A0A087YAZ9_POEFO Loading...

Transporter

AlphaFold DB , UniProt , Accession A0A087YAZ9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 621 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M32.1Very low39Very low251 Ų251140.8 Ų140.8100%1.23682%0.816SS**  0101.90-112.7159.5158.500106.3
2G35.8Very low42.3Very low84 Ų84135.1 Ų135.187%0.86677%0.77SS**PPolyproline II helixtrans-83.4118.5179.500000109.3
3E32.6Very low45.6Very low193 Ų193129.5 Ų129.590%0.90274%0.743SS**PPolyproline II helixtrans-72.4127.8168.4-77.2-177.6155.200109.2K5E3-K5 PolarHBondContact O-N 3.38Å
4A32.7Very low48.8Very low93 Ų93129.6 Ų129.677%0.76973%0.73SS**PPolyproline II helixtrans-63.7123.6176.900000110.1N6A4-N6 PolarHBondContact O-N 3.46Å
5K35Very low51.7Low157 Ų157122.7 Ų122.768%0.68369%0.688SS**PPolyproline II helixtrans-61.9117.8168.8-86.4-172.1165.7-162.40109.2E3 E11E3-K5 PolarHBondContact O-N 3.38Å; K5-E11 IonicContact NZ-OE1 3.14Å; K5-E11 IonicContact NZ-OE2 2.92Å; K5-E11 PolarHBondContact NZ-OE2 3.31Å
6N30.6Very low54.2Low130 Ų130121.6 Ų121.670%0.69568%0.68SS**PPolyproline II helixtrans-62.5126.6169-89.3-26.3000109.6A4 G8A4-N6 PolarHBondContact O-N 3.46Å; N6-G8 PolarHBondContact O-N 3.44Å
7P30.2Very low56.5Low141 Ų141118.4 Ų118.492%0.91666%0.661SS**THydrogen-bonded Turntrans-81.533.1-170.233.7-36.2000113.9
8G35.9Very low58.6Low73 Ų73115.7 Ų115.775%0.75364%0.641SS**THydrogen-bonded Turntrans-142.40.2-173.800000116.4N6N6-G8 PolarHBondContact O-N 3.44Å
9T40.2Very low60.5Low108 Ų108113.9 Ų113.966%0.66363%0.634SS**  trans-109.6102.4173.7430000108.5E11T9-E11 PolarHBondContact O-N 2.84Å; T9-E11 VanDerWaalsContact O-N 3.08Å
10E56.9Low62.3Low197 Ų197108.4 Ų108.492%0.92160%0.603SS**  trans-56.1114.7163.5-78.3177.5164.900107.6R12E10-R12 PolarHBondContact O-N 3.24Å
11E66.7Low63.9Low122 Ų122103.2 Ų103.257%0.5757%0.574SS**PPolyproline II helixtrans-64.3123.9174.9-78.9-179.7148.800107.8K5 T9K5-E11 IonicContact NZ-OE1 3.14Å; K5-E11 IonicContact NZ-OE2 2.92Å; K5-E11 PolarHBondContact NZ-OE2 3.31Å; T9-E11 PolarHBondContact O-N 2.84Å; T9-E11 VanDerWaalsContact O-N 3.08Å
12R79Confident67Low72 Ų7293 Ų9327%0.27252%0.524SS..PPolyproline II helixtrans-52.7145.4172-94.6-167.9-178.3-142.9-6.8110.1E10 R77 M78 S272 Y273 E426E10-R12 PolarHBondContact O-N 3.24Å; R12-R77 WeakPolarHBondContact CD-O 3.49Å; R12-R77 PolarHBondContact NE-O 3.49Å; R12-R77 VanDerWaalsContact NE-O 3.1Å; R12-M78 VanDerWaalsContact NH1-C 3.29Å; R12-S272 PolarHBondContact NH1-OG 3.47Å; R12-Y273 HydrophobicContact CB-CD1 4.35Å; R12-Y273 HydrophobicContact CG-CE1 4.44Å; R12-E426 IonicContact NH2-OE1 3.52Å; R12-E426 PolarHBondContact NH2-OE1 3.33Å
13P85.9Confident69.8Low63 Ų6390.5 Ų90.541%0.40949%0.491SS..PPolyproline II helixtrans-61.4154175.730.8-36.5000109.8I197 Y273P13-I197 HydrophobicContact CB-CD1 3.65Å; P13-I197 HydrophobicContact CB-CG1 3.95Å; P13-I197 HydrophobicContact CG-CD1 3.88Å; P13-I197 HydrophobicContact CG-CG1 4.23Å; P13-Y273 HydrophobicContact CG-CD1 3.9Å; P13-Y273 HydrophobicContact CG-CE1 3.64Å; P13-Y273 WeakPolarHBondContact O-CB 3.21Å; P13-Y273 VanDerWaalsContact O-CD1 3.22Å; P13-Y273 WeakPolarHBondContact O-CD1 3.27Å
14K89.6Confident72.9Confident131 Ų13181.5 Ų81.557%0.5745%0.449SS*.  trans-125.7150-175.2-65.1179.3-175.8170.40109.5
15W93.2Very high76Confident25 Ų2577 Ų7710%0.09541%0.412CS..  trans-66139.1171.4-59.9110.2000111.4N17 Q20 Y21 T24 I197 M200 F270 Y273W15-N17 VanDerWaalsContact C-N 3.27Å; W15-N17 PolarHBondContact O-N 2.82Å; W15-Q20 HydrophobicContact CE3-CG 3.92Å; W15-Q20 HydrophobicContact CZ3-CG 4.27Å; W15-Y21 AromaticContact CD1-CD2 3.98Å; W15-Y21 AromaticContact CE2-CD2 3.84Å; W15-Y21 HydrophobicContact CZ2-CD2 4.23Å; W15-Y21 AromaticContact NE1-CD2 3.4Å; W15-T24 HydrophobicContact CH2-CG2 3.95Å; W15-I197 HydrophobicContact CE3-CD1 4.49Å; W15-I197 HydrophobicContact CH2-CB 4.3Å; W15-I197 HydrophobicContact CH2-CG2 4.3Å; W15-I197 HydrophobicContact CZ3-CB 4.07Å; W15-M200 HydrophobicContact CH2-CE 3.53Å; W15-M200 HydrophobicContact CZ3-CE 3.81Å; W15-F270 AromaticContact CH2-CD1 3.94Å; W15-F270 HydrophobicContact CH2-CD1 3.94Å; W15-F270 HydrophobicContact CH2-CE1 4.37Å; W15-F270 HydrophobicContact CZ2-CB 4Å; W15-F270 AromaticContact CZ2-CD1 3.82Å; W15-F270 HydrophobicContact CZ2-CD1 3.82Å; W15-F270 HydrophobicContact CZ2-CG 4.17Å; W15-F270 PolarHBondContact NE1-O 3.03Å; W15-Y273 HydrophobicContact CZ2-CD2 4.03Å
16D91.4Very high78.9Confident105 Ų10570.5 Ų70.556%0.56139%0.385SS*.SBendtrans-61.9-38.3175.3-68.6-31000111.4Q20D16-Q20 PolarHBondContact OD2-OE1 3.35Å
17N93.5Very high82Confident68 Ų6864.4 Ų64.436%0.36435%0.353SS..SBendtrans-155.6170.417766.456.2000112.6W15 V19 Q20 Y21 Y205W15-N17 VanDerWaalsContact C-N 3.27Å; W15-N17 PolarHBondContact O-N 2.82Å; N17-V19 VanDerWaalsContact C-N 3.34Å; N17-V19 PolarHBondContact O-N 3.36Å; N17-V19 WeakPolarHBondContact OD1-CA 3.45Å; N17-V19 WeakPolarHBondContact OD1-CB 3.47Å; N17-V19 PolarHBondContact OD1-N 3.27Å; N17-Q20 PolarHBondContact O-N 2.95Å; N17-Q20 PolarHBondContact OD1-N 3.36Å; N17-Y21 PolarHBondContact O-N 2.91Å; N17-Y205 PolarHBondContact ND2-OH 3.31Å; N17-Y205 PolarHBondContact OD1-OH 3.13Å; N17-Y205 VanDerWaalsContact OD1-OH 3.13Å
18K94.1Very high85.1Confident70 Ų7057.8 Ų57.830%0.30431%0.309SS..Hα-helixtrans-66-33.6-177.7-176.860.4-179.1-177.60113.8Y21 L22 N278 D283K18-Y21 HydrophobicContact CD-CD1 4.14Å; K18-Y21 PolarHBondContact O-N 3.33Å; K18-L22 HydrophobicContact CG-CD1 4.15Å; K18-L22 PolarHBondContact O-N 3.36Å; K18-N278 VanDerWaalsContact NZ-CG 3.29Å; K18-N278 PolarHBondContact NZ-ND2 3.47Å; K18-N278 VanDerWaalsContact NZ-ND2 3.15Å; K18-N278 PolarHBondContact NZ-OD1 3.34Å; K18-D283 WeakPolarHBondContact CE-OD1 3.36Å; K18-D283 IonicContact NZ-OD1 3.98Å; K18-D283 PolarHBondContact NZ-OD1 3.29Å; K18-D283 IonicContact NZ-OD2 2.75Å; K18-D283 PolarHBondContact NZ-OD2 3.49Å
19V94.6Very high87.9Confident81 Ų8154.4 Ų54.449%0.49127%0.274SS..Hα-helixtrans-67.9-41.5-178.5176.70000110.2N17 Y21 L22 L23 Y205N17-V19 VanDerWaalsContact C-N 3.34Å; N17-V19 PolarHBondContact O-N 3.36Å; N17-V19 WeakPolarHBondContact OD1-CA 3.45Å; N17-V19 WeakPolarHBondContact OD1-CB 3.47Å; N17-V19 PolarHBondContact OD1-N 3.27Å; V19-Y21 VanDerWaalsContact C-N 3.34Å; V19-Y21 PolarHBondContact O-N 3.48Å; V19-L22 PolarHBondContact O-N 3.45Å; V19-L23 HydrophobicContact CG1-CD1 3.75Å; V19-L23 HydrophobicContact CG1-CG 4.03Å; V19-L23 WeakPolarHBondContact O-CB 3.28Å; V19-L23 WeakPolarHBondContact O-CG 3.47Å; V19-L23 PolarHBondContact O-N 2.83Å; V19-Y205 HydrophobicContact CG1-CE1 4.15Å
20Q95.8Very high90.4Very high4 Ų449.5 Ų49.52%0.01924%0.244CC..Hα-helixtrans-56.8-46.5175.1-172.9166.2-32.200112.1W15 D16 N17 T24 G201 Y205W15-Q20 HydrophobicContact CE3-CG 3.92Å; W15-Q20 HydrophobicContact CZ3-CG 4.27Å; D16-Q20 PolarHBondContact OD2-OE1 3.35Å; N17-Q20 PolarHBondContact O-N 2.95Å; N17-Q20 PolarHBondContact OD1-N 3.36Å; Q20-T24 WeakPolarHBondContact O-CB 3.32Å; Q20-T24 PolarHBondContact O-N 3.16Å; Q20-T24 PolarHBondContact O-OG1 2.91Å; Q20-G201 WeakPolarHBondContact CG-O 3.43Å; Q20-Y205 HydrophobicContact CB-CE2 4.27Å; Q20-Y205 HydrophobicContact CG-CE2 4.24Å
21Y95.9Very high91.9Very high0 Ų040.3 Ų40.30%020%0.202CC..Hα-helixtrans-60.7-49.7175.1164.3-106.1000112.1W15 N17 K18 V19 T24 C25 F270 N274 D283W15-Y21 AromaticContact CD1-CD2 3.98Å; W15-Y21 AromaticContact CE2-CD2 3.84Å; W15-Y21 HydrophobicContact CZ2-CD2 4.23Å; W15-Y21 AromaticContact NE1-CD2 3.4Å; N17-Y21 PolarHBondContact O-N 2.91Å; K18-Y21 HydrophobicContact CD-CD1 4.14Å; K18-Y21 PolarHBondContact O-N 3.33Å; V19-Y21 VanDerWaalsContact C-N 3.34Å; V19-Y21 PolarHBondContact O-N 3.48Å; Y21-T24 WeakPolarHBondContact O-CB 3.4Å; Y21-T24 PolarHBondContact O-N 3.41Å; Y21-C25 WeakPolarHBondContact CE2-SG 3.34Å; Y21-C25 PolarHBondContact O-N 2.99Å; Y21-C25 PolarHBondContact O-SG 3Å; Y21-C25 VanDerWaalsContact O-SG 3.35Å; Y21-F270 HydrophobicContact CE2-CB 4.43Å; Y21-N274 WeakPolarHBondContact CE1-ND2 3.15Å; Y21-N274 WeakPolarHBondContact CE2-ND2 3.42Å; Y21-N274 PolarHBondContact OH-ND2 2.98Å; Y21-D283 HydrophobicContact CE1-CB 4.2Å; Y21-D283 WeakPolarHBondContact CE1-OD2 3.48Å
22L96.7Very high92.9Very high37 Ų3734.5 Ų34.519%0.19418%0.175CC..Hα-helixtrans-64.5-43.9-178.5-76.4171.9000112K18 V19 T24 C25 I26 D283 V287K18-L22 HydrophobicContact CG-CD1 4.15Å; K18-L22 PolarHBondContact O-N 3.36Å; V19-L22 PolarHBondContact O-N 3.45Å; L22-T24 VanDerWaalsContact C-N 3.26Å; L22-T24 PolarHBondContact O-N 3.29Å; L22-C25 PolarHBondContact O-N 3.42Å; L22-I26 WeakPolarHBondContact O-CB 3.3Å; L22-I26 VanDerWaalsContact O-CG1 3.25Å; L22-I26 WeakPolarHBondContact O-CG1 3.5Å; L22-I26 PolarHBondContact O-N 3.1Å; L22-D283 HydrophobicContact CD2-CB 4.16Å; L22-V287 HydrophobicContact CD2-CG2 4.43Å
23L96.4Very high93.2Very high31 Ų3132 Ų3216%0.16217%0.171CC..Hα-helixtrans-63.3-33.6175.6-72.1178.6000111.9V19 G27 V204 Y205 A208 T209V19-L23 HydrophobicContact CG1-CD1 3.75Å; V19-L23 HydrophobicContact CG1-CG 4.03Å; V19-L23 WeakPolarHBondContact O-CB 3.28Å; V19-L23 WeakPolarHBondContact O-CG 3.47Å; V19-L23 PolarHBondContact O-N 2.83Å; L23-G27 WeakPolarHBondContact O-CA 3.32Å; L23-G27 PolarHBondContact O-N 3.24Å; L23-V204 HydrophobicContact CB-CG1 4.23Å; L23-V204 HydrophobicContact CB-CG2 4.46Å; L23-Y205 HydrophobicContact CD1-CD1 3.7Å; L23-Y205 HydrophobicContact CD1-CE1 3.94Å; L23-Y205 HydrophobicContact CD1-CG 4.46Å; L23-A208 HydrophobicContact CB-CB 4.46Å; L23-A208 HydrophobicContact CD2-CB 4.47Å; L23-T209 HydrophobicContact CD1-CG2 4.39Å; L23-T209 HydrophobicContact CD2-CG2 4.37Å
24T96.6Very high93.4Very high3 Ų329.1 Ų29.12%0.01815%0.152CC..Hα-helixtrans-66.6-45.7173.5-54.20000111.9W15 Q20 Y21 L22 G27 F28 M200 F270W15-T24 HydrophobicContact CH2-CG2 3.95Å; Q20-T24 WeakPolarHBondContact O-CB 3.32Å; Q20-T24 PolarHBondContact O-N 3.16Å; Q20-T24 PolarHBondContact O-OG1 2.91Å; Y21-T24 WeakPolarHBondContact O-CB 3.4Å; Y21-T24 PolarHBondContact O-N 3.41Å; L22-T24 VanDerWaalsContact C-N 3.26Å; L22-T24 PolarHBondContact O-N 3.29Å; T24-G27 PolarHBondContact O-N 2.92Å; T24-F28 WeakPolarHBondContact O-CB 3.25Å; T24-F28 PolarHBondContact O-N 2.87Å; T24-M200 HydrophobicContact CG2-CE 3.81Å; T24-F270 HydrophobicContact CG2-CD1 4.21Å; T24-F270 HydrophobicContact CG2-CD2 3.95Å; T24-F270 HydrophobicContact CG2-CE1 3.89Å; T24-F270 HydrophobicContact CG2-CE2 3.6Å; T24-F270 HydrophobicContact CG2-CG 4.24Å; T24-F270 HydrophobicContact CG2-CZ 3.56Å
25C97.1Very high93.2Very high0 Ų023.5 Ų23.50%013%0.129CC..Hα-helixtrans-65.7-42.5176.9-62.30000111.8Y21 L22 F28 A29 L267 V287Y21-C25 WeakPolarHBondContact CE2-SG 3.34Å; Y21-C25 PolarHBondContact O-N 2.99Å; Y21-C25 PolarHBondContact O-SG 3Å; Y21-C25 VanDerWaalsContact O-SG 3.35Å; L22-C25 PolarHBondContact O-N 3.42Å; C25-F28 PolarHBondContact O-N 2.87Å; C25-A29 PolarHBondContact O-N 3.16Å; C25-L267 HydrophobicContact CB-CD2 4.34Å; C25-V287 HydrophobicContact CB-CG1 4.27Å; C25-V287 HydrophobicContact CB-CG2 3.6Å
26I96.6Very high92.6Very high20 Ų2023 Ų2310%0.10313%0.127CC..Hα-helixtrans-64-44.1175.7-68.5166.2000110.5L22 F28 A29 V30 V287 T290L22-I26 WeakPolarHBondContact O-CB 3.3Å; L22-I26 VanDerWaalsContact O-CG1 3.25Å; L22-I26 WeakPolarHBondContact O-CG1 3.5Å; L22-I26 PolarHBondContact O-N 3.1Å; I26-F28 VanDerWaalsContact C-N 3.26Å; I26-F28 PolarHBondContact O-N 3.36Å; I26-A29 PolarHBondContact O-N 3.39Å; I26-V30 HydrophobicContact CG2-CG2 4.05Å; I26-V30 VanDerWaalsContact O-CB 3.27Å; I26-V30 WeakPolarHBondContact O-CB 3.2Å; I26-V30 WeakPolarHBondContact O-CG2 3.3Å; I26-V30 PolarHBondContact O-N 3.04Å; I26-V287 HydrophobicContact CG1-CG2 4.15Å; I26-T290 HydrophobicContact CD1-CG2 4.23Å; I26-T290 HydrophobicContact CG1-CG2 4.35Å; I26-T290 HydrophobicContact CG2-CG2 3.85Å
27G95Very high92.4Very high2 Ų220.2 Ų20.22%0.02111%0.108CC..Hα-helixtrans-67.6-25.7178.300000113.4L23 T24 V30 S411 S412L23-G27 WeakPolarHBondContact O-CA 3.32Å; L23-G27 PolarHBondContact O-N 3.24Å; T24-G27 PolarHBondContact O-N 2.92Å; G27-V30 VanDerWaalsContact O-O 3.1Å; G27-S411 CarbonylContact O-C 3.57Å; G27-S411 VanDerWaalsContact O-C 3.23Å; G27-S411 WeakPolarHBondContact O-CB 3.5Å; G27-S412 PolarHBondContact O-N 3.34Å
28F95.6Very high92.3Very high1 Ų117.1 Ų17.10%0.0049%0.092CC..Hα-helixtrans-77.8-37.6173-176.3-144.8000112.8T24 C25 I26 S261 F264 L267 F270 S412 G415 N416T24-F28 WeakPolarHBondContact O-CB 3.25Å; T24-F28 PolarHBondContact O-N 2.87Å; C25-F28 PolarHBondContact O-N 2.87Å; I26-F28 VanDerWaalsContact C-N 3.26Å; I26-F28 PolarHBondContact O-N 3.36Å; F28-S261 VanDerWaalsContact CE1-CB 3.44Å; F28-S261 VanDerWaalsContact CZ-CB 3.41Å; F28-S261 PolarHBondContact O-OG 3.45Å; F28-F264 HydrophobicContact CZ-CB 4.08Å; F28-F264 HydrophobicContact CZ-CG 4.41Å; F28-L267 HydrophobicContact CD1-CD2 3.89Å; F28-L267 HydrophobicContact CD1-CG 3.86Å; F28-L267 HydrophobicContact CE1-CG 3.99Å; F28-F270 HydrophobicContact CB-CE2 4.23Å; F28-F270 HydrophobicContact CD1-CE2 4.17Å; F28-F270 HydrophobicContact CG-CE2 4.33Å; F28-S412 WeakPolarHBondContact CD2-O 3.38Å; F28-G415 VanDerWaalsContact CD2-CA 3.44Å; F28-N416 WeakPolarHBondContact CE2-OD1 3.34Å
29A94.6Very high92.1Very high2 Ų213.8 Ų13.82%0.0178%0.077CC..Hα-helixtrans-73.8-47.5175.400000111.6C25 I26 G31 S259 V287 N291C25-A29 PolarHBondContact O-N 3.16Å; I26-A29 PolarHBondContact O-N 3.39Å; A29-G31 PolarHBondContact O-N 3.39Å; A29-S259 CarbonylContact C-O 3.6Å; A29-S259 VanDerWaalsContact C-O 3.3Å; A29-S259 WeakPolarHBondContact CA-O 3.1Å; A29-V287 HydrophobicContact CB-CG1 4.15Å; A29-N291 HydrophobicContact CB-CB 4.07Å; A29-N291 PolarHBondContact O-OD1 2.97Å
30V93.8Very high91.8Very high6 Ų612.6 Ų12.64%0.0366%0.064CC..SBendtrans-82101.9179.9-178.60000109.6I26 G27 N34 N291 T294 L408I26-V30 HydrophobicContact CG2-CG2 4.05Å; I26-V30 VanDerWaalsContact O-CB 3.27Å; I26-V30 WeakPolarHBondContact O-CB 3.2Å; I26-V30 WeakPolarHBondContact O-CG2 3.3Å; I26-V30 PolarHBondContact O-N 3.04Å; G27-V30 VanDerWaalsContact O-O 3.1Å; V30-N34 WeakPolarHBondContact CA-OD1 3.33Å; V30-N291 HydrophobicContact CG2-CB 4.27Å; V30-T294 HydrophobicContact CG1-CG2 3.63Å; V30-T294 HydrophobicContact CG2-CG2 4.37Å; V30-L408 HydrophobicContact CG1-CD2 3.91Å
31G88.7Confident91.5Very high4 Ų412.8 Ų12.84%0.0417%0.066CC..  trans-121.3-167.6179.300000113.3A29 G33 N34 S412A29-G31 PolarHBondContact O-N 3.39Å; G31-G33 PolarHBondContact O-N 2.72Å; G31-N34 PolarHBondContact N-OD1 2.68Å; G31-N34 PolarHBondContact O-N 2.69Å; G31-N34 PolarHBondContact O-OD1 3.12Å; G31-S412 WeakPolarHBondContact CA-OG 3.45Å
32I86.2Confident91.3Very high0 Ų012.8 Ų12.80%07%0.066CC..THydrogen-bonded Turntrans-67.7-24.9179.1-43.8166.6000111.2N34 L35 W36 Y109 I112 L405 L408I32-N34 PolarHBondContact O-N 3.46Å; I32-L35 PolarHBondContact O-N 2.92Å; I32-W36 HydrophobicContact CB-CH2 3.86Å; I32-W36 HydrophobicContact CB-CZ2 3.67Å; I32-W36 HydrophobicContact CB-CZ3 4.44Å; I32-W36 HydrophobicContact CD1-CH2 4.03Å; I32-W36 HydrophobicContact CD1-CZ2 4.31Å; I32-W36 HydrophobicContact CG2-CD2 3.66Å; I32-W36 HydrophobicContact CG2-CE3 3.5Å; I32-W36 HydrophobicContact CG2-CH2 3.1Å; I32-W36 HydrophobicContact CG2-CZ2 3.3Å; I32-W36 HydrophobicContact CG2-CZ3 3.26Å; I32-W36 PolarHBondContact O-N 3.46Å; I32-Y109 HydrophobicContact CD1-CE1 4.17Å; I32-Y109 PolarHBondContact N-OH 3.12Å; I32-I112 HydrophobicContact CD1-CG2 3.89Å; I32-L405 HydrophobicContact CG2-CD2 3.82Å; I32-L408 HydrophobicContact CG1-CB 4.22Å
33G85.4Confident90.8Very high18 Ų1811.4 Ų11.419%0.1866%0.058CC..Hα-helixtrans-57.4-31173.900000114G31 L35 R37 F38G31-G33 PolarHBondContact O-N 2.72Å; G33-L35 VanDerWaalsContact C-N 3.25Å; G33-L35 PolarHBondContact O-N 2.96Å; G33-R37 WeakPolarHBondContact O-CA 3.29Å; G33-R37 WeakPolarHBondContact O-CB 3.49Å; G33-R37 PolarHBondContact O-N 2.91Å; G33-F38 PolarHBondContact O-N 3.22Å
34N90.1Very high90.4Very high3 Ų312.6 Ų12.62%0.0166%0.064CC..Hα-helixtrans-68.7-24.9176.1-57.577.6000112.5V30 G31 I32 P39 S259 N291 S295V30-N34 WeakPolarHBondContact CA-OD1 3.33Å; G31-N34 PolarHBondContact N-OD1 2.68Å; G31-N34 PolarHBondContact O-N 2.69Å; G31-N34 PolarHBondContact O-OD1 3.12Å; I32-N34 PolarHBondContact O-N 3.46Å; N34-P39 WeakPolarHBondContact O-CD 3.36Å; N34-S259 PolarHBondContact ND2-OG 2.9Å; N34-N291 PolarHBondContact ND2-OD1 3.45Å; N34-S295 PolarHBondContact ND2-OG 2.82Å
35L85.1Confident90Very high13 Ų1313.9 Ų13.97%0.0687%0.069CC..Hα-helixtrans-101.5-14.5-177-66.4-169.1000114.9I32 G33 L215 I302 M404 L405 L408I32-L35 PolarHBondContact O-N 2.92Å; G33-L35 VanDerWaalsContact C-N 3.25Å; G33-L35 PolarHBondContact O-N 2.96Å; L35-L215 HydrophobicContact CD1-CD2 4.08Å; L35-L215 HydrophobicContact CD2-CD1 4.16Å; L35-L215 HydrophobicContact CD2-CD2 3.66Å; L35-I302 WeakPolarHBondContact O-CD1 3.37Å; L35-M404 HydrophobicContact CD1-CE 3.59Å; L35-M404 HydrophobicContact CD1-SD 4.09Å; L35-L405 HydrophobicContact CD1-CD2 4.02Å; L35-L408 HydrophobicContact CD1-CD1 3.29Å; L35-L408 HydrophobicContact CG-CD1 3.91Å
36W82.2Confident89.4Confident16 Ų1614.3 Ų14.36%0.0617%0.074CC..Hα-helixtrans-126.5-39.7169.755.758.6000114.1I32 Y40 I112 L379 A380 F381I32-W36 HydrophobicContact CB-CH2 3.86Å; I32-W36 HydrophobicContact CB-CZ2 3.67Å; I32-W36 HydrophobicContact CB-CZ3 4.44Å; I32-W36 HydrophobicContact CD1-CH2 4.03Å; I32-W36 HydrophobicContact CD1-CZ2 4.31Å; I32-W36 HydrophobicContact CG2-CD2 3.66Å; I32-W36 HydrophobicContact CG2-CE3 3.5Å; I32-W36 HydrophobicContact CG2-CH2 3.1Å; I32-W36 HydrophobicContact CG2-CZ2 3.3Å; I32-W36 HydrophobicContact CG2-CZ3 3.26Å; I32-W36 PolarHBondContact O-N 3.46Å; W36-Y40 WeakPolarHBondContact O-CB 3.31Å; W36-Y40 PolarHBondContact O-N 2.86Å; W36-I112 HydrophobicContact CH2-CG2 3.21Å; W36-I112 HydrophobicContact CZ2-CD1 4.14Å; W36-I112 HydrophobicContact CZ2-CG2 3.67Å; W36-I112 HydrophobicContact CZ3-CG2 4.36Å; W36-L379 HydrophobicContact CB-CB 4.13Å; W36-L379 HydrophobicContact CB-CD2 4Å; W36-L379 HydrophobicContact CB-CG 4.48Å; W36-L379 WeakPolarHBondContact O-CD2 3.48Å; W36-A380 HydrophobicContact CE3-CB 3.5Å; W36-A380 HydrophobicContact CZ3-CB 3.77Å; W36-F381 HydrophobicContact CZ3-CE2 4.34Å
37R87Confident88.9Confident46 Ų4613.4 Ų13.417%0.1747%0.069CC..Hα-helixtrans-76.8-47.7-168.5-171.9175.3171.2145.40.2108.8G33 Y40 L41 Q255 N467G33-R37 WeakPolarHBondContact O-CA 3.29Å; G33-R37 WeakPolarHBondContact O-CB 3.49Å; G33-R37 PolarHBondContact O-N 2.91Å; R37-Y40 PolarHBondContact O-N 2.95Å; R37-L41 HydrophobicContact CG-CD1 4.18Å; R37-L41 HydrophobicContact CG-CG 4.42Å; R37-L41 WeakPolarHBondContact O-CB 3.46Å; R37-L41 VanDerWaalsContact O-CG 3.24Å; R37-L41 WeakPolarHBondContact O-CG 3.3Å; R37-L41 PolarHBondContact O-N 3.4Å; R37-Q255 VanDerWaalsContact NE-OE1 3.1Å; R37-N467 PolarHBondContact NH1-OD1 3Å
38F91.6Very high88.5Confident2 Ų213.8 Ų13.81%0.0097%0.073CC..Hα-helixtrans-61.7-50.3177.9-179.9-87.3000112.6G33 Y40 L41 C42 F50 L51 Y54 Q255 S299G33-F38 PolarHBondContact O-N 3.22Å; F38-Y40 VanDerWaalsContact C-N 3.32Å; F38-Y40 PolarHBondContact O-N 3.38Å; F38-L41 PolarHBondContact O-N 3.3Å; F38-C42 VanDerWaalsContact CE1-SG 3.54Å; F38-C42 PolarHBondContact O-N 3.33Å; F38-C42 PolarHBondContact O-SG 3.42Å; F38-F50 HydrophobicContact CD2-CE1 4.24Å; F38-F50 HydrophobicContact CE2-CE1 4.12Å; F38-L51 HydrophobicContact CE1-CD2 4.27Å; F38-L51 HydrophobicContact CZ-CD2 3.63Å; F38-Y54 HydrophobicContact CD2-CD2 4.07Å; F38-Y54 AromaticContact CD2-CE2 3.74Å; F38-Y54 HydrophobicContact CD2-CE2 3.74Å; F38-Y54 AromaticContact CE2-CD1 3.84Å; F38-Y54 HydrophobicContact CE2-CD1 3.84Å; F38-Y54 AromaticContact CE2-CD2 3.62Å; F38-Y54 HydrophobicContact CE2-CD2 3.62Å; F38-Y54 AromaticContact CE2-CE1 3.79Å; F38-Y54 HydrophobicContact CE2-CE1 3.79Å; F38-Y54 AromaticContact CE2-CE2 3.53Å; F38-Y54 HydrophobicContact CE2-CE2 3.53Å; F38-Y54 AromaticContact CE2-CG 3.77Å; F38-Y54 HydrophobicContact CE2-CG 3.77Å; F38-Y54 AromaticContact CE2-CZ 3.64Å; F38-Y54 HydrophobicContact CZ-CD1 4.41Å; F38-Y54 HydrophobicContact CZ-CE1 4.39Å; F38-Q255 HydrophobicContact CD2-CG 4.36Å; F38-S299 VanDerWaalsContact CD1-OG 3.26Å; F38-S299 WeakPolarHBondContact CD1-OG 3.32Å; F38-S299 WeakPolarHBondContact CE1-OG 3.37Å
39P90.2Very high88.3Confident1 Ų113.7 Ų13.71%0.0067%0.072CC..Hα-helixtrans-58-41.5174-24.131000113.6N34 C42 Q43 I302 F303 L379N34-P39 WeakPolarHBondContact O-CD 3.36Å; P39-C42 WeakPolarHBondContact O-CB 3.25Å; P39-C42 PolarHBondContact O-N 2.9Å; P39-Q43 PolarHBondContact O-N 2.95Å; P39-I302 HydrophobicContact CB-CD1 4.24Å; P39-I302 HydrophobicContact CB-CG2 4.07Å; P39-I302 HydrophobicContact CG-CD1 3.6Å; P39-F303 HydrophobicContact CB-CD2 4.45Å; P39-F303 HydrophobicContact CB-CE2 3.84Å; P39-F303 WeakPolarHBondContact O-CZ 3.42Å; P39-L379 HydrophobicContact CB-CD2 4.11Å
40Y87.7Confident88.3Confident55 Ų5513.6 Ų13.622%0.2167%0.072CC..Hα-helixtrans-61-47.2175.9169.6-109.7000112W36 R37 F38 C42 Q43 I44 A374 S375W36-Y40 WeakPolarHBondContact O-CB 3.31Å; W36-Y40 PolarHBondContact O-N 2.86Å; R37-Y40 PolarHBondContact O-N 2.95Å; F38-Y40 VanDerWaalsContact C-N 3.32Å; F38-Y40 PolarHBondContact O-N 3.38Å; Y40-C42 VanDerWaalsContact C-N 3.34Å; Y40-C42 PolarHBondContact O-N 3.01Å; Y40-Q43 WeakPolarHBondContact O-CB 3.17Å; Y40-Q43 PolarHBondContact O-N 3.13Å; Y40-I44 HydrophobicContact CD1-CD1 4.47Å; Y40-I44 HydrophobicContact CD2-CG2 4.02Å; Y40-I44 HydrophobicContact CE1-CD1 3.83Å; Y40-I44 HydrophobicContact CE2-CG2 3.46Å; Y40-I44 VanDerWaalsContact CE2-CG2 3.46Å; Y40-I44 PolarHBondContact O-N 3.43Å; Y40-A374 WeakPolarHBondContact CD2-O 3.45Å; Y40-S375 VanDerWaalsContact CE2-CA 3.45Å
41L89.6Confident88.2Confident9 Ų914.8 Ų14.85%0.0478%0.077CC..Hα-helixtrans-62-41.2176.7-68.7177.4000111.6R37 F38 Q43 I44 Y45 F50 D251 Q255R37-L41 HydrophobicContact CG-CD1 4.18Å; R37-L41 HydrophobicContact CG-CG 4.42Å; R37-L41 WeakPolarHBondContact O-CB 3.46Å; R37-L41 VanDerWaalsContact O-CG 3.24Å; R37-L41 WeakPolarHBondContact O-CG 3.3Å; R37-L41 PolarHBondContact O-N 3.4Å; F38-L41 PolarHBondContact O-N 3.3Å; L41-Q43 VanDerWaalsContact C-N 3.29Å; L41-Q43 PolarHBondContact O-N 2.93Å; L41-I44 HydrophobicContact CD2-CD1 4.1Å; L41-Y45 HydrophobicContact CB-CD2 4.44Å; L41-Y45 HydrophobicContact CD2-CD2 4.27Å; L41-Y45 HydrophobicContact CD2-CE2 3.87Å; L41-Y45 VanDerWaalsContact O-CB 3.29Å; L41-Y45 WeakPolarHBondContact O-CB 3.18Å; L41-Y45 WeakPolarHBondContact O-CD2 3.46Å; L41-Y45 PolarHBondContact O-N 3.05Å; L41-F50 HydrophobicContact CB-CD1 4.38Å; L41-F50 HydrophobicContact CB-CE1 3.85Å; L41-F50 HydrophobicContact CB-CE2 4.13Å; L41-F50 HydrophobicContact CB-CZ 3.71Å; L41-F50 HydrophobicContact CD1-CZ 3.91Å; L41-F50 HydrophobicContact CG-CZ 4.41Å; L41-D251 HydrophobicContact CD2-CB 4.47Å; L41-Q255 HydrophobicContact CD1-CB 3.88Å; L41-Q255 HydrophobicContact CD1-CG 3.91Å
42C90.5Very high88.5Confident0 Ų017.6 Ų17.60%09%0.091CC..Hα-helixtrans-57.6-44170.9-68.20000111F38 P39 Y40 G47 L235 F303F38-C42 VanDerWaalsContact CE1-SG 3.54Å; F38-C42 PolarHBondContact O-N 3.33Å; F38-C42 PolarHBondContact O-SG 3.42Å; P39-C42 WeakPolarHBondContact O-CB 3.25Å; P39-C42 PolarHBondContact O-N 2.9Å; Y40-C42 VanDerWaalsContact C-N 3.34Å; Y40-C42 PolarHBondContact O-N 3.01Å; C42-G47 WeakPolarHBondContact O-CA 3.33Å; C42-G47 PolarHBondContact O-N 3.36Å; C42-L235 HydrophobicContact CB-CD1 4.22Å; C42-F303 HydrophobicContact CB-CE2 4.26Å; C42-F303 HydrophobicContact CB-CZ 4.02Å
43Q86.6Confident88.8Confident7 Ų717.7 Ų17.73%0.0339%0.091CC..Hα-helixtrans-64.7-47.6-177.5-169.8178.59.800112.5P39 Y40 L41 Y234 F303 L370 Q372 S373P39-Q43 PolarHBondContact O-N 2.95Å; Y40-Q43 WeakPolarHBondContact O-CB 3.17Å; Y40-Q43 PolarHBondContact O-N 3.13Å; L41-Q43 VanDerWaalsContact C-N 3.29Å; L41-Q43 PolarHBondContact O-N 2.93Å; Q43-Y234 HydrophobicContact CB-CE1 4.48Å; Q43-Y234 HydrophobicContact CG-CE1 3.86Å; Q43-Y234 PolarHBondContact O-OH 3.12Å; Q43-F303 HydrophobicContact CB-CE1 4.25Å; Q43-F303 HydrophobicContact CB-CZ 3.97Å; Q43-L370 PolarHBondContact NE2-O 3.45Å; Q43-Q372 PolarHBondContact NE2-O 3.11Å; Q43-S373 VanDerWaalsContact OE1-CB 3.22Å
44I87.4Confident89.3Confident56 Ų5617 Ų1729%0.2878%0.083SC..Hα-helixtrans-77.5-20.4-17766.9171.6000113.5Y40 L41Y40-I44 HydrophobicContact CD1-CD1 4.47Å; Y40-I44 HydrophobicContact CD2-CG2 4.02Å; Y40-I44 HydrophobicContact CE1-CD1 3.83Å; Y40-I44 HydrophobicContact CE2-CG2 3.46Å; Y40-I44 VanDerWaalsContact CE2-CG2 3.46Å; Y40-I44 PolarHBondContact O-N 3.43Å; L41-I44 HydrophobicContact CD2-CD1 4.1Å
45Y90.1Very high89.5Confident30 Ų3021.3 Ų21.312%0.11811%0.106CC..THydrogen-bonded Turntrans-109.441.2-178.8-63.3-47.1000113.5L41 F50 I242 Q247 V248 D251L41-Y45 HydrophobicContact CB-CD2 4.44Å; L41-Y45 HydrophobicContact CD2-CD2 4.27Å; L41-Y45 HydrophobicContact CD2-CE2 3.87Å; L41-Y45 VanDerWaalsContact O-CB 3.29Å; L41-Y45 WeakPolarHBondContact O-CB 3.18Å; L41-Y45 WeakPolarHBondContact O-CD2 3.46Å; L41-Y45 PolarHBondContact O-N 3.05Å; Y45-F50 AromaticContact CD2-CD2 3.71Å; Y45-F50 HydrophobicContact CD2-CD2 3.71Å; Y45-F50 AromaticContact CD2-CE2 3.86Å; Y45-F50 HydrophobicContact CD2-CE2 3.86Å; Y45-F50 HydrophobicContact CG-CD2 4.16Å; Y45-F50 PolarHBondContact O-N 3.32Å; Y45-I242 HydrophobicContact CD1-CG2 4.26Å; Y45-Q247 VanDerWaalsContact OH-CG 3.29Å; Y45-Q247 WeakPolarHBondContact OH-CG 3.42Å; Y45-V248 HydrophobicContact CD1-CB 4.47Å; Y45-V248 HydrophobicContact CD1-CG2 3.6Å; Y45-V248 HydrophobicContact CE1-CG2 3.98Å; Y45-V248 HydrophobicContact CG-CG1 4.25Å; Y45-V248 HydrophobicContact CG-CG2 4.08Å; Y45-D251 HydrophobicContact CE2-CB 3.67Å; Y45-D251 VanDerWaalsContact CE2-OD2 3.27Å; Y45-D251 WeakPolarHBondContact CE2-OD2 3.39Å; Y45-D251 VanDerWaalsContact CZ-OD2 3.26Å; Y45-D251 PolarHBondContact OH-OD2 3.3Å
46G83.3Confident90Very high10 Ų1023.5 Ų23.510%0.10312%0.117CC..THydrogen-bonded Turntrans76.933.9165.800000114.2G48 A49 D239G46-G48 PolarHBondContact O-N 2.81Å; G46-A49 WeakPolarHBondContact O-CB 3.23Å; G46-A49 PolarHBondContact O-N 3.41Å; G46-A49 VanDerWaalsContact O-N 3.08Å; G46-D239 PolarHBondContact O-N 3.47Å
47G85.8Confident90.5Very high0 Ų022.9 Ų22.90%012%0.115CC..BIsolated β-bridgetrans57.5-110.1176.800000111.6C42 A49 F50 L235C42-G47 WeakPolarHBondContact O-CA 3.33Å; C42-G47 PolarHBondContact O-N 3.36Å; G47-A49 PolarHBondContact O-N 3.34Å; G47-F50 PolarHBondContact O-N 2.89Å; G47-L235 CarbonylContact C-O 3.5Å
48G86.4Confident90.9Very high10 Ų1021.2 Ų21.210%0.10311%0.11CC..G310 helixtrans-65.5-20.4-176.300000113.3G46 F50 L51 L235G46-G48 PolarHBondContact O-N 2.81Å; G48-F50 VanDerWaalsContact C-N 3.34Å; G48-F50 PolarHBondContact O-N 3.34Å; G48-L51 WeakPolarHBondContact O-CB 3.33Å; G48-L51 PolarHBondContact O-N 3.12Å; G48-L235 WeakPolarHBondContact CA-O 3.27Å; G48-L235 PolarHBondContact N-O 3.32Å
49A92.7Very high91.2Very high0 Ų023.6 Ų23.60%013%0.125CC..G310 helixtrans-62.2-41.5178.600000111.6G46 G47 L51 I52 P53 P238 D239 L243G46-A49 WeakPolarHBondContact O-CB 3.23Å; G46-A49 PolarHBondContact O-N 3.41Å; G46-A49 VanDerWaalsContact O-N 3.08Å; G47-A49 PolarHBondContact O-N 3.34Å; A49-L51 PolarHBondContact O-N 3.36Å; A49-I52 PolarHBondContact O-N 3.03Å; A49-P53 WeakPolarHBondContact O-CD 3.45Å; A49-P238 HydrophobicContact CB-CB 4.09Å; A49-D239 VanDerWaalsContact CB-O 3.24Å; A49-D239 WeakPolarHBondContact CB-O 3.18Å; A49-L243 HydrophobicContact CB-CD2 4.18Å; A49-L243 HydrophobicContact CB-CG 4.2Å; A49-L243 WeakPolarHBondContact O-CD2 3.34Å
50F93.9Very high91.4Very high0 Ų026.8 Ų26.80%014%0.138CC..G310 helixtrans-61.8-26.6179.8-176.8-103.4000113.9F38 L41 Y45 G47 G48 I52 P53 Y54 V248 A252F38-F50 HydrophobicContact CD2-CE1 4.24Å; F38-F50 HydrophobicContact CE2-CE1 4.12Å; L41-F50 HydrophobicContact CB-CD1 4.38Å; L41-F50 HydrophobicContact CB-CE1 3.85Å; L41-F50 HydrophobicContact CB-CE2 4.13Å; L41-F50 HydrophobicContact CB-CZ 3.71Å; L41-F50 HydrophobicContact CD1-CZ 3.91Å; L41-F50 HydrophobicContact CG-CZ 4.41Å; Y45-F50 AromaticContact CD2-CD2 3.71Å; Y45-F50 HydrophobicContact CD2-CD2 3.71Å; Y45-F50 AromaticContact CD2-CE2 3.86Å; Y45-F50 HydrophobicContact CD2-CE2 3.86Å; Y45-F50 HydrophobicContact CG-CD2 4.16Å; Y45-F50 PolarHBondContact O-N 3.32Å; G47-F50 PolarHBondContact O-N 2.89Å; G48-F50 VanDerWaalsContact C-N 3.34Å; G48-F50 PolarHBondContact O-N 3.34Å; F50-I52 PolarHBondContact O-N 2.8Å; F50-P53 VanDerWaalsContact O-CD 3.22Å; F50-P53 WeakPolarHBondContact O-CD 3.34Å; F50-P53 WeakPolarHBondContact O-CG 3.41Å; F50-Y54 HydrophobicContact CE1-CD2 4.3Å; F50-Y54 WeakPolarHBondContact O-CB 3.18Å; F50-Y54 PolarHBondContact O-N 3.35Å; F50-V248 HydrophobicContact CD2-CG1 4.19Å; F50-A252 HydrophobicContact CE2-CB 3.77Å; F50-A252 HydrophobicContact CZ-CB 4.06Å
51L92.4Very high91.7Very high30 Ų3024.1 Ų24.116%0.15713%0.128CC..Hα-helixtrans-63.1-28.9178.9-60.5179.5000112.3F38 G48 A49 L55 L296F38-L51 HydrophobicContact CE1-CD2 4.27Å; F38-L51 HydrophobicContact CZ-CD2 3.63Å; G48-L51 WeakPolarHBondContact O-CB 3.33Å; G48-L51 PolarHBondContact O-N 3.12Å; A49-L51 PolarHBondContact O-N 3.36Å; L51-L55 WeakPolarHBondContact O-CB 3.22Å; L51-L55 WeakPolarHBondContact O-CG 3.37Å; L51-L55 PolarHBondContact O-N 3.13Å; L51-L296 HydrophobicContact CD1-CD1 4.37Å; L51-L296 HydrophobicContact CD2-CD1 4.44Å
52I93.5Very high91.9Very high63 Ų6323.7 Ų23.732%0.32313%0.126SC..Hα-helixtrans-65.8-61.1-179.5-59.3171.8000111.4A49 F50 Y54 L55 I56 W240 L243A49-I52 PolarHBondContact O-N 3.03Å; F50-I52 PolarHBondContact O-N 2.8Å; I52-Y54 VanDerWaalsContact C-N 3.25Å; I52-Y54 PolarHBondContact O-N 3.49Å; I52-L55 PolarHBondContact O-N 3.32Å; I52-I56 HydrophobicContact CG2-CD1 3.98Å; I52-I56 WeakPolarHBondContact O-CG1 3.49Å; I52-I56 PolarHBondContact O-N 2.85Å; I52-I56 VanDerWaalsContact O-N 3.09Å; I52-W240 HydrophobicContact CD1-CH2 4.27Å; I52-W240 HydrophobicContact CD1-CZ3 3.89Å; I52-L243 HydrophobicContact CD1-CD1 4.11Å
