very low189 Ų189157.6 Ų157.688%0.88381%0.812SS**  trans-110.5125.9157.1-104.4-167.1166.300108.8K289 Y293K289-E291 PolarHBondContact O-N 3.21Å; E291-Y293 PolarHBondContact O-N 3.33Å
292E26.8Very low32.7Very low177 Ų177156.8 Ų156.883%0.82781%0.81SS**  trans-77.8107.2-172.7-163.6174.6-172.200108.3R294E292-R294 VanDerWaalsContact C-N 3.3Å; E292-R294 PolarHBondContact O-N 2.91Å
293Y32.2Very low32.6Very low230 Ų230159.2 Ų159.290%0.90281%0.812SS**  trans-79.879.7178.2-141-91.6000110E291E291-Y293 PolarHBondContact O-N 3.33Å
294R34.3Very low32.8Very low242 Ų242159.1 Ų159.191%0.91382%0.816SS**  trans-133.198.3160.5-109.3-172.5179.6169.90.8108.8E292E292-R294 VanDerWaalsContact C-N 3.3Å; E292-R294 PolarHBondContact O-N 2.91Å
295G31.3Very low33.2Very low60 Ų60160.2 Ų160.262%0.61981%0.811SS**  trans164.886.7173.400000111.9
296L35.7Very low33.2Very low167 Ų167159.6 Ų159.687%0.87480%0.801SS**  trans-58.3146.4160.2-114.184.6000109.5
297P37.7Very low33.7Very low115 Ų115158.8 Ų158.875%0.74780%0.798SS**  -127.5139.7127.926.5-12000112.4M299P297-M299 PolarHBondContact O-N 3.47Å
298L37.3Very low34.4Very low150 Ų150156.3 Ų156.379%0.78579%0.794SS**PPolyproline II helixtrans-56.4116.3176.7-160.887.2000110.6T300L298-T300 PolarHBondContact O-N 2.76Å
299M36.1Very low35.2Very low165 Ų165154.7 Ų154.781%0.81379%0.786SS**PPolyproline II helixtrans-78.4117169.8-84.5-74.4-143.700109.8P297P297-M299 PolarHBondContact O-N 3.47Å
300T38.4Very low36Very low124 Ų124150.5 Ų150.576%0.76178%0.777SS**PPolyproline II helixtrans-86124.4168.3-41.70000109L298L298-T300 PolarHBondContact O-N 2.76Å
301F33.8Very low36.6Very low190 Ų190150.9 Ų150.983%0.83377%0.773SS**PPolyproline II helixtrans-85.5133.9176.3-73.4-86.6000111.3
302P34.5Very low37.4Very low118 Ų118146.3 Ų146.377%0.76676%0.762SS**PPolyproline II helixtrans-83.7129.4162.3106.2000110.5
303R37.6Very low38.4Very low214 Ų214141.6 Ų141.681%0.80875%0.754SS**PPolyproline II helixtrans-74.8126.3172.5-175.9-174.7175.8109.51.3109.5E305R303-E305 IonicContact CZ-OE1 3.83Å; R303-E305 IonicContact NE-OE1 2.75Å; R303-E305 PolarHBondContact NE-OE1 3.15Å; R303-E305 IonicContact NH2-OE1 3.93Å; R303-E305 PolarHBondContact NH2-OE1 3.07Å
304V36Very low38.9Very low135 Ų135138.3 Ų138.382%0.81875%0.746SS**  trans-132.5117.1170.2179.60000108
305E38.9Very low39.2Very low138 Ų138133.8 Ų133.865%0.64574%0.74SS**  trans-71.3145.7177.5-98.3117.8-155.200112.3R303R303-E305 IonicContact CZ-OE1 3.83Å; R303-E305 IonicContact NE-OE1 2.75Å; R303-E305 PolarHBondContact NE-OE1 3.15Å; R303-E305 IonicContact NH2-OE1 3.93Å; R303-E305 PolarHBondContact NH2-OE1 3.07Å
306S36Very low39.6Very low80 Ų80139.7 Ų139.756%0.55975%0.752SS**  trans-85.6138.6-175.2167.10000112.6L308S306-L308 PolarHBondContact OG-N 3.33Å
307P40.8Very low39.8Very low113 Ų113137.3 Ų137.373%0.73475%0.749SS**SBendtrans-89.513.4171.7-3.722.9000115.2
308L41.8Very low40.1Very low148 Ų148136.5 Ų136.578%0.77575%0.752SS**SBendtrans-115.831.4-171.6-147.276.7000114S306S306-L308 PolarHBondContact OG-N 3.33Å
309E45.3Very low40Very low157 Ų157134.9 Ų134.973%0.73475%0.753SS**SBendtrans-117.7-3.9169.8-74.8-170.6137.100113.2
310T43.9Very low40Very low109 Ų109135.4 Ų135.467%0.66976%0.755SS**SBendtrans-89.11.3-177.4370000115.2
311L41.3Very low39.7Very low147 Ų147135.6 Ų135.677%0.7776%0.757SS**SBendtrans-109-11.5178.7-79.5163.6000115
312S45.1Very low39.8Very low94 Ų94135.8 Ų135.866%0.65776%0.76SS**SBendtrans-94.9-11.9174.864.80000113.8
313A47.3Very low39.8Very low78 Ų78136.2 Ų136.265%0.64576%0.761SS**THydrogen-bonded Turntrans-86.8-5-178.500000114.5
314Q44.7Very low39.5Very low161 Ų161136 Ų13675%0.75278%0.783SS**THydrogen-bonded Turntrans-95.1-5.7-176-150.1161.3-9.300114.3
315N40.6Very low39.7Very low147 Ų147136.1 Ų136.179%0.78678%0.782SS**SBendtrans-104.74.8-175.8-99.41.9000116.1
316H38.7Very low39.8Very low184 Ų184136 Ų13685%0.85279%0.789SS**SBendtrans-123.99.9179.9-81.9-60.7000115.6
317S39.9Very low40Very low116 Ų116139.1 Ų139.181%0.81180%0.802SS**SBendtrans-115.336.6177.3-175.70000113.5
318A43.9Very low39.9Very low98 Ų98140.6 Ų140.681%0.8181%0.806SS**SBendtrans-137.563.1172.700000110.7
319S35.4Very low39.8Very low117 Ų117140.2 Ų140.282%0.81881%0.808SS**  trans-175.681160.6-176.50000110.3
320M35.5Very low39.4Very low175 Ų175139.1 Ų139.186%0.86281%0.813SS**SBendtrans-169.1120.3135.3-135.8142.416900111.2
321T32.5Very low39.1Very low128 Ų128141.2 Ų141.279%0.78582%0.823SS**  trans72.799.215451.80000120.3
322E35.1Very low39Very low194 Ų194140.8 Ų140.891%0.90783%0.827SS**  trans-85.1145.5150.3-162173.3-171.500108.9
323V35.3Very low38.4Very low128 Ų128144.7 Ų144.778%0.77684%0.841SS**  trans-105.7106.4175173.60000108.3
324T32.3Very low37.6Very low210 Ų210150.7 Ų150.7100%1.28886%0.859SS**  1640127.617.70000110.6

Retrieved 324 of 324 residues in 53.7 ms (Link to these results)