53P93.9Very high92.3Very high2 Ų224.4 Ų24.41%0.01313%0.129CC..Hα-helixtrans-62.2-34177.925.3-34000112A49 F50 I56 A57 L243 V248 W249 A252A49-P53 WeakPolarHBondContact O-CD 3.45Å; F50-P53 VanDerWaalsContact O-CD 3.22Å; F50-P53 WeakPolarHBondContact O-CD 3.34Å; F50-P53 WeakPolarHBondContact O-CG 3.41Å; P53-I56 PolarHBondContact O-N 3.36Å; P53-A57 WeakPolarHBondContact O-CB 3.25Å; P53-A57 PolarHBondContact O-N 3Å; P53-L243 HydrophobicContact CG-CD2 4.29Å; P53-V248 HydrophobicContact CG-CG1 3.99Å; P53-W249 HydrophobicContact CB-CD2 3.81Å; P53-W249 HydrophobicContact CB-CE3 3.51Å; P53-W249 HydrophobicContact CB-CG 4.44Å; P53-W249 HydrophobicContact CB-CH2 4.21Å; P53-W249 HydrophobicContact CB-CZ2 4.46Å; P53-W249 HydrophobicContact CB-CZ3 3.73Å; P53-A252 HydrophobicContact CB-CB 3.77Å; P53-A252 HydrophobicContact CG-CB 4.07Å
54Y94.7Very high92.8Very high3 Ų324 Ų241%0.01213%0.128CC..Hα-helixtrans-61.3-47.4175.7177.5-92.1000112.6F38 F50 I52 A57 L58 Q255 I256 S292F38-Y54 HydrophobicContact CD2-CD2 4.07Å; F38-Y54 AromaticContact CD2-CE2 3.74Å; F38-Y54 HydrophobicContact CD2-CE2 3.74Å; F38-Y54 AromaticContact CE2-CD1 3.84Å; F38-Y54 HydrophobicContact CE2-CD1 3.84Å; F38-Y54 AromaticContact CE2-CD2 3.62Å; F38-Y54 HydrophobicContact CE2-CD2 3.62Å; F38-Y54 AromaticContact CE2-CE1 3.79Å; F38-Y54 HydrophobicContact CE2-CE1 3.79Å; F38-Y54 AromaticContact CE2-CE2 3.53Å; F38-Y54 HydrophobicContact CE2-CE2 3.53Å; F38-Y54 AromaticContact CE2-CG 3.77Å; F38-Y54 HydrophobicContact CE2-CG 3.77Å; F38-Y54 AromaticContact CE2-CZ 3.64Å; F38-Y54 HydrophobicContact CZ-CD1 4.41Å; F38-Y54 HydrophobicContact CZ-CE1 4.39Å; F50-Y54 HydrophobicContact CE1-CD2 4.3Å; F50-Y54 WeakPolarHBondContact O-CB 3.18Å; F50-Y54 PolarHBondContact O-N 3.35Å; I52-Y54 VanDerWaalsContact C-N 3.25Å; I52-Y54 PolarHBondContact O-N 3.49Å; Y54-A57 PolarHBondContact O-N 3.01Å; Y54-L58 WeakPolarHBondContact O-CB 3.45Å; Y54-L58 PolarHBondContact O-N 2.95Å; Y54-Q255 HydrophobicContact CD2-CG 4.3Å; Y54-Q255 HydrophobicContact CE2-CG 4.05Å; Y54-I256 HydrophobicContact CD1-CD1 4.41Å; Y54-I256 HydrophobicContact CD2-CD1 3.68Å; Y54-I256 HydrophobicContact CD2-CG1 4.03Å; Y54-I256 HydrophobicContact CE1-CD1 4.03Å; Y54-I256 HydrophobicContact CE2-CD1 3.25Å; Y54-I256 HydrophobicContact CE2-CG1 3.97Å; Y54-I256 HydrophobicContact CG-CD1 4.25Å; Y54-I256 VanDerWaalsContact CZ-CD1 3.43Å; Y54-S292 PolarHBondContact OH-OG 3.49Å
55L94.8Very high93.2Very high95 Ų9521.4 Ų21.450%0.49711%0.114SC..Hα-helixtrans-68.1-35.2178.5-72.5172.5000112.4L51 I52 L58 V59L51-L55 WeakPolarHBondContact O-CB 3.22Å; L51-L55 WeakPolarHBondContact O-CG 3.37Å; L51-L55 PolarHBondContact O-N 3.13Å; I52-L55 PolarHBondContact O-N 3.32Å; L55-L58 HydrophobicContact CD2-CD2 4.28Å; L55-L58 PolarHBondContact O-N 3Å; L55-V59 WeakPolarHBondContact O-CG2 3.4Å; L55-V59 PolarHBondContact O-N 3.02Å
56I94.7Very high93.6Very high58 Ų5820 Ų2030%0.29711%0.109SC..Hα-helixtrans-63.4-49174.2-68.6169.4000109.9I52 P53 L58 V59 F60 W249 M522I52-I56 HydrophobicContact CG2-CD1 3.98Å; I52-I56 WeakPolarHBondContact O-CG1 3.49Å; I52-I56 PolarHBondContact O-N 2.85Å; I52-I56 VanDerWaalsContact O-N 3.09Å; P53-I56 PolarHBondContact O-N 3.36Å; I56-L58 VanDerWaalsContact C-N 3.34Å; I56-L58 PolarHBondContact O-N 3.08Å; I56-V59 PolarHBondContact O-N 3.4Å; I56-F60 HydrophobicContact CG2-CD2 3.91Å; I56-F60 HydrophobicContact CG2-CE2 4.44Å; I56-F60 WeakPolarHBondContact O-CD2 3.33Å; I56-F60 PolarHBondContact O-N 2.89Å; I56-W249 HydrophobicContact CD1-CH2 3.88Å; I56-W249 HydrophobicContact CD1-CZ3 3.88Å; I56-W249 HydrophobicContact CG2-CZ3 4.45Å; I56-M522 HydrophobicContact CG2-CE 4.41Å
57A94Very high94.3Very high3 Ų319.5 Ų19.53%0.02510%0.104CC..Hα-helixtrans-61.7-40.3176.300000111.8P53 Y54 V59 E61 G62 I256P53-A57 WeakPolarHBondContact O-CB 3.25Å; P53-A57 PolarHBondContact O-N 3Å; Y54-A57 PolarHBondContact O-N 3.01Å; A57-V59 PolarHBondContact O-N 3.36Å; A57-E61 WeakPolarHBondContact O-CA 3.29Å; A57-E61 VanDerWaalsContact O-CB 3.23Å; A57-E61 WeakPolarHBondContact O-CB 3.3Å; A57-E61 PolarHBondContact O-N 3.02Å; A57-G62 PolarHBondContact O-N 3.4Å; A57-I256 HydrophobicContact CB-CG1 3.84Å
58L95.7Very high94.8Very high11 Ų1119.6 Ų19.66%0.05810%0.104CC..Iπ-helixtrans-56.6-49.1175.1177.265.4000112.1Y54 L55 I56 G62 L63 I256 L260 S292Y54-L58 WeakPolarHBondContact O-CB 3.45Å; Y54-L58 PolarHBondContact O-N 2.95Å; L55-L58 HydrophobicContact CD2-CD2 4.28Å; L55-L58 PolarHBondContact O-N 3Å; I56-L58 VanDerWaalsContact C-N 3.34Å; I56-L58 PolarHBondContact O-N 3.08Å; L58-G62 PolarHBondContact O-N 3.49Å; L58-L63 HydrophobicContact CD1-CG 4.24Å; L58-L63 HydrophobicContact CG-CG 4.39Å; L58-L63 WeakPolarHBondContact O-CG 3.4Å; L58-L63 PolarHBondContact O-N 3.1Å; L58-I256 HydrophobicContact CB-CD1 3.76Å; L58-I256 HydrophobicContact CD1-CD1 4.11Å; L58-L260 HydrophobicContact CD1-CD1 4.04Å; L58-S292 WeakPolarHBondContact CD1-OG 3.21Å; L58-S292 VanDerWaalsContact CD2-OG 3.23Å; L58-S292 WeakPolarHBondContact CD2-OG 3.42Å
59V96.4Very high95.3Very high53 Ų5319.1 Ų19.132%0.32110%0.099SC..Iπ-helixtrans-71.7-48.6-1751720000110.5L55 I56 A57 P64 Y510L55-V59 WeakPolarHBondContact O-CG2 3.4Å; L55-V59 PolarHBondContact O-N 3.02Å; I56-V59 PolarHBondContact O-N 3.4Å; A57-V59 PolarHBondContact O-N 3.36Å; V59-P64 WeakPolarHBondContact O-CD 3.26Å; V59-P64 WeakPolarHBondContact O-CG 3.46Å; V59-Y510 HydrophobicContact CG1-CE2 4.19Å; V59-Y510 WeakPolarHBondContact CG1-OH 3.29Å; V59-Y510 PolarHBondContact O-OH 3.26Å
60F95.5Very high95.5Very high67 Ų6719.1 Ų19.129%0.29410%0.099SC..Iπ-helixtrans-92.9-12.3-169.9-66.4-69.1000115.2I56 Y510 I518 S519 M522I56-F60 HydrophobicContact CG2-CD2 3.91Å; I56-F60 HydrophobicContact CG2-CE2 4.44Å; I56-F60 WeakPolarHBondContact O-CD2 3.33Å; I56-F60 PolarHBondContact O-N 2.89Å; F60-Y510 HydrophobicContact CE1-CE2 4.28Å; F60-I518 HydrophobicContact CB-CG2 3.94Å; F60-I518 HydrophobicContact CD1-CD1 4.11Å; F60-I518 HydrophobicContact CD1-CG2 3.88Å; F60-I518 HydrophobicContact CE1-CD1 4.26Å; F60-I518 HydrophobicContact CG-CG2 4.13Å; F60-S519 WeakPolarHBondContact O-CB 3.38Å; F60-S519 PolarHBondContact O-OG 2.97Å; F60-M522 HydrophobicContact CB-SD 3.68Å
61E92.9Very high95.7Very high0 Ų019.1 Ų19.10%010%0.099CC..Iπ-helixtrans-127.7-57.2-176.9-172.8171.9-144.500110.9A57 P64 L65 F257 L523A57-E61 WeakPolarHBondContact O-CA 3.29Å; A57-E61 VanDerWaalsContact O-CB 3.23Å; A57-E61 WeakPolarHBondContact O-CB 3.3Å; A57-E61 PolarHBondContact O-N 3.02Å; E61-P64 WeakPolarHBondContact O-CD 3.48Å; E61-L65 HydrophobicContact CG-CD1 4.04Å; E61-L65 VanDerWaalsContact O-CB 3.32Å; E61-L65 WeakPolarHBondContact O-CB 3.38Å; E61-L65 WeakPolarHBondContact O-CD1 3.33Å; E61-L65 WeakPolarHBondContact O-CG 3.38Å; E61-L65 PolarHBondContact O-N 3.09Å; E61-L65 VanDerWaalsContact O-N 3.08Å; E61-F257 VanDerWaalsContact CD-CE2 3.44Å; E61-F257 HydrophobicContact CG-CE1 4.44Å; E61-F257 HydrophobicContact CG-CE2 4.11Å; E61-F257 HydrophobicContact CG-CZ 3.58Å; E61-F257 VanDerWaalsContact OE1-CE2 3.25Å; E61-F257 WeakPolarHBondContact OE1-CE2 3.24Å; E61-F257 WeakPolarHBondContact OE1-CZ 3.45Å; E61-L523 HydrophobicContact CG-CG 4.5Å; E61-L523 WeakPolarHBondContact OE1-CD2 3.28Å; E61-L523 VanDerWaalsContact OE1-CG 3.31Å; E61-L523 WeakPolarHBondContact OE1-CG 3.46Å
62G95.5Very high95.9Very high0 Ų017.7 Ų17.70%09%0.092CC..Iπ-helixtrans-61.2-58.2-175.700000114.7A57 L58 L65 L66A57-G62 PolarHBondContact O-N 3.4Å; L58-G62 PolarHBondContact O-N 3.49Å; G62-L65 PolarHBondContact O-N 2.93Å; G62-L66 VanDerWaalsContact O-CB 3.29Å; G62-L66 WeakPolarHBondContact O-CB 3.25Å; G62-L66 PolarHBondContact O-N 3.16Å
63L96.9Very high96Very high14 Ų1414.7 Ų14.77%0.0738%0.076CC..Hα-helixtrans-62.8-43.5-179-71.9175.9000113L58 L66 Y67 L285 W511L58-L63 HydrophobicContact CD1-CG 4.24Å; L58-L63 HydrophobicContact CG-CG 4.39Å; L58-L63 WeakPolarHBondContact O-CG 3.4Å; L58-L63 PolarHBondContact O-N 3.1Å; L63-L66 PolarHBondContact O-N 2.86Å; L63-Y67 WeakPolarHBondContact O-CB 3.3Å; L63-Y67 PolarHBondContact O-N 3.32Å; L63-L285 HydrophobicContact CD1-CD2 4.21Å; L63-L285 HydrophobicContact CD2-CD2 4.46Å; L63-W511 HydrophobicContact CB-CH2 4.27Å; L63-W511 HydrophobicContact CB-CZ3 4.28Å
64P97.1Very high96Very high0 Ų014.6 Ų14.60%08%0.076CC..Hα-helixtrans-60-44.3174.8-27.336.3000112.9V59 E61 L68 W511 C514 W515V59-P64 WeakPolarHBondContact O-CD 3.26Å; V59-P64 WeakPolarHBondContact O-CG 3.46Å; E61-P64 WeakPolarHBondContact O-CD 3.48Å; P64-L68 VanDerWaalsContact O-CB 3.3Å; P64-L68 WeakPolarHBondContact O-CB 3.33Å; P64-L68 PolarHBondContact O-N 3.36Å; P64-W511 HydrophobicContact CG-CE3 4.48Å; P64-W511 HydrophobicContact CG-CZ3 4.24Å; P64-C514 HydrophobicContact CB-CB 3.81Å; P64-C514 HydrophobicContact CG-CB 3.56Å; P64-W515 PolarHBondContact O-NE1 3.3Å
65L96.6Very high96.1Very high0 Ų018.1 Ų18.10%09%0.089CC..Hα-helixtrans-63.9-48.9177.1-84.4166.5000112.1E61 G62 Y67 L68 E69 F257 V262 A479 I483E61-L65 HydrophobicContact CG-CD1 4.04Å; E61-L65 VanDerWaalsContact O-CB 3.32Å; E61-L65 WeakPolarHBondContact O-CB 3.38Å; E61-L65 WeakPolarHBondContact O-CD1 3.33Å; E61-L65 WeakPolarHBondContact O-CG 3.38Å; E61-L65 PolarHBondContact O-N 3.09Å; E61-L65 VanDerWaalsContact O-N 3.08Å; G62-L65 PolarHBondContact O-N 2.93Å; L65-Y67 VanDerWaalsContact C-N 3.31Å; L65-Y67 PolarHBondContact O-N 3.41Å; L65-L68 WeakPolarHBondContact O-CB 3.26Å; L65-L68 PolarHBondContact O-N 3.38Å; L65-L68 VanDerWaalsContact O-N 3.12Å; L65-E69 PolarHBondContact O-N 3.08Å; L65-F257 HydrophobicContact CD1-CD1 4.39Å; L65-F257 HydrophobicContact CD1-CE1 3.4Å; L65-F257 HydrophobicContact CD1-CZ 3.92Å; L65-V262 HydrophobicContact CB-CB 4.44Å; L65-V262 HydrophobicContact CB-CG1 4.42Å; L65-V262 HydrophobicContact CB-CG2 4.48Å; L65-V262 HydrophobicContact CD1-CG2 4.44Å; L65-A479 HydrophobicContact CD1-CB 4.03Å; L65-A479 HydrophobicContact CD2-CB 4.13Å; L65-I483 HydrophobicContact CD1-CD1 4.39Å; L65-I483 HydrophobicContact CD2-CD1 3.48Å; L65-I483 VanDerWaalsContact CD2-CD1 3.48Å; L65-I483 HydrophobicContact CD2-CG1 3.3Å; L65-I483 HydrophobicContact CG-CD1 3.76Å; L65-I483 HydrophobicContact CG-CG1 4.12Å
66L97.8Very high96Very high1 Ų115 Ų151%0.0057%0.073CC..Hα-helixtrans-57.3-46.1178.2178.260.3000111.2G62 L63 L68 E69 L70 L260 V262 L267 A284 V287G62-L66 VanDerWaalsContact O-CB 3.29Å; G62-L66 WeakPolarHBondContact O-CB 3.25Å; G62-L66 PolarHBondContact O-N 3.16Å; L63-L66 PolarHBondContact O-N 2.86Å; L66-L68 VanDerWaalsContact C-N 3.32Å; L66-L68 PolarHBondContact O-N 3.23Å; L66-E69 PolarHBondContact O-N 3.08Å; L66-L70 HydrophobicContact CD1-CD1 4.05Å; L66-L70 HydrophobicContact CD1-CG 4.15Å; L66-L70 HydrophobicContact CG-CD1 4.23Å; L66-L70 VanDerWaalsContact O-CG 3.28Å; L66-L70 WeakPolarHBondContact O-CG 3.34Å; L66-L70 PolarHBondContact O-N 3.45Å; L66-L70 VanDerWaalsContact O-N 3.07Å; L66-L260 HydrophobicContact CD2-CD2 4.43Å; L66-V262 HydrophobicContact CB-CG1 4.01Å; L66-V262 HydrophobicContact CD1-CG1 4.27Å; L66-L267 HydrophobicContact CD1-CD1 3.46Å; L66-L267 VanDerWaalsContact CD1-CD1 3.46Å; L66-L267 HydrophobicContact CD1-CD2 4.42Å; L66-L267 HydrophobicContact CD1-CG 4.48Å; L66-A284 HydrophobicContact CD2-CB 4.49Å; L66-A284 WeakPolarHBondContact CD2-O 3.2Å; L66-A284 HydrophobicContact CG-CB 4.2Å; L66-V287 HydrophobicContact CD2-CB 4.17Å; L66-V287 HydrophobicContact CD2-CG1 4.04Å
67Y97.9Very high95.8Very high0 Ų016.6 Ų16.60%08%0.075CC..Hα-helixtrans-63.8-39.9178.1-179.2-151.2000112L63 L65 A71 C280 E281 A284 I499 W511 W515L63-Y67 WeakPolarHBondContact O-CB 3.3Å; L63-Y67 PolarHBondContact O-N 3.32Å; L65-Y67 VanDerWaalsContact C-N 3.31Å; L65-Y67 PolarHBondContact O-N 3.41Å; Y67-A71 HydrophobicContact CD2-CB 4.45Å; Y67-A71 HydrophobicContact CE2-CB 4.26Å; Y67-A71 WeakPolarHBondContact O-CB 3.44Å; Y67-A71 PolarHBondContact O-N 3.33Å; Y67-C280 HydrophobicContact CE2-CB 4.46Å; Y67-E281 HydrophobicContact CD2-CB 4.39Å; Y67-E281 HydrophobicContact CE1-CB 4.34Å; Y67-E281 HydrophobicContact CE1-CG 4.2Å; Y67-E281 VanDerWaalsContact CE2-CA 3.42Å; Y67-E281 HydrophobicContact CE2-CB 3.71Å; Y67-E281 HydrophobicContact CE2-CG 4.39Å; Y67-A284 HydrophobicContact CD2-CB 4.18Å; Y67-A284 HydrophobicContact CG-CB 4.28Å; Y67-I499 HydrophobicContact CE1-CD1 4.49Å; Y67-I499 VanDerWaalsContact OH-CG2 3.22Å; Y67-I499 WeakPolarHBondContact OH-CG2 3.26Å; Y67-W511 AromaticContact CD1-CD2 3.75Å; Y67-W511 HydrophobicContact CD1-CD2 3.75Å; Y67-W511 AromaticContact CD1-CE2 3.93Å; Y67-W511 AromaticContact CD1-CE3 3.83Å; Y67-W511 HydrophobicContact CD1-CE3 3.83Å; Y67-W511 HydrophobicContact CD1-CG 4.22Å; Y67-W511 HydrophobicContact CD1-CH2 4.29Å; Y67-W511 HydrophobicContact CD1-CZ2 4.21Å; Y67-W511 HydrophobicContact CD1-CZ3 4.11Å; Y67-W511 HydrophobicContact CE1-CD2 4.06Å; Y67-W511 HydrophobicContact CE1-CG 4.1Å; Y67-W515 AromaticContact CD1-CH2 3.48Å; Y67-W515 HydrophobicContact CD1-CH2 3.48Å; Y67-W515 VanDerWaalsContact CD1-CH2 3.48Å; Y67-W515 AromaticContact CD1-CZ2 3.31Å; Y67-W515 HydrophobicContact CD1-CZ2 3.31Å; Y67-W515 AromaticContact CE1-CH2 3.38Å; Y67-W515 HydrophobicContact CE1-CH2 3.38Å; Y67-W515 AromaticContact CE1-CZ2 3.77Å; Y67-W515 HydrophobicContact CE1-CZ2 3.77Å; Y67-W515 HydrophobicContact CG-CH2 4.38Å; Y67-W515 AromaticContact CG-CZ2 3.95Å; Y67-W515 HydrophobicContact CG-CZ2 3.95Å
68L97.4Very high95.7Very high1 Ų119.7 Ų19.71%0.0059%0.09CC..Hα-helixtrans-63-47.6177.6-178.9158.1000112P64 L65 L66 A71 I72 I483 V486 F495 W515P64-L68 VanDerWaalsContact O-CB 3.3Å; P64-L68 WeakPolarHBondContact O-CB 3.33Å; P64-L68 PolarHBondContact O-N 3.36Å; L65-L68 WeakPolarHBondContact O-CB 3.26Å; L65-L68 PolarHBondContact O-N 3.38Å; L65-L68 VanDerWaalsContact O-N 3.12Å; L66-L68 VanDerWaalsContact C-N 3.32Å; L66-L68 PolarHBondContact O-N 3.23Å; L68-A71 PolarHBondContact O-N 2.96Å; L68-I72 WeakPolarHBondContact O-CB 3.45Å; L68-I72 WeakPolarHBondContact O-CG2 3.46Å; L68-I72 PolarHBondContact O-N 3.33Å; L68-I483 HydrophobicContact CD1-CG1 4.31Å; L68-V486 HydrophobicContact CD1-CB 4.02Å; L68-V486 HydrophobicContact CD1-CG1 4.07Å; L68-V486 HydrophobicContact CD2-CB 4.28Å; L68-V486 HydrophobicContact CD2-CG2 3.9Å; L68-V486 HydrophobicContact CG-CB 4.25Å; L68-V486 HydrophobicContact CG-CG1 4.13Å; L68-V486 HydrophobicContact CG-CG2 4.33Å; L68-F495 HydrophobicContact CG-CZ 4.37Å; L68-W515 HydrophobicContact CB-CZ2 4.34Å; L68-W515 HydrophobicContact CD1-CG 4.36Å
69E97.2Very high95.4Very high0 Ų019.2 Ų19.20%09%0.087CC..Hα-helixtrans-61.6-46.6178.1-76.2-165.7147.900112.5L65 L66 A71 I72 G73 A263 L267 I268L65-E69 PolarHBondContact O-N 3.08Å; L66-E69 PolarHBondContact O-N 3.08Å; E69-A71 PolarHBondContact O-N 3.37Å; E69-I72 WeakPolarHBondContact O-CG2 3.38Å; E69-G73 PolarHBondContact O-N 3.18Å; E69-A263 VanDerWaalsContact OE1-CA 3.31Å; E69-A263 WeakPolarHBondContact OE1-CA 3.06Å; E69-A263 PolarHBondContact OE1-N 2.68Å; E69-L267 WeakPolarHBondContact OE2-CD1 3.44Å; E69-I268 HydrophobicContact CB-CG1 3.89Å; E69-I268 HydrophobicContact CG-CD1 4.27Å; E69-I268 HydrophobicContact CG-CG1 4.05Å
70L97.2Very high95.2Very high0 Ų016.8 Ų16.80%07%0.072CC..Hα-helixtrans-65.7-39.8179.7-65-178.3000111.6L66 Q74 L267 S271 C280 D283 A284L66-L70 HydrophobicContact CD1-CD1 4.05Å; L66-L70 HydrophobicContact CD1-CG 4.15Å; L66-L70 HydrophobicContact CG-CD1 4.23Å; L66-L70 VanDerWaalsContact O-CG 3.28Å; L66-L70 WeakPolarHBondContact O-CG 3.34Å; L66-L70 PolarHBondContact O-N 3.45Å; L66-L70 VanDerWaalsContact O-N 3.07Å; L70-Q74 VanDerWaalsContact O-CB 3.28Å; L70-Q74 WeakPolarHBondContact O-CB 3.19Å; L70-Q74 PolarHBondContact O-N 2.93Å; L70-Q74 VanDerWaalsContact O-N 3.13Å; L70-L267 HydrophobicContact CD2-CB 4.04Å; L70-L267 HydrophobicContact CD2-CD2 4.27Å; L70-S271 WeakPolarHBondContact O-CB 3.5Å; L70-S271 PolarHBondContact O-OG 3.36Å; L70-C280 HydrophobicContact CB-CB 4.49Å; L70-D283 HydrophobicContact CD1-CB 4.43Å; L70-A284 HydrophobicContact CD1-CB 4Å
71A97.3Very high95.1Very high0 Ų013.9 Ų13.90%06%0.06CC..Hα-helixtrans-68.6-44.4178.900000112.1Y67 L68 E69 R75 F495 I499 M502Y67-A71 HydrophobicContact CD2-CB 4.45Å; Y67-A71 HydrophobicContact CE2-CB 4.26Å; Y67-A71 WeakPolarHBondContact O-CB 3.44Å; Y67-A71 PolarHBondContact O-N 3.33Å; L68-A71 PolarHBondContact O-N 2.96Å; E69-A71 PolarHBondContact O-N 3.37Å; A71-R75 WeakPolarHBondContact O-CB 3.36Å; A71-R75 PolarHBondContact O-N 3.15Å; A71-F495 HydrophobicContact CB-CE2 4.23Å; A71-F495 HydrophobicContact CB-CZ 3.83Å; A71-I499 HydrophobicContact CB-CG1 4.41Å; A71-M502 HydrophobicContact CB-CE 4.22Å
72I96.2Very high95Very high0 Ų014.5 Ų14.50%07%0.067CC..Hα-helixtrans-69.8-39.7-178-162.265000111.8L68 E69 R75 L76 V83 I87 V486 F495L68-I72 WeakPolarHBondContact O-CB 3.45Å; L68-I72 WeakPolarHBondContact O-CG2 3.46Å; L68-I72 PolarHBondContact O-N 3.33Å; E69-I72 WeakPolarHBondContact O-CG2 3.38Å; I72-R75 PolarHBondContact O-N 3.08Å; I72-L76 HydrophobicContact CD1-CD1 3.84Å; I72-L76 HydrophobicContact CD1-CG 4.2Å; I72-L76 HydrophobicContact CG1-CD1 3.96Å; I72-L76 PolarHBondContact O-N 3.28Å; I72-L76 VanDerWaalsContact O-N 3.07Å; I72-V83 HydrophobicContact CG1-CG1 3.7Å; I72-V83 HydrophobicContact CG2-CG1 4.14Å; I72-I87 HydrophobicContact CD1-CD1 4.1Å; I72-I87 HydrophobicContact CG1-CD1 4.06Å; I72-V486 HydrophobicContact CD1-CG2 4.49Å; I72-V486 HydrophobicContact CG1-CG2 4.39Å; I72-F495 HydrophobicContact CB-CE2 4.36Å; I72-F495 HydrophobicContact CD1-CD2 4.36Å; I72-F495 HydrophobicContact CD1-CE2 4.16Å
73G95.3Very high94.9Very high0 Ų014.5 Ų14.50%07%0.067CC..Hα-helixtrans-62.5-45.7175.400000112E69 R75 R77 S271 S272E69-G73 PolarHBondContact O-N 3.18Å; G73-R75 PolarHBondContact O-N 3.46Å; G73-R77 WeakPolarHBondContact O-CA 3.43Å; G73-R77 PolarHBondContact O-N 3.45Å; G73-S271 WeakPolarHBondContact CA-OG 3.35Å; G73-S272 WeakPolarHBondContact O-CA 3.22Å
74Q95.8Very high94.9Very high0 Ų013.9 Ų13.90%06%0.063CC..Hα-helixtrans-63.5-40176.4-172.8178.2-63.200112.6L70 R77 N274 E276 N278 M502L70-Q74 VanDerWaalsContact O-CB 3.28Å; L70-Q74 WeakPolarHBondContact O-CB 3.19Å; L70-Q74 PolarHBondContact O-N 2.93Å; L70-Q74 VanDerWaalsContact O-N 3.13Å; Q74-R77 WeakPolarHBondContact O-CG 3.37Å; Q74-N274 HydrophobicContact CG-CB 4.3Å; Q74-E276 PolarHBondContact NE2-O 3.35Å; Q74-N278 PolarHBondContact NE2-O 2.93Å; Q74-N278 PolarHBondContact OE1-ND2 3.17Å; Q74-M502 HydrophobicContact CB-SD 4.18Å; Q74-M502 HydrophobicContact CG-SD 4.04Å
75R95.1Very high94.6Very high78 Ų7817 Ų1729%0.2948%0.08SC..Hα-helixtrans-70-46.5-176.8179.158.4-178.5107.5-0.8113.2A71 I72 G73 D498 M502A71-R75 WeakPolarHBondContact O-CB 3.36Å; A71-R75 PolarHBondContact O-N 3.15Å; I72-R75 PolarHBondContact O-N 3.08Å; G73-R75 PolarHBondContact O-N 3.46Å; R75-D498 HydrophobicContact CG-CB 3.98Å; R75-D498 IonicContact CZ-OD1 3.47Å; R75-D498 VanDerWaalsContact NE-CG 3.32Å; R75-D498 IonicContact NE-OD1 2.76Å; R75-D498 PolarHBondContact NE-OD1 3.09Å; R75-D498 IonicContact NH2-OD1 2.67Å; R75-D498 PolarHBondContact NH2-OD1 3.47Å; R75-D498 VanDerWaalsContact NH2-OD1 3.12Å; R75-M502 HydrophobicContact CB-CE 3.99Å; R75-M502 HydrophobicContact CB-SD 3.74Å
76L93.1Very high94.4Very high29 Ų2921.2 Ų21.215%0.15210%0.103CC..Hα-helixtrans-88.6-17.6-174.2-66.2179.4000112.8I72 M78 V83 N86 I87I72-L76 HydrophobicContact CD1-CD1 3.84Å; I72-L76 HydrophobicContact CD1-CG 4.2Å; I72-L76 HydrophobicContact CG1-CD1 3.96Å; I72-L76 PolarHBondContact O-N 3.28Å; I72-L76 VanDerWaalsContact O-N 3.07Å; L76-M78 WeakPolarHBondContact O-CG 3.42Å; L76-M78 PolarHBondContact O-N 3.12Å; L76-V83 HydrophobicContact CB-CG2 4.12Å; L76-V83 HydrophobicContact CD1-CB 4.21Å; L76-V83 HydrophobicContact CD1-CG1 3.94Å; L76-V83 HydrophobicContact CD1-CG2 4.11Å; L76-N86 HydrophobicContact CD1-CB 4.46Å; L76-I87 HydrophobicContact CD1-CG1 4.22Å
77R91.9Very high94.2Very high92 Ų9222.2 Ų22.235%0.34711%0.108SC..  trans51.939.9-179.4-67-171.5160.3161.53.3113.3R12 G73 Q74 E276R12-R77 WeakPolarHBondContact CD-O 3.49Å; R12-R77 PolarHBondContact NE-O 3.49Å; R12-R77 VanDerWaalsContact NE-O 3.1Å; G73-R77 WeakPolarHBondContact O-CA 3.43Å; G73-R77 PolarHBondContact O-N 3.45Å; Q74-R77 WeakPolarHBondContact O-CG 3.37Å; R77-E276 IonicContact CZ-OE1 3.19Å; R77-E276 IonicContact NE-OE1 2.69Å; R77-E276 IonicContact NH1-OE1 2.75Å; R77-E276 PolarHBondContact NH1-OE1 2.85Å; R77-E276 IonicContact NH2-OE1 3.79Å; R77-E276 PolarHBondContact NH2-OE1 3.44Å
78M90.6Very high93.9Very high68 Ų6823.3 Ų23.334%0.33512%0.115SC..  trans-125.8161.7178.8-71.6178.7175.400109.7R12 L76 V83 N86 S272R12-M78 VanDerWaalsContact NH1-C 3.29Å; L76-M78 WeakPolarHBondContact O-CG 3.42Å; L76-M78 PolarHBondContact O-N 3.12Å; M78-V83 HydrophobicContact CB-CG2 3.95Å; M78-N86 HydrophobicContact SD-CB 4.31Å; M78-S272 WeakPolarHBondContact O-CB 3.45Å
79G89.9Confident93.5Very high0 Ų027 Ų270%014%0.139CC..  trans-75.3178.916800000110.4I81 G82 V83 E426G79-I81 PolarHBondContact O-N 2.95Å; G79-G82 PolarHBondContact O-N 3.42Å; G79-V83 WeakPolarHBondContact O-CB 3.31Å; G79-V83 WeakPolarHBondContact O-CG2 3.23Å; G79-V83 PolarHBondContact O-N 2.93Å; G79-E426 WeakPolarHBondContact CA-OE1 3.47Å; G79-E426 PolarHBondContact N-OE1 3.3Å
80S92.3Very high93.2Very high2 Ų230.6 Ų30.61%0.01416%0.157CC..Hα-helixtrans-56.2-50-173.5-175.40000112.7G82 V83 W84 G95S80-G82 PolarHBondContact O-N 3.01Å; S80-V83 PolarHBondContact O-N 3.34Å; S80-W84 PolarHBondContact O-N 3.31Å; S80-W84 VanDerWaalsContact O-N 3.16Å; S80-W84 PolarHBondContact OG-NE1 2.95Å; S80-G95 WeakPolarHBondContact OG-CA 3.12Å
81I92.9Very high93Very high6 Ų631.5 Ų31.53%0.03116%0.162CC..Hα-helixtrans-62.8-42.6178.9-71.3176.2000111.8G79 N85 I96 M99 P423 L427G79-I81 PolarHBondContact O-N 2.95Å; I81-N85 VanDerWaalsContact CG2-ND2 3.28Å; I81-N85 WeakPolarHBondContact CG2-ND2 3.47Å; I81-N85 WeakPolarHBondContact O-CB 3.43Å; I81-N85 PolarHBondContact O-N 3.01Å; I81-N85 VanDerWaalsContact O-N 3.12Å; I81-N85 PolarHBondContact O-ND2 3.07Å; I81-I96 HydrophobicContact CD1-CG1 3.75Å; I81-I96 HydrophobicContact CG1-CG1 4.15Å; I81-M99 HydrophobicContact CD1-SD 4.4Å; I81-P423 HydrophobicContact CB-CB 4.3Å; I81-P423 HydrophobicContact CD1-CB 3.51Å; I81-P423 HydrophobicContact CG1-CB 3.79Å; I81-L427 HydrophobicContact CD1-CD1 3.74Å; I81-L427 HydrophobicContact CD1-CD2 4.06Å; I81-L427 HydrophobicContact CD1-CG 3.77Å; I81-L427 HydrophobicContact CG2-CD2 4.42Å
82G91.1Very high92.7Very high14 Ų1431.5 Ų31.514%0.14416%0.162CC..Hα-helixtrans-61.3-45.7177.300000113.1G79 S80 N86 E426G79-G82 PolarHBondContact O-N 3.42Å; S80-G82 PolarHBondContact O-N 3.01Å; G82-N86 WeakPolarHBondContact O-CB 3.19Å; G82-N86 PolarHBondContact O-N 3.41Å; G82-E426 PolarHBondContact N-OE2 3.33Å
83V94.4Very high92.6Very high0 Ų031.5 Ų31.50%016%0.162CC..Hα-helixtrans-56.2-54.7177.4161.20000111.1I72 L76 M78 G79 S80 N85 N86 I87 I268I72-V83 HydrophobicContact CG1-CG1 3.7Å; I72-V83 HydrophobicContact CG2-CG1 4.14Å; L76-V83 HydrophobicContact CB-CG2 4.12Å; L76-V83 HydrophobicContact CD1-CB 4.21Å; L76-V83 HydrophobicContact CD1-CG1 3.94Å; L76-V83 HydrophobicContact CD1-CG2 4.11Å; M78-V83 HydrophobicContact CB-CG2 3.95Å; G79-V83 WeakPolarHBondContact O-CB 3.31Å; G79-V83 WeakPolarHBondContact O-CG2 3.23Å; G79-V83 PolarHBondContact O-N 2.93Å; S80-V83 PolarHBondContact O-N 3.34Å; V83-N85 PolarHBondContact O-N 3.21Å; V83-N86 PolarHBondContact O-N 2.77Å; V83-N86 VanDerWaalsContact O-N 3.15Å; V83-I87 HydrophobicContact CG1-CD1 4Å; V83-I87 PolarHBondContact O-N 3.29Å; V83-I87 VanDerWaalsContact O-N 3.08Å; V83-I268 HydrophobicContact CB-CG2 4.39Å; V83-I268 HydrophobicContact CG2-CG2 3.75Å
84W95.3Very high92.6Very high0 Ų031.5 Ų31.50%016%0.162CC..Hα-helixtrans-68.2-37.1-174.2-62.3119000112.4S80 N86 I87 S88 L91 V94 I268 E482 V486S80-W84 PolarHBondContact O-N 3.31Å; S80-W84 VanDerWaalsContact O-N 3.16Å; S80-W84 PolarHBondContact OG-NE1 2.95Å; W84-N86 VanDerWaalsContact C-N 3.31Å; W84-N86 PolarHBondContact O-N 2.89Å; W84-I87 HydrophobicContact CE3-CD1 3.79Å; W84-I87 HydrophobicContact CZ3-CD1 3.78Å; W84-S88 CarbonylContact O-C 3.51Å; W84-S88 PolarHBondContact O-N 3.43Å; W84-L91 HydrophobicContact CB-CB 4.28Å; W84-L91 WeakPolarHBondContact CB-O 3.43Å; W84-L91 HydrophobicContact CE3-CD1 4.45Å; W84-V94 HydrophobicContact CB-CB 4.48Å; W84-V94 HydrophobicContact CD2-CB 4.24Å; W84-V94 HydrophobicContact CD2-CG1 4.08Å; W84-V94 HydrophobicContact CG-CB 3.98Å; W84-V94 HydrophobicContact CG-CG1 4.19Å; W84-I268 HydrophobicContact CZ2-CD1 4.09Å; W84-E482 VanDerWaalsContact CH2-CA 3.44Å; W84-E482 HydrophobicContact CH2-CB 3.49Å; W84-E482 VanDerWaalsContact CH2-CB 3.49Å; W84-E482 HydrophobicContact CH2-CG 3.64Å; W84-E482 HydrophobicContact CZ2-CB 3.7Å; W84-E482 HydrophobicContact CZ2-CG 3.29Å; W84-E482 HydrophobicContact CZ3-CB 4.39Å; W84-V486 HydrophobicContact CH2-CG2 3.95Å; W84-V486 HydrophobicContact CZ3-CG2 3.9Å
85N92.3Very high92.6Very high65 Ų6531.5 Ų31.535%0.34816%0.162SC..Hα-helixtrans-65-33173.4-81.1-47.6000113.4I81 V83 S88 G92I81-N85 VanDerWaalsContact CG2-ND2 3.28Å; I81-N85 WeakPolarHBondContact CG2-ND2 3.47Å; I81-N85 WeakPolarHBondContact O-CB 3.43Å; I81-N85 PolarHBondContact O-N 3.01Å; I81-N85 VanDerWaalsContact O-N 3.12Å; I81-N85 PolarHBondContact O-ND2 3.07Å; V83-N85 PolarHBondContact O-N 3.21Å; N85-S88 CarbonylContact O-C 3.23Å; N85-G92 WeakPolarHBondContact OD1-CA 3.45Å
86N92.6Very high92.6Very high90 Ų9029.9 Ų29.948%0.48116%0.159SC..Hα-helixtrans-72.5-42.1179-167.8-85.7000111.7L76 M78 G82 V83 W84L76-N86 HydrophobicContact CD1-CB 4.46Å; M78-N86 HydrophobicContact SD-CB 4.31Å; G82-N86 WeakPolarHBondContact O-CB 3.19Å; G82-N86 PolarHBondContact O-N 3.41Å; V83-N86 PolarHBondContact O-N 2.77Å; V83-N86 VanDerWaalsContact O-N 3.15Å; W84-N86 VanDerWaalsContact C-N 3.31Å; W84-N86 PolarHBondContact O-N 2.89Å
87I92.6Very high92.8Very high21 Ų2128.5 Ų28.511%0.10815%0.151CC..Hα-helixtrans-60.9-51.5174.4-68.7165.4000110.4I72 L76 V83 W84 L91 V486 I489 Y490I72-I87 HydrophobicContact CD1-CD1 4.1Å; I72-I87 HydrophobicContact CG1-CD1 4.06Å; L76-I87 HydrophobicContact CD1-CG1 4.22Å; V83-I87 HydrophobicContact CG1-CD1 4Å; V83-I87 PolarHBondContact O-N 3.29Å; V83-I87 VanDerWaalsContact O-N 3.08Å; W84-I87 HydrophobicContact CE3-CD1 3.79Å; W84-I87 HydrophobicContact CZ3-CD1 3.78Å; I87-L91 HydrophobicContact CG2-CD1 3.98Å; I87-V486 HydrophobicContact CD1-CG2 4.04Å; I87-I489 HydrophobicContact CG2-CG2 4.27Å; I87-Y490 HydrophobicContact CB-CD2 4.39Å; I87-Y490 HydrophobicContact CG1-CD2 3.92Å; I87-Y490 HydrophobicContact CG1-CG 4.34Å; I87-Y490 HydrophobicContact CG2-CD2 4.18Å; I87-Y490 HydrophobicContact CG2-CG 4.4Å
88S92Very high92.9Very high23 Ų2324.1 Ų24.116%0.16114%0.135CC..  trans-159.1129.2174.2173.60000109.7W84 N85 M90 L91W84-S88 CarbonylContact O-C 3.51Å; W84-S88 PolarHBondContact O-N 3.43Å; N85-S88 CarbonylContact O-C 3.23Å; S88-M90 PolarHBondContact O-N 2.88Å; S88-M90 PolarHBondContact OG-N 3.46Å; S88-L91 PolarHBondContact O-N 3.41Å
89P89.3Confident93.2Very high79 Ų7922.1 Ų22.151%0.51313%0.125SC..G310 helixtrans-54.4-24.5175.7-2734.6000113.8L91 N585P89-L91 VanDerWaalsContact C-N 3.32Å; P89-N585 PolarHBondContact O-ND2 2.97Å
90M90.1Very high93.4Very high75 Ų7523.9 Ų23.937%0.36914%0.136SC..G310 helixtrans-72.2-24.7177-63.5-175.562.700113.4S88 A582 L586S88-M90 PolarHBondContact O-N 2.88Å; S88-M90 PolarHBondContact OG-N 3.46Å; M90-A582 HydrophobicContact CB-CB 4.43Å; M90-A582 HydrophobicContact CE-CB 4.14Å; M90-L586 HydrophobicContact CE-CD1 3.66Å; M90-L586 HydrophobicContact CE-CD2 3.71Å; M90-L586 HydrophobicContact CE-CG 3.58Å; M90-L586 HydrophobicContact SD-CD2 3.89Å; M90-L586 HydrophobicContact SD-CG 4.24Å
91L93.1Very high93.6Very high19 Ų1923.8 Ų23.810%0.09914%0.135CC..G310 helixtrans-87.6-3.2179.6-65.8177.3000113.2W84 I87 S88 P89 G93 V94 I489W84-L91 HydrophobicContact CB-CB 4.28Å; W84-L91 WeakPolarHBondContact CB-O 3.43Å; W84-L91 HydrophobicContact CE3-CD1 4.45Å; I87-L91 HydrophobicContact CG2-CD1 3.98Å; S88-L91 PolarHBondContact O-N 3.41Å; P89-L91 VanDerWaalsContact C-N 3.32Å; L91-G93 PolarHBondContact O-N 3.39Å; L91-V94 HydrophobicContact CB-CG2 4.48Å; L91-V94 HydrophobicContact CD2-CG2 4.41Å; L91-V94 WeakPolarHBondContact O-CB 3.36Å; L91-V94 WeakPolarHBondContact O-CG2 3.32Å; L91-V94 PolarHBondContact O-N 3.01Å; L91-I489 HydrophobicContact CD1-CB 4.43Å; L91-I489 HydrophobicContact CD1-CD1 3.85Å; L91-I489 HydrophobicContact CD1-CG2 4.31Å; L91-I489 HydrophobicContact CD2-CD1 4Å; L91-I489 HydrophobicContact CG-CD1 4.17Å
92G90.7Very high93.7Very high1 Ų123.5 Ų23.51%0.0113%0.134CC..Hα-helixtrans-53.5-25.8-179.800000114.8N85 V94 G95N85-G92 WeakPolarHBondContact OD1-CA 3.45Å; G92-V94 VanDerWaalsContact C-N 3.29Å; G92-V94 PolarHBondContact O-N 2.93Å; G92-G95 PolarHBondContact O-N 2.97Å
93G94.2Very high93.9Very high0 Ų025.1 Ų25.10%014%0.137CC..Hα-helixtrans-66.8-24.5174.900000114.2L91 G95 I96 A97 S577L91-G93 PolarHBondContact O-N 3.39Å; G93-G95 PolarHBondContact O-N 2.87Å; G93-I96 PolarHBondContact O-N 2.86Å; G93-A97 WeakPolarHBondContact O-CB 3.29Å; G93-A97 PolarHBondContact O-N 2.86Å; G93-S577 PolarHBondContact O-OG 2.78Å; G93-S577 VanDerWaalsContact O-OG 3.1Å
94V96.3Very high93.9Very high0 Ų026.2 Ų26.20%014%0.143CC..Hα-helixtrans-60.6-46.8175.7179.20000110.2W84 L91 G92 I96 A97 S98 I478 C481 E482 I578W84-V94 HydrophobicContact CB-CB 4.48Å; W84-V94 HydrophobicContact CD2-CB 4.24Å; W84-V94 HydrophobicContact CD2-CG1 4.08Å; W84-V94 HydrophobicContact CG-CB 3.98Å; W84-V94 HydrophobicContact CG-CG1 4.19Å; L91-V94 HydrophobicContact CB-CG2 4.48Å; L91-V94 HydrophobicContact CD2-CG2 4.41Å; L91-V94 WeakPolarHBondContact O-CB 3.36Å; L91-V94 WeakPolarHBondContact O-CG2 3.32Å; L91-V94 PolarHBondContact O-N 3.01Å; G92-V94 VanDerWaalsContact C-N 3.29Å; G92-V94 PolarHBondContact O-N 2.93Å; V94-I96 VanDerWaalsContact C-N 3.32Å; V94-I96 PolarHBondContact O-N 2.97Å; V94-A97 WeakPolarHBondContact O-CB 3.28Å; V94-A97 PolarHBondContact O-N 3Å; V94-S98 PolarHBondContact O-N 3.41Å; V94-S98 PolarHBondContact O-OG 3.41Å; V94-I478 HydrophobicContact CG1-CG2 4.01Å; V94-C481 HydrophobicContact CG2-CB 3.77Å; V94-E482 HydrophobicContact CG1-CG 3.74Å; V94-I578 HydrophobicContact CG2-CD1 4.45Å; V94-I578 HydrophobicContact CG2-CG1 4.36Å; V94-I578 HydrophobicContact CG2-CG2 4.45Å
95G95.1Very high93.9Very high0 Ų026.4 Ų26.40%014%0.144CC..Hα-helixtrans-66.4-32177.500000113.7S80 G92 G93 M99S80-G95 WeakPolarHBondContact OG-CA 3.12Å; G92-G95 PolarHBondContact O-N 2.97Å; G93-G95 PolarHBondContact O-N 2.87Å; G95-M99 WeakPolarHBondContact O-CB 3.29Å; G95-M99 PolarHBondContact O-N 3.42Å
96I95Very high94Very high43 Ų4323.3 Ų23.322%0.22113%0.127CC..Hα-helixtrans-68.8-43.1173.8-59.9177.1000110I81 G93 V94 M99 V100 V581I81-I96 HydrophobicContact CD1-CG1 3.75Å; I81-I96 HydrophobicContact CG1-CG1 4.15Å; G93-I96 PolarHBondContact O-N 2.86Å; V94-I96 VanDerWaalsContact C-N 3.32Å; V94-I96 PolarHBondContact O-N 2.97Å; I96-M99 WeakPolarHBondContact O-CB 3.45Å; I96-M99 PolarHBondContact O-N 3.49Å; I96-V100 HydrophobicContact CG2-CG2 4.4Å; I96-V100 WeakPolarHBondContact O-CG2 3.25Å; I96-V100 PolarHBondContact O-N 2.89Å; I96-V581 HydrophobicContact CD1-CG2 3.9Å
97A96.3Very high94Very high0 Ų019.2 Ų19.20%011%0.105CC..Hα-helixtrans-58.2-48.9175.800000111G93 V94 M99 V100 V101 I478 P574 S577 I578G93-A97 WeakPolarHBondContact O-CB 3.29Å; G93-A97 PolarHBondContact O-N 2.86Å; V94-A97 WeakPolarHBondContact O-CB 3.28Å; V94-A97 PolarHBondContact O-N 3Å; A97-M99 VanDerWaalsContact C-N 3.33Å; A97-M99 PolarHBondContact O-N 3.24Å; A97-V100 PolarHBondContact O-N 3.06Å; A97-V101 WeakPolarHBondContact O-CG2 3.48Å; A97-V101 PolarHBondContact O-N 2.86Å; A97-I478 HydrophobicContact CB-CD1 3.74Å; A97-I478 HydrophobicContact CB-CG1 3.77Å; A97-P574 WeakPolarHBondContact CA-O 3.38Å; A97-P574 WeakPolarHBondContact CB-O 3.09Å; A97-S577 WeakPolarHBondContact CB-OG 3.37Å; A97-S577 PolarHBondContact N-OG 3.17Å; A97-I578 HydrophobicContact CB-CD1 4.22Å; A97-I578 HydrophobicContact CB-CG1 4.08Å
98S95.7Very high94Very high0 Ų018.4 Ų18.40%010%0.101CC..Hα-helixtrans-57.7-43.1175.4-58.80000112.4V94 V101 S102 A263 I478V94-S98 PolarHBondContact O-N 3.41Å; V94-S98 PolarHBondContact O-OG 3.41Å; S98-V101 PolarHBondContact O-N 3.07Å; S98-S102 WeakPolarHBondContact O-CB 3.36Å; S98-S102 PolarHBondContact O-N 2.98Å; S98-S102 PolarHBondContact O-OG 2.98Å; S98-S102 VanDerWaalsContact O-OG 3.08Å; S98-A263 WeakPolarHBondContact CB-O 3.49Å; S98-A263 PolarHBondContact OG-O 3.22Å; S98-I478 WeakPolarHBondContact OG-CG2 3.25Å
99M95.6Very high94.1Very high27 Ų2718.6 Ų18.613%0.13310%0.098CC..Hα-helixtrans-61.7-44.6177.1-175.6-167.273.300111.8I81 G95 I96 A97 S102 F103 P423 L424 L427I81-M99 HydrophobicContact CD1-SD 4.4Å; G95-M99 WeakPolarHBondContact O-CB 3.29Å; G95-M99 PolarHBondContact O-N 3.42Å; I96-M99 WeakPolarHBondContact O-CB 3.45Å; I96-M99 PolarHBondContact O-N 3.49Å; A97-M99 VanDerWaalsContact C-N 3.33Å; A97-M99 PolarHBondContact O-N 3.24Å; M99-S102 PolarHBondContact O-N 3.45Å; M99-F103 WeakPolarHBondContact O-CB 3.43Å; M99-F103 PolarHBondContact O-N 3.15Å; M99-P423 HydrophobicContact CB-CB 4.22Å; M99-P423 HydrophobicContact CB-CG 4.37Å; M99-P423 HydrophobicContact CG-CB 4.11Å; M99-P423 HydrophobicContact CG-CG 4.41Å; M99-P423 HydrophobicContact SD-CB 3.96Å; M99-L424 HydrophobicContact SD-CD2 3.98Å; M99-L424 HydrophobicContact SD-CG 3.94Å; M99-L427 HydrophobicContact CE-CD1 4.33Å; M99-L427 HydrophobicContact SD-CD1 4.16Å
100V95.4Very high94.4Very high37 Ų3714.8 Ų14.822%0.2247%0.074CC..Hα-helixtrans-66.5-42.7178.9175.60000111I96 A97 F103 L104 P574I96-V100 HydrophobicContact CG2-CG2 4.4Å; I96-V100 WeakPolarHBondContact O-CG2 3.25Å; I96-V100 PolarHBondContact O-N 2.89Å; A97-V100 PolarHBondContact O-N 3.06Å; V100-F103 PolarHBondContact O-N 3.28Å; V100-L104 HydrophobicContact CG1-CD1 4.1Å; V100-L104 HydrophobicContact CG1-CG 4.44Å; V100-L104 WeakPolarHBondContact O-CG 3.29Å; V100-L104 PolarHBondContact O-N 2.69Å; V100-P574 HydrophobicContact CB-CB 4.29Å; V100-P574 HydrophobicContact CG1-CB 4.01Å; V100-P574 HydrophobicContact CG1-CG 3.89Å
101V95.1Very high94.7Very high0 Ų011.2 Ų11.20%06%0.056CC..Hα-helixtrans-62.3-48.2175.8173.80000110.8A97 S98 F103 L104 V105 F264 V470 P474 L475 I478 P574A97-V101 WeakPolarHBondContact O-CG2 3.48Å; A97-V101 PolarHBondContact O-N 2.86Å; S98-V101 PolarHBondContact O-N 3.07Å; V101-F103 VanDerWaalsContact C-N 3.26Å; V101-F103 PolarHBondContact O-N 3.08Å; V101-L104 PolarHBondContact O-N 2.73Å; V101-L104 VanDerWaalsContact O-N 3.16Å; V101-V105 HydrophobicContact CG1-CG2 4.1Å; V101-V105 WeakPolarHBondContact O-CB 3.41Å; V101-V105 WeakPolarHBondContact O-CG2 3.37Å; V101-V105 PolarHBondContact O-N 2.92Å; V101-F264 HydrophobicContact CG1-CE1 4.39Å; V101-V470 HydrophobicContact CG1-CG1 4.35Å; V101-P474 HydrophobicContact CG2-CB 3.68Å; V101-L475 HydrophobicContact CG1-CD2 3.75Å; V101-L475 HydrophobicContact CG1-CG 4.25Å; V101-I478 HydrophobicContact CG2-CD1 3.81Å; V101-P574 HydrophobicContact CG2-CB 3.72Å; V101-P574 HydrophobicContact CG2-CG 4.2Å
102S95.1Very high94.8Very high0 Ų010.6 Ų10.60%05%0.053CC..Hα-helixtrans-58.1-38177.1-70.40000112.4S98 M99 S106 F264S98-S102 WeakPolarHBondContact O-CB 3.36Å; S98-S102 PolarHBondContact O-N 2.98Å; S98-S102 PolarHBondContact O-OG 2.98Å; S98-S102 VanDerWaalsContact O-OG 3.08Å; M99-S102 PolarHBondContact O-N 3.45Å; S102-S106 VanDerWaalsContact O-CB 3.29Å; S102-S106 WeakPolarHBondContact O-CB 3.14Å; S102-S106 PolarHBondContact O-N 2.8Å; S102-S106 PolarHBondContact O-OG 2.55Å; S102-F264 PolarHBondContact OG-O 3.41Å
103F95.9Very high95.1Very high47 Ų4710.6 Ų10.621%0.2065%0.053CC..Hα-helixtrans-65-50173.7178-100.4000112.3M99 V100 V101 V105 S106 M107 V420 V446 S447 I450M99-F103 WeakPolarHBondContact O-CB 3.43Å; M99-F103 PolarHBondContact O-N 3.15Å; V100-F103 PolarHBondContact O-N 3.28Å; V101-F103 VanDerWaalsContact C-N 3.26Å; V101-F103 PolarHBondContact O-N 3.08Å; F103-V105 VanDerWaalsContact C-N 3.34Å; F103-V105 PolarHBondContact O-N 3.02Å; F103-S106 WeakPolarHBondContact O-CB 3.45Å; F103-S106 PolarHBondContact O-N 3.44Å; F103-M107 HydrophobicContact CD1-SD 4.29Å; F103-M107 HydrophobicContact CE1-CG 4.44Å; F103-M107 HydrophobicContact CE1-SD 3.71Å; F103-M107 HydrophobicContact CZ-SD 4.13Å; F103-M107 WeakPolarHBondContact O-CG 3.47Å; F103-M107 PolarHBondContact O-N 3.12Å; F103-V420 HydrophobicContact CB-CG2 3.92Å; F103-V446 HydrophobicContact CZ-CG1 4.49Å; F103-S447 WeakPolarHBondContact CE2-OG 3.21Å; F103-I450 HydrophobicContact CE1-CD1 4.27Å; F103-I450 HydrophobicContact CZ-CD1 3.84Å
104L95.2Very high95.3Very high24 Ų2410.6 Ų10.613%0.1265%0.053CC..Hα-helixtrans-63.5-39.4179.8-68.4173.6000112.2V100 V101 M107 F466 V470 L570 P574V100-L104 HydrophobicContact CG1-CD1 4.1Å; V100-L104 HydrophobicContact CG1-CG 4.44Å; V100-L104 WeakPolarHBondContact O-CG 3.29Å; V100-L104 PolarHBondContact O-N 2.69Å; V101-L104 PolarHBondContact O-N 2.73Å; V101-L104 VanDerWaalsContact O-N 3.16Å; L104-M107 HydrophobicContact CD2-SD 4.48Å; L104-M107 PolarHBondContact O-N 3.02Å; L104-F466 HydrophobicContact CD2-CE1 4.07Å; L104-V470 HydrophobicContact CB-CG1 3.59Å; L104-V470 HydrophobicContact CB-CG2 4.26Å; L104-V470 HydrophobicContact CD1-CG1 4.16Å; L104-V470 HydrophobicContact CD1-CG2 4.39Å; L104-L570 HydrophobicContact CD1-CD2 4.31Å; L104-L570 HydrophobicContact CD2-CD2 4.22Å; L104-P574 HydrophobicContact CD1-CG 4.02Å
105V94.1Very high95.3Very high4 Ų410.6 Ų10.62%0.0245%0.053CC..Hα-helixtrans-66.5-43.2176174.40000111.1V101 F103 M107 F108 Y109 F264 V470V101-V105 HydrophobicContact CG1-CG2 4.1Å; V101-V105 WeakPolarHBondContact O-CB 3.41Å; V101-V105 WeakPolarHBondContact O-CG2 3.37Å; V101-V105 PolarHBondContact O-N 2.92Å; F103-V105 VanDerWaalsContact C-N 3.34Å; F103-V105 PolarHBondContact O-N 3.02Å; V105-M107 PolarHBondContact O-N 2.68Å; V105-M107 VanDerWaalsContact O-N 3.15Å; V105-F108 HydrophobicContact CB-CE1 4.04Å; V105-F108 HydrophobicContact CG1-CE1 3.99Å; V105-F108 HydrophobicContact CG1-CZ 4.1Å; V105-F108 HydrophobicContact CG2-CE1 3.98Å; V105-F108 PolarHBondContact O-N 3.47Å; V105-Y109 WeakPolarHBondContact O-CB 3.4Å; V105-Y109 PolarHBondContact O-N 2.61Å; V105-F264 HydrophobicContact CB-CE1 4.04Å; V105-F264 HydrophobicContact CG1-CE1 4Å; V105-F264 HydrophobicContact CG2-CE1 3.83Å; V105-F264 HydrophobicContact CG2-CZ 4.38Å; V105-V470 HydrophobicContact CG2-CG1 3.76Å
106S94.8Very high95.4Very high0 Ų010.7 Ų10.70%05%0.053CC..Hα-helixtrans-52.5-37.6175.3-66.60000112.7S102 F103 N110 M413 N416S102-S106 VanDerWaalsContact O-CB 3.29Å; S102-S106 WeakPolarHBondContact O-CB 3.14Å; S102-S106 PolarHBondContact O-N 2.8Å; S102-S106 PolarHBondContact O-OG 2.55Å; F103-S106 WeakPolarHBondContact O-CB 3.45Å; F103-S106 PolarHBondContact O-N 3.44Å; S106-N110 VanDerWaalsContact O-CB 3.28Å; S106-N110 WeakPolarHBondContact O-CB 3.32Å; S106-N110 PolarHBondContact O-N 3.04Å; S106-M413 WeakPolarHBondContact O-CE 3.44Å; S106-N416 VanDerWaalsContact OG-CB 3.29Å; S106-N416 WeakPolarHBondContact OG-CB 3.42Å
107M92.8Very high95.5Very high4 Ų49 Ų92%0.025%0.045CC..Hα-helixtrans-67.1-54.3-175.6-66.5177.732.700113.2F103 L104 V105 T111 I450 F454 F466F103-M107 HydrophobicContact CD1-SD 4.29Å; F103-M107 HydrophobicContact CE1-CG 4.44Å; F103-M107 HydrophobicContact CE1-SD 3.71Å; F103-M107 HydrophobicContact CZ-SD 4.13Å; F103-M107 WeakPolarHBondContact O-CG 3.47Å; F103-M107 PolarHBondContact O-N 3.12Å; L104-M107 HydrophobicContact CD2-SD 4.48Å; L104-M107 PolarHBondContact O-N 3.02Å; V105-M107 PolarHBondContact O-N 2.68Å; V105-M107 VanDerWaalsContact O-N 3.15Å; M107-T111 PolarHBondContact O-N 2.87Å; M107-T111 PolarHBondContact O-OG1 3.42Å; M107-T111 VanDerWaalsContact O-OG1 3.1Å; M107-I450 HydrophobicContact CE-CB 4.16Å; M107-I450 HydrophobicContact CE-CG2 3.3Å; M107-I450 HydrophobicContact SD-CB 4.3Å; M107-I450 HydrophobicContact SD-CG2 3.75Å; M107-F454 HydrophobicContact CB-CE2 3.9Å; M107-F454 HydrophobicContact CE-CE2 3.68Å; M107-F454 HydrophobicContact CE-CZ 3.91Å; M107-F466 HydrophobicContact CE-CE1 4.05Å
108F92.6Very high95.6Very high3 Ų311.2 Ų11.21%0.0135%0.053CC..Hα-helixtrans-73.8-34.8-178.480.1-99.4000111V105 N110 T111 I112 F454 V463 F466 N467V105-F108 HydrophobicContact CB-CE1 4.04Å; V105-F108 HydrophobicContact CG1-CE1 3.99Å; V105-F108 HydrophobicContact CG1-CZ 4.1Å; V105-F108 HydrophobicContact CG2-CE1 3.98Å; V105-F108 PolarHBondContact O-N 3.47Å; F108-N110 VanDerWaalsContact C-N 3.32Å; F108-N110 PolarHBondContact O-N 2.93Å; F108-T111 VanDerWaalsContact O-CB 3.29Å; F108-T111 WeakPolarHBondContact O-CB 3.48Å; F108-T111 PolarHBondContact O-N 3.5Å; F108-T111 VanDerWaalsContact O-N 3.08Å; F108-I112 HydrophobicContact CD2-CD1 4.09Å; F108-I112 HydrophobicContact CE2-CD1 4.33Å; F108-I112 PolarHBondContact O-N 3.13Å; F108-I112 VanDerWaalsContact O-N 3.11Å; F108-F454 HydrophobicContact CB-CE2 4.35Å; F108-F454 HydrophobicContact CB-CZ 4.12Å; F108-V463 HydrophobicContact CB-CG1 4.33Å; F108-V463 HydrophobicContact CD2-CG1 4.33Å; F108-F466 HydrophobicContact CB-CB 3.97Å; F108-F466 HydrophobicContact CD1-CB 3.74Å; F108-F466 HydrophobicContact CE1-CB 4.49Å; F108-F466 HydrophobicContact CG-CB 4.03Å; F108-N467 HydrophobicContact CD2-CB 4.13Å; F108-N467 HydrophobicContact CE2-CB 3.76Å; F108-N467 HydrophobicContact CZ-CB 4.12Å
109Y93.7Very high95.7Very high27 Ų2711.2 Ų11.211%0.1065%0.053CC..Hα-helixtrans-65.4-36.2179-158-89.8000111.8I32 V105 T111 I112 I113 G409 S412 M413I32-Y109 HydrophobicContact CD1-CE1 4.17Å; I32-Y109 PolarHBondContact N-OH 3.12Å; V105-Y109 WeakPolarHBondContact O-CB 3.4Å; V105-Y109 PolarHBondContact O-N 2.61Å; Y109-T111 VanDerWaalsContact C-N 3.31Å; Y109-T111 PolarHBondContact O-N 2.84Å; Y109-I112 WeakPolarHBondContact O-CB 3.37Å; Y109-I112 PolarHBondContact O-N 3.21Å; Y109-I113 HydrophobicContact CD1-CD1 4.38Å; Y109-I113 PolarHBondContact O-N 3.3Å; Y109-G409 WeakPolarHBondContact CE1-O 3.28Å; Y109-S412 WeakPolarHBondContact OH-CB 3.37Å; Y109-S412 PolarHBondContact OH-OG 2.77Å; Y109-M413 HydrophobicContact CD1-CG 3.89Å; Y109-M413 HydrophobicContact CD1-SD 3.71Å; Y109-M413 HydrophobicContact CE1-CG 4.39Å; Y109-M413 HydrophobicContact CG-SD 4.31Å
110N96.1Very high95.8Very high0 Ų011.9 Ų11.90%06%0.055CC..Hα-helixtrans-72.8-23.8173.8-158.842.2000113.5S106 F108 I112 I113 A114 A185 W186 I189 M413S106-N110 VanDerWaalsContact O-CB 3.28Å; S106-N110 WeakPolarHBondContact O-CB 3.32Å; S106-N110 PolarHBondContact O-N 3.04Å; F108-N110 VanDerWaalsContact C-N 3.32Å; F108-N110 PolarHBondContact O-N 2.93Å; N110-I112 VanDerWaalsContact C-N 3.33Å; N110-I113 WeakPolarHBondContact O-CB 3.45Å; N110-I113 PolarHBondContact O-N 3.07Å; N110-A114 PolarHBondContact O-N 3.33Å; N110-A185 WeakPolarHBondContact OD1-CB 3.37Å; N110-W186 HydrophobicContact CB-CZ2 3.9Å; N110-W186 PolarHBondContact ND2-N 3.26Å; N110-W186 PolarHBondContact ND2-NE1 2.96Å; N110-I189 HydrophobicContact CB-CD1 4.43Å; N110-I189 WeakPolarHBondContact OD1-CD1 3.43Å; N110-M413 HydrophobicContact CB-CE 3.94Å; N110-M413 HydrophobicContact CB-SD 4.41Å
111T96.2Very high95.9Very high0 Ų014.8 Ų14.80%07%0.065CC..Hα-helixtrans-66.6-40170.4-54.80000110.7M107 F108 Y109 I113 A114 W115 F454 V463M107-T111 PolarHBondContact O-N 2.87Å; M107-T111 PolarHBondContact O-OG1 3.42Å; M107-T111 VanDerWaalsContact O-OG1 3.1Å; F108-T111 VanDerWaalsContact O-CB 3.29Å; F108-T111 WeakPolarHBondContact O-CB 3.48Å; F108-T111 PolarHBondContact O-N 3.5Å; F108-T111 VanDerWaalsContact O-N 3.08Å; Y109-T111 VanDerWaalsContact C-N 3.31Å; Y109-T111 PolarHBondContact O-N 2.84Å; T111-I113 VanDerWaalsContact C-N 3.28Å; T111-I113 PolarHBondContact O-N 2.86Å; T111-A114 WeakPolarHBondContact O-CA 3.43Å; T111-A114 VanDerWaalsContact O-CB 3.22Å; T111-A114 WeakPolarHBondContact O-CB 3.4Å; T111-A114 PolarHBondContact O-N 2.84Å; T111-W115 HydrophobicContact CG2-CZ2 4.03Å; T111-W115 PolarHBondContact O-N 3.32Å; T111-F454 HydrophobicContact CG2-CB 3.54Å; T111-F454 HydrophobicContact CG2-CG 4.36Å; T111-F454 WeakPolarHBondContact OG1-CD2 3.44Å; T111-V463 HydrophobicContact CG2-CG2 4Å
112I95.1Very high96Very high6 Ų615.8 Ų15.83%0.0317%0.07CC..Hα-helixtrans-60-41.2173.4-66.9175000110.9I32 W36 F108 Y109 N110 A114 W115 V116 V463I32-I112 HydrophobicContact CD1-CG2 3.89Å; W36-I112 HydrophobicContact CH2-CG2 3.21Å; W36-I112 HydrophobicContact CZ2-CD1 4.14Å; W36-I112 HydrophobicContact CZ2-CG2 3.67Å; W36-I112 HydrophobicContact CZ3-CG2 4.36Å; F108-I112 HydrophobicContact CD2-CD1 4.09Å; F108-I112 HydrophobicContact CE2-CD1 4.33Å; F108-I112 PolarHBondContact O-N 3.13Å; F108-I112 VanDerWaalsContact O-N 3.11Å; Y109-I112 WeakPolarHBondContact O-CB 3.37Å; Y109-I112 PolarHBondContact O-N 3.21Å; N110-I112 VanDerWaalsContact C-N 3.33Å; I112-A114 VanDerWaalsContact C-N 3.28Å; I112-A114 PolarHBondContact O-N 2.89Å; I112-W115 HydrophobicContact CB-CE3 4.3Å; I112-W115 HydrophobicContact CG1-CE3 3.95Å; I112-W115 HydrophobicContact CG1-CZ3 3.82Å; I112-W115 WeakPolarHBondContact O-CB 3.44Å; I112-W115 PolarHBondContact O-N 2.88Å; I112-V116 WeakPolarHBondContact O-CG2 3.09Å; I112-V116 PolarHBondContact O-N 3.37Å; I112-V463 HydrophobicContact CD1-CG1 4.49Å; I112-V463 HydrophobicContact CG1-CG1 4.29Å
113I96.6Very high96.1Very high0 Ų015.8 Ų15.80%07%0.07CC..Hα-helixtrans-61.6-37.5173.3-64.8172.8000111.1Y109 N110 T111 W115 V116 L117 A185 L406 G409 M413Y109-I113 HydrophobicContact CD1-CD1 4.38Å; Y109-I113 PolarHBondContact O-N 3.3Å; N110-I113 WeakPolarHBondContact O-CB 3.45Å; N110-I113 PolarHBondContact O-N 3.07Å; T111-I113 VanDerWaalsContact C-N 3.28Å; T111-I113 PolarHBondContact O-N 2.86Å; I113-W115 VanDerWaalsContact C-N 3.35Å; I113-W115 PolarHBondContact O-N 2.93Å; I113-V116 WeakPolarHBondContact O-CB 3.23Å; I113-V116 PolarHBondContact O-N 3.43Å; I113-L117 HydrophobicContact CG2-CD1 4.45Å; I113-L117 WeakPolarHBondContact O-CG 3.32Å; I113-L117 PolarHBondContact O-N 3.08Å; I113-A185 HydrophobicContact CB-CB 4.43Å; I113-A185 HydrophobicContact CG2-CB 3.95Å; I113-L406 HydrophobicContact CG2-CD1 3.61Å; I113-G409 VanDerWaalsContact CD1-C 3.49Å; I113-M413 HydrophobicContact CD1-CG 3.51Å
114A97.7Very high96.1Very high0 Ų019.4 Ų19.40%09%0.086CC..Hα-helixtrans-61.8-40.7174.200000112.2N110 T111 I112 L117 W118 C181 L182N110-A114 PolarHBondContact O-N 3.33Å; T111-A114 WeakPolarHBondContact O-CA 3.43Å; T111-A114 VanDerWaalsContact O-CB 3.22Å; T111-A114 WeakPolarHBondContact O-CB 3.4Å; T111-A114 PolarHBondContact O-N 2.84Å; I112-A114 VanDerWaalsContact C-N 3.28Å; I112-A114 PolarHBondContact O-N 2.89Å; A114-L117 PolarHBondContact O-N 3.39Å; A114-W118 PolarHBondContact O-N 3.1Å; A114-C181 HydrophobicContact CB-CB 3.99Å; A114-C181 WeakPolarHBondContact O-CB 3.31Å; A114-L182 HydrophobicContact CB-CB 4.11Å; A114-L182 HydrophobicContact CB-CD1 4.28Å
115W97.5Very high96Very high1 Ų122.9 Ų22.90%0.00410%0.102CC..Hα-helixtrans-62.7-42.7172.4-60.7-29.5000112T111 I112 I113 L117 W118 Y119 W157 L162 T377 F381 V463T111-W115 HydrophobicContact CG2-CZ2 4.03Å; T111-W115 PolarHBondContact O-N 3.32Å; I112-W115 HydrophobicContact CB-CE3 4.3Å; I112-W115 HydrophobicContact CG1-CE3 3.95Å; I112-W115 HydrophobicContact CG1-CZ3 3.82Å; I112-W115 WeakPolarHBondContact O-CB 3.44Å; I112-W115 PolarHBondContact O-N 2.88Å; I113-W115 VanDerWaalsContact C-N 3.35Å; I113-W115 PolarHBondContact O-N 2.93Å; W115-L117 VanDerWaalsContact C-N 3.32Å; W115-L117 PolarHBondContact O-N 3.2Å; W115-W118 WeakPolarHBondContact O-CB 3.47Å; W115-W118 PolarHBondContact O-N 2.83Å; W115-Y119 WeakPolarHBondContact O-CD2 3.4Å; W115-Y119 PolarHBondContact O-N 3.39Å; W115-Y119 VanDerWaalsContact O-N 3.09Å; W115-W157 HydrophobicContact CB-CH2 4.48Å; W115-W157 HydrophobicContact CB-CZ3 4.36Å; W115-W157 AromaticContact CD2-CH2 3.81Å; W115-W157 HydrophobicContact CD2-CH2 3.81Å; W115-W157 HydrophobicContact CD2-CZ3 4.43Å; W115-W157 AromaticContact CE3-CH2 3.79Å; W115-W157 HydrophobicContact CE3-CH2 3.79Å; W115-W157 HydrophobicContact CG-CH2 4.14Å; W115-W157 HydrophobicContact CG-CZ3 4.3Å; W115-W157 HydrophobicContact CZ3-CH2 4.24Å; W115-L162 HydrophobicContact CZ2-CD2 3.93Å; W115-T377 HydrophobicContact CE3-CG2 4.22Å; W115-T377 HydrophobicContact CZ3-CG2 3.59Å; W115-F381 HydrophobicContact CB-CE1 4.02Å; W115-F381 HydrophobicContact CB-CE2 4.07Å; W115-F381 HydrophobicContact CB-CZ 3.53Å; W115-F381 HydrophobicContact CE3-CE2 4.07Å; W115-V463 HydrophobicContact CH2-CB 3.76Å; W115-V463 HydrophobicContact CH2-CG1 3.66Å; W115-V463 HydrophobicContact CH2-CG2 3.7Å; W115-V463 HydrophobicContact CZ2-CB 4.47Å; W115-V463 HydrophobicContact CZ2-CG2 3.96Å; W115-V463 HydrophobicContact CZ3-CG1 3.96Å
116V97.2Very high95.8Very high1 Ų129 Ų291%0.00613%0.134CC..Hα-helixtrans-60.2-42.6174.6172.40000111.4I112 I113 Y119 F120 F381 F402 L405 L406I112-V116 WeakPolarHBondContact O-CG2 3.09Å; I112-V116 PolarHBondContact O-N 3.37Å; I113-V116 WeakPolarHBondContact O-CB 3.23Å; I113-V116 PolarHBondContact O-N 3.43Å; V116-Y119 PolarHBondContact O-N 3.26Å; V116-F120 WeakPolarHBondContact O-CB 3.26Å; V116-F120 PolarHBondContact O-N 2.69Å; V116-F381 HydrophobicContact CG2-CE1 4.24Å; V116-F381 HydrophobicContact CG2-CZ 3.89Å; V116-F402 HydrophobicContact CG1-CB 4.26Å; V116-F402 HydrophobicContact CG1-CD1 4.23Å; V116-F402 WeakPolarHBondContact CG1-O 3.09Å; V116-L405 HydrophobicContact CG1-CB 3.86Å; V116-L405 HydrophobicContact CG2-CB 3.92Å; V116-L405 HydrophobicContact CG2-CD1 4.19Å; V116-L406 HydrophobicContact CG1-CB 3.95Å
117L97.8Very high95.7Very high8 Ų832.5 Ų32.54%0.04216%0.157CC..Hα-helixtrans-62.7-42.1175.9-75.2174.1000112I113 A114 W115 Y119 F120 F121 T184 A185 L406I113-L117 HydrophobicContact CG2-CD1 4.45Å; I113-L117 WeakPolarHBondContact O-CG 3.32Å; I113-L117 PolarHBondContact O-N 3.08Å; A114-L117 PolarHBondContact O-N 3.39Å; W115-L117 VanDerWaalsContact C-N 3.32Å; W115-L117 PolarHBondContact O-N 3.2Å; L117-Y119 PolarHBondContact O-N 3.37Å; L117-F120 WeakPolarHBondContact O-CB 3.25Å; L117-F120 PolarHBondContact O-N 3.26Å; L117-F121 HydrophobicContact CB-CE2 4.11Å; L117-F121 HydrophobicContact CD2-CZ 4.38Å; L117-F121 WeakPolarHBondContact O-CD2 3.5Å; L117-F121 WeakPolarHBondContact O-CG 3.47Å; L117-F121 PolarHBondContact O-N 3.1Å; L117-T184 HydrophobicContact CD1-CG2 4.03Å; L117-A185 HydrophobicContact CD1-CB 3.88Å; L117-L406 HydrophobicContact CD2-CD1 3.93Å; L117-L406 HydrophobicContact CD2-CD2 3.89Å; L117-L406 HydrophobicContact CG-CD1 4.19Å
118W97.8Very high95.8Very high47 Ų4732.5 Ų32.518%0.17816%0.157CC..Hα-helixtrans-57-48.4175.8171.6-105.9000111.9A114 W115 F121 N122 F156 T161 W177A114-W118 PolarHBondContact O-N 3.1Å; W115-W118 WeakPolarHBondContact O-CB 3.47Å; W115-W118 PolarHBondContact O-N 2.83Å; W118-F121 PolarHBondContact O-N 3.05Å; W118-N122 VanDerWaalsContact CE2-ND2 3.28Å; W118-N122 WeakPolarHBondContact O-CB 3.17Å; W118-N122 PolarHBondContact O-N 3.48Å; W118-N122 VanDerWaalsContact O-N 3.15Å; W118-N122 PolarHBondContact O-ND2 3.21Å; W118-F156 AromaticContact NE1-CE1 3.89Å; W118-F156 AromaticContact NE1-CZ 3.68Å; W118-T161 VanDerWaalsContact CD1-CG2 3.45Å; W118-T161 HydrophobicContact CG-CG2 4.31Å; W118-T161 PolarHBondContact NE1-OG1 2.93Å; W118-W177 HydrophobicContact CE3-CB 4.33Å; W118-W177 HydrophobicContact CH2-CB 4.16Å; W118-W177 HydrophobicContact CH2-CG 4.16Å; W118-W177 HydrophobicContact CZ3-CB 3.71Å; W118-W177 HydrophobicContact CZ3-CG 4.09Å
119Y97.8Very high95.9Very high0 Ų034.1 Ų34.10%017%0.168CC..Hα-helixtrans-68.1-38.1176.8-86.8-95.6000112.8W115 V116 L117 F121 N122 S123 W130 F156 W157 T161 F381 T385 F402W115-Y119 WeakPolarHBondContact O-CD2 3.4Å; W115-Y119 PolarHBondContact O-N 3.39Å; W115-Y119 VanDerWaalsContact O-N 3.09Å; V116-Y119 PolarHBondContact O-N 3.26Å; L117-Y119 PolarHBondContact O-N 3.37Å; Y119-F121 PolarHBondContact O-N 3.34Å; Y119-N122 CarbonylContact O-C 3.35Å; Y119-N122 PolarHBondContact O-N 2.95Å; Y119-S123 PolarHBondContact O-N 2.87Å; Y119-S123 PolarHBondContact O-OG 3.19Å; Y119-W130 AromaticContact CD1-CE3 3.94Å; Y119-W130 HydrophobicContact CD1-CE3 3.94Å; Y119-W130 AromaticContact CD1-CH2 3.84Å; Y119-W130 HydrophobicContact CD1-CH2 3.84Å; Y119-W130 HydrophobicContact CD1-CZ2 4.44Å; Y119-W130 AromaticContact CD1-CZ3 3.55Å; Y119-W130 HydrophobicContact CD1-CZ3 3.55Å; Y119-W130 HydrophobicContact CE1-CD2 4.33Å; Y119-W130 AromaticContact CE1-CE3 3.93Å; Y119-W130 HydrophobicContact CE1-CE3 3.93Å; Y119-W130 HydrophobicContact CE1-CZ3 4.04Å; Y119-F156 HydrophobicContact CD1-CE1 4.1Å; Y119-F156 AromaticContact CE1-CD1 3.75Å; Y119-F156 HydrophobicContact CE1-CD1 3.75Å; Y119-F156 AromaticContact CE1-CE1 3.57Å; Y119-F156 HydrophobicContact CE1-CE1 3.57Å; Y119-F156 HydrophobicContact CE2-CE1 4.22Å; Y119-F156 AromaticContact CZ-CD1 3.72Å; Y119-F156 AromaticContact CZ-CE1 3.66Å; Y119-F156 WeakPolarHBondContact OH-CD1 3.32Å; Y119-W157 AromaticContact CE2-CE3 3.78Å; Y119-W157 HydrophobicContact CE2-CE3 3.78Å; Y119-W157 AromaticContact CE2-CZ3 3.91Å; Y119-W157 HydrophobicContact CE2-CZ3 3.91Å; Y119-T161 HydrophobicContact CE2-CG2 4.18Å; Y119-F381 AromaticContact CD2-CD1 3.44Å; Y119-F381 HydrophobicContact CD2-CD1 3.44Å; Y119-F381 VanDerWaalsContact CD2-CD1 3.44Å; Y119-F381 AromaticContact CD2-CE1 3.68Å; Y119-F381 HydrophobicContact CD2-CE1 3.68Å; Y119-F381 HydrophobicContact CE1-CD1 4.44Å; Y119-F381 HydrophobicContact CE2-CB 4.18Å; Y119-F381 AromaticContact CE2-CD1 3.34Å; Y119-F381 HydrophobicContact CE2-CD1 3.34Å; Y119-F381 AromaticContact CE2-CE1 4Å; Y119-F381 HydrophobicContact CE2-CE1 4Å; Y119-F381 HydrophobicContact CE2-CG 4.03Å; Y119-F381 HydrophobicContact CG-CD1 4.03Å; Y119-F381 HydrophobicContact CG-CE1 4.31Å; Y119-F381 AromaticContact CZ-CD1 3.87Å; Y119-F381 PolarHBondContact OH-O 3.37Å; Y119-T385 HydrophobicContact CD1-CG2 4.09Å; Y119-T385 HydrophobicContact CE1-CG2 3.84Å; Y119-F402 VanDerWaalsContact CB-CE1 3.4Å; Y119-F402 HydrophobicContact CD1-CE1 4.05Å; Y119-F402 AromaticContact CD1-CE2 3.79Å; Y119-F402 HydrophobicContact CD1-CE2 3.79Å; Y119-F402 AromaticContact CD1-CZ 3.34Å; Y119-F402 HydrophobicContact CD1-CZ 3.34Å; Y119-F402 HydrophobicContact CD2-CE1 4.47Å; Y119-F402 HydrophobicContact CE1-CZ 4.24Å; Y119-F402 HydrophobicContact CG-CD1 4.46Å; Y119-F402 AromaticContact CG-CE1 3.75Å; Y119-F402 HydrophobicContact CG-CE1 3.75Å; Y119-F402 HydrophobicContact CG-CE2 4.07Å; Y119-F402 AromaticContact CG-CZ 3.52Å; Y119-F402 HydrophobicContact CG-CZ 3.52Å
120F97.4Very high96Very high41 Ų4132.9 Ų32.918%0.1816%0.163CC..Hα-helixtrans-57.7-49.2174.9170.2-107.7000111.4V116 L117 N122 S123 F124 V399 F402 V403V116-F120 WeakPolarHBondContact O-CB 3.26Å; V116-F120 PolarHBondContact O-N 2.69Å; L117-F120 WeakPolarHBondContact O-CB 3.25Å; L117-F120 PolarHBondContact O-N 3.26Å; F120-N122 VanDerWaalsContact C-N 3.29Å; F120-N122 PolarHBondContact O-N 3.42Å; F120-S123 WeakPolarHBondContact O-CB 3.22Å; F120-S123 PolarHBondContact O-N 2.96Å; F120-S123 VanDerWaalsContact O-N 3.14Å; F120-F124 HydrophobicContact CD1-CE2 4.41Å; F120-F124 HydrophobicContact CD2-CE2 4.14Å; F120-F124 HydrophobicContact CD2-CZ 4.43Å; F120-F124 HydrophobicContact CE1-CE2 4Å; F120-F124 HydrophobicContact CE1-CZ 4.43Å; F120-F124 AromaticContact CE2-CE2 3.69Å; F120-F124 HydrophobicContact CE2-CE2 3.69Å; F120-F124 AromaticContact CE2-CZ 3.63Å; F120-F124 HydrophobicContact CE2-CZ 3.63Å; F120-F124 HydrophobicContact CG-CE2 4.48Å; F120-F124 AromaticContact CZ-CE2 3.63Å; F120-F124 HydrophobicContact CZ-CE2 3.63Å; F120-F124 AromaticContact CZ-CZ 3.64Å; F120-F124 HydrophobicContact CZ-CZ 3.64Å; F120-F124 WeakPolarHBondContact O-CD2 3.41Å; F120-F124 VanDerWaalsContact O-CE2 3.31Å; F120-F124 WeakPolarHBondContact O-CE2 3.35Å; F120-V399 HydrophobicContact CE2-CG1 4.23Å; F120-F402 HydrophobicContact CB-CB 4Å; F120-V403 HydrophobicContact CD2-CG2 3.58Å; F120-V403 HydrophobicContact CE2-CG2 3.28Å; F120-V403 HydrophobicContact CZ-CG2 4.24Å
121F97.1Very high95.9Very high97 Ų9734.7 Ų34.743%0.42518%0.176SC..Hα-helixtrans-64.3-33.9178.3-64.7-45.1000112.8L117 W118 Y119 S123L117-F121 HydrophobicContact CB-CE2 4.11Å; L117-F121 HydrophobicContact CD2-CZ 4.38Å; L117-F121 WeakPolarHBondContact O-CD2 3.5Å; L117-F121 WeakPolarHBondContact O-CG 3.47Å; L117-F121 PolarHBondContact O-N 3.1Å; W118-F121 PolarHBondContact O-N 3.05Å; Y119-F121 PolarHBondContact O-N 3.34Å; F121-S123 VanDerWaalsContact C-N 3.32Å
122N96.8Very high95.6Very high21 Ų2141.2 Ų41.211%0.11221%0.206CC..Hα-helixtrans-78.1-11.6176.5-81.1-70000114.2W118 Y119 F120 F124 P129 W130 F156W118-N122 VanDerWaalsContact CE2-ND2 3.28Å; W118-N122 WeakPolarHBondContact O-CB 3.17Å; W118-N122 PolarHBondContact O-N 3.48Å; W118-N122 VanDerWaalsContact O-N 3.15Å; W118-N122 PolarHBondContact O-ND2 3.21Å; Y119-N122 CarbonylContact O-C 3.35Å; Y119-N122 PolarHBondContact O-N 2.95Å; F120-N122 VanDerWaalsContact C-N 3.29Å; F120-N122 PolarHBondContact O-N 3.42Å; N122-F124 VanDerWaalsContact C-N 3.29Å; N122-F124 PolarHBondContact O-N 3.39Å; N122-P129 HydrophobicContact CB-CG 4.07Å; N122-P129 VanDerWaalsContact O-CD 3.3Å; N122-P129 WeakPolarHBondContact O-CD 3.33Å; N122-W130 HydrophobicContact CB-CZ3 4.08Å; N122-F156 HydrophobicContact CB-CZ 4.41Å
123S97.4Very high95.4Very high0 Ų042.3 Ų42.30%021%0.214CC..THydrogen-bonded Turntrans-76.3-11.7-177.6-62.80000114.2Y119 F120 F121 Q125Y119-S123 PolarHBondContact O-N 2.87Å; Y119-S123 PolarHBondContact O-OG 3.19Å; F120-S123 WeakPolarHBondContact O-CB 3.22Å; F120-S123 PolarHBondContact O-N 2.96Å; F120-S123 VanDerWaalsContact O-N 3.14Å; F121-S123 VanDerWaalsContact C-N 3.32Å; S123-Q125 VanDerWaalsContact C-N 3.28Å; S123-Q125 PolarHBondContact O-N 3.23Å
124F95.6Very high95.1Very high123 Ų12344.5 Ų44.554%0.53923%0.229SC..THydrogen-bonded Turntrans-85.111.4-177-66.2-81000114.5F120 N122 V399F120-F124 HydrophobicContact CD1-CE2 4.41Å; F120-F124 HydrophobicContact CD2-CE2 4.14Å; F120-F124 HydrophobicContact CD2-CZ 4.43Å; F120-F124 HydrophobicContact CE1-CE2 4Å; F120-F124 HydrophobicContact CE1-CZ 4.43Å; F120-F124 AromaticContact CE2-CE2 3.69Å; F120-F124 HydrophobicContact CE2-CE2 3.69Å; F120-F124 AromaticContact CE2-CZ 3.63Å; F120-F124 HydrophobicContact CE2-CZ 3.63Å; F120-F124 HydrophobicContact CG-CE2 4.48Å; F120-F124 AromaticContact CZ-CE2 3.63Å; F120-F124 HydrophobicContact CZ-CE2 3.63Å; F120-F124 AromaticContact CZ-CZ 3.64Å; F120-F124 HydrophobicContact CZ-CZ 3.64Å; F120-F124 WeakPolarHBondContact O-CD2 3.41Å; F120-F124 VanDerWaalsContact O-CE2 3.31Å; F120-F124 WeakPolarHBondContact O-CE2 3.35Å; N122-F124 VanDerWaalsContact C-N 3.29Å; N122-F124 PolarHBondContact O-N 3.39Å; F124-V399 HydrophobicContact CD1-CG2 4.33Å; F124-V399 HydrophobicContact CE1-CG1 4.44Å; F124-V399 HydrophobicContact CE1-CG2 4.05Å; F124-V399 HydrophobicContact CZ-CG1 4.28Å; F124-V399 HydrophobicContact CZ-CG2 4.18Å
125Q93.2Very high94.6Very high97 Ų9749.4 Ų49.445%0.45325%0.254SS..SBendtrans-113.4140.8-175.1-57.2178.340.900111.9S123 P127 Q395S123-Q125 VanDerWaalsContact C-N 3.28Å; S123-Q125 PolarHBondContact O-N 3.23Å; Q125-P127 CarbonylContact C-O 3.3Å; Q125-P127 CarbonylContact O-C 3.38Å; Q125-Q395 PolarHBondContact O-NE2 3.49Å
126N90Very high93.9Very high132 Ų13252 Ų5271%0.70627%0.268SS*.SBendtrans-122.1114.3175.3-165.2-15.6000108.9Q395N126-Q395 VanDerWaalsContact N-NE2 3.18Å
127P92.5Very high92.9Very high75 Ų7556.9 Ų56.949%0.48731%0.309SS..SBendcis-71.8162.52.132.2-37000113.3Q125Q125-P127 CarbonylContact C-O 3.3Å; Q125-P127 CarbonylContact O-C 3.38Å
128L95.7Very high92Very high3 Ų363 Ų632%0.01634%0.341CS..  trans-64.5143.7175.3-75.7171.2000110.6W130 S131 V388 L389 Q395 A398L128-W130 VanDerWaalsContact C-N 3.27Å; L128-W130 HydrophobicContact CB-CD2 4.44Å; L128-W130 HydrophobicContact CB-CZ2 4.4Å; L128-W130 HydrophobicContact CD1-CZ2 3.91Å; L128-W130 HydrophobicContact CD2-CH2 4.04Å; L128-W130 HydrophobicContact CD2-CZ2 3.88Å; L128-W130 HydrophobicContact CG-CZ2 4.29Å; L128-W130 PolarHBondContact O-N 3.46Å; L128-S131 WeakPolarHBondContact O-CB 3.38Å; L128-S131 PolarHBondContact O-N 3.43Å; L128-S131 PolarHBondContact O-OG 2.96Å; L128-V388 HydrophobicContact CD1-CG1 4.39Å; L128-L389 HydrophobicContact CB-CD2 4.23Å; L128-L389 HydrophobicContact CD1-CD2 4.02Å; L128-Q395 HydrophobicContact CD2-CG 4.27Å; L128-Q395 HydrophobicContact CG-CG 4.32Å; L128-A398 HydrophobicContact CD1-CB 4.37Å; L128-A398 HydrophobicContact CD2-CB 4.38Å
129P94.9Very high90.9Very high38 Ų3868.3 Ų68.325%0.24737%0.368CS..THydrogen-bonded Turntrans-61-29.6-174.7-29.939.7000115.3N122 S131 F156N122-P129 HydrophobicContact CB-CG 4.07Å; N122-P129 VanDerWaalsContact O-CD 3.3Å; N122-P129 WeakPolarHBondContact O-CD 3.33Å; P129-S131 VanDerWaalsContact C-N 3.32Å; P129-F156 HydrophobicContact CB-CD2 4.08Å; P129-F156 HydrophobicContact CB-CE2 3.52Å; P129-F156 HydrophobicContact CB-CZ 4.12Å
130W95.3Very high89.7Confident1 Ų173.7 Ų73.70%0.00440%0.401CS..THydrogen-bonded Turntrans-88.77.7177.553.488.7000114.1Y119 N122 L128 S152 V153 F156 T385 A398 F402Y119-W130 AromaticContact CD1-CE3 3.94Å; Y119-W130 HydrophobicContact CD1-CE3 3.94Å; Y119-W130 AromaticContact CD1-CH2 3.84Å; Y119-W130 HydrophobicContact CD1-CH2 3.84Å; Y119-W130 HydrophobicContact CD1-CZ2 4.44Å; Y119-W130 AromaticContact CD1-CZ3 3.55Å; Y119-W130 HydrophobicContact CD1-CZ3 3.55Å; Y119-W130 HydrophobicContact CE1-CD2 4.33Å; Y119-W130 AromaticContact CE1-CE3 3.93Å; Y119-W130 HydrophobicContact CE1-CE3 3.93Å; Y119-W130 HydrophobicContact CE1-CZ3 4.04Å; N122-W130 HydrophobicContact CB-CZ3 4.08Å; L128-W130 VanDerWaalsContact C-N 3.27Å; L128-W130 HydrophobicContact CB-CD2 4.44Å; L128-W130 HydrophobicContact CB-CZ2 4.4Å; L128-W130 HydrophobicContact CD1-CZ2 3.91Å; L128-W130 HydrophobicContact CD2-CH2 4.04Å; L128-W130 HydrophobicContact CD2-CZ2 3.88Å; L128-W130 HydrophobicContact CG-CZ2 4.29Å; L128-W130 PolarHBondContact O-N 3.46Å; W130-S152 WeakPolarHBondContact O-CB 3.35Å; W130-S152 PolarHBondContact O-OG 3.43Å; W130-V153 HydrophobicContact CB-CG2 4.38Å; W130-F156 HydrophobicContact CB-CB 3.69Å; W130-F156 HydrophobicContact CB-CD1 3.97Å; W130-F156 HydrophobicContact CB-CD2 4.37Å; W130-F156 HydrophobicContact CB-CG 3.74Å; W130-F156 AromaticContact CE3-CD1 3.91Å; W130-F156 HydrophobicContact CE3-CD1 3.91Å; W130-F156 AromaticContact CE3-CE1 3.61Å; W130-F156 HydrophobicContact CE3-CE1 3.61Å; W130-F156 HydrophobicContact CE3-CG 4.49Å; W130-F156 AromaticContact CE3-CZ 3.94Å; W130-F156 HydrophobicContact CE3-CZ 3.94Å; W130-F156 HydrophobicContact CZ3-CE1 4.14Å; W130-F156 HydrophobicContact CZ3-CZ 4.37Å; W130-T385 HydrophobicContact CZ2-CG2 4.44Å; W130-A398 HydrophobicContact CH2-CB 4.45Å; W130-A398 HydrophobicContact CZ2-CB 4.01Å; W130-F402 HydrophobicContact CH2-CE2 4.11Å; W130-F402 HydrophobicContact CZ2-CE2 4.27Å
131S93.7Very high88.3Confident37 Ų3774.9 Ų74.926%0.25943%0.425SS..SBendtrans-79.4-24.2-176.965.30000114.7L128 P129L128-S131 WeakPolarHBondContact O-CB 3.38Å; L128-S131 PolarHBondContact O-N 3.43Å; L128-S131 PolarHBondContact O-OG 2.96Å; P129-S131 VanDerWaalsContact C-N 3.32Å
132Q91.3Very high87.3Confident137 Ų13771.5 Ų71.564%0.6442%0.418SS*.SBendtrans-140147.4-172.8-65.8-178.10.600111.2
133C90.9Very high86.7Confident30 Ų3076.4 Ų76.420%0.20344%0.435CS..PPolyproline II helixtrans-72.3139.4172.6-76.40000111.2Y143 C147C133-Y143 HydrophobicContact CB-CD1 3.64Å; C133-Y143 HydrophobicContact CB-CE1 4.34Å; C133-Y143 HydrophobicContact CB-CG 4.08Å; C133-Y143 WeakPolarHBondContact O-CD1 3.34Å; C133-C147 WeakPolarHBondContact CA-SG 3.29Å; C133-C147 HydrophobicContact CB-CB 3.78Å; C133-C147 WeakPolarHBondContact CB-SG 3.47Å; C133-C147 WeakPolarHBondContact SG-CB 3.3Å; C133-C147 CovalentContact SG-SG 2.03Å; C133-C147 PolarHBondContact SG-SG 3.42Å
134P90.1Very high86.2Confident46 Ų4677.3 Ų77.330%0.29944%0.442SS..PPolyproline II helixtrans-69.9153.5171.829.7-33.4000111.1S144 Y155P134-S144 PolarHBondContact O-N 3.21Å; P134-Y155 HydrophobicContact CG-CD1 4.01Å; P134-Y155 HydrophobicContact CG-CE1 3.44Å; P134-Y155 VanDerWaalsContact CG-CE1 3.44Å
135L87.4Confident85.9Confident103 Ų10374.5 Ų74.554%0.53944%0.438SS..BIsolated β-bridgetrans-66.9151.2172.7-65174.7000110.6Y143L135-Y143 HydrophobicContact CD2-CD1 4.5Å; L135-Y143 HydrophobicContact CD2-CE1 4.48Å
136N82.9Confident85.7Confident55 Ų5571.4 Ų71.429%0.29442%0.423SS..PPolyproline II helixtrans-55153172.8-86.7-43000111.9N138 Q139 G142 Y143 S144N136-N138 PolarHBondContact O-N 2.95Å; N136-Q139 WeakPolarHBondContact O-CA 3.34Å; N136-Q139 PolarHBondContact O-N 3.47Å; N136-G142 WeakPolarHBondContact CB-O 3.39Å; N136-G142 PolarHBondContact N-O 3.43Å; N136-G142 PolarHBondContact ND2-O 2.88Å; N136-Y143 PolarHBondContact ND2-O 3.29Å; N136-Y143 PolarHBondContact OD1-O 3.21Å; N136-S144 VanDerWaalsContact OD1-CA 3.27Å; N136-S144 WeakPolarHBondContact OD1-CA 3.43Å
137A74.9Confident85.8Confident104 Ų10465.1 Ų65.186%0.8639%0.39SS*.THydrogen-bonded Turntrans-53.9-29.7-179.500000113.9Q139A137-Q139 VanDerWaalsContact C-N 3.33Å
138N79.6Confident85.6Confident135 Ų13568.1 Ų68.172%0.72240%0.397SS*.THydrogen-bonded Turntrans-85-3.1178.9-63.1-21.4000113.8N136 T140N136-N138 PolarHBondContact O-N 2.95Å; N138-T140 HydrophobicContact CB-CG2 3.91Å; N138-T140 WeakPolarHBondContact O-CG2 3.23Å; N138-T140 PolarHBondContact O-N 3.23Å
139Q75.1Confident85.2Confident159 Ų15973.9 Ų73.974%0.74342%0.422SS*.  trans51.124.1-178.6-60.5179.3-11.300114.3N136 A137 G141N136-Q139 WeakPolarHBondContact O-CA 3.34Å; N136-Q139 PolarHBondContact O-N 3.47Å; A137-Q139 VanDerWaalsContact C-N 3.33Å; Q139-G141 PolarHBondContact O-N 3.2Å
140T72.1Confident84.9Confident114 Ų11472.9 Ų72.970%0.69942%0.416SS*.SBendtrans-77.921.4-175.948.10000113.9N138N138-T140 HydrophobicContact CB-CG2 3.91Å; N138-T140 WeakPolarHBondContact O-CG2 3.23Å; N138-T140 PolarHBondContact O-N 3.23Å
141G67.3Low84.7Confident65 Ų6574.9 Ų74.967%0.6743%0.428SS*.SBendtrans84.23.2178.500000116.3Q139Q139-G141 PolarHBondContact O-N 3.2Å
142G76.4Confident84.6Confident27 Ų2774.3 Ų74.328%0.27842%0.424SS..PPolyproline II helixtrans-100.9154.8173.500000113.1N136N136-G142 WeakPolarHBondContact CB-O 3.39Å; N136-G142 PolarHBondContact N-O 3.43Å; N136-G142 PolarHBondContact ND2-O 2.88Å
143Y84.8Confident84.7Confident123 Ų12367.8 Ų67.848%0.48239%0.394SS..BIsolated β-bridgetrans-81157.9173-65.8-70.2000112C133 L135 N136 S145C133-Y143 HydrophobicContact CB-CD1 3.64Å; C133-Y143 HydrophobicContact CB-CE1 4.34Å; C133-Y143 HydrophobicContact CB-CG 4.08Å; C133-Y143 WeakPolarHBondContact O-CD1 3.34Å; L135-Y143 HydrophobicContact CD2-CD1 4.5Å; L135-Y143 HydrophobicContact CD2-CE1 4.48Å; N136-Y143 PolarHBondContact ND2-O 3.29Å; N136-Y143 PolarHBondContact OD1-O 3.21Å; Y143-S145 PolarHBondContact O-N 2.94Å
144S87.3Confident84.7Confident19 Ų1967.8 Ų67.813%0.13339%0.392CS..PPolyproline II helixtrans-51.4124.7171.7178.30000111.2P134 N136 E146 C147 E148P134-S144 PolarHBondContact O-N 3.21Å; N136-S144 VanDerWaalsContact OD1-CA 3.27Å; N136-S144 WeakPolarHBondContact OD1-CA 3.43Å; S144-E146 PolarHBondContact O-N 2.86Å; S144-C147 WeakPolarHBondContact O-CB 3.15Å; S144-C147 PolarHBondContact O-N 3.21Å; S144-E148 PolarHBondContact O-N 3.01Å
145S87.8Confident84.9Confident65 Ų6567.3 Ų67.346%0.45538%0.384SS..Hα-helixtrans-57.6-34-176.8177.40000113Y143 K149Y143-S145 PolarHBondContact O-N 2.94Å; S145-K149 WeakPolarHBondContact O-CB 3.46Å; S145-K149 WeakPolarHBondContact O-CG 3.45Å; S145-K149 PolarHBondContact O-N 3.37Å
146E90.4Very high85.3Confident31 Ų3163 Ų6315%0.14536%0.361CS..Hα-helixtrans-69.1-38.7176.7-176.2176.6-179.800111.6S144 S150 Y155 R159 W544 F551S144-E146 PolarHBondContact O-N 2.86Å; E146-S150 WeakPolarHBondContact O-CB 3.2Å; E146-S150 PolarHBondContact O-N 2.9Å; E146-S150 PolarHBondContact O-OG 3.21Å; E146-Y155 HydrophobicContact CB-CD2 4.34Å; E146-Y155 HydrophobicContact CB-CE2 4.4Å; E146-Y155 HydrophobicContact CG-CD2 4.35Å; E146-R159 IonicContact OE1-CZ 3.14Å; E146-R159 IonicContact OE1-NE 2.87Å; E146-R159 PolarHBondContact OE1-NE 3.36Å; E146-R159 IonicContact OE1-NH2 2.77Å; E146-R159 PolarHBondContact OE1-NH2 2.87Å; E146-R159 IonicContact OE2-CZ 3.62Å; E146-R159 IonicContact OE2-NE 2.8Å; E146-R159 PolarHBondContact OE2-NE 3.16Å; E146-R159 IonicContact OE2-NH2 3.12Å; E146-W544 PolarHBondContact OE1-NE1 3.14Å; E146-F551 HydrophobicContact CG-CZ 3.85Å
147C91.2Very high85.9Confident1 Ų160.4 Ų60.41%0.00735%0.347CS..Hα-helixtrans-70.6-41.7179.3-164.80000111.7C133 S144 S150 T151 S152 Y155C133-C147 WeakPolarHBondContact CA-SG 3.29Å; C133-C147 HydrophobicContact CB-CB 3.78Å; C133-C147 WeakPolarHBondContact CB-SG 3.47Å; C133-C147 WeakPolarHBondContact SG-CB 3.3Å; C133-C147 CovalentContact SG-SG 2.03Å; C133-C147 PolarHBondContact SG-SG 3.42Å; S144-C147 WeakPolarHBondContact O-CB 3.15Å; S144-C147 PolarHBondContact O-N 3.21Å; C147-S150 CarbonylContact O-C 3.32Å; C147-S150 PolarHBondContact O-N 2.88Å; C147-T151 PolarHBondContact O-N 3.36Å; C147-S152 VanDerWaalsContact SG-CA 3.56Å; C147-Y155 HydrophobicContact CB-CD2 3.7Å; C147-Y155 HydrophobicContact CB-CE2 4.39Å; C147-Y155 HydrophobicContact CB-CG 3.86Å
148E88.3Confident86.8Confident137 Ų13757.1 Ų57.164%0.6431%0.313SS*.Hα-helixtrans-66-38.5179.7-172.6176.7-16700112.6S144S144-E148 PolarHBondContact O-N 3.01Å
149K87.1Confident87.5Confident124 Ų12452.7 Ų52.754%0.53929%0.286SS..Hα-helixtrans-75.4-22.9176.1-73.5180-177.3-1760113.5S145 F551 P552S145-K149 WeakPolarHBondContact O-CB 3.46Å; S145-K149 WeakPolarHBondContact O-CG 3.45Å; S145-K149 PolarHBondContact O-N 3.37Å; K149-F551 HydrophobicContact CB-CD1 3.62Å; K149-F551 HydrophobicContact CB-CE1 3.45Å; K149-F551 VanDerWaalsContact CB-CE1 3.45Å; K149-F551 HydrophobicContact CD-CD1 3.92Å; K149-F551 HydrophobicContact CD-CE1 4.32Å; K149-F551 HydrophobicContact CG-CD1 4.45Å; K149-P552 WeakPolarHBondContact O-CG 3.36Å
150S89.3Confident88.4Confident18 Ų1849.4 Ų49.413%0.12627%0.27CS..SBendtrans-109.1-117.717864.70000110.5E146 C147E146-S150 WeakPolarHBondContact O-CB 3.2Å; E146-S150 PolarHBondContact O-N 2.9Å; E146-S150 PolarHBondContact O-OG 3.21Å; C147-S150 CarbonylContact O-C 3.32Å; C147-S150 PolarHBondContact O-N 2.88Å
151T89.9Confident89.5Confident43 Ų4344 Ų4426%0.26424%0.237SC..  trans-146.6160.3172.164.60000109.6C147 V153 N154 Y155C147-T151 PolarHBondContact O-N 3.36Å; T151-V153 PolarHBondContact O-N 3.31Å; T151-N154 PolarHBondContact O-N 3.37Å; T151-N154 WeakPolarHBondContact OG1-CB 3.33Å; T151-N154 PolarHBondContact OG1-N 2.98Å; T151-N154 VanDerWaalsContact OG1-N 3.07Å; T151-N154 PolarHBondContact OG1-ND2 3.45Å; T151-Y155 WeakPolarHBondContact O-CB 3.45Å; T151-Y155 PolarHBondContact O-N 3Å
152S92.9Very high90.8Very high24 Ų2441.4 Ų41.417%0.16821%0.208CC..Hα-helixtrans-56.7-34.6173.960.40000112.7W130 C147 F156W130-S152 WeakPolarHBondContact O-CB 3.35Å; W130-S152 PolarHBondContact O-OG 3.43Å; C147-S152 VanDerWaalsContact SG-CA 3.56Å; S152-F156 WeakPolarHBondContact O-CB 3.42Å; S152-F156 PolarHBondContact O-N 3.09Å
153V93.1Very high91.7Very high1 Ų143.3 Ų43.31%0.00621%0.212CC..Hα-helixtrans-73.3-44.5179.1-173.50000111.7W130 T151 Y155 F156 W157 I382 T385 E386 L389W130-V153 HydrophobicContact CB-CG2 4.38Å; T151-V153 PolarHBondContact O-N 3.31Å; V153-Y155 VanDerWaalsContact C-N 3.3Å; V153-Y155 PolarHBondContact O-N 2.99Å; V153-F156 PolarHBondContact O-N 2.91Å; V153-W157 PolarHBondContact O-N 3.3Å; V153-I382 HydrophobicContact CG1-CB 4.41Å; V153-I382 HydrophobicContact CG1-CG2 4.21Å; V153-T385 WeakPolarHBondContact CG1-OG1 3.33Å; V153-E386 HydrophobicContact CG2-CB 4Å; V153-E386 HydrophobicContact CG2-CG 4.38Å; V153-L389 HydrophobicContact CG2-CD1 3.84Å
154N91.8Very high92.2Very high29 Ų2937.8 Ų37.816%0.15519%0.191CC..Hα-helixtrans-59.1-44.1173.3-81-40.6000111T151 W157 Y158 I382 W544T151-N154 PolarHBondContact O-N 3.37Å; T151-N154 WeakPolarHBondContact OG1-CB 3.33Å; T151-N154 PolarHBondContact OG1-N 2.98Å; T151-N154 VanDerWaalsContact OG1-N 3.07Å; T151-N154 PolarHBondContact OG1-ND2 3.45Å; N154-W157 PolarHBondContact O-N 3.06Å; N154-Y158 HydrophobicContact CB-CD2 4.43Å; N154-Y158 VanDerWaalsContact O-CD2 3.31Å; N154-Y158 WeakPolarHBondContact O-CD2 3.45Å; N154-Y158 PolarHBondContact O-N 3.34Å; N154-I382 WeakPolarHBondContact OD1-CD1 3.34Å; N154-I382 WeakPolarHBondContact OD1-CG2 3.22Å; N154-W544 HydrophobicContact CB-CH2 4.16Å
155Y93.9Very high92.6Very high37 Ų3737.9 Ų37.915%0.14519%0.191CC..Hα-helixtrans-61.6-45.8176.8-172.6-86.2000111.6P134 E146 C147 T151 V153 W157 R159 E160P134-Y155 HydrophobicContact CG-CD1 4.01Å; P134-Y155 HydrophobicContact CG-CE1 3.44Å; P134-Y155 VanDerWaalsContact CG-CE1 3.44Å; E146-Y155 HydrophobicContact CB-CD2 4.34Å; E146-Y155 HydrophobicContact CB-CE2 4.4Å; E146-Y155 HydrophobicContact CG-CD2 4.35Å; C147-Y155 HydrophobicContact CB-CD2 3.7Å; C147-Y155 HydrophobicContact CB-CE2 4.39Å; C147-Y155 HydrophobicContact CB-CG 3.86Å; T151-Y155 WeakPolarHBondContact O-CB 3.45Å; T151-Y155 PolarHBondContact O-N 3Å; V153-Y155 VanDerWaalsContact C-N 3.3Å; V153-Y155 PolarHBondContact O-N 2.99Å; Y155-W157 VanDerWaalsContact C-N 3.31Å; Y155-W157 PolarHBondContact O-N 3.24Å; Y155-R159 HydrophobicContact CD1-CB 4.33Å; Y155-R159 HydrophobicContact CD2-CB 4.33Å; Y155-R159 HydrophobicContact CD2-CG 4.01Å; Y155-R159 HydrophobicContact CE1-CB 4.05Å; Y155-R159 HydrophobicContact CE2-CB 4.08Å; Y155-R159 HydrophobicContact CE2-CG 3.82Å; Y155-R159 HydrophobicContact CG-CB 4.46Å; Y155-R159 WeakPolarHBondContact O-CA 3.42Å; Y155-R159 VanDerWaalsContact O-CB 3.32Å; Y155-R159 WeakPolarHBondContact O-CB 3.48Å; Y155-R159 PolarHBondContact O-N 3.45Å; Y155-E160 HydrophobicContact CD1-CG 4.26Å; Y155-E160 HydrophobicContact CE1-CG 4.05Å; Y155-E160 PolarHBondContact O-N 3.4Å
156F95.5Very high92.8Very high11 Ų1138.6 Ų38.65%0.04819%0.187CC..Iπ-helixtrans-61.9-37.2177.3-174.5-96.3000112.7W118 Y119 N122 P129 W130 S152 V153 E160 T161W118-F156 AromaticContact NE1-CE1 3.89Å; W118-F156 AromaticContact NE1-CZ 3.68Å; Y119-F156 HydrophobicContact CD1-CE1 4.1Å; Y119-F156 AromaticContact CE1-CD1 3.75Å; Y119-F156 HydrophobicContact CE1-CD1 3.75Å; Y119-F156 AromaticContact CE1-CE1 3.57Å; Y119-F156 HydrophobicContact CE1-CE1 3.57Å; Y119-F156 HydrophobicContact CE2-CE1 4.22Å; Y119-F156 AromaticContact CZ-CD1 3.72Å; Y119-F156 AromaticContact CZ-CE1 3.66Å; Y119-F156 WeakPolarHBondContact OH-CD1 3.32Å; N122-F156 HydrophobicContact CB-CZ 4.41Å; P129-F156 HydrophobicContact CB-CD2 4.08Å; P129-F156 HydrophobicContact CB-CE2 3.52Å; P129-F156 HydrophobicContact CB-CZ 4.12Å; W130-F156 HydrophobicContact CB-CB 3.69Å; W130-F156 HydrophobicContact CB-CD1 3.97Å; W130-F156 HydrophobicContact CB-CD2 4.37Å; W130-F156 HydrophobicContact CB-CG 3.74Å; W130-F156 AromaticContact CE3-CD1 3.91Å; W130-F156 HydrophobicContact CE3-CD1 3.91Å; W130-F156 AromaticContact CE3-CE1 3.61Å; W130-F156 HydrophobicContact CE3-CE1 3.61Å; W130-F156 HydrophobicContact CE3-CG 4.49Å; W130-F156 AromaticContact CE3-CZ 3.94Å; W130-F156 HydrophobicContact CE3-CZ 3.94Å; W130-F156 HydrophobicContact CZ3-CE1 4.14Å; W130-F156 HydrophobicContact CZ3-CZ 4.37Å; S152-F156 WeakPolarHBondContact O-CB 3.42Å; S152-F156 PolarHBondContact O-N 3.09Å; V153-F156 PolarHBondContact O-N 2.91Å; F156-E160 HydrophobicContact CD2-CB 3.77Å; F156-E160 HydrophobicContact CD2-CG 4.08Å; F156-E160 HydrophobicContact CE2-CB 4.09Å; F156-E160 HydrophobicContact CG-CB 4.35Å; F156-E160 WeakPolarHBondContact O-CB 3.17Å; F156-E160 PolarHBondContact O-N 3.43Å; F156-T161 WeakPolarHBondContact CE1-OG1 3.15Å; F156-T161 VanDerWaalsContact O-CB 3.31Å; F156-T161 WeakPolarHBondContact O-CB 3.47Å; F156-T161 PolarHBondContact O-N 3.4Å; F156-T161 PolarHBondContact O-OG1 2.91Å
157W95.3Very high92.8Very high2 Ų238.9 Ų38.91%0.00819%0.189CC..Iπ-helixtrans-70.5-57.3176.1177.3-116.1000112.4W115 Y119 V153 N154 Y155 T161 L162 F381 I382W115-W157 HydrophobicContact CB-CH2 4.48Å; W115-W157 HydrophobicContact CB-CZ3 4.36Å; W115-W157 AromaticContact CD2-CH2 3.81Å; W115-W157 HydrophobicContact CD2-CH2 3.81Å; W115-W157 HydrophobicContact CD2-CZ3 4.43Å; W115-W157 AromaticContact CE3-CH2 3.79Å; W115-W157 HydrophobicContact CE3-CH2 3.79Å; W115-W157 HydrophobicContact CG-CH2 4.14Å; W115-W157 HydrophobicContact CG-CZ3 4.3Å; W115-W157 HydrophobicContact CZ3-CH2 4.24Å; Y119-W157 AromaticContact CE2-CE3 3.78Å; Y119-W157 HydrophobicContact CE2-CE3 3.78Å; Y119-W157 AromaticContact CE2-CZ3 3.91Å; Y119-W157 HydrophobicContact CE2-CZ3 3.91Å; V153-W157 PolarHBondContact O-N 3.3Å; N154-W157 PolarHBondContact O-N 3.06Å; Y155-W157 VanDerWaalsContact C-N 3.31Å; Y155-W157 PolarHBondContact O-N 3.24Å; W157-T161 HydrophobicContact CE3-CG2 3.92Å; W157-T161 HydrophobicContact CZ3-CG2 3.96Å; W157-T161 WeakPolarHBondContact O-CB 3.34Å; W157-L162 HydrophobicContact CD2-CD1 3.98Å; W157-L162 HydrophobicContact CD2-CG 4.31Å; W157-L162 VanDerWaalsContact CE2-CD1 3.5Å; W157-L162 HydrophobicContact CE3-CG 4.41Å; W157-L162 HydrophobicContact CG-CD1 4.42Å; W157-L162 HydrophobicContact CH2-CD1 4.34Å; W157-L162 HydrophobicContact CH2-CD2 4.29Å; W157-L162 HydrophobicContact CH2-CG 4.47Å; W157-L162 HydrophobicContact CZ2-CD1 3.72Å; W157-L162 HydrophobicContact CZ2-CD2 4.43Å; W157-L162 HydrophobicContact CZ2-CG 4.32Å; W157-L162 WeakPolarHBondContact O-CB 3.35Å; W157-L162 WeakPolarHBondContact O-CG 3.21Å; W157-L162 PolarHBondContact O-N 3.39Å; W157-F381 HydrophobicContact CD2-CB 4Å; W157-F381 HydrophobicContact CE3-CB 3.66Å; W157-F381 HydrophobicContact CE3-CD2 4.34Å; W157-F381 AromaticContact CE3-CG 3.95Å; W157-F381 HydrophobicContact CE3-CG 3.95Å; W157-F381 HydrophobicContact CH2-CB 4.21Å; W157-F381 AromaticContact CH2-CD2 3.39Å; W157-F381 HydrophobicContact CH2-CD2 3.39Å; W157-F381 AromaticContact CH2-CE2 3.86Å; W157-F381 HydrophobicContact CH2-CE2 3.86Å; W157-F381 AromaticContact CH2-CG 3.85Å; W157-F381 HydrophobicContact CH2-CG 3.85Å; W157-F381 HydrophobicContact CZ2-CD2 4.05Å; W157-F381 HydrophobicContact CZ3-CB 3.77Å; W157-F381 HydrophobicContact CZ3-CD1 4.03Å; W157-F381 AromaticContact CZ3-CD2 3.56Å; W157-F381 HydrophobicContact CZ3-CD2 3.56Å; W157-F381 HydrophobicContact CZ3-CE2 4.13Å; W157-F381 AromaticContact CZ3-CG 3.51Å; W157-F381 HydrophobicContact CZ3-CG 3.51Å; W157-I382 HydrophobicContact CB-CG1 4.23Å; W157-I382 HydrophobicContact CG-CD1 4.35Å; W157-I382 HydrophobicContact CG-CG1 4.19Å
158Y94.2Very high92.9Very high34 Ų3438.8 Ų38.813%0.13319%0.189CC..Iπ-helixtrans-78.1-29.7-171.3-69.7-65.5000113.7N154 L162 N163 I164 I382 W544N154-Y158 HydrophobicContact CB-CD2 4.43Å; N154-Y158 VanDerWaalsContact O-CD2 3.31Å; N154-Y158 WeakPolarHBondContact O-CD2 3.45Å; N154-Y158 PolarHBondContact O-N 3.34Å; Y158-L162 HydrophobicContact CD1-CD1 4.39Å; Y158-N163 WeakPolarHBondContact O-CA 3.25Å; Y158-N163 PolarHBondContact O-N 3.31Å; Y158-I164 HydrophobicContact CD1-CB 4.47Å; Y158-I164 HydrophobicContact CD1-CD1 3.97Å; Y158-I164 HydrophobicContact CD1-CG2 3.87Å; Y158-I164 HydrophobicContact CE1-CD1 4.22Å; Y158-I164 HydrophobicContact CG-CG2 4.32Å; Y158-I164 WeakPolarHBondContact O-CG2 3.21Å; Y158-I164 PolarHBondContact O-N 3.08Å; Y158-I382 HydrophobicContact CE2-CD1 4.19Å; Y158-W544 HydrophobicContact CD1-CB 3.94Å; Y158-W544 HydrophobicContact CD1-CD2 4.07Å; Y158-W544 AromaticContact CD1-CG 3.82Å; Y158-W544 HydrophobicContact CD1-CG 3.82Å; Y158-W544 AromaticContact CD2-CD2 3.46Å; Y158-W544 HydrophobicContact CD2-CD2 3.46Å; Y158-W544 VanDerWaalsContact CD2-CD2 3.46Å; Y158-W544 AromaticContact CD2-CE2 3.56Å; Y158-W544 AromaticContact CD2-CE3 3.58Å; Y158-W544 HydrophobicContact CD2-CE3 3.58Å; Y158-W544 HydrophobicContact CD2-CG 4.06Å; Y158-W544 AromaticContact CD2-CH2 3.89Å; Y158-W544 HydrophobicContact CD2-CH2 3.89Å; Y158-W544 AromaticContact CD2-CZ2 3.77Å; Y158-W544 HydrophobicContact CD2-CZ2 3.77Å; Y158-W544 AromaticContact CD2-CZ3 3.8Å; Y158-W544 HydrophobicContact CD2-CZ3 3.8Å; Y158-W544 HydrophobicContact CE1-CB 4.07Å; Y158-W544 HydrophobicContact CE1-CD2 4.3Å; Y158-W544 HydrophobicContact CE1-CE3 4.31Å; Y158-W544 HydrophobicContact CE1-CG 4.22Å; Y158-W544 AromaticContact CE2-CD2 3.74Å; Y158-W544 HydrophobicContact CE2-CD2 3.74Å; Y158-W544 AromaticContact CE2-CE3 3.35Å; Y158-W544 HydrophobicContact CE2-CE3 3.35Å; Y158-W544 HydrophobicContact CE2-CG 4.47Å; Y158-W544 HydrophobicContact CE2-CH2 4.04Å; Y158-W544 HydrophobicContact CE2-CZ2 4.36Å; Y158-W544 AromaticContact CE2-CZ3 3.53Å; Y158-W544 HydrophobicContact CE2-CZ3 3.53Å; Y158-W544 HydrophobicContact CG-CB 4.35Å; Y158-W544 AromaticContact CG-CD1 3.91Å; Y158-W544 AromaticContact CG-CD2 3.64Å; Y158-W544 HydrophobicContact CG-CD2 3.64Å; Y158-W544 AromaticContact CG-CE2 3.8Å; Y158-W544 HydrophobicContact CG-CE3 4.16Å; Y158-W544 AromaticContact CG-CG 3.71Å; Y158-W544 HydrophobicContact CG-CG 3.71Å; Y158-W544 HydrophobicContact CG-CZ2 4.42Å; Y158-W544 AromaticContact CG-NE1 3.96Å; Y158-W544 AromaticContact CZ-CE3 3.74Å
159R93.5Very high93Very high43 Ų4334 Ų3416%0.16218%0.176CC..Iπ-helixtrans-104.3-54.6-177.3-64-69.5170.4-117.8-7.6113.4E146 Y155 N163 I164 W544E146-R159 IonicContact OE1-CZ 3.14Å; E146-R159 IonicContact OE1-NE 2.87Å; E146-R159 PolarHBondContact OE1-NE 3.36Å; E146-R159 IonicContact OE1-NH2 2.77Å; E146-R159 PolarHBondContact OE1-NH2 2.87Å; E146-R159 IonicContact OE2-CZ 3.62Å; E146-R159 IonicContact OE2-NE 2.8Å; E146-R159 PolarHBondContact OE2-NE 3.16Å; E146-R159 IonicContact OE2-NH2 3.12Å; Y155-R159 HydrophobicContact CD1-CB 4.33Å; Y155-R159 HydrophobicContact CD2-CB 4.33Å; Y155-R159 HydrophobicContact CD2-CG 4.01Å; Y155-R159 HydrophobicContact CE1-CB 4.05Å; Y155-R159 HydrophobicContact CE2-CB 4.08Å; Y155-R159 HydrophobicContact CE2-CG 3.82Å; Y155-R159 HydrophobicContact CG-CB 4.46Å; Y155-R159 WeakPolarHBondContact O-CA 3.42Å; Y155-R159 VanDerWaalsContact O-CB 3.32Å; Y155-R159 WeakPolarHBondContact O-CB 3.48Å; Y155-R159 PolarHBondContact O-N 3.45Å; R159-N163 VanDerWaalsContact O-CA 3.28Å; R159-N163 WeakPolarHBondContact O-CA 3.25Å; R159-N163 PolarHBondContact O-N 2.95Å; R159-I164 PolarHBondContact NH1-O 3.49Å; R159-W544 VanDerWaalsContact NH2-CD1 3.28Å
160E94.1Very high93.2Very high89 Ų8932.7 Ų32.742%0.41617%0.174SC..Iπ-helixtrans-76.1-39.8-175.3-61.8-66.7156.800112.4Y155 F156Y155-E160 HydrophobicContact CD1-CG 4.26Å; Y155-E160 HydrophobicContact CE1-CG 4.05Å; Y155-E160 PolarHBondContact O-N 3.4Å; F156-E160 HydrophobicContact CD2-CB 3.77Å; F156-E160 HydrophobicContact CD2-CG 4.08Å; F156-E160 HydrophobicContact CE2-CB 4.09Å; F156-E160 HydrophobicContact CG-CB 4.35Å; F156-E160 WeakPolarHBondContact O-CB 3.17Å; F156-E160 PolarHBondContact O-N 3.43Å
161T95.8Very high93.1Very high0 Ų034.4 Ų34.40%019%0.186CC..Iπ-helixtrans-84.2-59.6-177.3-58.80000111.5W118 Y119 F156 W157 W177 M178W118-T161 VanDerWaalsContact CD1-CG2 3.45Å; W118-T161 HydrophobicContact CG-CG2 4.31Å; W118-T161 PolarHBondContact NE1-OG1 2.93Å; Y119-T161 HydrophobicContact CE2-CG2 4.18Å; F156-T161 WeakPolarHBondContact CE1-OG1 3.15Å; F156-T161 VanDerWaalsContact O-CB 3.31Å; F156-T161 WeakPolarHBondContact O-CB 3.47Å; F156-T161 PolarHBondContact O-N 3.4Å; F156-T161 PolarHBondContact O-OG1 2.91Å; W157-T161 HydrophobicContact CE3-CG2 3.92Å; W157-T161 HydrophobicContact CZ3-CG2 3.96Å; W157-T161 WeakPolarHBondContact O-CB 3.34Å; T161-W177 PolarHBondContact O-NE1 3.28Å; T161-M178 HydrophobicContact CG2-CE 3.64Å; T161-M178 VanDerWaalsContact O-CE 3.26Å; T161-M178 WeakPolarHBondContact O-CE 3.13Å
162L95.1Very high93.1Very high12 Ų1234.6 Ų34.66%0.06320%0.196CC..SBendtrans-88.8-31.3-173.2-64.8177000113.5W115 W157 Y158 I164 N460W115-L162 HydrophobicContact CZ2-CD2 3.93Å; W157-L162 HydrophobicContact CD2-CD1 3.98Å; W157-L162 HydrophobicContact CD2-CG 4.31Å; W157-L162 VanDerWaalsContact CE2-CD1 3.5Å; W157-L162 HydrophobicContact CE3-CG 4.41Å; W157-L162 HydrophobicContact CG-CD1 4.42Å; W157-L162 HydrophobicContact CH2-CD1 4.34Å; W157-L162 HydrophobicContact CH2-CD2 4.29Å; W157-L162 HydrophobicContact CH2-CG 4.47Å; W157-L162 HydrophobicContact CZ2-CD1 3.72Å; W157-L162 HydrophobicContact CZ2-CD2 4.43Å; W157-L162 HydrophobicContact CZ2-CG 4.32Å; W157-L162 WeakPolarHBondContact O-CB 3.35Å; W157-L162 WeakPolarHBondContact O-CG 3.21Å; W157-L162 PolarHBondContact O-N 3.39Å; Y158-L162 HydrophobicContact CD1-CD1 4.39Å; L162-I164 VanDerWaalsContact C-N 3.3Å; L162-I164 HydrophobicContact CB-CB 4.21Å; L162-I164 HydrophobicContact CD1-CD1 4.43Å; L162-I164 PolarHBondContact O-N 2.91Å; L162-N460 HydrophobicContact CD1-CB 3.81Å; L162-N460 HydrophobicContact CD2-CB 4.33Å
163N95.3Very high93.2Very high67 Ų6736.9 Ų36.936%0.35821%0.213SC..  trans46.556.9-166.5-170.216.6000111Y158 R159 Q175 W177 G457Y158-N163 WeakPolarHBondContact O-CA 3.25Å; Y158-N163 PolarHBondContact O-N 3.31Å; R159-N163 VanDerWaalsContact O-CA 3.28Å; R159-N163 WeakPolarHBondContact O-CA 3.25Å; R159-N163 PolarHBondContact O-N 2.95Å; N163-Q175 HydrophobicContact CB-CG 4.3Å; N163-Q175 PolarHBondContact ND2-NE2 2.85Å; N163-Q175 PolarHBondContact ND2-OE1 3.43Å; N163-Q175 VanDerWaalsContact ND2-OE1 3.12Å; N163-W177 HydrophobicContact CB-CZ2 4.24Å; N163-G457 WeakPolarHBondContact O-CA 3.48Å
164I94.3Very high93.3Very high7 Ų741.3 Ų41.34%0.03624%0.236CC..  trans-72.1141.2-165-159.6171.9000112.3Y158 R159 L162 G457 N460 Y461 W544Y158-I164 HydrophobicContact CD1-CB 4.47Å; Y158-I164 HydrophobicContact CD1-CD1 3.97Å; Y158-I164 HydrophobicContact CD1-CG2 3.87Å; Y158-I164 HydrophobicContact CE1-CD1 4.22Å; Y158-I164 HydrophobicContact CG-CG2 4.32Å; Y158-I164 WeakPolarHBondContact O-CG2 3.21Å; Y158-I164 PolarHBondContact O-N 3.08Å; R159-I164 PolarHBondContact NH1-O 3.49Å; L162-I164 VanDerWaalsContact C-N 3.3Å; L162-I164 HydrophobicContact CB-CB 4.21Å; L162-I164 HydrophobicContact CD1-CD1 4.43Å; L162-I164 PolarHBondContact O-N 2.91Å; I164-G457 VanDerWaalsContact CA-O 3.32Å; I164-G457 WeakPolarHBondContact CA-O 3.46Å; I164-N460 HydrophobicContact CD1-CB 4.08Å; I164-Y461 HydrophobicContact CD1-CE1 3.83Å; I164-Y461 HydrophobicContact CD1-CE2 4.11Å; I164-Y461 HydrophobicContact CG1-CE2 3.96Å; I164-W544 HydrophobicContact CD1-CB 4.43Å; I164-W544 HydrophobicContact CG2-CB 3.89Å; I164-W544 HydrophobicContact CG2-CG 4.05Å
165T94.9Very high93.5Very high21 Ų2140.4 Ų40.413%0.12923%0.231CC..  trans-81.4158.3171.853.50000111.9D167 I170 G457 S458 Y461T165-D167 PolarHBondContact O-N 3.46Å; T165-D167 PolarHBondContact OG1-O 2.95Å; T165-D167 VanDerWaalsContact OG1-O 3.06Å; T165-I170 WeakPolarHBondContact CB-O 3.39Å; T165-I170 HydrophobicContact CG2-CG2 4.09Å; T165-I170 WeakPolarHBondContact CG2-O 3.42Å; T165-I170 PolarHBondContact OG1-O 2.93Å; T165-G457 PolarHBondContact N-O 3.38Å; T165-G457 VanDerWaalsContact N-O 3.11Å; T165-S458 WeakPolarHBondContact OG1-CA 3.36Å; T165-S458 PolarHBondContact OG1-N 2.92Å; T165-Y461 VanDerWaalsContact O-CE2 3.26Å; T165-Y461 WeakPolarHBondContact O-CE2 3.34Å; T165-Y461 PolarHBondContact O-OH 3.01Å
166E92.2Very high93.6Very high79 Ų7946.9 Ų46.937%0.36926%0.255SS..SBendtrans-69.8-14.9179.5-62177.3174.300113.3N547 K557E166-N547 PolarHBondContact OE1-ND2 2.68Å; E166-K557 PolarHBondContact O-NZ 2.91Å
167D92Very high93.7Very high37 Ų3748.9 Ų48.920%0.19826%0.262CS..SBendtrans-151.9146.7-173.2-158.4-82.4000111.8T165 G169 I170 Y541 K557T165-D167 PolarHBondContact O-N 3.46Å; T165-D167 PolarHBondContact OG1-O 2.95Å; T165-D167 VanDerWaalsContact OG1-O 3.06Å; D167-G169 PolarHBondContact O-N 3.12Å; D167-G169 WeakPolarHBondContact OD1-CA 3.48Å; D167-G169 PolarHBondContact OD1-N 3.45Å; D167-I170 HydrophobicContact CB-CD1 4.24Å; D167-I170 HydrophobicContact CB-CG1 4.37Å; D167-I170 PolarHBondContact O-N 2.98Å; D167-I170 VanDerWaalsContact O-N 3.17Å; D167-Y541 PolarHBondContact OD1-OH 3.22Å; D167-Y541 PolarHBondContact OD2-OH 3.04Å; D167-K557 WeakPolarHBondContact OD2-CD 3.47Å; D167-K557 IonicContact OD2-NZ 3.54Å; D167-K557 PolarHBondContact OD2-NZ 3.42Å
168I93Very high93.8Very high0 Ų049 Ų490%026%0.263CS..THydrogen-bonded Turntrans-65.2-26.9175.2-167170.8000112.4I170 Y461 W462 V465 Y541 Y559 P560 V563I168-I170 PolarHBondContact O-N 3.37Å; I168-Y461 HydrophobicContact CB-CD2 4.09Å; I168-Y461 HydrophobicContact CB-CG 4.3Å; I168-W462 HydrophobicContact CD1-CD2 4.39Å; I168-V465 HydrophobicContact CD1-CG2 4.24Å; I168-Y541 HydrophobicContact CB-CE2 4.36Å; I168-Y541 HydrophobicContact CG2-CE1 3.96Å; I168-Y541 HydrophobicContact CG2-CE2 4.48Å; I168-Y541 WeakPolarHBondContact CG2-OH 3.35Å; I168-Y541 PolarHBondContact N-OH 3.46Å; I168-Y559 HydrophobicContact CD1-CD1 4.21Å; I168-Y559 HydrophobicContact CD1-CE1 3.93Å; I168-P560 HydrophobicContact CG2-CG 3.96Å; I168-V563 HydrophobicContact CD1-CG1 3.97Å; I168-V563 HydrophobicContact CD1-CG2 4.28Å; I168-V563 HydrophobicContact CG2-CG2 4.18Å
169G89.9Confident94Very high37 Ų3749 Ų4938%0.38127%0.266SS..THydrogen-bonded Turntrans-63.1-24174.400000114.2D167D167-G169 PolarHBondContact O-N 3.12Å; D167-G169 WeakPolarHBondContact OD1-CA 3.48Å; D167-G169 PolarHBondContact OD1-N 3.45Å
170I91.5Very high94.2Very high95 Ų9551.3 Ų51.349%0.48728%0.281SS..  trans-104.3101.9-178.5-57169.4000107.6T165 D167 I168 G172 S458T165-I170 WeakPolarHBondContact CB-O 3.39Å; T165-I170 HydrophobicContact CG2-CG2 4.09Å; T165-I170 WeakPolarHBondContact CG2-O 3.42Å; T165-I170 PolarHBondContact OG1-O 2.93Å; D167-I170 HydrophobicContact CB-CD1 4.24Å; D167-I170 HydrophobicContact CB-CG1 4.37Å; D167-I170 PolarHBondContact O-N 2.98Å; D167-I170 VanDerWaalsContact O-N 3.17Å; I168-I170 PolarHBondContact O-N 3.37Å; I170-G172 VanDerWaalsContact C-N 3.35Å; I170-G172 PolarHBondContact O-N 3.04Å; I170-S458 WeakPolarHBondContact O-CB 2.95Å
171S87.3Confident94.4Very high54 Ų5447.3 Ų47.338%0.37826%0.263SS..  trans-68-31.2-174.8-54.10000114.1L456 G457 S458S171-L456 WeakPolarHBondContact O-CB 3.39Å; S171-G457 PolarHBondContact O-N 3.34Å; S171-S458 PolarHBondContact O-N 3.37Å; S171-S458 VanDerWaalsContact O-N 3.1Å
172G90.5Very high94.5Very high47 Ų4747.3 Ų47.349%0.48526%0.263SS..  trans68.5-162.9-172.900000113I170I170-G172 VanDerWaalsContact C-N 3.35Å; I170-G172 PolarHBondContact O-N 3.04Å
173S93.3Very high94.7Very high73 Ų7348.2 Ų48.251%0.5127%0.272SS..  trans-95.7162.4177.855.60000112.5Q175 L456 G457S173-Q175 PolarHBondContact O-N 2.98Å; S173-Q175 PolarHBondContact O-NE2 3.49Å; S173-L456 WeakPolarHBondContact O-CA 3.41Å; S173-G457 PolarHBondContact O-N 2.77Å
174L95.1Very high94.8Very high94 Ų9447.3 Ų47.349%0.49227%0.269SS..BIsolated β-bridgetrans-69.1124.3168-71.7168.5000110W176 L452 T455 L456L174-W176 PolarHBondContact O-N 3.07Å; L174-L452 HydrophobicContact CD2-CB 4.37Å; L174-L452 WeakPolarHBondContact CD2-O 3.33Å; L174-T455 VanDerWaalsContact CD2-OG1 3.29Å; L174-T455 WeakPolarHBondContact CD2-OG1 3.44Å; L174-L456 HydrophobicContact CD2-CD2 3.64Å; L174-L456 HydrophobicContact CD2-CG 4.06Å; L174-L456 HydrophobicContact CG-CD2 3.89Å
175Q96.4Very high95Very high10 Ų1047 Ų475%0.04727%0.267CS..  trans-84.5105178-52.6-54.9-30.100109.5N163 S173 W177 M178 V179 T455N163-Q175 HydrophobicContact CB-CG 4.3Å; N163-Q175 PolarHBondContact ND2-NE2 2.85Å; N163-Q175 PolarHBondContact ND2-OE1 3.43Å; N163-Q175 VanDerWaalsContact ND2-OE1 3.12Å; S173-Q175 PolarHBondContact O-N 2.98Å; S173-Q175 PolarHBondContact O-NE2 3.49Å; Q175-W177 VanDerWaalsContact C-N 3.32Å; Q175-W177 HydrophobicContact CB-CD2 4.39Å; Q175-W177 HydrophobicContact CB-CZ2 3.93Å; Q175-W177 HydrophobicContact CG-CZ2 4.21Å; Q175-W177 PolarHBondContact O-N 3.37Å; Q175-W177 VanDerWaalsContact OE1-CZ2 3.25Å; Q175-M178 HydrophobicContact CB-CB 4.13Å; Q175-M178 WeakPolarHBondContact O-CB 3.27Å; Q175-M178 PolarHBondContact O-N 3.48Å; Q175-V179 PolarHBondContact O-N 3.34Å; Q175-T455 WeakPolarHBondContact CG-O 3.46Å; Q175-T455 PolarHBondContact N-O 3.39Å
176W96.8Very high95.1Very high173 Ų17346.3 Ų46.366%0.65526%0.262SS*.Hα-helixtrans-61.4-34.9-168.668.2-92.9000113.8L174 M178 V179 I180L174-W176 PolarHBondContact O-N 3.07Å; W176-M178 VanDerWaalsContact C-N 3.28Å; W176-M178 PolarHBondContact O-N 3.07Å; W176-V179 PolarHBondContact O-N 3.29Å; W176-I180 HydrophobicContact CE3-CD1 3.58Å; W176-I180 HydrophobicContact CZ3-CD1 3.66Å; W176-I180 WeakPolarHBondContact O-CG1 3.44Å; W176-I180 PolarHBondContact O-N 3.04Å
177W97.2Very high95.3Very high53 Ų5345.9 Ų45.920%0.20127%0.267CS..Hα-helixtrans-63.7-36.9175.752.788.4000111.5W118 T161 N163 Q175 I180 C181W118-W177 HydrophobicContact CE3-CB 4.33Å; W118-W177 HydrophobicContact CH2-CB 4.16Å; W118-W177 HydrophobicContact CH2-CG 4.16Å; W118-W177 HydrophobicContact CZ3-CB 3.71Å; W118-W177 HydrophobicContact CZ3-CG 4.09Å; T161-W177 PolarHBondContact O-NE1 3.28Å; N163-W177 HydrophobicContact CB-CZ2 4.24Å; Q175-W177 VanDerWaalsContact C-N 3.32Å; Q175-W177 HydrophobicContact CB-CD2 4.39Å; Q175-W177 HydrophobicContact CB-CZ2 3.93Å; Q175-W177 HydrophobicContact CG-CZ2 4.21Å; Q175-W177 PolarHBondContact O-N 3.37Å; Q175-W177 VanDerWaalsContact OE1-CZ2 3.25Å; W177-I180 PolarHBondContact O-N 3.28Å; W177-C181 PolarHBondContact O-N 3.34Å; W177-C181 VanDerWaalsContact O-N 3.1Å; W177-C181 PolarHBondContact O-SG 3.41Å
178M97.4Very high95.6Very high4 Ų446.3 Ų46.32%0.0227%0.271CS..Hα-helixtrans-72.7-36.4177.2-15957.569.400111.9T161 Q175 W176 I180 C181 L182 T455T161-M178 HydrophobicContact CG2-CE 3.64Å; T161-M178 VanDerWaalsContact O-CE 3.26Å; T161-M178 WeakPolarHBondContact O-CE 3.13Å; Q175-M178 HydrophobicContact CB-CB 4.13Å; Q175-M178 WeakPolarHBondContact O-CB 3.27Å; Q175-M178 PolarHBondContact O-N 3.48Å; W176-M178 VanDerWaalsContact C-N 3.28Å; W176-M178 PolarHBondContact O-N 3.07Å; M178-I180 VanDerWaalsContact C-N 3.31Å; M178-I180 PolarHBondContact O-N 3.06Å; M178-C181 PolarHBondContact O-N 3.47Å; M178-L182 WeakPolarHBondContact O-CB 3.28Å; M178-L182 PolarHBondContact O-N 2.62Å; M178-T455 HydrophobicContact CB-CG2 4.25Å; M178-T455 HydrophobicContact CG-CG2 3.97Å
179V97.9Very high95.7Very high34 Ų3446.3 Ų46.321%0.20627%0.271CS..Hα-helixtrans-60.1-42.3172.5175.80000111Q175 W176 L182 A183 F448 L452 T455Q175-V179 PolarHBondContact O-N 3.34Å; W176-V179 PolarHBondContact O-N 3.29Å; V179-L182 PolarHBondContact O-N 2.96Å; V179-A183 WeakPolarHBondContact O-CB 3.34Å; V179-A183 PolarHBondContact O-N 3.21Å; V179-F448 HydrophobicContact CG1-CE2 4.47Å; V179-F448 HydrophobicContact CG1-CZ 4.15Å; V179-L452 HydrophobicContact CG1-CD2 3.93Å; V179-L452 HydrophobicContact CG2-CD2 4.07Å; V179-T455 HydrophobicContact CG2-CG2 4.29Å; V179-T455 WeakPolarHBondContact CG2-OG1 3.49Å
180I98.3Very high96Very high91 Ų9148 Ų4847%0.46727%0.266SS..Hα-helixtrans-62.5-47.8175.5-67.4172.7000110.4W176 W177 M178 L182 A183 T184W176-I180 HydrophobicContact CE3-CD1 3.58Å; W176-I180 HydrophobicContact CZ3-CD1 3.66Å; W176-I180 WeakPolarHBondContact O-CG1 3.44Å; W176-I180 PolarHBondContact O-N 3.04Å; W177-I180 PolarHBondContact O-N 3.28Å; M178-I180 VanDerWaalsContact C-N 3.31Å; M178-I180 PolarHBondContact O-N 3.06Å; I180-L182 VanDerWaalsContact C-N 3.3Å; I180-L182 PolarHBondContact O-N 2.96Å; I180-A183 PolarHBondContact O-N 3.29Å; I180-T184 PolarHBondContact O-N 2.96Å; I180-T184 PolarHBondContact O-OG1 3.2Å
181C98.3Very high96.2Very high5 Ų548.5 Ų48.53%0.03427%0.269CS..Hα-helixtrans-61-39.7178.6-64.90000112.1A114 W177 M178 T184 A185A114-C181 HydrophobicContact CB-CB 3.99Å; A114-C181 WeakPolarHBondContact O-CB 3.31Å; W177-C181 PolarHBondContact O-N 3.34Å; W177-C181 VanDerWaalsContact O-N 3.1Å; W177-C181 PolarHBondContact O-SG 3.41Å; M178-C181 PolarHBondContact O-N 3.47Å; C181-T184 PolarHBondContact O-N 3.36Å; C181-A185 WeakPolarHBondContact O-CB 3.36Å; C181-A185 PolarHBondContact O-N 2.83Å
182L98.3Very high96.5Very high1 Ų146.9 Ų46.91%0.00526%0.257CS..Hα-helixtrans-66.6-41.6176.4-176.166000111.9A114 M178 V179 I180 T184 A185 W186 F448 T455A114-L182 HydrophobicContact CB-CB 4.11Å; A114-L182 HydrophobicContact CB-CD1 4.28Å; M178-L182 WeakPolarHBondContact O-CB 3.28Å; M178-L182 PolarHBondContact O-N 2.62Å; V179-L182 PolarHBondContact O-N 2.96Å; I180-L182 VanDerWaalsContact C-N 3.3Å; I180-L182 PolarHBondContact O-N 2.96Å; L182-T184 VanDerWaalsContact C-N 3.35Å; L182-A185 PolarHBondContact O-N 3.19Å; L182-W186 PolarHBondContact O-N 3.01Å; L182-F448 HydrophobicContact CB-CE2 4.46Å; L182-F448 HydrophobicContact CD2-CD2 4.17Å; L182-F448 HydrophobicContact CD2-CE2 4.34Å; L182-F448 HydrophobicContact CG-CD2 4.03Å; L182-F448 HydrophobicContact CG-CE2 4.29Å; L182-T455 HydrophobicContact CB-CG2 4.36Å; L182-T455 HydrophobicContact CD2-CG2 3.8Å
183A98.3Very high96.6Very high31 Ų3144.6 Ų44.626%0.25623%0.234SC..Hα-helixtrans-61.7-44.5174.100000110.8V179 I180 A185 W186 C187 F448V179-A183 WeakPolarHBondContact O-CB 3.34Å; V179-A183 PolarHBondContact O-N 3.21Å; I180-A183 PolarHBondContact O-N 3.29Å; A183-A185 PolarHBondContact O-N 3.41Å; A183-W186 PolarHBondContact O-N 3.21Å; A183-C187 WeakPolarHBondContact O-CB 3.3Å; A183-C187 PolarHBondContact O-N 3.25Å; A183-C187 PolarHBondContact O-SG 3.26Å; A183-F448 HydrophobicContact CB-CD2 4.33Å; A183-F448 HydrophobicContact CB-CE2 3.65Å; A183-F448 HydrophobicContact CB-CZ 4.05Å
184T98.3Very high96.4Very high47 Ų4744.3 Ų44.329%0.28823%0.226SC..Hα-helixtrans-60-44.6174.9-56.60000111.5L117 I180 C181 L182 W186 C187 V188L117-T184 HydrophobicContact CD1-CG2 4.03Å; I180-T184 PolarHBondContact O-N 2.96Å; I180-T184 PolarHBondContact O-OG1 3.2Å; C181-T184 PolarHBondContact O-N 3.36Å; L182-T184 VanDerWaalsContact C-N 3.35Å; T184-W186 PolarHBondContact O-N 3.28Å; T184-C187 WeakPolarHBondContact O-CB 3.4Å; T184-C187 PolarHBondContact O-N 3.12Å; T184-V188 HydrophobicContact CG2-CG2 4.47Å; T184-V188 WeakPolarHBondContact O-CG2 3.45Å; T184-V188 PolarHBondContact O-N 2.93Å
185A97.8Very high96.1Very high0 Ų046.8 Ų46.80%023%0.233CC..Hα-helixtrans-59.2-48.7178.500000112N110 I113 L117 C181 L182 A183 C187 V188 I189N110-A185 WeakPolarHBondContact OD1-CB 3.37Å; I113-A185 HydrophobicContact CB-CB 4.43Å; I113-A185 HydrophobicContact CG2-CB 3.95Å; L117-A185 HydrophobicContact CD1-CB 3.88Å; C181-A185 WeakPolarHBondContact O-CB 3.36Å; C181-A185 PolarHBondContact O-N 2.83Å; L182-A185 PolarHBondContact O-N 3.19Å; A183-A185 PolarHBondContact O-N 3.41Å; A185-C187 PolarHBondContact O-N 2.92Å; A185-V188 PolarHBondContact O-N 3.12Å; A185-I189 WeakPolarHBondContact O-CG1 3.49Å; A185-I189 PolarHBondContact O-N 3.43Å; A185-I189 VanDerWaalsContact O-N 3.11Å
186W97.8Very high95.8Very high7 Ų746.6 Ų46.63%0.02723%0.233CC..Hα-helixtrans-64.3-37.6175.8-81.1111000113.2N110 L182 A183 T184 I189 Y190 M413 I417 C444 F448N110-W186 HydrophobicContact CB-CZ2 3.9Å; N110-W186 PolarHBondContact ND2-N 3.26Å; N110-W186 PolarHBondContact ND2-NE1 2.96Å; L182-W186 PolarHBondContact O-N 3.01Å; A183-W186 PolarHBondContact O-N 3.21Å; T184-W186 PolarHBondContact O-N 3.28Å; W186-I189 HydrophobicContact CE3-CD1 4.31Å; W186-I189 HydrophobicContact CZ3-CD1 4.41Å; W186-I189 PolarHBondContact O-N 3.38Å; W186-Y190 WeakPolarHBondContact O-CB 3.43Å; W186-Y190 PolarHBondContact O-N 2.83Å; W186-M413 HydrophobicContact CH2-CE 4.07Å; W186-M413 HydrophobicContact CZ3-CE 4.4Å; W186-I417 HydrophobicContact CH2-CD1 4.19Å; W186-I417 HydrophobicContact CZ3-CD1 3.82Å; W186-C444 HydrophobicContact CE3-CB 3.87Å; W186-C444 HydrophobicContact CZ3-CB 4.45Å; W186-F448 HydrophobicContact CB-CB 4.48Å; W186-F448 AromaticContact CD1-CD2 3.92Å; W186-F448 HydrophobicContact CG-CB 4.01Å
187C97.3Very high95.5Very high71 Ų7138.6 Ų38.648%0.4820%0.203SC..Hα-helixtrans-62.4-43.2174.5-76.10000112A183 T184 A185 Y190 I191A183-C187 WeakPolarHBondContact O-CB 3.3Å; A183-C187 PolarHBondContact O-N 3.25Å; A183-C187 PolarHBondContact O-SG 3.26Å; T184-C187 WeakPolarHBondContact O-CB 3.4Å; T184-C187 PolarHBondContact O-N 3.12Å; A185-C187 PolarHBondContact O-N 2.92Å; C187-Y190 PolarHBondContact O-N 3.46Å; C187-I191 VanDerWaalsContact O-CG1 3.26Å; C187-I191 WeakPolarHBondContact O-CG1 3.29Å; C187-I191 PolarHBondContact O-N 3.42Å
188V96.4Very high95.1Very high46 Ų4639.5 Ų39.528%0.27921%0.212SC..Hα-helixtrans-62-45.5177172.70000110.6T184 A185 Y190 I191 C192 L410T184-V188 HydrophobicContact CG2-CG2 4.47Å; T184-V188 WeakPolarHBondContact O-CG2 3.45Å; T184-V188 PolarHBondContact O-N 2.93Å; A185-V188 PolarHBondContact O-N 3.12Å; V188-Y190 PolarHBondContact O-N 3.22Å; V188-I191 PolarHBondContact O-N 3.4Å; V188-C192 PolarHBondContact O-N 3.05Å; V188-C192 PolarHBondContact O-SG 2.89Å; V188-C192 VanDerWaalsContact O-SG 3.35Å; V188-L410 HydrophobicContact CG1-CD1 3.92Å; V188-L410 HydrophobicContact CG1-CD2 3.72Å; V188-L410 HydrophobicContact CG1-CG 4.5Å
189I95.8Very high94.9Very high0 Ų040.7 Ų40.70%022%0.221CC..Hα-helixtrans-59.1-48176-69169.8000111N110 A185 W186 I191 C192 F193 L410 M413 I417N110-I189 HydrophobicContact CB-CD1 4.43Å; N110-I189 WeakPolarHBondContact OD1-CD1 3.43Å; A185-I189 WeakPolarHBondContact O-CG1 3.49Å; A185-I189 PolarHBondContact O-N 3.43Å; A185-I189 VanDerWaalsContact O-N 3.11Å; W186-I189 HydrophobicContact CE3-CD1 4.31Å; W186-I189 HydrophobicContact CZ3-CD1 4.41Å; W186-I189 PolarHBondContact O-N 3.38Å; I189-I191 VanDerWaalsContact C-N 3.33Å; I189-I191 PolarHBondContact O-N 3.47Å; I189-C192 PolarHBondContact O-N 2.94Å; I189-F193 HydrophobicContact CG2-CD2 4.14Å; I189-F193 PolarHBondContact O-N 3.14Å; I189-L410 HydrophobicContact CG1-CD2 4Å; I189-M413 HydrophobicContact CD1-CB 3.97Å; I189-M413 HydrophobicContact CD1-CE 3.58Å; I189-M413 HydrophobicContact CD1-CG 3.93Å; I189-M413 HydrophobicContact CG1-CB 4.37Å; I189-I417 HydrophobicContact CG2-CG1 4.01Å
190Y96.1Very high94.7Very high71 Ų7139.1 Ų39.128%0.27821%0.211SC..Hα-helixtrans-57.6-45178170.3-107.7000112.1W186 C187 V188 C192 F193 I194 T440 A441W186-Y190 WeakPolarHBondContact O-CB 3.43Å; W186-Y190 PolarHBondContact O-N 2.83Å; C187-Y190 PolarHBondContact O-N 3.46Å; V188-Y190 PolarHBondContact O-N 3.22Å; Y190-C192 VanDerWaalsContact C-N 3.33Å; Y190-C192 PolarHBondContact O-N 2.5Å; Y190-F193 CarbonylContact O-C 3.46Å; Y190-F193 PolarHBondContact O-N 3.45Å; Y190-F193 VanDerWaalsContact O-N 3.14Å; Y190-I194 PolarHBondContact O-N 3.08Å; Y190-T440 HydrophobicContact CD2-CG2 3.99Å; Y190-A441 HydrophobicContact CD2-CB 4.14Å; Y190-A441 HydrophobicContact CE2-CB 3.6Å
191I95.3Very high94.3Very high107 Ų10734.8 Ų34.855%0.54919%0.189SC..Hα-helixtrans-61.1-42.8177.5-69.4164.7000110.7C187 V188 I189 F193 I194C187-I191 VanDerWaalsContact O-CG1 3.26Å; C187-I191 WeakPolarHBondContact O-CG1 3.29Å; C187-I191 PolarHBondContact O-N 3.42Å; V188-I191 PolarHBondContact O-N 3.4Å; I189-I191 VanDerWaalsContact C-N 3.33Å; I189-I191 PolarHBondContact O-N 3.47Å; I191-F193 VanDerWaalsContact C-N 3.27Å; I191-F193 PolarHBondContact O-N 3.16Å; I191-I194 VanDerWaalsContact O-CG2 3.29Å; I191-I194 WeakPolarHBondContact O-CG2 3.5Å; I191-I194 PolarHBondContact O-N 3.23Å
192C94.7Very high94.1Very high19 Ų1940.9 Ų40.913%0.12822%0.215CC..Hα-helixtrans-62.6-33.9176.7-68.60000112.4V188 I189 Y190 S199 M200 F414V188-C192 PolarHBondContact O-N 3.05Å; V188-C192 PolarHBondContact O-SG 2.89Å; V188-C192 VanDerWaalsContact O-SG 3.35Å; I189-C192 PolarHBondContact O-N 2.94Å; Y190-C192 VanDerWaalsContact C-N 3.33Å; Y190-C192 PolarHBondContact O-N 2.5Å; C192-S199 CarbonylContact O-C 3.33Å; C192-S199 WeakPolarHBondContact O-CB 3.48Å; C192-S199 PolarHBondContact O-OG 2.9Å; C192-M200 PolarHBondContact O-N 2.7Å; C192-M200 VanDerWaalsContact O-N 3.09Å; C192-F414 HydrophobicContact CB-CE1 3.51Å; C192-F414 HydrophobicContact CB-CZ 3.76Å
193F91.8Very high93.9Very high0 Ų042 Ų420%023%0.225CC..Hα-helixtrans-92.92.2-179.8-88.7-84.7000115.9I189 Y190 I191 K195 G196 M200 F414 I417 L421 T440I189-F193 HydrophobicContact CG2-CD2 4.14Å; I189-F193 PolarHBondContact O-N 3.14Å; Y190-F193 CarbonylContact O-C 3.46Å; Y190-F193 PolarHBondContact O-N 3.45Å; Y190-F193 VanDerWaalsContact O-N 3.14Å; I191-F193 VanDerWaalsContact C-N 3.27Å; I191-F193 PolarHBondContact O-N 3.16Å; F193-K195 PolarHBondContact O-N 3.31Å; F193-G196 PolarHBondContact O-N 3.39Å; F193-M200 HydrophobicContact CE1-CG 4.4Å; F193-M200 HydrophobicContact CE1-SD 3.76Å; F193-M200 HydrophobicContact CE2-CG 4.49Å; F193-M200 HydrophobicContact CE2-SD 4.49Å; F193-M200 HydrophobicContact CZ-CG 4.07Å; F193-M200 HydrophobicContact CZ-SD 3.57Å; F193-M200 VanDerWaalsContact CZ-SD 3.57Å; F193-F414 HydrophobicContact CD2-CD1 4.28Å; F193-F414 HydrophobicContact CE2-CB 4.11Å; F193-F414 AromaticContact CE2-CD1 3.53Å; F193-F414 HydrophobicContact CE2-CD1 3.53Å; F193-F414 HydrophobicContact CE2-CE1 4.33Å; F193-F414 HydrophobicContact CE2-CG 4.12Å; F193-F414 HydrophobicContact CZ-CB 4Å; F193-F414 HydrophobicContact CZ-CD1 4.26Å; F193-F414 HydrophobicContact CZ-CG 4.41Å; F193-F414 VanDerWaalsContact CZ-O 3.27Å; F193-F414 WeakPolarHBondContact CZ-O 3.39Å; F193-I417 HydrophobicContact CD1-CG2 4.23Å; F193-I417 HydrophobicContact CD2-CB 4.49Å; F193-I417 HydrophobicContact CD2-CG2 4.1Å; F193-I417 HydrophobicContact CE1-CG2 4.15Å; F193-I417 HydrophobicContact CE2-CB 3.94Å; F193-I417 HydrophobicContact CE2-CG2 3.97Å; F193-I417 HydrophobicContact CG-CG2 4.21Å; F193-I417 HydrophobicContact CZ-CB 4.03Å; F193-I417 HydrophobicContact CZ-CG2 4.04Å; F193-L421 HydrophobicContact CD1-CD1 4.21Å; F193-T440 HydrophobicContact CB-CG2 3.69Å
194I89.8Confident93.7Very high66 Ų6640.6 Ų40.634%0.33821%0.213SC..THydrogen-bonded Turntrans-57.8-22.7-171.5-160.9172.2000113.7Y190 I191 E437Y190-I194 PolarHBondContact O-N 3.08Å; I191-I194 VanDerWaalsContact O-CG2 3.29Å; I191-I194 WeakPolarHBondContact O-CG2 3.5Å; I191-I194 PolarHBondContact O-N 3.23Å; I194-E437 HydrophobicContact CG1-CG 4.43Å; I194-E437 WeakPolarHBondContact O-CG 3.43Å
195K89.4Confident93.5Very high147 Ų14742.1 Ų42.164%0.63921%0.214SC*.THydrogen-bonded Turntrans-122.827.4172.6-65.2-179.4177.6-176.40112.8F193 I197 D198F193-K195 PolarHBondContact O-N 3.31Å; K195-I197 PolarHBondContact O-N 3.01Å; K195-D198 HydrophobicContact CB-CB 4.42Å
196G89.3Confident93.4Very high5 Ų546.6 Ų46.65%0.05224%0.241CC..THydrogen-bonded Turntrans57.3-134.8-173.400000111.9F193 D198 S199 M200F193-G196 PolarHBondContact O-N 3.39Å; G196-D198 PolarHBondContact O-N 3.32Å; G196-S199 PolarHBondContact O-N 2.81Å; G196-M200 WeakPolarHBondContact O-CB 3.45Å; G196-M200 PolarHBondContact O-N 2.8Å; G196-M200 VanDerWaalsContact O-N 3.1Å
197I89.6Confident93.2Very high5 Ų546.9 Ų46.93%0.02624%0.243CC..Hα-helixtrans-63.9-23.3-172.870.1170000114.6P13 W15 K195 M200 G201 Y273P13-I197 HydrophobicContact CB-CD1 3.65Å; P13-I197 HydrophobicContact CB-CG1 3.95Å; P13-I197 HydrophobicContact CG-CD1 3.88Å; P13-I197 HydrophobicContact CG-CG1 4.23Å; W15-I197 HydrophobicContact CE3-CD1 4.49Å; W15-I197 HydrophobicContact CH2-CB 4.3Å; W15-I197 HydrophobicContact CH2-CG2 4.3Å; W15-I197 HydrophobicContact CZ3-CB 4.07Å; K195-I197 PolarHBondContact O-N 3.01Å; I197-M200 HydrophobicContact CB-CE 4.17Å; I197-M200 HydrophobicContact CG2-CE 4.04Å; I197-G201 WeakPolarHBondContact O-CA 3.46Å; I197-G201 PolarHBondContact O-N 3.22Å; I197-Y273 HydrophobicContact CD1-CD1 4.45Å; I197-Y273 HydrophobicContact CD1-CD2 3.91Å; I197-Y273 HydrophobicContact CD1-CE2 4.36Å; I197-Y273 HydrophobicContact CD1-CG 3.97Å; I197-Y273 HydrophobicContact CG2-CD2 4Å; I197-Y273 HydrophobicContact CG2-CE2 3.6Å
198D89.6Confident93Very high73 Ų7343.8 Ų43.839%0.3922%0.223SC..Hα-helixtrans-71.3-34-179.6-69.4-4.5000112.6K195 G196 K202K195-D198 HydrophobicContact CB-CB 4.42Å; G196-D198 PolarHBondContact O-N 3.32Å; D198-K202 WeakPolarHBondContact O-CD 3.4Å; D198-K202 WeakPolarHBondContact O-CG 3.24Å
199S92.9Very high92.9Very high29 Ų2945 Ų4520%0.20323%0.23CC..Hα-helixtrans-86.6-47.9177176.80000110.5C192 G196 G201 K202 A203C192-S199 CarbonylContact O-C 3.33Å; C192-S199 WeakPolarHBondContact O-CB 3.48Å; C192-S199 PolarHBondContact O-OG 2.9Å; G196-S199 PolarHBondContact O-N 2.81Å; S199-G201 VanDerWaalsContact C-N 3.32Å; S199-G201 PolarHBondContact O-N 3.27Å; S199-K202 PolarHBondContact O-N 3.46Å; S199-A203 PolarHBondContact O-N 3.5Å; S199-A203 VanDerWaalsContact O-N 3.13Å
200M93.7Very high92.9Very high0 Ų047.5 Ų47.50%024%0.242CC..Hα-helixtrans-58.4-44.3178.7177-157.673.700111.4W15 T24 C192 F193 G196 I197 K202 A203 V204 F270 F414W15-M200 HydrophobicContact CH2-CE 3.53Å; W15-M200 HydrophobicContact CZ3-CE 3.81Å; T24-M200 HydrophobicContact CG2-CE 3.81Å; C192-M200 PolarHBondContact O-N 2.7Å; C192-M200 VanDerWaalsContact O-N 3.09Å; F193-M200 HydrophobicContact CE1-CG 4.4Å; F193-M200 HydrophobicContact CE1-SD 3.76Å; F193-M200 HydrophobicContact CE2-CG 4.49Å; F193-M200 HydrophobicContact CE2-SD 4.49Å; F193-M200 HydrophobicContact CZ-CG 4.07Å; F193-M200 HydrophobicContact CZ-SD 3.57Å; F193-M200 VanDerWaalsContact CZ-SD 3.57Å; G196-M200 WeakPolarHBondContact O-CB 3.45Å; G196-M200 PolarHBondContact O-N 2.8Å; G196-M200 VanDerWaalsContact O-N 3.1Å; I197-M200 HydrophobicContact CB-CE 4.17Å; I197-M200 HydrophobicContact CG2-CE 4.04Å; M200-K202 PolarHBondContact O-N 3.38Å; M200-A203 WeakPolarHBondContact O-CB 3.45Å; M200-A203 PolarHBondContact O-N 3.44Å; M200-A203 VanDerWaalsContact O-N 3.12Å; M200-V204 PolarHBondContact O-N 2.98Å; M200-F270 HydrophobicContact CE-CD1 4.47Å; M200-F270 HydrophobicContact CE-CE1 3.72Å; M200-F270 HydrophobicContact CE-CZ 4.27Å; M200-F270 HydrophobicContact SD-CE1 3.97Å; M200-F270 HydrophobicContact SD-CZ 4.15Å; M200-F414 HydrophobicContact CG-CB 3.88Å; M200-F414 HydrophobicContact CG-CD1 4.28Å; M200-F414 HydrophobicContact CG-CD2 3.61Å; M200-F414 HydrophobicContact CG-CE2 4.19Å; M200-F414 HydrophobicContact CG-CG 3.66Å; M200-F414 HydrophobicContact SD-CB 3.77Å; M200-F414 HydrophobicContact SD-CG 4.25Å
201G90.5Very high92.8Very high0 Ų044.2 Ų44.20%023%0.229CC..Hα-helixtrans-68-14.2179.100000114.5Q20 I197 S199 V204 Y205Q20-G201 WeakPolarHBondContact CG-O 3.43Å; I197-G201 WeakPolarHBondContact O-CA 3.46Å; I197-G201 PolarHBondContact O-N 3.22Å; S199-G201 VanDerWaalsContact C-N 3.32Å; S199-G201 PolarHBondContact O-N 3.27Å; G201-V204 WeakPolarHBondContact O-CG1 3.44Å; G201-Y205 WeakPolarHBondContact O-CD2 3.38Å; G201-Y205 WeakPolarHBondContact O-CE2 3.48Å
202K92.8Very high92.8Very high134 Ų13442.1 Ų42.158%0.58322%0.215SC*.Hα-helixtrans-85.3-41.5168.3-69172.5-174169.90111.4D198 S199 M200 V204 Y205D198-K202 WeakPolarHBondContact O-CD 3.4Å; D198-K202 WeakPolarHBondContact O-CG 3.24Å; S199-K202 PolarHBondContact O-N 3.46Å; M200-K202 PolarHBondContact O-N 3.38Å; K202-V204 PolarHBondContact O-N 3.44Å; K202-Y205 PolarHBondContact O-N 3.28Å
203A94.1Very high92.8Very high25 Ų2546.1 Ų46.121%0.20723%0.234CC..Hα-helixtrans-58.7-39175.800000111.5S199 M200 Y205 V206 T207 F414S199-A203 PolarHBondContact O-N 3.5Å; S199-A203 VanDerWaalsContact O-N 3.13Å; M200-A203 WeakPolarHBondContact O-CB 3.45Å; M200-A203 PolarHBondContact O-N 3.44Å; M200-A203 VanDerWaalsContact O-N 3.12Å; A203-Y205 VanDerWaalsContact C-N 3.26Å; A203-Y205 PolarHBondContact O-N 3.49Å; A203-V206 PolarHBondContact O-N 3.06Å; A203-T207 PolarHBondContact O-N 3.15Å; A203-T207 PolarHBondContact O-OG1 3.46Å; A203-F414 HydrophobicContact CB-CE2 4.02Å; A203-F414 HydrophobicContact CB-CZ 3.93Å
204V94.6Very high93Very high1 Ų146.2 Ų46.21%0.00623%0.234CC..Hα-helixtrans-61.6-28.5-176.1850000114.5L23 M200 G201 K202 V206 T207 A208L23-V204 HydrophobicContact CB-CG1 4.23Å; L23-V204 HydrophobicContact CB-CG2 4.46Å; M200-V204 PolarHBondContact O-N 2.98Å; G201-V204 WeakPolarHBondContact O-CG1 3.44Å; K202-V204 PolarHBondContact O-N 3.44Å; V204-V206 PolarHBondContact O-N 2.9Å; V204-T207 WeakPolarHBondContact CA-OG1 3.33Å; V204-T207 PolarHBondContact O-N 3.33Å; V204-A208 HydrophobicContact CG2-CB 3.97Å; V204-A208 WeakPolarHBondContact O-CB 3.36Å; V204-A208 PolarHBondContact O-N 2.75Å
205Y94.9Very high93.1Very high78 Ų7843.4 Ų43.431%0.30622%0.22SC..Hα-helixtrans-60-35.5176.2-77.2-80.8000111.7N17 V19 Q20 L23 G201 K202 A203 T209N17-Y205 PolarHBondContact ND2-OH 3.31Å; N17-Y205 PolarHBondContact OD1-OH 3.13Å; N17-Y205 VanDerWaalsContact OD1-OH 3.13Å; V19-Y205 HydrophobicContact CG1-CE1 4.15Å; Q20-Y205 HydrophobicContact CB-CE2 4.27Å; Q20-Y205 HydrophobicContact CG-CE2 4.24Å; L23-Y205 HydrophobicContact CD1-CD1 3.7Å; L23-Y205 HydrophobicContact CD1-CE1 3.94Å; L23-Y205 HydrophobicContact CD1-CG 4.46Å; G201-Y205 WeakPolarHBondContact O-CD2 3.38Å; G201-Y205 WeakPolarHBondContact O-CE2 3.48Å; K202-Y205 PolarHBondContact O-N 3.28Å; A203-Y205 VanDerWaalsContact C-N 3.26Å; A203-Y205 PolarHBondContact O-N 3.49Å; Y205-T209 WeakPolarHBondContact O-CB 3.42Å; Y205-T209 WeakPolarHBondContact O-CG2 3.34Å; Y205-T209 PolarHBondContact O-OG1 3.21Å
206V94.8Very high93.4Very high94 Ų9439.2 Ų39.257%0.5721%0.207SC*.Hα-helixtrans-84.4-51.4176-179.30000109.7A203 V204 A208 T209 F210A203-V206 PolarHBondContact O-N 3.06Å; V204-V206 PolarHBondContact O-N 2.9Å; V206-A208 VanDerWaalsContact C-N 3.29Å; V206-A208 PolarHBondContact O-N 3.1Å; V206-T209 PolarHBondContact O-N 3.19Å; V206-F210 HydrophobicContact CG1-CB 4.46Å; V206-F210 WeakPolarHBondContact O-CB 3.28Å; V206-F210 PolarHBondContact O-N 3.01Å
207T94.7Very high93.7Very high13 Ų1341.9 Ų41.98%0.0822%0.22CC..Hα-helixtrans-68-27.5-170.165.60000113.3A203 V204 P211 L410 S411A203-T207 PolarHBondContact O-N 3.15Å; A203-T207 PolarHBondContact O-OG1 3.46Å; V204-T207 WeakPolarHBondContact CA-OG1 3.33Å; V204-T207 PolarHBondContact O-N 3.33Å; T207-P211 WeakPolarHBondContact O-CD 3.33Å; T207-P211 VanDerWaalsContact O-CG 3.24Å; T207-P211 WeakPolarHBondContact O-CG 3.39Å; T207-L410 HydrophobicContact CG2-CB 4.4Å; T207-S411 VanDerWaalsContact C-OG 3.31Å; T207-S411 WeakPolarHBondContact CB-OG 3.35Å; T207-S411 PolarHBondContact O-OG 3.2Å; T207-S411 PolarHBondContact OG1-OG 2.96Å
208A92.8Very high93.8Very high6 Ų641.9 Ų41.95%0.0522%0.219CC..Hα-helixtrans-89.7-26.7176.800000113.8L23 V204 V206 Y212L23-A208 HydrophobicContact CB-CB 4.46Å; L23-A208 HydrophobicContact CD2-CB 4.47Å; V204-A208 HydrophobicContact CG2-CB 3.97Å; V204-A208 WeakPolarHBondContact O-CB 3.36Å; V204-A208 PolarHBondContact O-N 2.75Å; V206-A208 VanDerWaalsContact C-N 3.29Å; V206-A208 PolarHBondContact O-N 3.1Å; A208-Y212 WeakPolarHBondContact O-CD2 3.32Å; A208-Y212 WeakPolarHBondContact O-CE2 3.34Å
209T94Very high94Very high71 Ų7139.9 Ų39.944%0.43621%0.208SC..Hα-helixtrans-94.6-36.9-177.166.40000113.3L23 Y205 V206 P211 Y212 L213L23-T209 HydrophobicContact CD1-CG2 4.39Å; L23-T209 HydrophobicContact CD2-CG2 4.37Å; Y205-T209 WeakPolarHBondContact O-CB 3.42Å; Y205-T209 WeakPolarHBondContact O-CG2 3.34Å; Y205-T209 PolarHBondContact O-OG1 3.21Å; V206-T209 PolarHBondContact O-N 3.19Å; T209-P211 VanDerWaalsContact C-CD 3.49Å; T209-P211 VanDerWaalsContact C-N 3.34Å; T209-Y212 PolarHBondContact O-N 3.08Å; T209-Y212 VanDerWaalsContact O-N 3.11Å; T209-L213 PolarHBondContact O-N 3.19Å
210F95Very high94.1Very high54 Ų5443.9 Ų43.924%0.23723%0.227CC..Hα-helixtrans-56.7-40.3-179.5-177.9-100.9000113.2V206 Y212 L213 V214 V403V206-F210 HydrophobicContact CG1-CB 4.46Å; V206-F210 WeakPolarHBondContact O-CB 3.28Å; V206-F210 PolarHBondContact O-N 3.01Å; F210-Y212 VanDerWaalsContact C-N 3.31Å; F210-Y212 PolarHBondContact O-N 3.19Å; F210-L213 HydrophobicContact CD2-CD2 4.49Å; F210-L213 WeakPolarHBondContact O-CB 3.44Å; F210-L213 PolarHBondContact O-N 3.25Å; F210-V214 HydrophobicContact CD1-CG2 4.01Å; F210-V214 HydrophobicContact CD2-CG2 4.43Å; F210-V214 HydrophobicContact CE1-CG2 3.43Å; F210-V214 VanDerWaalsContact CE1-CG2 3.43Å; F210-V214 HydrophobicContact CE2-CG2 3.94Å; F210-V214 HydrophobicContact CG-CG2 4.47Å; F210-V214 HydrophobicContact CZ-CG2 3.41Å; F210-V214 VanDerWaalsContact CZ-CG2 3.41Å; F210-V214 PolarHBondContact O-N 3.46Å; F210-V214 VanDerWaalsContact O-N 3.09Å; F210-V403 HydrophobicContact CD1-CG1 4.08Å; F210-V403 HydrophobicContact CE1-CB 3.93Å; F210-V403 HydrophobicContact CE1-CG1 3.37Å; F210-V403 HydrophobicContact CZ-CB 4.47Å; F210-V403 HydrophobicContact CZ-CG1 3.93Å
211P94.7Very high94Very high1 Ų146.9 Ų46.91%0.00624%0.238CC..Hα-helixtrans-57.3-39.3175.3-28.537.4000114.3T207 T209 L213 V214 L215 M404 L408T207-P211 WeakPolarHBondContact O-CD 3.33Å; T207-P211 VanDerWaalsContact O-CG 3.24Å; T207-P211 WeakPolarHBondContact O-CG 3.39Å; T209-P211 VanDerWaalsContact C-CD 3.49Å; T209-P211 VanDerWaalsContact C-N 3.34Å; P211-L213 VanDerWaalsContact C-N 3.34Å; P211-L213 PolarHBondContact O-N 3.22Å; P211-V214 PolarHBondContact O-N 3.33Å; P211-L215 WeakPolarHBondContact O-CB 3.2Å; P211-L215 VanDerWaalsContact O-CG 3.25Å; P211-L215 WeakPolarHBondContact O-CG 3.23Å; P211-L215 PolarHBondContact O-N 3.07Å; P211-M404 HydrophobicContact CB-CG 3.99Å; P211-L408 HydrophobicContact CB-CD1 4.26Å; P211-L408 HydrophobicContact CB-CD2 3.63Å; P211-L408 HydrophobicContact CB-CG 3.77Å; P211-L408 HydrophobicContact CG-CD2 3.68Å; P211-L408 HydrophobicContact CG-CG 3.71Å
212Y94.6Very high94.1Very high64 Ų6446.9 Ų46.925%0.25124%0.238SC..Hα-helixtrans-66.8-37178.8-71.1-83.2000112.4A208 T209 F210 T216 T294A208-Y212 WeakPolarHBondContact O-CD2 3.32Å; A208-Y212 WeakPolarHBondContact O-CE2 3.34Å; T209-Y212 PolarHBondContact O-N 3.08Å; T209-Y212 VanDerWaalsContact O-N 3.11Å; F210-Y212 VanDerWaalsContact C-N 3.31Å; F210-Y212 PolarHBondContact O-N 3.19Å; Y212-T216 WeakPolarHBondContact O-CB 3.28Å; Y212-T216 PolarHBondContact O-N 3.35Å; Y212-T216 PolarHBondContact O-OG1 3.05Å; Y212-T294 HydrophobicContact CE1-CG2 3.86Å; Y212-T294 VanDerWaalsContact CE1-OG1 3.25Å; Y212-T294 WeakPolarHBondContact CE1-OG1 3.29Å; Y212-T294 PolarHBondContact OH-OG1 2.96Å
213L95.6Very high94.2Very high103 Ų10344.6 Ų44.654%0.53923%0.232SC..Hα-helixtrans-60.6-50.1173.6177.266.1000110.4T209 F210 P211 T216 I217T209-L213 PolarHBondContact O-N 3.19Å; F210-L213 HydrophobicContact CD2-CD2 4.49Å; F210-L213 WeakPolarHBondContact O-CB 3.44Å; F210-L213 PolarHBondContact O-N 3.25Å; P211-L213 VanDerWaalsContact C-N 3.34Å; P211-L213 PolarHBondContact O-N 3.22Å; L213-T216 WeakPolarHBondContact O-CB 3.48Å; L213-T216 PolarHBondContact O-N 2.99Å; L213-I217 HydrophobicContact CD1-CD1 4.45Å; L213-I217 HydrophobicContact CG-CD1 4.23Å; L213-I217 WeakPolarHBondContact O-CG1 3.45Å; L213-I217 PolarHBondContact O-N 3.3Å; L213-I217 VanDerWaalsContact O-N 3.09Å
214V94.6Very high94.2Very high1 Ų147.8 Ų47.81%0.00625%0.248CC..Hα-helixtrans-66.7-43.1-178.3177.20000111.6F210 P211 T216 I217 F218 L400 M404F210-V214 HydrophobicContact CD1-CG2 4.01Å; F210-V214 HydrophobicContact CD2-CG2 4.43Å; F210-V214 HydrophobicContact CE1-CG2 3.43Å; F210-V214 VanDerWaalsContact CE1-CG2 3.43Å; F210-V214 HydrophobicContact CE2-CG2 3.94Å; F210-V214 HydrophobicContact CG-CG2 4.47Å; F210-V214 HydrophobicContact CZ-CG2 3.41Å; F210-V214 VanDerWaalsContact CZ-CG2 3.41Å; F210-V214 PolarHBondContact O-N 3.46Å; F210-V214 VanDerWaalsContact O-N 3.09Å; P211-V214 PolarHBondContact O-N 3.33Å; V214-T216 VanDerWaalsContact C-N 3.25Å; V214-T216 PolarHBondContact O-N 3.13Å; V214-I217 WeakPolarHBondContact O-CB 3.33Å; V214-I217 PolarHBondContact O-N 2.96Å; V214-I217 VanDerWaalsContact O-N 3.12Å; V214-F218 HydrophobicContact CG1-CD2 3.5Å; V214-F218 VanDerWaalsContact CG1-CD2 3.5Å; V214-F218 HydrophobicContact CG1-CE2 3.45Å; V214-F218 VanDerWaalsContact CG1-CE2 3.45Å; V214-F218 WeakPolarHBondContact O-CD2 3.4Å; V214-F218 PolarHBondContact O-N 3.21Å; V214-L400 HydrophobicContact CG1-CB 4.16Å; V214-L400 HydrophobicContact CG2-CD2 4.46Å; V214-M404 HydrophobicContact CB-CB 3.94Å; V214-M404 HydrophobicContact CB-CG 4.23Å; V214-M404 HydrophobicContact CB-SD 3.94Å; V214-M404 HydrophobicContact CG1-CB 3.73Å; V214-M404 HydrophobicContact CG1-CG 4.21Å; V214-M404 HydrophobicContact CG1-SD 3.67Å; V214-M404 HydrophobicContact CG2-CB 4.31Å
215L93.1Very high94.1Very high7 Ų748.2 Ų48.24%0.03725%0.251CS..Hα-helixtrans-58.6-38.1174.2-74.1173.6000112.1L35 P211 F218 L219 Y297 M404L35-L215 HydrophobicContact CD1-CD2 4.08Å; L35-L215 HydrophobicContact CD2-CD1 4.16Å; L35-L215 HydrophobicContact CD2-CD2 3.66Å; P211-L215 WeakPolarHBondContact O-CB 3.2Å; P211-L215 VanDerWaalsContact O-CG 3.25Å; P211-L215 WeakPolarHBondContact O-CG 3.23Å; P211-L215 PolarHBondContact O-N 3.07Å; L215-F218 PolarHBondContact O-N 2.88Å; L215-L219 VanDerWaalsContact O-CB 3.29Å; L215-L219 WeakPolarHBondContact O-CB 3.35Å; L215-L219 PolarHBondContact O-N 3.23Å; L215-Y297 HydrophobicContact CB-CD1 4.34Å; L215-Y297 HydrophobicContact CB-CE1 3.72Å; L215-Y297 HydrophobicContact CD1-CD1 4.32Å; L215-Y297 HydrophobicContact CD1-CE1 4.46Å; L215-M404 HydrophobicContact CD2-CE 4.13Å; L215-M404 HydrophobicContact CD2-SD 3.55Å; L215-M404 VanDerWaalsContact CD2-SD 3.55Å; L215-M404 HydrophobicContact CG-SD 3.58Å; L215-M404 VanDerWaalsContact CG-SD 3.58Å
216T95.3Very high93.9Very high60 Ų6048.7 Ų48.737%0.36826%0.263SS..Hα-helixtrans-65.5-41.7176-54.10000111.6Y212 L213 V214 L219 I220 Y297Y212-T216 WeakPolarHBondContact O-CB 3.28Å; Y212-T216 PolarHBondContact O-N 3.35Å; Y212-T216 PolarHBondContact O-OG1 3.05Å; L213-T216 WeakPolarHBondContact O-CB 3.48Å; L213-T216 PolarHBondContact O-N 2.99Å; V214-T216 VanDerWaalsContact C-N 3.25Å; V214-T216 PolarHBondContact O-N 3.13Å; T216-L219 PolarHBondContact O-N 2.98Å; T216-I220 HydrophobicContact CG2-CD1 4.38Å; T216-I220 WeakPolarHBondContact O-CG1 3.39Å; T216-I220 PolarHBondContact O-N 3.25Å; T216-I220 VanDerWaalsContact O-N 3.11Å; T216-Y297 VanDerWaalsContact CA-OH 3.23Å; T216-Y297 WeakPolarHBondContact CA-OH 3.49Å; T216-Y297 PolarHBondContact OG1-OH 3.22Å
217I94.8Very high93.7Very high61 Ų6144.9 Ų44.931%0.31324%0.244SC..Hα-helixtrans-62.6-45.9175.5-66.5165.7000110.4L213 V214 I220 R221 W397L213-I217 HydrophobicContact CD1-CD1 4.45Å; L213-I217 HydrophobicContact CG-CD1 4.23Å; L213-I217 WeakPolarHBondContact O-CG1 3.45Å; L213-I217 PolarHBondContact O-N 3.3Å; L213-I217 VanDerWaalsContact O-N 3.09Å; V214-I217 WeakPolarHBondContact O-CB 3.33Å; V214-I217 PolarHBondContact O-N 2.96Å; V214-I217 VanDerWaalsContact O-N 3.12Å; I217-I220 PolarHBondContact O-N 3.48Å; I217-R221 PolarHBondContact O-N 3.42Å; I217-R221 VanDerWaalsContact O-N 3.1Å; I217-W397 HydrophobicContact CG2-CH2 4.4Å; I217-W397 HydrophobicContact CG2-CZ3 3.93Å
218F92.3Very high93.6Very high5 Ų544.5 Ų44.52%0.02224%0.241CC..Hα-helixtrans-64.8-37.9176.6-86.2-68.8000112.8V214 L215 R221 A222 P301 F384 W397 L400 F401V214-F218 HydrophobicContact CG1-CD2 3.5Å; V214-F218 VanDerWaalsContact CG1-CD2 3.5Å; V214-F218 HydrophobicContact CG1-CE2 3.45Å; V214-F218 VanDerWaalsContact CG1-CE2 3.45Å; V214-F218 WeakPolarHBondContact O-CD2 3.4Å; V214-F218 PolarHBondContact O-N 3.21Å; L215-F218 PolarHBondContact O-N 2.88Å; F218-R221 PolarHBondContact O-N 3.09Å; F218-A222 WeakPolarHBondContact O-CB 3.41Å; F218-A222 PolarHBondContact O-N 3.35Å; F218-P301 HydrophobicContact CB-CB 4.49Å; F218-F384 HydrophobicContact CD1-CE2 4.46Å; F218-F384 AromaticContact CD1-CZ 3.85Å; F218-F384 HydrophobicContact CD1-CZ 3.85Å; F218-F384 HydrophobicContact CE1-CE1 4.12Å; F218-F384 HydrophobicContact CE1-CE2 4.41Å; F218-F384 AromaticContact CE1-CZ 3.43Å; F218-F384 HydrophobicContact CE1-CZ 3.43Å; F218-F384 VanDerWaalsContact CE1-CZ 3.43Å; F218-F384 HydrophobicContact CE2-CZ 4.38Å; F218-F384 HydrophobicContact CZ-CE1 4.18Å; F218-F384 AromaticContact CZ-CZ 3.73Å; F218-F384 HydrophobicContact CZ-CZ 3.73Å; F218-W397 HydrophobicContact CD1-CE3 4.08Å; F218-W397 HydrophobicContact CD1-CZ3 4.36Å; F218-W397 HydrophobicContact CE1-CB 4.38Å; F218-W397 HydrophobicContact CE1-CD2 4.43Å; F218-W397 AromaticContact CE1-CE3 3.54Å; F218-W397 HydrophobicContact CE1-CE3 3.54Å; F218-W397 HydrophobicContact CE1-CZ3 4.25Å; F218-W397 HydrophobicContact CZ-CB 4.43Å; F218-W397 AromaticContact CZ-CE3 3.97Å; F218-W397 HydrophobicContact CZ-CE3 3.97Å; F218-W397 WeakPolarHBondContact CZ-O 3.49Å; F218-L400 HydrophobicContact CE2-CB 4.23Å; F218-F401 HydrophobicContact CE2-CB 4.05Å; F218-F401 HydrophobicContact CZ-CB 3.84Å
219L94.4Very high93.7Very high30 Ų3048.8 Ų48.816%0.15727%0.267CS..Hα-helixtrans-58.8-50.9175.8176.666.2000111.1L215 T216 R221 A222 L223 Y297 I300L215-L219 VanDerWaalsContact O-CB 3.29Å; L215-L219 WeakPolarHBondContact O-CB 3.35Å; L215-L219 PolarHBondContact O-N 3.23Å; T216-L219 PolarHBondContact O-N 2.98Å; L219-R221 VanDerWaalsContact C-N 3.3Å; L219-R221 PolarHBondContact O-N 3.43Å; L219-A222 PolarHBondContact O-N 2.78Å; L219-L223 HydrophobicContact CD1-CD1 3.75Å; L219-L223 HydrophobicContact CD1-CG 4.04Å; L219-L223 HydrophobicContact CG-CD1 4.02Å; L219-L223 WeakPolarHBondContact O-CB 3.19Å; L219-L223 VanDerWaalsContact O-CG 3.29Å; L219-L223 WeakPolarHBondContact O-CG 3.43Å; L219-L223 PolarHBondContact O-N 3.15Å; L219-L223 VanDerWaalsContact O-N 3.08Å; L219-Y297 HydrophobicContact CD2-CE2 3.53Å; L219-I300 HydrophobicContact CD1-CB 4.13Å; L219-I300 HydrophobicContact CD1-CG2 3.44Å; L219-I300 VanDerWaalsContact CD1-CG2 3.44Å
220I94.6Very high93.7Very high114 Ų11447 Ų4759%0.58526%0.255SS*.Hα-helixtrans-58.5-46.2178.7-65.4165.7000109.8T216 I217 T224T216-I220 HydrophobicContact CG2-CD1 4.38Å; T216-I220 WeakPolarHBondContact O-CG1 3.39Å; T216-I220 PolarHBondContact O-N 3.25Å; T216-I220 VanDerWaalsContact O-N 3.11Å; I217-I220 PolarHBondContact O-N 3.48Å; I220-T224 WeakPolarHBondContact O-CG2 3.25Å
221R92.7Very high93.5Very high62 Ų6244.4 Ų44.423%0.23424%0.243CC..Hα-helixtrans-65.1-49.4179.4178.457.7-176.6151.7-0.3112.3I217 F218 L219 L223 T224 M391 W397I217-R221 PolarHBondContact O-N 3.42Å; I217-R221 VanDerWaalsContact O-N 3.1Å; F218-R221 PolarHBondContact O-N 3.09Å; L219-R221 VanDerWaalsContact C-N 3.3Å; L219-R221 PolarHBondContact O-N 3.43Å; R221-L223 VanDerWaalsContact C-N 3.31Å; R221-L223 PolarHBondContact O-N 3.31Å; R221-T224 PolarHBondContact NH1-OG1 3.04Å; R221-T224 PolarHBondContact O-N 3.11Å; R221-T224 PolarHBondContact O-OG1 2.93Å; R221-M391 HydrophobicContact CG-SD 4.05Å; R221-W397 HydrophobicContact CB-CH2 3.55Å; R221-W397 HydrophobicContact CB-CZ2 4.36Å; R221-W397 HydrophobicContact CB-CZ3 3.77Å; R221-W397 HydrophobicContact CG-CH2 3.52Å; R221-W397 HydrophobicContact CG-CZ2 3.85Å; R221-W397 HydrophobicContact CG-CZ3 3.89Å
222A92.3Very high93.5Very high1 Ų146 Ų461%0.00825%0.252CS..Hα-helixtrans-61.9-38.9-174.100000111.9F218 L219 T224 L225 A228 P301 I305F218-A222 WeakPolarHBondContact O-CB 3.41Å; F218-A222 PolarHBondContact O-N 3.35Å; L219-A222 PolarHBondContact O-N 2.78Å; A222-T224 PolarHBondContact O-N 2.62Å; A222-L225 WeakPolarHBondContact O-CB 3.46Å; A222-L225 PolarHBondContact O-N 2.9Å; A222-A228 WeakPolarHBondContact O-CB 3.28Å; A222-P301 HydrophobicContact CB-CB 3.95Å; A222-I305 HydrophobicContact CB-CD1 4.41Å; A222-I305 HydrophobicContact CB-CG1 3.99Å
223L94.8Very high93.5Very high86 Ų8647.3 Ų47.345%0.4527%0.266SS..Hα-helixtrans-68.1-18.8176.4-68.1176000113.8L219 R221 L232 I300L219-L223 HydrophobicContact CD1-CD1 3.75Å; L219-L223 HydrophobicContact CD1-CG 4.04Å; L219-L223 HydrophobicContact CG-CD1 4.02Å; L219-L223 WeakPolarHBondContact O-CB 3.19Å; L219-L223 VanDerWaalsContact O-CG 3.29Å; L219-L223 WeakPolarHBondContact O-CG 3.43Å; L219-L223 PolarHBondContact O-N 3.15Å; L219-L223 VanDerWaalsContact O-N 3.08Å; R221-L223 VanDerWaalsContact C-N 3.31Å; R221-L223 PolarHBondContact O-N 3.31Å; L223-L232 HydrophobicContact CD2-CD1 3.75Å; L223-I300 HydrophobicContact CD2-CG2 4.38Å
224T93.7Very high93.2Very high91 Ų9144.1 Ų44.156%0.55825%0.247SC*.THydrogen-bonded Turntrans-88.9-6175.863.80000113.9I220 R221 A222I220-T224 WeakPolarHBondContact O-CG2 3.25Å; R221-T224 PolarHBondContact NH1-OG1 3.04Å; R221-T224 PolarHBondContact O-N 3.11Å; R221-T224 PolarHBondContact O-OG1 2.93Å; A222-T224 PolarHBondContact O-N 2.62Å
225L91.5Very high93.1Very high11 Ų1144.1 Ų44.16%0.05825%0.247CC..SBendtrans-76.2144.4179.4-65.4172.5000111A222 A228 I305 F308 M391A222-L225 WeakPolarHBondContact O-CB 3.46Å; A222-L225 PolarHBondContact O-N 2.9Å; L225-A228 VanDerWaalsContact O-CB 3.27Å; L225-A228 WeakPolarHBondContact O-CB 3.5Å; L225-A228 PolarHBondContact O-N 3.47Å; L225-I305 HydrophobicContact CD1-CG1 4.26Å; L225-F308 HydrophobicContact CB-CB 3.95Å; L225-F308 HydrophobicContact CB-CD2 3.91Å; L225-F308 HydrophobicContact CB-CG 3.98Å; L225-F308 HydrophobicContact CD1-CB 4.2Å; L225-F308 HydrophobicContact CD1-CD1 4.18Å; L225-F308 HydrophobicContact CD1-CG 4.07Å; L225-F308 HydrophobicContact CD2-CD2 4.45Å; L225-F308 HydrophobicContact CG-CG 4.46Å; L225-M391 HydrophobicContact CD1-CE 3.75Å
226P91.3Very high93.1Very high87 Ų8748.8 Ų48.857%0.56527%0.268SS*.THydrogen-bonded Turntrans-64.1139.8175.426.6-31.9000110.4A228 F308P226-A228 PolarHBondContact O-N 2.85Å; P226-F308 HydrophobicContact CG-CD2 3.77Å; P226-F308 HydrophobicContact CG-CE2 3.8Å; P226-F308 VanDerWaalsContact O-CA 3.32Å; P226-F308 WeakPolarHBondContact O-CA 3.45Å; P226-F308 WeakPolarHBondContact O-CB 3.47Å; P226-F308 VanDerWaalsContact O-CD2 3.28Å; P226-F308 WeakPolarHBondContact O-CD2 3.14Å
227G90.6Very high92.9Very high15 Ų1549.9 Ų49.916%0.15527%0.274CS..THydrogen-bonded Turntrans76.81.4-177.400000115.5T229 D230 G307G227-T229 PolarHBondContact O-N 2.67Å; G227-D230 WeakPolarHBondContact CA-OD2 3.37Å; G227-D230 WeakPolarHBondContact O-CB 3.49Å; G227-D230 PolarHBondContact O-N 3.41Å; G227-G307 CarbonylContact O-C 3.57Å; G227-G307 WeakPolarHBondContact O-CA 3.44Å
228A93.6Very high92.8Very high4 Ų449.1 Ų49.13%0.03327%0.273CS..Hα-helixtrans-56.5-35.6175.600000113A222 L225 P226 D230 G231 L232 S304A222-A228 WeakPolarHBondContact O-CB 3.28Å; L225-A228 VanDerWaalsContact O-CB 3.27Å; L225-A228 WeakPolarHBondContact O-CB 3.5Å; L225-A228 PolarHBondContact O-N 3.47Å; P226-A228 PolarHBondContact O-N 2.85Å; A228-D230 VanDerWaalsContact C-N 3.29Å; A228-D230 PolarHBondContact O-N 3.2Å; A228-G231 PolarHBondContact O-N 3.49Å; A228-L232 WeakPolarHBondContact O-CG 3.44Å; A228-L232 PolarHBondContact O-N 3.08Å; A228-S304 WeakPolarHBondContact CA-O 3.42Å
229T94.3Very high92.7Very high96 Ų9652.2 Ų52.259%0.58929%0.29SS*.Hα-helixtrans-62.7-33.1177.649.40000113.1G227 L232 V233G227-T229 PolarHBondContact O-N 2.67Å; T229-L232 PolarHBondContact O-N 2.96Å; T229-V233 WeakPolarHBondContact O-CG2 3.48Å; T229-V233 PolarHBondContact O-N 3.16Å
230D93.3Very high92.6Very high33 Ų3358.6 Ų58.618%0.17631%0.312CS..Hα-helixtrans-65-44-177.7-57.5-43.4000110.6G227 A228 V233 Y234 R311G227-D230 WeakPolarHBondContact CA-OD2 3.37Å; G227-D230 WeakPolarHBondContact O-CB 3.49Å; G227-D230 PolarHBondContact O-N 3.41Å; A228-D230 VanDerWaalsContact C-N 3.29Å; A228-D230 PolarHBondContact O-N 3.2Å; D230-V233 PolarHBondContact O-N 3.09Å; D230-Y234 PolarHBondContact O-N 2.9Å; D230-R311 IonicContact OD1-CZ 3.37Å; D230-R311 IonicContact OD1-NH2 3.41Å; D230-R311 PolarHBondContact OD1-NH2 3.28Å; D230-R311 IonicContact OD2-CZ 2.63Å; D230-R311 IonicContact OD2-NE 3.82Å; D230-R311 PolarHBondContact OD2-NE 2.93Å; D230-R311 IonicContact OD2-NH2 2.73Å; D230-R311 PolarHBondContact OD2-NH2 3.48Å
231G92.4Very high92.4Very high0 Ų058.7 Ų58.70%031%0.31CS..Hα-helixtrans-69.2-32.417600000113.6A228 Y234 L235 F303A228-G231 PolarHBondContact O-N 3.49Å; G231-Y234 PolarHBondContact O-N 3.01Å; G231-L235 PolarHBondContact O-N 2.86Å; G231-F303 WeakPolarHBondContact CA-O 3.46Å
232L94.1Very high92.3Very high35 Ų3556.8 Ų56.818%0.18330%0.304CS..Hα-helixtrans-69.6-40.1173.8-67.2177.8000112.4L223 A228 T229 Y234 L235 F236 I300L223-L232 HydrophobicContact CD2-CD1 3.75Å; A228-L232 WeakPolarHBondContact O-CG 3.44Å; A228-L232 PolarHBondContact O-N 3.08Å; T229-L232 PolarHBondContact O-N 2.96Å; L232-Y234 VanDerWaalsContact C-N 3.28Å; L232-Y234 PolarHBondContact O-N 2.86Å; L232-L235 PolarHBondContact O-N 3.47Å; L232-F236 WeakPolarHBondContact O-CD2 3.39Å; L232-F236 PolarHBondContact O-N 2.97Å; L232-F236 VanDerWaalsContact O-N 3.09Å; L232-I300 HydrophobicContact CD2-CG2 3.86Å
233V93.6Very high92.2Very high92 Ų9258.1 Ų58.156%0.55831%0.311SS*.Hα-helixtrans-61-43.3173170.20000109.5T229 D230 L235 F236 T237T229-V233 WeakPolarHBondContact O-CG2 3.48Å; T229-V233 PolarHBondContact O-N 3.16Å; D230-V233 PolarHBondContact O-N 3.09Å; V233-L235 PolarHBondContact O-N 3.28Å; V233-F236 PolarHBondContact O-N 3.49Å; V233-T237 VanDerWaalsContact O-CB 3.25Å; V233-T237 WeakPolarHBondContact O-CB 3.42Å; V233-T237 PolarHBondContact O-N 2.89Å; V233-T237 PolarHBondContact O-OG1 3Å
234Y91Very high92Very high36 Ų3660.9 Ų60.914%0.14132%0.319CS..Hα-helixtrans-59.9-44.7174.7-176.1-86.5000112.4Q43 D230 G231 L232 F236 F303 Q367 L370 D371Q43-Y234 HydrophobicContact CB-CE1 4.48Å; Q43-Y234 HydrophobicContact CG-CE1 3.86Å; Q43-Y234 PolarHBondContact O-OH 3.12Å; D230-Y234 PolarHBondContact O-N 2.9Å; G231-Y234 PolarHBondContact O-N 3.01Å; L232-Y234 VanDerWaalsContact C-N 3.28Å; L232-Y234 PolarHBondContact O-N 2.86Å; Y234-F236 VanDerWaalsContact C-N 3.35Å; Y234-F236 PolarHBondContact O-N 2.82Å; Y234-F303 HydrophobicContact CD1-CD1 4.06Å; Y234-F303 AromaticContact CD1-CE1 3.69Å; Y234-F303 HydrophobicContact CD1-CE1 3.69Å; Y234-F303 AromaticContact CE1-CE1 3.97Å; Y234-F303 HydrophobicContact CE1-CE1 3.97Å; Y234-Q367 VanDerWaalsContact CE2-NE2 3.32Å; Y234-L370 HydrophobicContact CD2-CB 4.04Å; Y234-L370 HydrophobicContact CD2-CD1 4.4Å; Y234-L370 HydrophobicContact CE2-CB 4.31Å; Y234-L370 HydrophobicContact CG-CB 4.48Å; Y234-D371 VanDerWaalsContact CE2-OD1 3.29Å; Y234-D371 WeakPolarHBondContact CE2-OD1 3.28Å; Y234-D371 PolarHBondContact OH-OD1 3.37Å
235L91.8Very high91.7Very high0 Ų062.3 Ų62.30%032%0.318CS..Hα-helixtrans-60.7-39.3177.817658.5000113.2C42 G47 G48 G231 L232 V233 F303C42-L235 HydrophobicContact CB-CD1 4.22Å; G47-L235 CarbonylContact C-O 3.5Å; G48-L235 WeakPolarHBondContact CA-O 3.27Å; G48-L235 PolarHBondContact N-O 3.32Å; G231-L235 PolarHBondContact O-N 2.86Å; L232-L235 PolarHBondContact O-N 3.47Å; V233-L235 PolarHBondContact O-N 3.28Å; L235-F303 HydrophobicContact CB-CB 4.13Å; L235-F303 HydrophobicContact CB-CD1 3.76Å; L235-F303 HydrophobicContact CB-CD2 4.29Å; L235-F303 HydrophobicContact CB-CE1 4.23Å; L235-F303 HydrophobicContact CB-CG 3.79Å; L235-F303 HydrophobicContact CD1-CD1 4.41Å; L235-F303 HydrophobicContact CD1-CD2 3.83Å; L235-F303 HydrophobicContact CD1-CE1 4.26Å; L235-F303 HydrophobicContact CD1-CE2 3.65Å; L235-F303 HydrophobicContact CD1-CG 4.2Å; L235-F303 HydrophobicContact CD1-CZ 3.87Å; L235-F303 HydrophobicContact CD2-CB 4.19Å; L235-F303 HydrophobicContact CD2-CD2 3.97Å; L235-F303 HydrophobicContact CD2-CG 4.09Å; L235-F303 HydrophobicContact CG-CD2 4.24Å; L235-F303 HydrophobicContact CG-CG 4.24Å
236F93.4Very high91.5Very high106 Ų10665.6 Ų65.647%0.46534%0.34SS..Hα-helixtrans-100.3-2.1-172.6-69.5-65000114.6L232 V233 Y234 P238 L296L232-F236 WeakPolarHBondContact O-CD2 3.39Å; L232-F236 PolarHBondContact O-N 2.97Å; L232-F236 VanDerWaalsContact O-N 3.09Å; V233-F236 PolarHBondContact O-N 3.49Å; Y234-F236 VanDerWaalsContact C-N 3.35Å; Y234-F236 PolarHBondContact O-N 2.82Å; F236-P238 WeakPolarHBondContact O-CD 3.41Å; F236-L296 HydrophobicContact CE1-CD1 4.17Å; F236-L296 HydrophobicContact CZ-CD1 4.33Å
237T91.5Very high91.2Very high83 Ų8364.5 Ų64.551%0.50933%0.327SS..SBendtrans-90.4113175.2-57.30000109.6V233V233-T237 VanDerWaalsContact O-CB 3.25Å; V233-T237 WeakPolarHBondContact O-CB 3.42Å; V233-T237 PolarHBondContact O-N 2.89Å; V233-T237 PolarHBondContact O-OG1 3Å
238P92.3Very high91.2Very high44 Ų4463.8 Ų63.829%0.28632%0.32SS..BIsolated β-bridgetrans-82130.6-177.831.3-33.4000112.1A49 F236 W240A49-P238 HydrophobicContact CB-CB 4.09Å; F236-P238 WeakPolarHBondContact O-CD 3.41Å; P238-W240 HydrophobicContact CB-CZ2 4.28Å; P238-W240 HydrophobicContact CG-CH2 4.42Å; P238-W240 HydrophobicContact CG-CZ2 3.68Å
239D89.9Confident90.9Very high70 Ų7068.5 Ų68.537%0.37434%0.337SS..  trans-87.8107.2162.5-177.9-0.1000110.9G46 A49 E241 I242G46-D239 PolarHBondContact O-N 3.47Å; A49-D239 VanDerWaalsContact CB-O 3.24Å; A49-D239 WeakPolarHBondContact CB-O 3.18Å; D239-E241 VanDerWaalsContact C-N 3.32Å; D239-E241 PolarHBondContact O-N 3.16Å; D239-E241 PolarHBondContact OD1-N 2.97Å; D239-I242 HydrophobicContact CB-CD1 4.08Å; D239-I242 HydrophobicContact CB-CG1 4.41Å; D239-I242 VanDerWaalsContact OD2-CD1 3.3Å; D239-I242 WeakPolarHBondContact OD2-CD1 3.45Å; D239-I242 WeakPolarHBondContact OD2-CG1 3.36Å
240W91.6Very high90.5Very high164 Ų16464.1 Ų64.162%0.62131%0.31SS*.THydrogen-bonded Turntrans-70.4-24.2-177.2-58.399.1000113.9I52 P238 I242 L243I52-W240 HydrophobicContact CD1-CH2 4.27Å; I52-W240 HydrophobicContact CD1-CZ3 3.89Å; P238-W240 HydrophobicContact CB-CZ2 4.28Å; P238-W240 HydrophobicContact CG-CH2 4.42Å; P238-W240 HydrophobicContact CG-CZ2 3.68Å; W240-I242 VanDerWaalsContact C-N 3.31Å; W240-L243 HydrophobicContact CE3-CD1 3.91Å; W240-L243 HydrophobicContact CZ3-CD1 4.26Å; W240-L243 PolarHBondContact O-N 2.64Å
241E91.9Very high90.3Very high117 Ų11764 Ų6455%0.54731%0.309SS..THydrogen-bonded Turntrans-71.4-31.4-178.5-71.7-61.6132.500111.4D239 L243 K244D239-E241 VanDerWaalsContact C-N 3.32Å; D239-E241 PolarHBondContact O-N 3.16Å; D239-E241 PolarHBondContact OD1-N 2.97Å; E241-L243 VanDerWaalsContact C-N 3.3Å; E241-L243 PolarHBondContact O-N 3.34Å; E241-K244 WeakPolarHBondContact O-CB 3.25Å; E241-K244 PolarHBondContact O-N 3.45Å; E241-K244 IonicContact OE1-NZ 2.93Å; E241-K244 PolarHBondContact OE1-NZ 3.29Å; E241-K244 IonicContact OE2-NZ 3.64Å; E241-K244 PolarHBondContact OE2-NZ 2.98Å
242I89.6Confident90.2Very high21 Ų2164 Ų6411%0.10831%0.31CS..G310 helixtrans-63.9-33.9178.3-74.2174.6000111.9Y45 D239 W240 K244 K245 V248Y45-I242 HydrophobicContact CD1-CG2 4.26Å; D239-I242 HydrophobicContact CB-CD1 4.08Å; D239-I242 HydrophobicContact CB-CG1 4.41Å; D239-I242 VanDerWaalsContact OD2-CD1 3.3Å; D239-I242 WeakPolarHBondContact OD2-CD1 3.45Å; D239-I242 WeakPolarHBondContact OD2-CG1 3.36Å; W240-I242 VanDerWaalsContact C-N 3.31Å; I242-K244 PolarHBondContact O-N 2.85Å; I242-K245 WeakPolarHBondContact O-CB 3.31Å; I242-K245 PolarHBondContact O-N 3.49Å; I242-V248 HydrophobicContact CG2-CG2 3.52Å; I242-V248 WeakPolarHBondContact O-CG2 3.32Å
243L90.3Very high89.9Confident30 Ų3062.5 Ų62.516%0.15730%0.302CS..G310 helixtrans-62.7-18-179.2-66.5178.6000114.5A49 I52 P53 W240 E241 K245 V248 W249A49-L243 HydrophobicContact CB-CD2 4.18Å; A49-L243 HydrophobicContact CB-CG 4.2Å; A49-L243 WeakPolarHBondContact O-CD2 3.34Å; I52-L243 HydrophobicContact CD1-CD1 4.11Å; P53-L243 HydrophobicContact CG-CD2 4.29Å; W240-L243 HydrophobicContact CE3-CD1 3.91Å; W240-L243 HydrophobicContact CZ3-CD1 4.26Å; W240-L243 PolarHBondContact O-N 2.64Å; E241-L243 VanDerWaalsContact C-N 3.3Å; E241-L243 PolarHBondContact O-N 3.34Å; L243-K245 PolarHBondContact O-N 3.2Å; L243-V248 HydrophobicContact CD2-CG1 4.49Å; L243-W249 PolarHBondContact O-NE1 3.45Å
244K89.9Confident89.5Confident143 Ų14358.4 Ų58.462%0.62228%0.277SS*.G310 helixtrans-72.6-18.1174.8-63.1174-172.9166.20112.4E241 I242 P246E241-K244 WeakPolarHBondContact O-CB 3.25Å; E241-K244 PolarHBondContact O-N 3.45Å; E241-K244 IonicContact OE1-NZ 2.93Å; E241-K244 PolarHBondContact OE1-NZ 3.29Å; E241-K244 IonicContact OE2-NZ 3.64Å; E241-K244 PolarHBondContact OE2-NZ 2.98Å; I242-K244 PolarHBondContact O-N 2.85Å; K244-P246 WeakPolarHBondContact O-CD 3.27Å
245K88.5Confident89.5Confident121 Ų12156.8 Ų56.853%0.52627%0.271SS..SBendtrans-80.1121.9-179.2-62.8178.7-178175.10110.1I242 L243 Q247 V248I242-K245 WeakPolarHBondContact O-CB 3.31Å; I242-K245 PolarHBondContact O-N 3.49Å; L243-K245 PolarHBondContact O-N 3.2Å; K245-Q247 PolarHBondContact O-N 3.25Å; K245-V248 HydrophobicContact CB-CG2 3.98Å; K245-V248 PolarHBondContact O-N 3.2Å
246P85.9Confident89.5Confident81 Ų8156.9 Ų56.953%0.52627%0.271SS..Hα-helixtrans-59.4-30.7179-2635.2000114.3K244 V248 W249 L250K244-P246 WeakPolarHBondContact O-CD 3.27Å; P246-V248 PolarHBondContact O-N 3.43Å; P246-W249 PolarHBondContact O-N 3.02Å; P246-L250 PolarHBondContact O-N 3.09Å
247Q86.2Confident89.2Confident63 Ų6351.9 Ų51.929%0.29425%0.249SC..Hα-helixtrans-56.7-34.6178.5-170.570.432.600112.6Y45 K245 W249 L250 D251Y45-Q247 VanDerWaalsContact OH-CG 3.29Å; Y45-Q247 WeakPolarHBondContact OH-CG 3.42Å; K245-Q247 PolarHBondContact O-N 3.25Å; Q247-W249 VanDerWaalsContact C-N 3.34Å; Q247-W249 PolarHBondContact O-N 3.05Å; Q247-L250 WeakPolarHBondContact O-CB 3.2Å; Q247-L250 PolarHBondContact O-N 3.3Å; Q247-D251 PolarHBondContact NE2-OD1 3.45Å; Q247-D251 WeakPolarHBondContact O-CB 3.35Å; Q247-D251 PolarHBondContact O-N 3.31Å
248V89.9Confident88.9Confident0 Ų049.6 Ų49.60%023%0.232CC..Hα-helixtrans-63.6-42.6-178.4-178.30000111Y45 F50 P53 I242 L243 K245 P246 A252Y45-V248 HydrophobicContact CD1-CB 4.47Å; Y45-V248 HydrophobicContact CD1-CG2 3.6Å; Y45-V248 HydrophobicContact CE1-CG2 3.98Å; Y45-V248 HydrophobicContact CG-CG1 4.25Å; Y45-V248 HydrophobicContact CG-CG2 4.08Å; F50-V248 HydrophobicContact CD2-CG1 4.19Å; P53-V248 HydrophobicContact CG-CG1 3.99Å; I242-V248 HydrophobicContact CG2-CG2 3.52Å; I242-V248 WeakPolarHBondContact O-CG2 3.32Å; L243-V248 HydrophobicContact CD2-CG1 4.49Å; K245-V248 HydrophobicContact CB-CG2 3.98Å; K245-V248 PolarHBondContact O-N 3.2Å; P246-V248 PolarHBondContact O-N 3.43Å; V248-A252 VanDerWaalsContact O-CB 3.26Å; V248-A252 WeakPolarHBondContact O-CB 3.23Å; V248-A252 PolarHBondContact O-N 3.27Å
249W88.6Confident88.9Confident103 Ų10347.6 Ų47.639%0.3922%0.22SC..Hα-helixtrans-70.1-38178.9-6686.5000111.6P53 I56 L243 P246 Q247 A253P53-W249 HydrophobicContact CB-CD2 3.81Å; P53-W249 HydrophobicContact CB-CE3 3.51Å; P53-W249 HydrophobicContact CB-CG 4.44Å; P53-W249 HydrophobicContact CB-CH2 4.21Å; P53-W249 HydrophobicContact CB-CZ2 4.46Å; P53-W249 HydrophobicContact CB-CZ3 3.73Å; I56-W249 HydrophobicContact CD1-CH2 3.88Å; I56-W249 HydrophobicContact CD1-CZ3 3.88Å; I56-W249 HydrophobicContact CG2-CZ3 4.45Å; L243-W249 PolarHBondContact O-NE1 3.45Å; P246-W249 PolarHBondContact O-N 3.02Å; Q247-W249 VanDerWaalsContact C-N 3.34Å; Q247-W249 PolarHBondContact O-N 3.05Å; W249-A253 WeakPolarHBondContact O-CB 3.45Å; W249-A253 PolarHBondContact O-N 2.94Å
250L85.8Confident89.1Confident4 Ų444.3 Ų44.32%0.02120%0.202CC..Hα-helixtrans-64-47.3176.2177.658.8000111.9P246 Q247 A252 A253 T254 V526 Y530 L533P246-L250 PolarHBondContact O-N 3.09Å; Q247-L250 WeakPolarHBondContact O-CB 3.2Å; Q247-L250 PolarHBondContact O-N 3.3Å; L250-A252 VanDerWaalsContact C-N 3.35Å; L250-A253 PolarHBondContact O-N 3.01Å; L250-T254 HydrophobicContact CD1-CG2 4.31Å; L250-T254 WeakPolarHBondContact O-CG2 3.34Å; L250-T254 PolarHBondContact O-N 3.04Å; L250-T254 PolarHBondContact O-OG1 3.03Å; L250-V526 HydrophobicContact CD1-CG1 3.43Å; L250-V526 VanDerWaalsContact CD1-CG1 3.43Å; L250-Y530 HydrophobicContact CD1-CD2 3.91Å; L250-Y530 HydrophobicContact CD1-CG 4.34Å; L250-Y530 HydrophobicContact CD2-CD2 3.71Å; L250-Y530 HydrophobicContact CD2-CG 4.25Å; L250-Y530 HydrophobicContact CG-CD2 4.13Å; L250-L533 HydrophobicContact CD2-CD1 3.87Å
251D87.8Confident89.2Confident31 Ų3136.9 Ų36.917%0.16618%0.175CC..Hα-helixtrans-70.7-33.3-179.8-73.53.4000111.6L41 Y45 Q247 T254 Q255L41-D251 HydrophobicContact CD2-CB 4.47Å; Y45-D251 HydrophobicContact CE2-CB 3.67Å; Y45-D251 VanDerWaalsContact CE2-OD2 3.27Å; Y45-D251 WeakPolarHBondContact CE2-OD2 3.39Å; Y45-D251 VanDerWaalsContact CZ-OD2 3.26Å; Y45-D251 PolarHBondContact OH-OD2 3.3Å; Q247-D251 PolarHBondContact NE2-OD1 3.45Å; Q247-D251 WeakPolarHBondContact O-CB 3.35Å; Q247-D251 PolarHBondContact O-N 3.31Å; D251-T254 WeakPolarHBondContact CA-OG1 3.49Å; D251-T254 PolarHBondContact O-OG1 2.95Å; D251-T254 VanDerWaalsContact O-OG1 3.14Å; D251-Q255 WeakPolarHBondContact O-CB 3.49Å; D251-Q255 PolarHBondContact O-N 3.44Å
252A90.9Very high89.3Confident1 Ų131.3 Ų31.31%0.00815%0.149CC..Hα-helixtrans-63.8-45.6171.800000112.4F50 P53 V248 L250 Q255 I256F50-A252 HydrophobicContact CE2-CB 3.77Å; F50-A252 HydrophobicContact CZ-CB 4.06Å; P53-A252 HydrophobicContact CB-CB 3.77Å; P53-A252 HydrophobicContact CG-CB 4.07Å; V248-A252 VanDerWaalsContact O-CB 3.26Å; V248-A252 WeakPolarHBondContact O-CB 3.23Å; V248-A252 PolarHBondContact O-N 3.27Å; L250-A252 VanDerWaalsContact C-N 3.35Å; A252-Q255 PolarHBondContact O-N 2.9Å; A252-I256 PolarHBondContact O-N 3.35Å
253A87.9Confident89.5Confident2 Ų230.3 Ų30.32%0.01714%0.144CC..Hα-helixtrans-63.4-52.3176.900000111.2W249 L250 Q255 I256 F257 V526W249-A253 WeakPolarHBondContact O-CB 3.45Å; W249-A253 PolarHBondContact O-N 2.94Å; L250-A253 PolarHBondContact O-N 3.01Å; A253-Q255 VanDerWaalsContact C-N 3.26Å; A253-Q255 PolarHBondContact O-N 2.77Å; A253-I256 WeakPolarHBondContact O-CB 3.43Å; A253-I256 PolarHBondContact O-N 2.92Å; A253-F257 WeakPolarHBondContact O-CD2 3.37Å; A253-F257 PolarHBondContact O-N 3.04Å; A253-V526 HydrophobicContact CB-CG1 4Å; A253-V526 HydrophobicContact CB-CG2 3.94Å
254T85.3Confident89.7Confident7 Ų729 Ų294%0.04314%0.137CC..Hα-helixtrans-59.4-35.3177.756.50000112.8L250 D251 I256 F257 F258 L476L250-T254 HydrophobicContact CD1-CG2 4.31Å; L250-T254 WeakPolarHBondContact O-CG2 3.34Å; L250-T254 PolarHBondContact O-N 3.04Å; L250-T254 PolarHBondContact O-OG1 3.03Å; D251-T254 WeakPolarHBondContact CA-OG1 3.49Å; D251-T254 PolarHBondContact O-OG1 2.95Å; D251-T254 VanDerWaalsContact O-OG1 3.14Å; T254-I256 VanDerWaalsContact C-N 3.33Å; T254-I256 PolarHBondContact O-N 2.99Å; T254-F257 PolarHBondContact O-N 3.43Å; T254-F258 PolarHBondContact O-N 3.04Å; T254-F258 VanDerWaalsContact O-N 3.16Å; T254-L476 HydrophobicContact CG2-CD1 4.35Å
255Q90.4Very high89.8Confident2 Ų222.2 Ų22.21%0.00911%0.108CC..Hα-helixtrans-62.4-37.3173.5-179.560.22700112.3R37 F38 L41 Y54 D251 A252 A253 F258 S259R37-Q255 VanDerWaalsContact NE-OE1 3.1Å; F38-Q255 HydrophobicContact CD2-CG 4.36Å; L41-Q255 HydrophobicContact CD1-CB 3.88Å; L41-Q255 HydrophobicContact CD1-CG 3.91Å; Y54-Q255 HydrophobicContact CD2-CG 4.3Å; Y54-Q255 HydrophobicContact CE2-CG 4.05Å; D251-Q255 WeakPolarHBondContact O-CB 3.49Å; D251-Q255 PolarHBondContact O-N 3.44Å; A252-Q255 PolarHBondContact O-N 2.9Å; A253-Q255 VanDerWaalsContact C-N 3.26Å; A253-Q255 PolarHBondContact O-N 2.77Å; Q255-F258 PolarHBondContact O-N 2.89Å; Q255-S259 WeakPolarHBondContact O-CB 3.26Å; Q255-S259 PolarHBondContact O-N 3.46Å
256I91.7Very high90.1Very high1 Ų116.5 Ų16.51%0.0058%0.083CC..Hα-helixtrans-65.9-40.2176.7-70.6-68.4000111.5Y54 A57 L58 A252 A253 T254 S259 L260Y54-I256 HydrophobicContact CD1-CD1 4.41Å; Y54-I256 HydrophobicContact CD2-CD1 3.68Å; Y54-I256 HydrophobicContact CD2-CG1 4.03Å; Y54-I256 HydrophobicContact CE1-CD1 4.03Å; Y54-I256 HydrophobicContact CE2-CD1 3.25Å; Y54-I256 HydrophobicContact CE2-CG1 3.97Å; Y54-I256 HydrophobicContact CG-CD1 4.25Å; Y54-I256 VanDerWaalsContact CZ-CD1 3.43Å; A57-I256 HydrophobicContact CB-CG1 3.84Å; L58-I256 HydrophobicContact CB-CD1 3.76Å; L58-I256 HydrophobicContact CD1-CD1 4.11Å; A252-I256 PolarHBondContact O-N 3.35Å; A253-I256 WeakPolarHBondContact O-CB 3.43Å; A253-I256 PolarHBondContact O-N 2.92Å; T254-I256 VanDerWaalsContact C-N 3.33Å; T254-I256 PolarHBondContact O-N 2.99Å; I256-S259 PolarHBondContact O-N 2.87Å; I256-L260 HydrophobicContact CG2-CD1 3.88Å; I256-L260 HydrophobicContact CG2-CG 4.45Å; I256-L260 WeakPolarHBondContact O-CB 3.37Å; I256-L260 PolarHBondContact O-N 3.25Å
257F87.8Confident90.6Very high2 Ų212.6 Ų12.61%0.0096%0.058CC..Hα-helixtrans-59-51175.1-72-76.2000112E61 L65 A253 T254 S259 S261 V262 L475 L476 A479 L523E61-F257 VanDerWaalsContact CD-CE2 3.44Å; E61-F257 HydrophobicContact CG-CE1 4.44Å; E61-F257 HydrophobicContact CG-CE2 4.11Å; E61-F257 HydrophobicContact CG-CZ 3.58Å; E61-F257 VanDerWaalsContact OE1-CE2 3.25Å; E61-F257 WeakPolarHBondContact OE1-CE2 3.24Å; E61-F257 WeakPolarHBondContact OE1-CZ 3.45Å; L65-F257 HydrophobicContact CD1-CD1 4.39Å; L65-F257 HydrophobicContact CD1-CE1 3.4Å; L65-F257 HydrophobicContact CD1-CZ 3.92Å; A253-F257 WeakPolarHBondContact O-CD2 3.37Å; A253-F257 PolarHBondContact O-N 3.04Å; T254-F257 PolarHBondContact O-N 3.43Å; F257-S259 VanDerWaalsContact C-N 3.34Å; F257-S259 PolarHBondContact O-N 3.37Å; F257-S261 WeakPolarHBondContact O-CA 3.33Å; F257-S261 PolarHBondContact O-N 3.31Å; F257-V262 HydrophobicContact CD1-CG2 3.65Å; F257-V262 HydrophobicContact CE1-CG2 4.21Å; F257-V262 HydrophobicContact CG-CG2 4.49Å; F257-V262 PolarHBondContact O-N 2.83Å; F257-L475 HydrophobicContact CB-CD1 4.35Å; F257-L476 HydrophobicContact CD2-CD2 3.83Å; F257-L476 HydrophobicContact CE2-CD2 3.41Å; F257-L476 VanDerWaalsContact CE2-CD2 3.41Å; F257-L476 HydrophobicContact CZ-CD2 3.99Å; F257-A479 HydrophobicContact CD1-CB 4.23Å; F257-A479 HydrophobicContact CE1-CB 3.51Å; F257-A479 HydrophobicContact CZ-CB 4.31Å; F257-L523 HydrophobicContact CE1-CD2 4.09Å; F257-L523 HydrophobicContact CE2-CD2 4.14Å; F257-L523 HydrophobicContact CZ-CD2 3.38Å; F257-L523 HydrophobicContact CZ-CG 4.4Å
258F85.3Confident91.1Very high34 Ų349.6 Ų9.615%0.1494%0.044CC..Hα-helixtrans-65.6-36.1177.6-91-72.2000113.1T254 Q255 F264 G471T254-F258 PolarHBondContact O-N 3.04Å; T254-F258 VanDerWaalsContact O-N 3.16Å; Q255-F258 PolarHBondContact O-N 2.89Å; F258-F264 HydrophobicContact CD1-CZ 4.35Å; F258-G471 WeakPolarHBondContact CE2-O 3.16Å
259S91.5Very high91.3Very high3 Ų39.7 Ų9.72%0.0214%0.044CC..Hα-helixtrans-82-27.1-174.9-170.60000113.3A29 N34 Q255 I256 F257 N291A29-S259 CarbonylContact C-O 3.6Å; A29-S259 VanDerWaalsContact C-O 3.3Å; A29-S259 WeakPolarHBondContact CA-O 3.1Å; N34-S259 PolarHBondContact ND2-OG 2.9Å; Q255-S259 WeakPolarHBondContact O-CB 3.26Å; Q255-S259 PolarHBondContact O-N 3.46Å; I256-S259 PolarHBondContact O-N 2.87Å; F257-S259 VanDerWaalsContact C-N 3.34Å; F257-S259 PolarHBondContact O-N 3.37Å; S259-N291 VanDerWaalsContact O-CG 3.24Å; S259-N291 PolarHBondContact O-ND2 3.38Å; S259-N291 PolarHBondContact O-OD1 3.35Å; S259-N291 PolarHBondContact OG-ND2 3.01Å; S259-N291 PolarHBondContact OG-OD1 3.04Å
260L94Very high91.6Very high0 Ų04.8 Ų4.80%03%0.025CC..Hα-helixtrans-94.1-8.4173.3-65.7177.5000112.6L58 L66 I256 V262 L267 N291L58-L260 HydrophobicContact CD1-CD1 4.04Å; L66-L260 HydrophobicContact CD2-CD2 4.43Å; I256-L260 HydrophobicContact CG2-CD1 3.88Å; I256-L260 HydrophobicContact CG2-CG 4.45Å; I256-L260 WeakPolarHBondContact O-CB 3.37Å; I256-L260 PolarHBondContact O-N 3.25Å; L260-V262 HydrophobicContact CB-CG1 3.89Å; L260-V262 PolarHBondContact O-N 2.57Å; L260-L267 WeakPolarHBondContact O-CD1 3.45Å; L260-N291 HydrophobicContact CD2-CB 3.84Å; L260-N291 WeakPolarHBondContact CD2-ND2 3.42Å
261S94.4Very high92.1Very high8 Ų84.6 Ų4.66%0.0563%0.025CC..THydrogen-bonded Turntrans56.335-176.4-54.30000113.1F28 F257 F264F28-S261 VanDerWaalsContact CE1-CB 3.44Å; F28-S261 VanDerWaalsContact CZ-CB 3.41Å; F28-S261 PolarHBondContact O-OG 3.45Å; F257-S261 WeakPolarHBondContact O-CA 3.33Å; F257-S261 PolarHBondContact O-N 3.31Å; S261-F264 VanDerWaalsContact C-CD2 3.47Å; S261-F264 WeakPolarHBondContact O-CD2 3.44Å
262V94.2Very high92.5Very high0 Ų03.2 Ų3.20%02%0.017CC..THydrogen-bonded Turntrans-82.4151.5175.6-63.80000110.7L65 L66 F257 L260 F264 L267L65-V262 HydrophobicContact CB-CB 4.44Å; L65-V262 HydrophobicContact CB-CG1 4.42Å; L65-V262 HydrophobicContact CB-CG2 4.48Å; L65-V262 HydrophobicContact CD1-CG2 4.44Å; L66-V262 HydrophobicContact CB-CG1 4.01Å; L66-V262 HydrophobicContact CD1-CG1 4.27Å; F257-V262 HydrophobicContact CD1-CG2 3.65Å; F257-V262 HydrophobicContact CE1-CG2 4.21Å; F257-V262 HydrophobicContact CG-CG2 4.49Å; F257-V262 PolarHBondContact O-N 2.83Å; L260-V262 HydrophobicContact CB-CG1 3.89Å; L260-V262 PolarHBondContact O-N 2.57Å; V262-F264 VanDerWaalsContact O-CD2 3.28Å; V262-F264 WeakPolarHBondContact O-CD2 3.46Å; V262-F264 PolarHBondContact O-N 2.58Å; V262-L267 HydrophobicContact CG1-CD1 4.16Å
263A93.9Very high92.6Very high0 Ų04 Ų40%02%0.02CC..THydrogen-bonded Turntrans70.54.5-172.100000115.6E69 S98 L475 I478 A479E69-A263 VanDerWaalsContact OE1-CA 3.31Å; E69-A263 WeakPolarHBondContact OE1-CA 3.06Å; E69-A263 PolarHBondContact OE1-N 2.68Å; S98-A263 WeakPolarHBondContact CB-O 3.49Å; S98-A263 PolarHBondContact OG-O 3.22Å; A263-L475 HydrophobicContact CB-CD2 4.04Å; A263-I478 HydrophobicContact CB-CB 4.05Å; A263-I478 HydrophobicContact CB-CG2 3.68Å; A263-A479 HydrophobicContact CB-CB 4.08Å
264F93.5Very high92.9Very high3 Ų34.5 Ų4.51%0.0132%0.023CC..SBendtrans-83.8-19.6174.6-75-103.7000113.1F28 V101 S102 V105 F258 S261 V262 G266 L475F28-F264 HydrophobicContact CZ-CB 4.08Å; F28-F264 HydrophobicContact CZ-CG 4.41Å; V101-F264 HydrophobicContact CG1-CE1 4.39Å; S102-F264 PolarHBondContact OG-O 3.41Å; V105-F264 HydrophobicContact CB-CE1 4.04Å; V105-F264 HydrophobicContact CG1-CE1 4Å; V105-F264 HydrophobicContact CG2-CE1 3.83Å; V105-F264 HydrophobicContact CG2-CZ 4.38Å; F258-F264 HydrophobicContact CD1-CZ 4.35Å; S261-F264 VanDerWaalsContact C-CD2 3.47Å; S261-F264 WeakPolarHBondContact O-CD2 3.44Å; V262-F264 VanDerWaalsContact O-CD2 3.28Å; V262-F264 WeakPolarHBondContact O-CD2 3.46Å; V262-F264 PolarHBondContact O-N 2.58Å; F264-G266 PolarHBondContact O-N 3.31Å; F264-L475 HydrophobicContact CD2-CD1 4.38Å; F264-L475 HydrophobicContact CD2-CD2 3.9Å; F264-L475 HydrophobicContact CE2-CD1 3.42Å; F264-L475 VanDerWaalsContact CE2-CD1 3.42Å; F264-L475 HydrophobicContact CE2-CD2 3.71Å; F264-L475 HydrophobicContact CE2-CG 4.24Å; F264-L475 HydrophobicContact CG-CD2 4.46Å; F264-L475 HydrophobicContact CZ-CD1 3.63Å; F264-L475 HydrophobicContact CZ-CD2 4.12Å; F264-L475 HydrophobicContact CZ-CG 4.49Å
265G92.8Very high93.2Very high1 Ų17.2 Ų7.21%0.015%0.046CC..SBendtrans79.4-10-176.300000115.4I268 A269G265-I268 PolarHBondContact O-N 2.94Å; G265-A269 PolarHBondContact O-N 3.26Å; G265-A269 VanDerWaalsContact O-N 3.13Å
266G94.3Very high93.1Very high0 Ų010.5 Ų10.50%06%0.061CC..Hα-helixtrans-65.3-40.1175.600000113.2F264 A269 F270F264-G266 PolarHBondContact O-N 3.31Å; G266-A269 WeakPolarHBondContact O-CB 3.39Å; G266-A269 PolarHBondContact O-N 2.78Å; G266-F270 WeakPolarHBondContact O-CD2 3.26Å; G266-F270 WeakPolarHBondContact O-CG 3.44Å; G266-F270 PolarHBondContact O-N 2.98Å
267L96.6Very high93.1Very high0 Ų020.1 Ų20.10%010%0.098CC..Hα-helixtrans-67.3-35.8177-70.4168.7000112.7C25 F28 L66 E69 L70 L260 V262 A269 F270 S271C25-L267 HydrophobicContact CB-CD2 4.34Å; F28-L267 HydrophobicContact CD1-CD2 3.89Å; F28-L267 HydrophobicContact CD1-CG 3.86Å; F28-L267 HydrophobicContact CE1-CG 3.99Å; L66-L267 HydrophobicContact CD1-CD1 3.46Å; L66-L267 VanDerWaalsContact CD1-CD1 3.46Å; L66-L267 HydrophobicContact CD1-CD2 4.42Å; L66-L267 HydrophobicContact CD1-CG 4.48Å; E69-L267 WeakPolarHBondContact OE2-CD1 3.44Å; L70-L267 HydrophobicContact CD2-CB 4.04Å; L70-L267 HydrophobicContact CD2-CD2 4.27Å; L260-L267 WeakPolarHBondContact O-CD1 3.45Å; V262-L267 HydrophobicContact CG1-CD1 4.16Å; L267-A269 VanDerWaalsContact C-N 3.33Å; L267-F270 PolarHBondContact O-N 3.04Å; L267-S271 WeakPolarHBondContact O-CB 3.37Å; L267-S271 PolarHBondContact O-N 3.08Å; L267-S271 PolarHBondContact O-OG 3.35Å
268I96.4Very high93.4Very high0 Ų021.2 Ų21.20%010%0.104CC..Hα-helixtrans-61-45.1171.4-60.3177.4000109.7E69 V83 W84 G265 S271 S272E69-I268 HydrophobicContact CB-CG1 3.89Å; E69-I268 HydrophobicContact CG-CD1 4.27Å; E69-I268 HydrophobicContact CG-CG1 4.05Å; V83-I268 HydrophobicContact CB-CG2 4.39Å; V83-I268 HydrophobicContact CG2-CG2 3.75Å; W84-I268 HydrophobicContact CZ2-CD1 4.09Å; G265-I268 PolarHBondContact O-N 2.94Å; I268-S271 PolarHBondContact O-OG 3.38Å; I268-S272 WeakPolarHBondContact O-CB 3.4Å; I268-S272 PolarHBondContact O-N 2.82Å; I268-S272 VanDerWaalsContact O-N 3.15Å
269A94.6Very high93.9Very high1 Ų122.7 Ų22.71%0.00811%0.113CC..Hα-helixtrans-63.2-48.4176.800000112G265 G266 L267 S271 S272 Y273 E418 T422G265-A269 PolarHBondContact O-N 3.26Å; G265-A269 VanDerWaalsContact O-N 3.13Å; G266-A269 WeakPolarHBondContact O-CB 3.39Å; G266-A269 PolarHBondContact O-N 2.78Å; L267-A269 VanDerWaalsContact C-N 3.33Å; A269-S271 PolarHBondContact O-N 2.97Å; A269-S272 WeakPolarHBondContact O-CB 3.25Å; A269-S272 PolarHBondContact O-N 3.19Å; A269-S272 PolarHBondContact O-OG 2.76Å; A269-Y273 WeakPolarHBondContact O-CD2 3.21Å; A269-Y273 WeakPolarHBondContact O-CE2 3.47Å; A269-E418 HydrophobicContact CB-CG 3.81Å; A269-T422 HydrophobicContact CB-CG2 4.32Å
270F95.4Very high94.1Very high0 Ų022.5 Ų22.50%011%0.112CC..Hα-helixtrans-62.5-40.6-180-68.6-31.4000113.9W15 Y21 T24 F28 M200 G266 L267 S272 Y273 E418W15-F270 AromaticContact CH2-CD1 3.94Å; W15-F270 HydrophobicContact CH2-CD1 3.94Å; W15-F270 HydrophobicContact CH2-CE1 4.37Å; W15-F270 HydrophobicContact CZ2-CB 4Å; W15-F270 AromaticContact CZ2-CD1 3.82Å; W15-F270 HydrophobicContact CZ2-CD1 3.82Å; W15-F270 HydrophobicContact CZ2-CG 4.17Å; W15-F270 PolarHBondContact NE1-O 3.03Å; Y21-F270 HydrophobicContact CE2-CB 4.43Å; T24-F270 HydrophobicContact CG2-CD1 4.21Å; T24-F270 HydrophobicContact CG2-CD2 3.95Å; T24-F270 HydrophobicContact CG2-CE1 3.89Å; T24-F270 HydrophobicContact CG2-CE2 3.6Å; T24-F270 HydrophobicContact CG2-CG 4.24Å; T24-F270 HydrophobicContact CG2-CZ 3.56Å; F28-F270 HydrophobicContact CB-CE2 4.23Å; F28-F270 HydrophobicContact CD1-CE2 4.17Å; F28-F270 HydrophobicContact CG-CE2 4.33Å; M200-F270 HydrophobicContact CE-CD1 4.47Å; M200-F270 HydrophobicContact CE-CE1 3.72Å; M200-F270 HydrophobicContact CE-CZ 4.27Å; M200-F270 HydrophobicContact SD-CE1 3.97Å; M200-F270 HydrophobicContact SD-CZ 4.15Å; G266-F270 WeakPolarHBondContact O-CD2 3.26Å; G266-F270 WeakPolarHBondContact O-CG 3.44Å; G266-F270 PolarHBondContact O-N 2.98Å; L267-F270 PolarHBondContact O-N 3.04Å; F270-S272 VanDerWaalsContact C-N 3.3Å; F270-S272 PolarHBondContact O-N 3.01Å; F270-Y273 PolarHBondContact O-N 2.89Å; F270-E418 HydrophobicContact CD1-CG 3.99Å; F270-E418 HydrophobicContact CE1-CB 3.73Å; F270-E418 HydrophobicContact CE1-CG 3.6Å; F270-E418 HydrophobicContact CZ-CB 4Å; F270-E418 HydrophobicContact CZ-CG 4.35Å
271S96.1Very high94.2Very high0 Ų024.3 Ų24.30%012%0.12CC..Hα-helixtrans-69.6-27.8178.358.40000112.8L70 G73 L267 I268 A269 Y273 N274L70-S271 WeakPolarHBondContact O-CB 3.5Å; L70-S271 PolarHBondContact O-OG 3.36Å; G73-S271 WeakPolarHBondContact CA-OG 3.35Å; L267-S271 WeakPolarHBondContact O-CB 3.37Å; L267-S271 PolarHBondContact O-N 3.08Å; L267-S271 PolarHBondContact O-OG 3.35Å; I268-S271 PolarHBondContact O-OG 3.38Å; A269-S271 PolarHBondContact O-N 2.97Å; S271-Y273 PolarHBondContact O-N 2.84Å; S271-N274 WeakPolarHBondContact O-CB 3.42Å; S271-N274 PolarHBondContact O-N 3.3Å; S271-N274 VanDerWaalsContact O-N 3.09Å
272S95.1Very high94.3Very high2 Ų232.1 Ų32.11%0.01415%0.148CC..Hα-helixtrans-63.6-23.2178.181.10000114.4R12 G73 M78 I268 A269 F270 N274R12-S272 PolarHBondContact NH1-OG 3.47Å; G73-S272 WeakPolarHBondContact O-CA 3.22Å; M78-S272 WeakPolarHBondContact O-CB 3.45Å; I268-S272 WeakPolarHBondContact O-CB 3.4Å; I268-S272 PolarHBondContact O-N 2.82Å; I268-S272 VanDerWaalsContact O-N 3.15Å; A269-S272 WeakPolarHBondContact O-CB 3.25Å; A269-S272 PolarHBondContact O-N 3.19Å; A269-S272 PolarHBondContact O-OG 2.76Å; F270-S272 VanDerWaalsContact C-N 3.3Å; F270-S272 PolarHBondContact O-N 3.01Å; S272-N274 VanDerWaalsContact C-N 3.3Å
273Y93.3Very high94.4Very high17 Ų1732.4 Ų32.47%0.06715%0.15CC..THydrogen-bonded Turntrans-82.3-6.5177.7-56.5-46.9000113R12 P13 W15 I197 A269 F270 S271 E418R12-Y273 HydrophobicContact CB-CD1 4.35Å; R12-Y273 HydrophobicContact CG-CE1 4.44Å; P13-Y273 HydrophobicContact CG-CD1 3.9Å; P13-Y273 HydrophobicContact CG-CE1 3.64Å; P13-Y273 WeakPolarHBondContact O-CB 3.21Å; P13-Y273 VanDerWaalsContact O-CD1 3.22Å; P13-Y273 WeakPolarHBondContact O-CD1 3.27Å; W15-Y273 HydrophobicContact CZ2-CD2 4.03Å; I197-Y273 HydrophobicContact CD1-CD1 4.45Å; I197-Y273 HydrophobicContact CD1-CD2 3.91Å; I197-Y273 HydrophobicContact CD1-CE2 4.36Å; I197-Y273 HydrophobicContact CD1-CG 3.97Å; I197-Y273 HydrophobicContact CG2-CD2 4Å; I197-Y273 HydrophobicContact CG2-CE2 3.6Å; A269-Y273 WeakPolarHBondContact O-CD2 3.21Å; A269-Y273 WeakPolarHBondContact O-CE2 3.47Å; F270-Y273 PolarHBondContact O-N 2.89Å; S271-Y273 PolarHBondContact O-N 2.84Å; Y273-E418 WeakPolarHBondContact CE2-OE1 3.19Å; Y273-E418 PolarHBondContact OH-OE1 2.64Å
274N94Very high94.6Very high13 Ų1332.4 Ų32.47%0.0715%0.15CC..SBendtrans-75.2159.7177.4-77.2-37.3000113Y21 Q74 S271 S272 N278Y21-N274 WeakPolarHBondContact CE1-ND2 3.15Å; Y21-N274 WeakPolarHBondContact CE2-ND2 3.42Å; Y21-N274 PolarHBondContact OH-ND2 2.98Å; Q74-N274 HydrophobicContact CG-CB 4.3Å; S271-N274 WeakPolarHBondContact O-CB 3.42Å; S271-N274 PolarHBondContact O-N 3.3Å; S271-N274 VanDerWaalsContact O-N 3.09Å; S272-N274 VanDerWaalsContact C-N 3.3Å; N274-N278 HydrophobicContact CB-CB 4.43Å
275A90.9Very high94.8Very high65 Ų6535 Ų3554%0.53716%0.163SC..  trans-60.3147.9164.300000110.6R277 N278A275-R277 VanDerWaalsContact C-N 3.26Å; A275-R277 PolarHBondContact O-N 3.09Å; A275-N278 WeakPolarHBondContact O-CB 3.02Å
276E88.8Confident95Very high70 Ų7037.5 Ų37.533%0.32718%0.179SC..SBendtrans-59.7-38.3-179.1-93.4159.6-129.300112Q74 R77 N278 M502Q74-E276 PolarHBondContact NE2-O 3.35Å; R77-E276 IonicContact CZ-OE1 3.19Å; R77-E276 IonicContact NE-OE1 2.69Å; R77-E276 IonicContact NH1-OE1 2.75Å; R77-E276 PolarHBondContact NH1-OE1 2.85Å; R77-E276 IonicContact NH2-OE1 3.79Å; R77-E276 PolarHBondContact NH2-OE1 3.44Å; E276-N278 VanDerWaalsContact C-N 3.35Å; E276-N278 PolarHBondContact O-N 3.4Å; E276-M502 WeakPolarHBondContact O-CB 3.27Å; E276-M502 WeakPolarHBondContact O-CG 3.47Å
277R92.1Very high95.2Very high204 Ų20437.5 Ų37.577%0.7718%0.179SC*.SBendtrans-93.860.5179.1-66.2-170.3177.6-175.10.5111.9A275 M502A275-R277 VanDerWaalsContact C-N 3.26Å; A275-R277 PolarHBondContact O-N 3.09Å; R277-M502 WeakPolarHBondContact CA-O 3.34Å
278N94.3Very high95.2Very high25 Ų2537.5 Ų37.513%0.13418%0.179CC..  trans-116143.7174.3172.872.8000110.9K18 Q74 N274 A275 E276 C280 D283K18-N278 VanDerWaalsContact NZ-CG 3.29Å; K18-N278 PolarHBondContact NZ-ND2 3.47Å; K18-N278 VanDerWaalsContact NZ-ND2 3.15Å; K18-N278 PolarHBondContact NZ-OD1 3.34Å; Q74-N278 PolarHBondContact NE2-O 2.93Å; Q74-N278 PolarHBondContact OE1-ND2 3.17Å; N274-N278 HydrophobicContact CB-CB 4.43Å; A275-N278 WeakPolarHBondContact O-CB 3.02Å; E276-N278 VanDerWaalsContact C-N 3.35Å; E276-N278 PolarHBondContact O-N 3.4Å; N278-C280 PolarHBondContact O-N 3.21Å; N278-D283 PolarHBondContact ND2-OD2 3.38Å
279D95.8Very high95.2Very high64 Ų6442.2 Ų42.234%0.34220%0.203SC..  trans-79.981.9-177.9-171.2-9.6000111.4E281 R282 D283D279-E281 VanDerWaalsContact C-N 3.28Å; D279-E281 PolarHBondContact O-N 3.42Å; D279-E281 PolarHBondContact OD1-N 3.43Å; D279-R282 HydrophobicContact CB-CB 4.31Å; D279-R282 PolarHBondContact O-N 2.92Å; D279-R282 PolarHBondContact OD1-N 2.92Å; D279-R282 VanDerWaalsContact OD1-N 3.09Å; D279-R282 WeakPolarHBondContact OD2-CB 3.47Å; D279-D283 PolarHBondContact O-N 2.96Å
280C95.8Very high95.2Very high0 Ų044.2 Ų44.20%022%0.215CC..Hα-helixtrans-68.6-21.7179.452.70000113.8Y67 L70 N278 A284Y67-C280 HydrophobicContact CE2-CB 4.46Å; L70-C280 HydrophobicContact CB-CB 4.49Å; N278-C280 PolarHBondContact O-N 3.21Å; C280-A284 WeakPolarHBondContact O-CB 3.4Å; C280-A284 PolarHBondContact O-N 2.75Å
281E96.4Very high95.3Very high38 Ų3844.2 Ų44.218%0.17822%0.215CC..Hα-helixtrans-68.5-49.5175.5-176.6178.4-176.800110Y67 D279 D283 A284 L285 W511Y67-E281 HydrophobicContact CD2-CB 4.39Å; Y67-E281 HydrophobicContact CE1-CB 4.34Å; Y67-E281 HydrophobicContact CE1-CG 4.2Å; Y67-E281 VanDerWaalsContact CE2-CA 3.42Å; Y67-E281 HydrophobicContact CE2-CB 3.71Å; Y67-E281 HydrophobicContact CE2-CG 4.39Å; D279-E281 VanDerWaalsContact C-N 3.28Å; D279-E281 PolarHBondContact O-N 3.42Å; D279-E281 PolarHBondContact OD1-N 3.43Å; E281-D283 VanDerWaalsContact C-N 3.29Å; E281-D283 PolarHBondContact O-N 2.91Å; E281-A284 PolarHBondContact O-N 2.73Å; E281-L285 HydrophobicContact CG-CD1 4.47Å; E281-L285 WeakPolarHBondContact O-CG 3.23Å; E281-L285 PolarHBondContact O-N 3.34Å; E281-L285 VanDerWaalsContact O-N 3.11Å; E281-W511 HydrophobicContact CG-CZ2 4.38Å; E281-W511 PolarHBondContact OE1-NE1 3.18Å
282R96.1Very high95.2Very high171 Ų17144.8 Ų44.865%0.64522%0.219SC*.Hα-helixtrans-61.7-40.3176.6-174.5178.4-179.8-176.5-0.3111.6D279 L285 V286D279-R282 HydrophobicContact CB-CB 4.31Å; D279-R282 PolarHBondContact O-N 2.92Å; D279-R282 PolarHBondContact OD1-N 2.92Å; D279-R282 VanDerWaalsContact OD1-N 3.09Å; D279-R282 WeakPolarHBondContact OD2-CB 3.47Å; R282-L285 PolarHBondContact O-N 3.49Å; R282-V286 HydrophobicContact CG-CG2 4.37Å; R282-V286 WeakPolarHBondContact O-CB 3.35Å; R282-V286 VanDerWaalsContact O-CG2 3.28Å; R282-V286 WeakPolarHBondContact O-CG2 3.07Å; R282-V286 PolarHBondContact O-N 2.77Å
283D97.2Very high95.2Very high6 Ų647.3 Ų47.33%0.03224%0.24CC..Hα-helixtrans-60.9-48.2177.9-62.9-29.1000111.8K18 Y21 L22 L70 N278 D279 E281 L285 V286 V287K18-D283 WeakPolarHBondContact CE-OD1 3.36Å; K18-D283 IonicContact NZ-OD1 3.98Å; K18-D283 PolarHBondContact NZ-OD1 3.29Å; K18-D283 IonicContact NZ-OD2 2.75Å; K18-D283 PolarHBondContact NZ-OD2 3.49Å; Y21-D283 HydrophobicContact CE1-CB 4.2Å; Y21-D283 WeakPolarHBondContact CE1-OD2 3.48Å; L22-D283 HydrophobicContact CD2-CB 4.16Å; L70-D283 HydrophobicContact CD1-CB 4.43Å; N278-D283 PolarHBondContact ND2-OD2 3.38Å; D279-D283 PolarHBondContact O-N 2.96Å; E281-D283 VanDerWaalsContact C-N 3.29Å; E281-D283 PolarHBondContact O-N 2.91Å; D283-L285 VanDerWaalsContact C-N 3.33Å; D283-L285 PolarHBondContact O-N 3.19Å; D283-V286 PolarHBondContact O-N 2.97Å; D283-V287 WeakPolarHBondContact O-CB 3.26Å; D283-V287 VanDerWaalsContact O-CG2 3.27Å; D283-V287 WeakPolarHBondContact O-CG2 3.43Å; D283-V287 PolarHBondContact O-N 3.34Å
284A97.1Very high95.3Very high0 Ų046.8 Ų46.80%024%0.239CC..Hα-helixtrans-59.1-44.417900000111.7L66 Y67 L70 C280 E281 G288L66-A284 HydrophobicContact CD2-CB 4.49Å; L66-A284 WeakPolarHBondContact CD2-O 3.2Å; L66-A284 HydrophobicContact CG-CB 4.2Å; Y67-A284 HydrophobicContact CD2-CB 4.18Å; Y67-A284 HydrophobicContact CG-CB 4.28Å; L70-A284 HydrophobicContact CD1-CB 4Å; C280-A284 WeakPolarHBondContact O-CB 3.4Å; C280-A284 PolarHBondContact O-N 2.75Å; E281-A284 PolarHBondContact O-N 2.73Å; A284-G288 PolarHBondContact O-N 3.26Å
285L97.2Very high95.3Very high57 Ų5746.2 Ų46.230%0.29824%0.235SC..Hα-helixtrans-64.5-45177.7-69.8174.2000112.2L63 E281 R282 D283 I289 W511L63-L285 HydrophobicContact CD1-CD2 4.21Å; L63-L285 HydrophobicContact CD2-CD2 4.46Å; E281-L285 HydrophobicContact CG-CD1 4.47Å; E281-L285 WeakPolarHBondContact O-CG 3.23Å; E281-L285 PolarHBondContact O-N 3.34Å; E281-L285 VanDerWaalsContact O-N 3.11Å; R282-L285 PolarHBondContact O-N 3.49Å; D283-L285 VanDerWaalsContact C-N 3.33Å; D283-L285 PolarHBondContact O-N 3.19Å; L285-I289 VanDerWaalsContact O-CB 3.25Å; L285-I289 WeakPolarHBondContact O-CB 3.44Å; L285-I289 WeakPolarHBondContact O-CD1 3.44Å; L285-I289 WeakPolarHBondContact O-CG1 3.36Å; L285-I289 PolarHBondContact O-N 2.74Å; L285-W511 HydrophobicContact CD2-CH2 3.96Å; L285-W511 HydrophobicContact CD2-CZ2 4.01Å; L285-W511 HydrophobicContact CG-CZ2 4.4Å
286V97.6Very high95.4Very high55 Ų5546 Ų4633%0.33323%0.225SC..Hα-helixtrans-62-49.9178.1169.80000110.4R282 D283 T290R282-V286 HydrophobicContact CG-CG2 4.37Å; R282-V286 WeakPolarHBondContact O-CB 3.35Å; R282-V286 VanDerWaalsContact O-CG2 3.28Å; R282-V286 WeakPolarHBondContact O-CG2 3.07Å; R282-V286 PolarHBondContact O-N 2.77Å; D283-V286 PolarHBondContact O-N 2.97Å; V286-T290 WeakPolarHBondContact O-CB 3.36Å; V286-T290 PolarHBondContact O-N 3.39Å; V286-T290 PolarHBondContact O-OG1 3.33Å
287V97.6Very high95.6Very high0 Ų045.5 Ų45.50%022%0.221CC..Hα-helixtrans-60.9-49.1-179.81730000111L22 C25 I26 A29 L66 D283 N291L22-V287 HydrophobicContact CD2-CG2 4.43Å; C25-V287 HydrophobicContact CB-CG1 4.27Å; C25-V287 HydrophobicContact CB-CG2 3.6Å; I26-V287 HydrophobicContact CG1-CG2 4.15Å; A29-V287 HydrophobicContact CB-CG1 4.15Å; L66-V287 HydrophobicContact CD2-CB 4.17Å; L66-V287 HydrophobicContact CD2-CG1 4.04Å; D283-V287 WeakPolarHBondContact O-CB 3.26Å; D283-V287 VanDerWaalsContact O-CG2 3.27Å; D283-V287 WeakPolarHBondContact O-CG2 3.43Å; D283-V287 PolarHBondContact O-N 3.34Å; V287-N291 WeakPolarHBondContact O-CB 3.33Å; V287-N291 PolarHBondContact O-N 2.77Å
288G96.6Very high95.6Very high0 Ų035.8 Ų35.80%018%0.184CC..Hα-helixtrans-68.4-40.2-176.400000114.2A284 S292A284-G288 PolarHBondContact O-N 3.26Å; G288-S292 PolarHBondContact O-N 3.2Å; G288-S292 PolarHBondContact O-OG 3.44Å
289I96.3Very high95.6Very high99 Ų9934.6 Ų34.651%0.50818%0.178SC..Hα-helixtrans-69.4-45.4176.2-67168.5000110.2L285 N291 S292 A293L285-I289 VanDerWaalsContact O-CB 3.25Å; L285-I289 WeakPolarHBondContact O-CB 3.44Å; L285-I289 WeakPolarHBondContact O-CD1 3.44Å; L285-I289 WeakPolarHBondContact O-CG1 3.36Å; L285-I289 PolarHBondContact O-N 2.74Å; I289-N291 VanDerWaalsContact C-N 3.32Å; I289-N291 PolarHBondContact O-N 2.91Å; I289-S292 PolarHBondContact O-N 3.46Å; I289-A293 WeakPolarHBondContact O-CB 3.34Å; I289-A293 PolarHBondContact O-N 2.96Å
290T96.5Very high95.5Very high42 Ų4233.5 Ų33.526%0.25817%0.171SC..Hα-helixtrans-59.1-45.1176.8-66.80000110.7I26 V286 S292 A293 T294I26-T290 HydrophobicContact CD1-CG2 4.23Å; I26-T290 HydrophobicContact CG1-CG2 4.35Å; I26-T290 HydrophobicContact CG2-CG2 3.85Å; V286-T290 WeakPolarHBondContact O-CB 3.36Å; V286-T290 PolarHBondContact O-N 3.39Å; V286-T290 PolarHBondContact O-OG1 3.33Å; T290-S292 PolarHBondContact O-N 3.37Å; T290-A293 PolarHBondContact O-N 3.01Å; T290-T294 WeakPolarHBondContact O-CB 3.14Å; T290-T294 PolarHBondContact O-N 3.3Å; T290-T294 PolarHBondContact O-OG1 3.02Å
291N95.7Very high95.3Very high0 Ų033.7 Ų33.70%017%0.172CC..Hα-helixtrans-55.2-52.3177171.762.8000112.6A29 V30 N34 S259 L260 V287 I289 T294 S295A29-N291 HydrophobicContact CB-CB 4.07Å; A29-N291 PolarHBondContact O-OD1 2.97Å; V30-N291 HydrophobicContact CG2-CB 4.27Å; N34-N291 PolarHBondContact ND2-OD1 3.45Å; S259-N291 VanDerWaalsContact O-CG 3.24Å; S259-N291 PolarHBondContact O-ND2 3.38Å; S259-N291 PolarHBondContact O-OD1 3.35Å; S259-N291 PolarHBondContact OG-ND2 3.01Å; S259-N291 PolarHBondContact OG-OD1 3.04Å; L260-N291 HydrophobicContact CD2-CB 3.84Å; L260-N291 WeakPolarHBondContact CD2-ND2 3.42Å; V287-N291 WeakPolarHBondContact O-CB 3.33Å; V287-N291 PolarHBondContact O-N 2.77Å; I289-N291 VanDerWaalsContact C-N 3.32Å; I289-N291 PolarHBondContact O-N 2.91Å; N291-T294 PolarHBondContact O-N 3.14Å; N291-S295 PolarHBondContact O-N 3.4Å; N291-S295 PolarHBondContact O-OG 3.34Å
292S94.2Very high95Very high12 Ų1232.8 Ų32.88%0.08417%0.169CC..Hα-helixtrans-71.2-35.2-177-64.60000113Y54 L58 G288 I289 T290 T294 S295 L296Y54-S292 PolarHBondContact OH-OG 3.49Å; L58-S292 WeakPolarHBondContact CD1-OG 3.21Å; L58-S292 VanDerWaalsContact CD2-OG 3.23Å; L58-S292 WeakPolarHBondContact CD2-OG 3.42Å; G288-S292 PolarHBondContact O-N 3.2Å; G288-S292 PolarHBondContact O-OG 3.44Å; I289-S292 PolarHBondContact O-N 3.46Å; T290-S292 PolarHBondContact O-N 3.37Å; S292-T294 VanDerWaalsContact C-N 3.28Å; S292-T294 PolarHBondContact O-N 3.26Å; S292-S295 WeakPolarHBondContact O-CB 3.29Å; S292-S295 PolarHBondContact O-N 2.68Å; S292-L296 PolarHBondContact O-N 3.29Å; S292-L296 VanDerWaalsContact O-N 3.17Å
293A95.4Very high94.8Very high55 Ų5524.8 Ų24.846%0.45514%0.139SC..Hα-helixtrans-61.5-39.8171.300000110.8I289 T290 L296 Y297I289-A293 WeakPolarHBondContact O-CB 3.34Å; I289-A293 PolarHBondContact O-N 2.96Å; T290-A293 PolarHBondContact O-N 3.01Å; A293-L296 PolarHBondContact O-N 3.14Å; A293-Y297 WeakPolarHBondContact O-CB 3.41Å; A293-Y297 PolarHBondContact O-N 2.99Å
294T95.1Very high94.6Very high7 Ų724.5 Ų24.54%0.04314%0.137CC..Hα-helixtrans-68.3-37.6176.8-58.20000112.5V30 Y212 T290 N291 S292 L296 Y297 G298V30-T294 HydrophobicContact CG1-CG2 3.63Å; V30-T294 HydrophobicContact CG2-CG2 4.37Å; Y212-T294 HydrophobicContact CE1-CG2 3.86Å; Y212-T294 VanDerWaalsContact CE1-OG1 3.25Å; Y212-T294 WeakPolarHBondContact CE1-OG1 3.29Å; Y212-T294 PolarHBondContact OH-OG1 2.96Å; T290-T294 WeakPolarHBondContact O-CB 3.14Å; T290-T294 PolarHBondContact O-N 3.3Å; T290-T294 PolarHBondContact O-OG1 3.02Å; N291-T294 PolarHBondContact O-N 3.14Å; S292-T294 VanDerWaalsContact C-N 3.28Å; S292-T294 PolarHBondContact O-N 3.26Å; T294-L296 PolarHBondContact O-N 3.15Å; T294-Y297 PolarHBondContact O-N 3.22Å; T294-G298 PolarHBondContact O-N 3.15Å
295S94Very high94.3Very high0 Ų024.7 Ų24.70%014%0.138CC..Hα-helixtrans-57.1-47.6172-59.70000112.1N34 N291 S292 S299N34-S295 PolarHBondContact ND2-OG 2.82Å; N291-S295 PolarHBondContact O-N 3.4Å; N291-S295 PolarHBondContact O-OG 3.34Å; S292-S295 WeakPolarHBondContact O-CB 3.29Å; S292-S295 PolarHBondContact O-N 2.68Å; S295-S299 PolarHBondContact O-N 3.24Å; S295-S299 VanDerWaalsContact O-N 3.12Å; S295-S299 PolarHBondContact O-OG 3.49Å
296L93.3Very high93.9Very high62 Ų6222.7 Ų22.733%0.32513%0.128SC..Hα-helixtrans-68.2-44.7177.8-175.662000111.3L51 F236 S292 A293 T294 G298 S299 I300L51-L296 HydrophobicContact CD1-CD1 4.37Å; L51-L296 HydrophobicContact CD2-CD1 4.44Å; F236-L296 HydrophobicContact CE1-CD1 4.17Å; F236-L296 HydrophobicContact CZ-CD1 4.33Å; S292-L296 PolarHBondContact O-N 3.29Å; S292-L296 VanDerWaalsContact O-N 3.17Å; A293-L296 PolarHBondContact O-N 3.14Å; T294-L296 PolarHBondContact O-N 3.15Å; L296-G298 VanDerWaalsContact C-N 3.35Å; L296-G298 PolarHBondContact O-N 2.89Å; L296-S299 WeakPolarHBondContact O-CB 3.33Å; L296-S299 PolarHBondContact O-N 2.97Å; L296-S299 VanDerWaalsContact O-N 3.13Å; L296-I300 PolarHBondContact O-N 2.98Å
297Y94.5Very high93.6Very high59 Ų5920.1 Ų20.123%0.23111%0.112CC..Hα-helixtrans-59.7-43.3178.8-178.6-105.2000112.4L215 T216 L219 A293 T294 S299 I300 P301L215-Y297 HydrophobicContact CB-CD1 4.34Å; L215-Y297 HydrophobicContact CB-CE1 3.72Å; L215-Y297 HydrophobicContact CD1-CD1 4.32Å; L215-Y297 HydrophobicContact CD1-CE1 4.46Å; T216-Y297 VanDerWaalsContact CA-OH 3.23Å; T216-Y297 WeakPolarHBondContact CA-OH 3.49Å; T216-Y297 PolarHBondContact OG1-OH 3.22Å; L219-Y297 HydrophobicContact CD2-CE2 3.53Å; A293-Y297 WeakPolarHBondContact O-CB 3.41Å; A293-Y297 PolarHBondContact O-N 2.99Å; T294-Y297 PolarHBondContact O-N 3.22Å; Y297-S299 VanDerWaalsContact C-N 3.32Å; Y297-I300 PolarHBondContact O-N 3.43Å; Y297-P301 WeakPolarHBondContact O-CD 3.46Å
298G92.1Very high93.3Very high0 Ų020.9 Ų20.90%012%0.115CC..Hα-helixtrans-69.6-26.9175.900000113.5T294 L296 P301 I302T294-G298 PolarHBondContact O-N 3.15Å; L296-G298 VanDerWaalsContact C-N 3.35Å; L296-G298 PolarHBondContact O-N 2.89Å; G298-P301 WeakPolarHBondContact O-CD 3.07Å; G298-P301 WeakPolarHBondContact O-CG 3.36Å; G298-I302 VanDerWaalsContact O-CD1 3.25Å; G298-I302 WeakPolarHBondContact O-CD1 3.27Å; G298-I302 WeakPolarHBondContact O-CG1 3.35Å
299S92.4Very high92.9Very high0 Ų022.8 Ų22.80%012%0.124CC..Hα-helixtrans-69.6-36.3176.1-59.90000112.5F38 S295 L296 Y297 I302 F303F38-S299 VanDerWaalsContact CD1-OG 3.26Å; F38-S299 WeakPolarHBondContact CD1-OG 3.32Å; F38-S299 WeakPolarHBondContact CE1-OG 3.37Å; S295-S299 PolarHBondContact O-N 3.24Å; S295-S299 VanDerWaalsContact O-N 3.12Å; S295-S299 PolarHBondContact O-OG 3.49Å; L296-S299 WeakPolarHBondContact O-CB 3.33Å; L296-S299 PolarHBondContact O-N 2.97Å; L296-S299 VanDerWaalsContact O-N 3.13Å; Y297-S299 VanDerWaalsContact C-N 3.32Å; S299-I302 PolarHBondContact O-N 3.09Å; S299-I302 VanDerWaalsContact O-N 3.15Å; S299-F303 WeakPolarHBondContact O-CD2 3.29Å; S299-F303 PolarHBondContact O-N 3.14Å
300I93.8Very high92.6Very high40 Ų4018.2 Ų18.221%0.20510%0.101CC..Hα-helixtrans-54.9-54.1-177.9-64167.9000113.1L219 L223 L232 L296 Y297 I302 S304L219-I300 HydrophobicContact CD1-CB 4.13Å; L219-I300 HydrophobicContact CD1-CG2 3.44Å; L219-I300 VanDerWaalsContact CD1-CG2 3.44Å; L223-I300 HydrophobicContact CD2-CG2 4.38Å; L232-I300 HydrophobicContact CD2-CG2 3.86Å; L296-I300 PolarHBondContact O-N 2.98Å; Y297-I300 PolarHBondContact O-N 3.43Å; I300-I302 VanDerWaalsContact C-N 3.3Å; I300-I302 PolarHBondContact O-N 3.48Å; I300-S304 WeakPolarHBondContact O-CB 3.41Å; I300-S304 PolarHBondContact O-N 3.44Å; I300-S304 PolarHBondContact O-OG 2.79Å
301P92.3Very high92.3Very high4 Ų420 Ų203%0.02610%0.103CC..Hα-helixtrans-64.3-34.6177.322.9-31.1000112.6F218 A222 Y297 G298 S304 I305F218-P301 HydrophobicContact CB-CB 4.49Å; A222-P301 HydrophobicContact CB-CB 3.95Å; Y297-P301 WeakPolarHBondContact O-CD 3.46Å; G298-P301 WeakPolarHBondContact O-CD 3.07Å; G298-P301 WeakPolarHBondContact O-CG 3.36Å; P301-S304 PolarHBondContact O-N 2.84Å; P301-I305 WeakPolarHBondContact O-CB 3.29Å; P301-I305 VanDerWaalsContact O-CG1 3.25Å; P301-I305 WeakPolarHBondContact O-CG1 3.5Å; P301-I305 PolarHBondContact O-N 3.01Å
302I90.2Very high92Very high20 Ų2021.8 Ų21.810%0.10311%0.114CC..Hα-helixtrans-66.2-50.2179.9-66.7168.7000110.8L35 P39 G298 S299 I300 S304 I305 L306 L379L35-I302 WeakPolarHBondContact O-CD1 3.37Å; P39-I302 HydrophobicContact CB-CD1 4.24Å; P39-I302 HydrophobicContact CB-CG2 4.07Å; P39-I302 HydrophobicContact CG-CD1 3.6Å; G298-I302 VanDerWaalsContact O-CD1 3.25Å; G298-I302 WeakPolarHBondContact O-CD1 3.27Å; G298-I302 WeakPolarHBondContact O-CG1 3.35Å; S299-I302 PolarHBondContact O-N 3.09Å; S299-I302 VanDerWaalsContact O-N 3.15Å; I300-I302 VanDerWaalsContact C-N 3.3Å; I300-I302 PolarHBondContact O-N 3.48Å; I302-S304 VanDerWaalsContact C-N 3.29Å; I302-S304 PolarHBondContact O-N 2.84Å; I302-I305 PolarHBondContact O-N 3.01Å; I302-L306 HydrophobicContact CG2-CD1 4.12Å; I302-L306 WeakPolarHBondContact O-CG 3.37Å; I302-L306 PolarHBondContact O-N 3.37Å; I302-L379 HydrophobicContact CG2-CD1 4.28Å; I302-L379 HydrophobicContact CG2-CD2 4.14Å; I302-L379 HydrophobicContact CG2-CG 4.49Å
303F91.9Very high91.7Very high2 Ų223.7 Ų23.71%0.00912%0.123CC..Hα-helixtrans-65.6-33.6177-83.9-92.2000111.9P39 C42 Q43 G231 Y234 L235 S299 L306 G307P39-F303 HydrophobicContact CB-CD2 4.45Å; P39-F303 HydrophobicContact CB-CE2 3.84Å; P39-F303 WeakPolarHBondContact O-CZ 3.42Å; C42-F303 HydrophobicContact CB-CE2 4.26Å; C42-F303 HydrophobicContact CB-CZ 4.02Å; Q43-F303 HydrophobicContact CB-CE1 4.25Å; Q43-F303 HydrophobicContact CB-CZ 3.97Å; G231-F303 WeakPolarHBondContact CA-O 3.46Å; Y234-F303 HydrophobicContact CD1-CD1 4.06Å; Y234-F303 AromaticContact CD1-CE1 3.69Å; Y234-F303 HydrophobicContact CD1-CE1 3.69Å; Y234-F303 AromaticContact CE1-CE1 3.97Å; Y234-F303 HydrophobicContact CE1-CE1 3.97Å; L235-F303 HydrophobicContact CB-CB 4.13Å; L235-F303 HydrophobicContact CB-CD1 3.76Å; L235-F303 HydrophobicContact CB-CD2 4.29Å; L235-F303 HydrophobicContact CB-CE1 4.23Å; L235-F303 HydrophobicContact CB-CG 3.79Å; L235-F303 HydrophobicContact CD1-CD1 4.41Å; L235-F303 HydrophobicContact CD1-CD2 3.83Å; L235-F303 HydrophobicContact CD1-CE1 4.26Å; L235-F303 HydrophobicContact CD1-CE2 3.65Å; L235-F303 HydrophobicContact CD1-CG 4.2Å; L235-F303 HydrophobicContact CD1-CZ 3.87Å; L235-F303 HydrophobicContact CD2-CB 4.19Å; L235-F303 HydrophobicContact CD2-CD2 3.97Å; L235-F303 HydrophobicContact CD2-CG 4.09Å; L235-F303 HydrophobicContact CG-CD2 4.24Å; L235-F303 HydrophobicContact CG-CG 4.24Å; S299-F303 WeakPolarHBondContact O-CD2 3.29Å; S299-F303 PolarHBondContact O-N 3.14Å; F303-L306 HydrophobicContact CD1-CD1 4.32Å; F303-L306 HydrophobicContact CG-CD1 4.49Å; F303-L306 PolarHBondContact O-N 3.45Å; F303-G307 PolarHBondContact O-N 3.34Å
304S93.4Very high91.6Very high0 Ų023 Ų230%011%0.109CC..Hα-helixtrans-62.4-42.5172-59.50000111.9A228 I300 P301 I302 G307 F308A228-S304 WeakPolarHBondContact CA-O 3.42Å; I300-S304 WeakPolarHBondContact O-CB 3.41Å; I300-S304 PolarHBondContact O-N 3.44Å; I300-S304 PolarHBondContact O-OG 2.79Å; P301-S304 PolarHBondContact O-N 2.84Å; I302-S304 VanDerWaalsContact C-N 3.29Å; I302-S304 PolarHBondContact O-N 2.84Å; S304-G307 PolarHBondContact O-N 3.01Å; S304-F308 PolarHBondContact O-N 2.98Å
305I89.4Confident91.4Very high4 Ų425.3 Ų25.32%0.02112%0.122CC..Hα-helixtrans-67.8-40.3175.9-71.7169.7000111.4A222 L225 P301 I302 G307 F308 K309 F384 A387 M391A222-I305 HydrophobicContact CB-CD1 4.41Å; A222-I305 HydrophobicContact CB-CG1 3.99Å; L225-I305 HydrophobicContact CD1-CG1 4.26Å; P301-I305 WeakPolarHBondContact O-CB 3.29Å; P301-I305 VanDerWaalsContact O-CG1 3.25Å; P301-I305 WeakPolarHBondContact O-CG1 3.5Å; P301-I305 PolarHBondContact O-N 3.01Å; I302-I305 PolarHBondContact O-N 3.01Å; I305-G307 VanDerWaalsContact C-N 3.33Å; I305-G307 PolarHBondContact O-N 2.99Å; I305-F308 WeakPolarHBondContact O-CB 3.41Å; I305-F308 PolarHBondContact O-N 3.39Å; I305-K309 WeakPolarHBondContact O-CB 3.17Å; I305-K309 PolarHBondContact O-N 3.22Å; I305-F384 HydrophobicContact CD1-CD2 4.04Å; I305-F384 HydrophobicContact CD1-CE2 3.55Å; I305-F384 HydrophobicContact CD1-CZ 4.34Å; I305-A387 HydrophobicContact CG2-CB 3.18Å; I305-M391 HydrophobicContact CD1-CE 4.25Å; I305-M391 HydrophobicContact CG1-CE 4.27Å
306L88.9Confident91.2Very high16 Ų1628.1 Ų28.18%0.08414%0.139CC..Hα-helixtrans-60.1-42.9173.4-75.3171.2000111.4I302 F303 K309 A310 L379 V383I302-L306 HydrophobicContact CG2-CD1 4.12Å; I302-L306 WeakPolarHBondContact O-CG 3.37Å; I302-L306 PolarHBondContact O-N 3.37Å; F303-L306 HydrophobicContact CD1-CD1 4.32Å; F303-L306 HydrophobicContact CG-CD1 4.49Å; F303-L306 PolarHBondContact O-N 3.45Å; L306-K309 PolarHBondContact O-N 3.25Å; L306-A310 WeakPolarHBondContact O-CB 3.34Å; L306-A310 PolarHBondContact O-N 3.19Å; L306-L379 HydrophobicContact CD2-CD1 4.47Å; L306-V383 HydrophobicContact CD2-CG1 3.53Å
307G92Very high91.2Very high0 Ų025.7 Ų25.70%013%0.127CC..Hα-helixtrans-61.6-44.917500000112.6G227 F303 S304 I305 A310 R311G227-G307 CarbonylContact O-C 3.57Å; G227-G307 WeakPolarHBondContact O-CA 3.44Å; F303-G307 PolarHBondContact O-N 3.34Å; S304-G307 PolarHBondContact O-N 3.01Å; I305-G307 VanDerWaalsContact C-N 3.33Å; I305-G307 PolarHBondContact O-N 2.99Å; G307-A310 PolarHBondContact O-N 2.86Å; G307-R311 WeakPolarHBondContact O-CB 3.4Å; G307-R311 PolarHBondContact O-N 3.18Å
308F90.5Very high91.1Very high17 Ų1723.3 Ų23.38%0.07512%0.118CC..Hα-helixtrans-57.4-49.3172.3166.4-103.3000111.8L225 P226 S304 I305 A310 R311 T312 E390L225-F308 HydrophobicContact CB-CB 3.95Å; L225-F308 HydrophobicContact CB-CD2 3.91Å; L225-F308 HydrophobicContact CB-CG 3.98Å; L225-F308 HydrophobicContact CD1-CB 4.2Å; L225-F308 HydrophobicContact CD1-CD1 4.18Å; L225-F308 HydrophobicContact CD1-CG 4.07Å; L225-F308 HydrophobicContact CD2-CD2 4.45Å; L225-F308 HydrophobicContact CG-CG 4.46Å; P226-F308 HydrophobicContact CG-CD2 3.77Å; P226-F308 HydrophobicContact CG-CE2 3.8Å; P226-F308 VanDerWaalsContact O-CA 3.32Å; P226-F308 WeakPolarHBondContact O-CA 3.45Å; P226-F308 WeakPolarHBondContact O-CB 3.47Å; P226-F308 VanDerWaalsContact O-CD2 3.28Å; P226-F308 WeakPolarHBondContact O-CD2 3.14Å; S304-F308 PolarHBondContact O-N 2.98Å; I305-F308 WeakPolarHBondContact O-CB 3.41Å; I305-F308 PolarHBondContact O-N 3.39Å; F308-A310 PolarHBondContact O-N 3.36Å; F308-R311 PolarHBondContact O-N 3.34Å; F308-T312 WeakPolarHBondContact O-CB 3.49Å; F308-T312 PolarHBondContact O-N 3.41Å; F308-T312 PolarHBondContact O-OG1 2.97Å; F308-E390 HydrophobicContact CE1-CB 3.64Å; F308-E390 HydrophobicContact CE1-CG 4.07Å; F308-E390 HydrophobicContact CZ-CB 3.74Å; F308-E390 HydrophobicContact CZ-CG 4.31Å
309K88.4Confident91Very high40 Ų4028.6 Ų28.617%0.17414%0.143CC..Hα-helixtrans-59.9-48.5178.5-177.5-177.8178.51770111.9I305 L306 R311 T312 N313 V383 E386I305-K309 WeakPolarHBondContact O-CB 3.17Å; I305-K309 PolarHBondContact O-N 3.22Å; L306-K309 PolarHBondContact O-N 3.25Å; K309-R311 VanDerWaalsContact C-N 3.33Å; K309-R311 PolarHBondContact O-N 3.22Å; K309-T312 PolarHBondContact O-N 3.29Å; K309-N313 WeakPolarHBondContact O-CB 3.4Å; K309-N313 PolarHBondContact O-N 2.73Å; K309-V383 HydrophobicContact CD-CG1 4.25Å; K309-E386 VanDerWaalsContact CE-CD 3.42Å; K309-E386 WeakPolarHBondContact CE-OE1 3.43Å; K309-E386 WeakPolarHBondContact CE-OE2 3.37Å; K309-E386 IonicContact NZ-OE1 2.8Å; K309-E386 PolarHBondContact NZ-OE1 3.16Å; K309-E386 IonicContact NZ-OE2 2.79Å; K309-E386 PolarHBondContact NZ-OE2 3.27Å
310A90Very high91Very high3 Ų332 Ų323%0.02516%0.159CC..Hα-helixtrans-61.5-42.4179.800000111.5L306 G307 F308 N313 F314 L366 F369 L370L306-A310 WeakPolarHBondContact O-CB 3.34Å; L306-A310 PolarHBondContact O-N 3.19Å; G307-A310 PolarHBondContact O-N 2.86Å; F308-A310 PolarHBondContact O-N 3.36Å; A310-N313 PolarHBondContact O-N 3.12Å; A310-F314 VanDerWaalsContact O-CB 3.25Å; A310-F314 WeakPolarHBondContact O-CB 3.27Å; A310-F314 PolarHBondContact O-N 2.76Å; A310-L366 HydrophobicContact CB-CD1 4.05Å; A310-F369 HydrophobicContact CB-CB 3.89Å; A310-L370 HydrophobicContact CB-CD2 3.61Å; A310-L370 HydrophobicContact CB-CG 3.89Å
311R91.3Very high90.9Very high80 Ų8030.2 Ų30.230%0.30215%0.15SC..Hα-helixtrans-65.6-42.1176.9-175.26675.9169.27.9112.1D230 G307 F308 K309 F314 N315D230-R311 IonicContact OD1-CZ 3.37Å; D230-R311 IonicContact OD1-NH2 3.41Å; D230-R311 PolarHBondContact OD1-NH2 3.28Å; D230-R311 IonicContact OD2-CZ 2.63Å; D230-R311 IonicContact OD2-NE 3.82Å; D230-R311 PolarHBondContact OD2-NE 2.93Å; D230-R311 IonicContact OD2-NH2 2.73Å; D230-R311 PolarHBondContact OD2-NH2 3.48Å; G307-R311 WeakPolarHBondContact O-CB 3.4Å; G307-R311 PolarHBondContact O-N 3.18Å; F308-R311 PolarHBondContact O-N 3.34Å; K309-R311 VanDerWaalsContact C-N 3.33Å; K309-R311 PolarHBondContact O-N 3.22Å; R311-F314 PolarHBondContact O-N 3.32Å; R311-N315 VanDerWaalsContact O-CG 3.23Å; R311-N315 PolarHBondContact O-N 2.93Å
312T89.5Confident90.9Very high37 Ų3730.9 Ų30.923%0.22715%0.153CC..Hα-helixtrans-61.9-48.9175.3-61.60000111F308 K309 F314 N315 T316F308-T312 WeakPolarHBondContact O-CB 3.49Å; F308-T312 PolarHBondContact O-N 3.41Å; F308-T312 PolarHBondContact O-OG1 2.97Å; K309-T312 PolarHBondContact O-N 3.29Å; T312-F314 VanDerWaalsContact C-N 3.33Å; T312-F314 PolarHBondContact O-N 3.03Å; T312-N315 PolarHBondContact O-N 3.4Å; T312-T316 PolarHBondContact O-N 2.79Å; T312-T316 PolarHBondContact O-OG1 3.26Å; T312-T316 VanDerWaalsContact O-OG1 3.12Å
313N88.2Confident90.9Very high51 Ų5134.8 Ų34.827%0.27317%0.174SC..Hα-helixtrans-61.9-39.9178.1-72.7-5.9000112.5K309 A310 T316 C317 F369K309-N313 WeakPolarHBondContact O-CB 3.4Å; K309-N313 PolarHBondContact O-N 2.73Å; A310-N313 PolarHBondContact O-N 3.12Å; N313-T316 PolarHBondContact O-N 3.13Å; N313-C317 WeakPolarHBondContact O-CB 3.5Å; N313-C317 PolarHBondContact O-N 3.34Å; N313-F369 HydrophobicContact CB-CD1 4.05Å; N313-F369 HydrophobicContact CB-CE1 4.11Å; N313-F369 HydrophobicContact CB-CG 4.36Å; N313-F369 HydrophobicContact CB-CZ 4.46Å
314F91.7Very high90.8Very high40 Ų4037 Ų3718%0.17519%0.187CC..Hα-helixtrans-60.2-47.4173.8177.1-97.7000111.6A310 R311 T312 C317 L318 C364 L366 F369A310-F314 VanDerWaalsContact O-CB 3.25Å; A310-F314 WeakPolarHBondContact O-CB 3.27Å; A310-F314 PolarHBondContact O-N 2.76Å; R311-F314 PolarHBondContact O-N 3.32Å; T312-F314 VanDerWaalsContact C-N 3.33Å; T312-F314 PolarHBondContact O-N 3.03Å; F314-C317 WeakPolarHBondContact O-CB 3.39Å; F314-C317 PolarHBondContact O-N 3.4Å; F314-L318 HydrophobicContact CD1-CD1 4.01Å; F314-L318 HydrophobicContact CE1-CD1 3.36Å; F314-L318 HydrophobicContact CE1-CG 4.28Å; F314-L318 HydrophobicContact CE2-CD1 4.37Å; F314-L318 HydrophobicContact CZ-CD1 3.57Å; F314-L318 HydrophobicContact CZ-CG 4.26Å; F314-L318 PolarHBondContact O-N 3.33Å; F314-C364 HydrophobicContact CD2-CB 4.26Å; F314-C364 HydrophobicContact CE2-CB 4.19Å; F314-L366 HydrophobicContact CB-CD1 4.12Å; F314-L366 HydrophobicContact CD2-CB 4.1Å; F314-L366 HydrophobicContact CE2-CB 4.44Å; F314-L366 HydrophobicContact CG-CB 4.45Å; F314-L366 HydrophobicContact CG-CD1 4.45Å; F314-F369 HydrophobicContact CB-CD2 4.1Å; F314-F369 HydrophobicContact CB-CE2 4.28Å; F314-F369 HydrophobicContact CD2-CE2 4.49Å
315N92.1Very high90.6Very high56 Ų5637 Ų3730%0.29919%0.187SC..Hα-helixtrans-63.1-44.4177.7-69.4-12.2000111.7R311 T312 C317 L318 E319R311-N315 VanDerWaalsContact O-CG 3.23Å; R311-N315 PolarHBondContact O-N 2.93Å; T312-N315 PolarHBondContact O-N 3.4Å; N315-C317 VanDerWaalsContact C-N 3.32Å; N315-C317 PolarHBondContact O-N 2.98Å; N315-L318 PolarHBondContact O-N 3.4Å; N315-E319 WeakPolarHBondContact O-CG 3.5Å; N315-E319 PolarHBondContact O-N 3.22Å
316T90.3Very high90.6Very high60 Ų6037.5 Ų37.537%0.36819%0.191SC..Hα-helixtrans-62.6-37.7176.6-57.30000112.3T312 N313 E319 Q320T312-T316 PolarHBondContact O-N 2.79Å; T312-T316 PolarHBondContact O-OG1 3.26Å; T312-T316 VanDerWaalsContact O-OG1 3.12Å; N313-T316 PolarHBondContact O-N 3.13Å; T316-E319 PolarHBondContact O-N 2.85Å; T316-Q320 WeakPolarHBondContact O-CG 3.32Å; T316-Q320 PolarHBondContact O-N 2.99Å; T316-Q320 VanDerWaalsContact O-N 3.14Å
317C91.8Very high90.7Very high10 Ų1042.2 Ų42.27%0.06822%0.216CC..Hα-helixtrans-61.3-46.1174-176.40000111.3N313 F314 N315 Q320 N321 C364 F369N313-C317 WeakPolarHBondContact O-CB 3.5Å; N313-C317 PolarHBondContact O-N 3.34Å; F314-C317 WeakPolarHBondContact O-CB 3.39Å; F314-C317 PolarHBondContact O-N 3.4Å; N315-C317 VanDerWaalsContact C-N 3.32Å; N315-C317 PolarHBondContact O-N 2.98Å; C317-Q320 PolarHBondContact O-N 2.7Å; C317-N321 PolarHBondContact O-N 2.91Å; C317-C364 HydrophobicContact CB-CB 3.83Å; C317-C364 WeakPolarHBondContact CB-SG 3.3Å; C317-C364 VanDerWaalsContact SG-CA 3.54Å; C317-C364 WeakPolarHBondContact SG-CB 3.32Å; C317-C364 CovalentContact SG-SG 2.04Å; C317-C364 PolarHBondContact SG-SG 2.88Å; C317-F369 HydrophobicContact CB-CE2 4.44Å; C317-F369 HydrophobicContact CB-CZ 4.29Å
318L92.6Very high90.6Very high10 Ų1046.7 Ų46.75%0.05224%0.237CC..Hα-helixtrans-65.2-42.2177.1-70.5-179.6000112.2F314 N315 Q320 N321 I322 V338 Y341 C364F314-L318 HydrophobicContact CD1-CD1 4.01Å; F314-L318 HydrophobicContact CE1-CD1 3.36Å; F314-L318 HydrophobicContact CE1-CG 4.28Å; F314-L318 HydrophobicContact CE2-CD1 4.37Å; F314-L318 HydrophobicContact CZ-CD1 3.57Å; F314-L318 HydrophobicContact CZ-CG 4.26Å; F314-L318 PolarHBondContact O-N 3.33Å; N315-L318 PolarHBondContact O-N 3.4Å; L318-Q320 VanDerWaalsContact C-N 3.27Å; L318-Q320 PolarHBondContact O-N 3.01Å; L318-N321 PolarHBondContact O-N 3.37Å; L318-N321 VanDerWaalsContact O-N 3.13Å; L318-I322 WeakPolarHBondContact O-CB 3.15Å; L318-I322 VanDerWaalsContact O-CG1 3.25Å; L318-I322 WeakPolarHBondContact O-CG1 3.25Å; L318-I322 PolarHBondContact O-N 3.48Å; L318-V338 HydrophobicContact CD1-CG1 3.8Å; L318-Y341 HydrophobicContact CD2-CD1 3.68Å; L318-Y341 HydrophobicContact CD2-CD2 4.42Å; L318-Y341 HydrophobicContact CD2-CE1 3.64Å; L318-Y341 HydrophobicContact CD2-CE2 4.41Å; L318-Y341 HydrophobicContact CD2-CG 4.08Å; L318-C364 HydrophobicContact CD2-CB 3.87Å; L318-C364 HydrophobicContact CG-CB 4.24Å
319E91.5Very high90.6Very high111 Ų11148.1 Ų48.152%0.51924%0.243SC..Hα-helixtrans-58.8-37.3176.6-75.3176.1175.900112.4N315 T316 I322 L323 V338N315-E319 WeakPolarHBondContact O-CG 3.5Å; N315-E319 PolarHBondContact O-N 3.22Å; T316-E319 PolarHBondContact O-N 2.85Å; E319-I322 PolarHBondContact O-N 3.4Å; E319-L323 WeakPolarHBondContact O-CB 3.37Å; E319-L323 PolarHBondContact O-N 2.8Å; E319-V338 HydrophobicContact CG-CG2 4.07Å
320Q90.7Very high90.6Very high71 Ų7153.6 Ų53.633%0.33227%0.274SS..Hα-helixtrans-67-41175-71.7170.5-3.700112.5T316 C317 L318 L323 T324T316-Q320 WeakPolarHBondContact O-CG 3.32Å; T316-Q320 PolarHBondContact O-N 2.99Å; T316-Q320 VanDerWaalsContact O-N 3.14Å; C317-Q320 PolarHBondContact O-N 2.7Å; L318-Q320 VanDerWaalsContact C-N 3.27Å; L318-Q320 PolarHBondContact O-N 3.01Å; Q320-L323 PolarHBondContact O-N 3.49Å; Q320-T324 PolarHBondContact O-N 3.41Å; Q320-T324 PolarHBondContact O-OG1 2.8Å
321N92.1Very high90.5Very high3 Ų354.6 Ų54.62%0.01628%0.278CS..Hα-helixtrans-65.4-43173.8-74.8-8.3000111.2C317 L318 L323 T324 L325 Y341 L361 R362C317-N321 PolarHBondContact O-N 2.91Å; L318-N321 PolarHBondContact O-N 3.37Å; L318-N321 VanDerWaalsContact O-N 3.13Å; N321-L323 VanDerWaalsContact C-N 3.35Å; N321-L323 PolarHBondContact O-N 2.82Å; N321-T324 PolarHBondContact O-N 3.3Å; N321-L325 WeakPolarHBondContact O-CB 3.25Å; N321-L325 VanDerWaalsContact O-CG 3.32Å; N321-L325 WeakPolarHBondContact O-CG 3.41Å; N321-L325 PolarHBondContact O-N 2.82Å; N321-Y341 HydrophobicContact CB-CE2 3.84Å; N321-Y341 PolarHBondContact ND2-OH 3.43Å; N321-L361 HydrophobicContact CB-CD2 4.26Å; N321-R362 PolarHBondContact ND2-O 3.49Å; N321-R362 PolarHBondContact OD1-N 3.08Å
322I91.6Very high90.2Very high17 Ų1753.6 Ų53.69%0.08729%0.288CS..Hα-helixtrans-58.2-47.7175.3-70.1166.3000110.1L318 E319 T324 L325 T326 M336 V338 Y341L318-I322 WeakPolarHBondContact O-CB 3.15Å; L318-I322 VanDerWaalsContact O-CG1 3.25Å; L318-I322 WeakPolarHBondContact O-CG1 3.25Å; L318-I322 PolarHBondContact O-N 3.48Å; E319-I322 PolarHBondContact O-N 3.4Å; I322-T324 VanDerWaalsContact C-N 3.31Å; I322-T324 PolarHBondContact O-N 2.87Å; I322-L325 PolarHBondContact O-N 3.24Å; I322-T326 WeakPolarHBondContact O-CB 3.35Å; I322-T326 PolarHBondContact O-N 3.05Å; I322-T326 PolarHBondContact O-OG1 3.5Å; I322-M336 HydrophobicContact CB-SD 4.34Å; I322-M336 HydrophobicContact CG1-CE 4.23Å; I322-M336 HydrophobicContact CG1-CG 4.11Å; I322-M336 HydrophobicContact CG1-SD 4.04Å; I322-M336 HydrophobicContact CG2-CB 4.05Å; I322-M336 HydrophobicContact CG2-CG 4.09Å; I322-M336 HydrophobicContact CG2-SD 4.13Å; I322-V338 HydrophobicContact CD1-CG2 4.2Å; I322-Y341 HydrophobicContact CD1-CD2 4.15Å; I322-Y341 HydrophobicContact CG1-CD2 3.55Å; I322-Y341 HydrophobicContact CG1-CE2 4.13Å
323L90.7Very high89.5Confident103 Ų10360 Ų6054%0.53932%0.315SS..Hα-helixtrans-60.1-43.2178.4-176.366000111.5E319 Q320 N321 N327E319-L323 WeakPolarHBondContact O-CB 3.37Å; E319-L323 PolarHBondContact O-N 2.8Å; Q320-L323 PolarHBondContact O-N 3.49Å; N321-L323 VanDerWaalsContact C-N 3.35Å; N321-L323 PolarHBondContact O-N 2.82Å; L323-N327 VanDerWaalsContact O-CB 3.3Å; L323-N327 WeakPolarHBondContact O-CB 3.43Å; L323-N327 PolarHBondContact O-N 3.44Å; L323-N327 PolarHBondContact O-ND2 2.87Å; L323-N327 VanDerWaalsContact O-ND2 3.15Å
324T89.9Confident89Confident47 Ų4768.3 Ų68.329%0.28834%0.343SS..Hα-helixtrans-62.8-45.6178.1-55.70000111.5Q320 N321 I322 H328 L359 L361Q320-T324 PolarHBondContact O-N 3.41Å; Q320-T324 PolarHBondContact O-OG1 2.8Å; N321-T324 PolarHBondContact O-N 3.3Å; I322-T324 VanDerWaalsContact C-N 3.31Å; I322-T324 PolarHBondContact O-N 2.87Å; T324-H328 WeakPolarHBondContact O-CB 3.32Å; T324-H328 PolarHBondContact O-N 3.44Å; T324-H328 VanDerWaalsContact O-N 3.09Å; T324-L359 HydrophobicContact CG2-CD2 4.29Å; T324-L361 HydrophobicContact CG2-CD2 4.35Å
325L89.9Confident88.7Confident0 Ų070.6 Ų70.60%036%0.357CS..Hα-helixtrans-68.2-44.3178.8-71167.2000112N321 I322 N327 H328 F329 M336 Y341 F345 L348 I356 L359 L361N321-L325 WeakPolarHBondContact O-CB 3.25Å; N321-L325 VanDerWaalsContact O-CG 3.32Å; N321-L325 WeakPolarHBondContact O-CG 3.41Å; N321-L325 PolarHBondContact O-N 2.82Å; I322-L325 PolarHBondContact O-N 3.24Å; L325-N327 VanDerWaalsContact C-N 3.33Å; L325-N327 PolarHBondContact O-N 3.47Å; L325-H328 PolarHBondContact O-N 3.4Å; L325-F329 HydrophobicContact CD2-CD2 4.17Å; L325-F329 HydrophobicContact CD2-CE2 3.82Å; L325-F329 WeakPolarHBondContact O-CB 3.32Å; L325-F329 WeakPolarHBondContact O-CD2 3.42Å; L325-F329 PolarHBondContact O-N 3.02Å; L325-M336 HydrophobicContact CB-SD 4.24Å; L325-M336 HydrophobicContact CD1-CE 3.64Å; L325-M336 HydrophobicContact CD1-SD 4.17Å; L325-Y341 HydrophobicContact CD1-CE2 4Å; L325-F345 HydrophobicContact CD1-CD2 4.47Å; L325-L348 HydrophobicContact CD2-CD1 4.28Å; L325-I356 HydrophobicContact CD2-CD1 4.26Å; L325-L359 HydrophobicContact CD2-CD1 3.88Å; L325-L361 HydrophobicContact CD1-CD2 4.48Å; L325-L361 HydrophobicContact CD2-CD1 4.36Å; L325-L361 HydrophobicContact CD2-CD2 4.26Å; L325-L361 HydrophobicContact CG-CD2 4.08Å
326T89.9Confident88.5Confident16 Ų1668.3 Ų68.310%0.09834%0.344CS..Hα-helixtrans-61.9-43.2-179.6-57.30000110.6I322 D330 I331I322-T326 WeakPolarHBondContact O-CB 3.35Å; I322-T326 PolarHBondContact O-N 3.05Å; I322-T326 PolarHBondContact O-OG1 3.5Å; T326-D330 WeakPolarHBondContact O-CA 3.37Å; T326-D330 PolarHBondContact O-N 3.17Å; T326-I331 HydrophobicContact CG2-CB 4.13Å; T326-I331 WeakPolarHBondContact CG2-O 3.5Å; T326-I331 PolarHBondContact O-N 3.42Å
327N90.3Very high88.4Confident115 Ų11568 Ų6862%0.61534%0.343SS*.Hα-helixtrans-68.7-34.9176.6-71.3-22.1000113L323 L325L323-N327 VanDerWaalsContact O-CB 3.3Å; L323-N327 WeakPolarHBondContact O-CB 3.43Å; L323-N327 PolarHBondContact O-N 3.44Å; L323-N327 PolarHBondContact O-ND2 2.87Å; L323-N327 VanDerWaalsContact O-ND2 3.15Å; L325-N327 VanDerWaalsContact C-N 3.33Å; L325-N327 PolarHBondContact O-N 3.47Å
328H90.4Very high88.2Confident94 Ų9469.8 Ų69.844%0.43535%0.353SS..Hα-helixtrans-77-42.3-178.6-171.179.1000112.6T324 L325 L359T324-H328 WeakPolarHBondContact O-CB 3.32Å; T324-H328 PolarHBondContact O-N 3.44Å; T324-H328 VanDerWaalsContact O-N 3.09Å; L325-H328 PolarHBondContact O-N 3.4Å; H328-L359 HydrophobicContact CB-CD1 4.31Å; H328-L359 HydrophobicContact CB-CD2 4.15Å
329F89.4Confident88Confident47 Ų4778.2 Ų78.221%0.20639%0.392CS..Hα-helixtrans-94.75.9-178-67.8-73.3000113.8L325 I331 L348 H352 D355 I356 L359L325-F329 HydrophobicContact CD2-CD2 4.17Å; L325-F329 HydrophobicContact CD2-CE2 3.82Å; L325-F329 WeakPolarHBondContact O-CB 3.32Å; L325-F329 WeakPolarHBondContact O-CD2 3.42Å; L325-F329 PolarHBondContact O-N 3.02Å; F329-I331 HydrophobicContact CB-CD1 3.96Å; F329-I331 HydrophobicContact CB-CG1 3.83Å; F329-I331 PolarHBondContact O-N 3.33Å; F329-L348 HydrophobicContact CD1-CD2 4.17Å; F329-L348 HydrophobicContact CD2-CD1 3.88Å; F329-L348 HydrophobicContact CD2-CD2 4.12Å; F329-L348 HydrophobicContact CE1-CD2 4.29Å; F329-L348 HydrophobicContact CE2-CD1 4.02Å; F329-L348 HydrophobicContact CE2-CD2 4.25Å; F329-L348 HydrophobicContact CG-CD2 4.08Å; F329-L348 HydrophobicContact CZ-CD2 4.33Å; F329-H352 HydrophobicContact CE1-CB 4.03Å; F329-H352 HydrophobicContact CZ-CB 4.24Å; F329-D355 HydrophobicContact CZ-CB 4.24Å; F329-I356 HydrophobicContact CZ-CG1 4.4Å; F329-L359 HydrophobicContact CE2-CD1 4.11Å
330D87.8Confident88Confident154 Ų15474.6 Ų74.682%0.82438%0.376SS*.THydrogen-bonded Turntrans50.343.6-179.3-155.722.1000112.9T326T326-D330 WeakPolarHBondContact O-CA 3.37Å; T326-D330 PolarHBondContact O-N 3.17Å
331I88Confident88Confident24 Ų2472.1 Ų72.112%0.12336%0.364CS..PPolyproline II helixtrans-79.1138.9179-56.7175.4000107.8T326 F329 E333 N335 W344 L348T326-I331 HydrophobicContact CG2-CB 4.13Å; T326-I331 WeakPolarHBondContact CG2-O 3.5Å; T326-I331 PolarHBondContact O-N 3.42Å; F329-I331 HydrophobicContact CB-CD1 3.96Å; F329-I331 HydrophobicContact CB-CG1 3.83Å; F329-I331 PolarHBondContact O-N 3.33Å; I331-E333 PolarHBondContact O-N 3.18Å; I331-N335 HydrophobicContact CG2-CB 3.81Å; I331-W344 HydrophobicContact CD1-CE3 4.4Å; I331-W344 HydrophobicContact CD1-CZ3 4.32Å; I331-L348 HydrophobicContact CD1-CD1 4.34Å
332A85.1Confident87.8Confident60 Ų6077.3 Ų77.350%0.49639%0.392SS..PPolyproline II helixtrans-61138.5176.400000111.6R334 N335A332-R334 PolarHBondContact O-N 2.81Å; A332-N335 WeakPolarHBondContact O-CB 3.47Å; A332-N335 PolarHBondContact O-N 2.91Å; A332-N335 VanDerWaalsContact O-N 3.16Å
333E75.5Confident87.8Confident172 Ų17283.4 Ų83.480%0.80442%0.42SS*.THydrogen-bonded Turntrans-51.7135.6176.3-68.5-176.6178.400110.8I331 N335I331-E333 PolarHBondContact O-N 3.18Å; E333-N335 VanDerWaalsContact C-N 3.35Å; E333-N335 PolarHBondContact O-N 3.27Å
334R77.3Confident87.8Confident225 Ų22582 Ų8285%0.84941%0.407SS*.THydrogen-bonded Turntrans75.6-0.6-178.2-48.2176.5177.3-173.6-2.5117.2A332A332-R334 PolarHBondContact O-N 2.81Å
335N85.6Confident87.9Confident88 Ų8882.2 Ų82.247%0.47141%0.405SS..SBendtrans-71.2-36169.3-80.1-4.9000111.9I331 A332 E333 N340 W344I331-N335 HydrophobicContact CG2-CB 3.81Å; A332-N335 WeakPolarHBondContact O-CB 3.47Å; A332-N335 PolarHBondContact O-N 2.91Å; A332-N335 VanDerWaalsContact O-N 3.16Å; E333-N335 VanDerWaalsContact C-N 3.35Å; E333-N335 PolarHBondContact O-N 3.27Å; N335-N340 PolarHBondContact O-ND2 2.82Å; N335-W344 PolarHBondContact O-NE1 3.2Å
336M87.8Confident88Confident7 Ų786.9 Ų86.93%0.03443%0.429CS..SBendtrans-101.6124.5172-164-177.6-170.800108.8I322 L325 N340 Y341 W344I322-M336 HydrophobicContact CB-SD 4.34Å; I322-M336 HydrophobicContact CG1-CE 4.23Å; I322-M336 HydrophobicContact CG1-CG 4.11Å; I322-M336 HydrophobicContact CG1-SD 4.04Å; I322-M336 HydrophobicContact CG2-CB 4.05Å; I322-M336 HydrophobicContact CG2-CG 4.09Å; I322-M336 HydrophobicContact CG2-SD 4.13Å; L325-M336 HydrophobicContact CB-SD 4.24Å; L325-M336 HydrophobicContact CD1-CE 3.64Å; L325-M336 HydrophobicContact CD1-SD 4.17Å; M336-N340 WeakPolarHBondContact CA-OD1 3.26Å; M336-Y341 HydrophobicContact CE-CD2 3.28Å; M336-Y341 HydrophobicContact CE-CE2 3.67Å; M336-Y341 HydrophobicContact CE-CG 4.12Å; M336-W344 HydrophobicContact CE-CB 3.65Å; M336-W344 HydrophobicContact CG-CB 4.09Å; M336-W344 HydrophobicContact CG-CG 4.07Å; M336-W344 HydrophobicContact SD-CB 4.23Å
337T89.4Confident88Confident55 Ų5592.6 Ų92.634%0.33745%0.45SS..  trans-128.6168.2-179.865.40000109.3E339 N340 Y341T337-E339 PolarHBondContact O-N 3.06Å; T337-N340 PolarHBondContact N-OD1 2.72Å; T337-N340 PolarHBondContact O-N 3.46Å; T337-N340 PolarHBondContact O-OD1 3.1Å; T337-N340 PolarHBondContact OG1-OD1 3.3Å; T337-Y341 PolarHBondContact O-N 3.5Å; T337-Y341 VanDerWaalsContact O-N 3.08Å
338V87.2Confident88.1Confident47 Ų4787.5 Ų87.529%0.28542%0.423SS..G310 helixtrans-58.1-33.7177.7178.10000111.8L318 E319 I322L318-V338 HydrophobicContact CD1-CG1 3.8Å; E319-V338 HydrophobicContact CG-CG2 4.07Å; I322-V338 HydrophobicContact CD1-CG2 4.2Å
339E88.3Confident88.1Confident186 Ų18686.1 Ų86.187%0.86942%0.419SS*.G310 helixtrans-74-29.7-177.8-63.5179.417700113.9T337T337-E339 PolarHBondContact O-N 3.06Å
340N91.4Very high88.3Confident36 Ų3689.7 Ų89.719%0.19344%0.444CS..G310 helixtrans-108.610.1-178.272.210.8000112.9N335 M336 T337 D342 Q343 W344N335-N340 PolarHBondContact O-ND2 2.82Å; M336-N340 WeakPolarHBondContact CA-OD1 3.26Å; T337-N340 PolarHBondContact N-OD1 2.72Å; T337-N340 PolarHBondContact O-N 3.46Å; T337-N340 PolarHBondContact O-OD1 3.1Å; T337-N340 PolarHBondContact OG1-OD1 3.3Å; N340-D342 PolarHBondContact O-N 3.25Å; N340-Q343 PolarHBondContact O-N 3.43Å; N340-W344 PolarHBondContact O-N 3.41Å; N340-W344 VanDerWaalsContact O-N 3.1Å
341Y89.7Confident88.5Confident18 Ų1885.1 Ų85.17%0.07142%0.422CS..Hα-helixtrans-55.3-52.1-176.4174.9-96.8000112.2L318 N321 I322 L325 M336 T337 Q343 W344 F345L318-Y341 HydrophobicContact CD2-CD1 3.68Å; L318-Y341 HydrophobicContact CD2-CD2 4.42Å; L318-Y341 HydrophobicContact CD2-CE1 3.64Å; L318-Y341 HydrophobicContact CD2-CE2 4.41Å; L318-Y341 HydrophobicContact CD2-CG 4.08Å; N321-Y341 HydrophobicContact CB-CE2 3.84Å; N321-Y341 PolarHBondContact ND2-OH 3.43Å; I322-Y341 HydrophobicContact CD1-CD2 4.15Å; I322-Y341 HydrophobicContact CG1-CD2 3.55Å; I322-Y341 HydrophobicContact CG1-CE2 4.13Å; L325-Y341 HydrophobicContact CD1-CE2 4Å; M336-Y341 HydrophobicContact CE-CD2 3.28Å; M336-Y341 HydrophobicContact CE-CE2 3.67Å; M336-Y341 HydrophobicContact CE-CG 4.12Å; T337-Y341 PolarHBondContact O-N 3.5Å; T337-Y341 VanDerWaalsContact O-N 3.08Å; Y341-Q343 VanDerWaalsContact C-N 3.3Å; Y341-Q343 PolarHBondContact O-N 2.96Å; Y341-W344 PolarHBondContact O-N 3.11Å; Y341-F345 HydrophobicContact CE1-CB 4.36Å; Y341-F345 VanDerWaalsContact O-CB 3.29Å; Y341-F345 WeakPolarHBondContact O-CB 3.38Å; Y341-F345 PolarHBondContact O-N 3.37Å
342D89.7Confident88.7Confident112 Ų11288 Ų8860%0.59944%0.435SS*.Hα-helixtrans-61.3-40.1-176.3-62.8-33.8000111.7N340 F345 D346N340-D342 PolarHBondContact O-N 3.25Å; D342-F345 PolarHBondContact O-N 2.98Å; D342-D346 WeakPolarHBondContact O-CB 3.32Å; D342-D346 PolarHBondContact O-N 3.47Å
343Q91.6Very high88.8Confident145 Ų14588.7 Ų88.768%0.67843%0.434SS*.Hα-helixtrans-65.3-43.9178.9-63.3179.2-4.100111.9N340 Y341 Y347N340-Q343 PolarHBondContact O-N 3.43Å; Y341-Q343 VanDerWaalsContact C-N 3.3Å; Y341-Q343 PolarHBondContact O-N 2.96Å; Q343-Y347 WeakPolarHBondContact O-CB 3.34Å; Q343-Y347 PolarHBondContact O-N 3.02Å; Q343-Y347 VanDerWaalsContact O-N 3.08Å
344W89.9Confident89.4Confident73 Ų7383.1 Ų83.128%0.27742%0.422SS..Hα-helixtrans-68.3-40.4175.9-87.7106.7000112I331 N335 M336 N340 Y341 Y347 L348I331-W344 HydrophobicContact CD1-CE3 4.4Å; I331-W344 HydrophobicContact CD1-CZ3 4.32Å; N335-W344 PolarHBondContact O-NE1 3.2Å; M336-W344 HydrophobicContact CE-CB 3.65Å; M336-W344 HydrophobicContact CG-CB 4.09Å; M336-W344 HydrophobicContact CG-CG 4.07Å; M336-W344 HydrophobicContact SD-CB 4.23Å; N340-W344 PolarHBondContact O-N 3.41Å; N340-W344 VanDerWaalsContact O-N 3.1Å; Y341-W344 PolarHBondContact O-N 3.11Å; W344-Y347 HydrophobicContact CE3-CD1 4.07Å; W344-Y347 HydrophobicContact CZ3-CD1 4.09Å; W344-Y347 HydrophobicContact CZ3-CE1 4.23Å; W344-Y347 PolarHBondContact O-N 3.41Å; W344-L348 WeakPolarHBondContact O-CB 3.45Å; W344-L348 VanDerWaalsContact O-CG 3.28Å; W344-L348 WeakPolarHBondContact O-CG 3.48Å; W344-L348 PolarHBondContact O-N 3.44Å
345F90.8Very high89.9Confident53 Ų5375.6 Ų75.623%0.23240%0.399CS..Hα-helixtrans-61.3-47.8177.8-177.9-97.9000110.9L325 Y341 D342 Y347 L348 N349 I356 L361L325-F345 HydrophobicContact CD1-CD2 4.47Å; Y341-F345 HydrophobicContact CE1-CB 4.36Å; Y341-F345 VanDerWaalsContact O-CB 3.29Å; Y341-F345 WeakPolarHBondContact O-CB 3.38Å; Y341-F345 PolarHBondContact O-N 3.37Å; D342-F345 PolarHBondContact O-N 2.98Å; F345-Y347 PolarHBondContact O-N 2.83Å; F345-L348 PolarHBondContact O-N 3.14Å; F345-N349 WeakPolarHBondContact O-CB 3.29Å; F345-N349 PolarHBondContact O-N 3.27Å; F345-I356 HydrophobicContact CD2-CD1 4.28Å; F345-I356 HydrophobicContact CE2-CD1 4.09Å; F345-I356 HydrophobicContact CE2-CG2 4.11Å; F345-I356 HydrophobicContact CZ-CG2 4.23Å; F345-L361 HydrophobicContact CD2-CD1 4.4Å; F345-L361 HydrophobicContact CE2-CD1 3.64Å
346D92Very high90Very high98 Ų9872 Ų7252%0.52438%0.38SS..Hα-helixtrans-61-43.3176-75.8-19.1000111.9D342 N349 V350D342-D346 WeakPolarHBondContact O-CB 3.32Å; D342-D346 PolarHBondContact O-N 3.47Å; D346-N349 PolarHBondContact O-N 3.17Å; D346-V350 VanDerWaalsContact O-CG2 3.3Å; D346-V350 WeakPolarHBondContact O-CG2 3.45Å; D346-V350 PolarHBondContact O-N 3.09Å
347Y91.7Very high89.9Confident136 Ų13675.9 Ų75.953%0.53341%0.413SS..Hα-helixtrans-60.3-46.2176.2172.3-98.9000112.4Q343 W344 F345 V350 T351Q343-Y347 WeakPolarHBondContact O-CB 3.34Å; Q343-Y347 PolarHBondContact O-N 3.02Å; Q343-Y347 VanDerWaalsContact O-N 3.08Å; W344-Y347 HydrophobicContact CE3-CD1 4.07Å; W344-Y347 HydrophobicContact CZ3-CD1 4.09Å; W344-Y347 HydrophobicContact CZ3-CE1 4.23Å; W344-Y347 PolarHBondContact O-N 3.41Å; F345-Y347 PolarHBondContact O-N 2.83Å; Y347-V350 PolarHBondContact O-N 3.2Å; Y347-T351 HydrophobicContact CD2-CG2 4.38Å; Y347-T351 HydrophobicContact CE1-CG2 4.42Å; Y347-T351 HydrophobicContact CE2-CG2 3.94Å; Y347-T351 WeakPolarHBondContact O-CB 3.5Å; Y347-T351 WeakPolarHBondContact O-CG2 3.48Å; Y347-T351 PolarHBondContact O-N 2.88Å; Y347-T351 PolarHBondContact O-OG1 3.43Å
348L90.6Very high89.8Confident7 Ų777.4 Ų77.44%0.03743%0.426CS..Hα-helixtrans-70.6-36.6179.8-68.6171.9000111.9L325 F329 I331 W344 F345 V350 T351 H352 I356L325-L348 HydrophobicContact CD2-CD1 4.28Å; F329-L348 HydrophobicContact CD1-CD2 4.17Å; F329-L348 HydrophobicContact CD2-CD1 3.88Å; F329-L348 HydrophobicContact CD2-CD2 4.12Å; F329-L348 HydrophobicContact CE1-CD2 4.29Å; F329-L348 HydrophobicContact CE2-CD1 4.02Å; F329-L348 HydrophobicContact CE2-CD2 4.25Å; F329-L348 HydrophobicContact CG-CD2 4.08Å; F329-L348 HydrophobicContact CZ-CD2 4.33Å; I331-L348 HydrophobicContact CD1-CD1 4.34Å; W344-L348 WeakPolarHBondContact O-CB 3.45Å; W344-L348 VanDerWaalsContact O-CG 3.28Å; W344-L348 WeakPolarHBondContact O-CG 3.48Å; W344-L348 PolarHBondContact O-N 3.44Å; F345-L348 PolarHBondContact O-N 3.14Å; L348-V350 VanDerWaalsContact C-N 3.34Å; L348-V350 PolarHBondContact O-N 3.18Å; L348-T351 WeakPolarHBondContact CA-OG1 3.45Å; L348-T351 PolarHBondContact O-N 3.05Å; L348-T351 PolarHBondContact O-OG1 3.3Å; L348-H352 CarbonylContact O-C 3.21Å; L348-H352 WeakPolarHBondContact O-CA 3.32Å; L348-H352 PolarHBondContact O-N 2.98Å; L348-I356 HydrophobicContact CB-CD1 3.65Å; L348-I356 HydrophobicContact CB-CG1 4.36Å
349N92Very high89.9Confident66 Ų6676.3 Ų76.335%0.35342%0.418SS..Hα-helixtrans-65.7-37.3176.8-169.424000111.7F345 D346 P353 I356F345-N349 WeakPolarHBondContact O-CB 3.29Å; F345-N349 PolarHBondContact O-N 3.27Å; D346-N349 PolarHBondContact O-N 3.17Å; N349-P353 WeakPolarHBondContact O-CA 3.32Å; N349-P353 WeakPolarHBondContact O-CB 3.35Å; N349-I356 HydrophobicContact CB-CD1 4.35Å
350V93.4Very high89.9Confident121 Ų12172.6 Ų72.673%0.73341%0.41SS*.Hα-helixtrans-72.3-39.4175171.80000112D346 Y347 L348D346-V350 VanDerWaalsContact O-CG2 3.3Å; D346-V350 WeakPolarHBondContact O-CG2 3.45Å; D346-V350 PolarHBondContact O-N 3.09Å; Y347-V350 PolarHBondContact O-N 3.2Å; L348-V350 VanDerWaalsContact C-N 3.34Å; L348-V350 PolarHBondContact O-N 3.18Å
351T92.2Very high89.7Confident59 Ų5973 Ų7336%0.36241%0.412SS..Hα-helixtrans-80.7-38.1-176.549.10000113.5Y347 L348Y347-T351 HydrophobicContact CD2-CG2 4.38Å; Y347-T351 HydrophobicContact CE1-CG2 4.42Å; Y347-T351 HydrophobicContact CE2-CG2 3.94Å; Y347-T351 WeakPolarHBondContact O-CB 3.5Å; Y347-T351 WeakPolarHBondContact O-CG2 3.48Å; Y347-T351 PolarHBondContact O-N 2.88Å; Y347-T351 PolarHBondContact O-OG1 3.43Å; L348-T351 WeakPolarHBondContact CA-OG1 3.45Å; L348-T351 PolarHBondContact O-N 3.05Å; L348-T351 PolarHBondContact O-OG1 3.3Å
352H90.6Very high89.6Confident84 Ų8479.3 Ų79.339%0.38944%0.436SS..  trans-136.864.3-174.3-58.387.6000111.9F329 L348 G354 D355 I356F329-H352 HydrophobicContact CE1-CB 4.03Å; F329-H352 HydrophobicContact CZ-CB 4.24Å; L348-H352 CarbonylContact O-C 3.21Å; L348-H352 WeakPolarHBondContact O-CA 3.32Å; L348-H352 PolarHBondContact O-N 2.98Å; H352-G354 VanDerWaalsContact C-N 3.31Å; H352-G354 PolarHBondContact O-N 3.5Å; H352-D355 HydrophobicContact CB-CB 4.28Å; H352-D355 IonicContact CD2-OD2 3.73Å; H352-D355 PolarHBondContact O-N 2.89Å; H352-I356 WeakPolarHBondContact O-CG1 3.48Å; H352-I356 PolarHBondContact O-N 3.47Å
353P89.1Confident89.5Confident75 Ų7580.3 Ų80.349%0.48745%0.446SS..Hα-helixtrans-64-33.2-174.623.2-33.3000113.6N349 A357N349-P353 WeakPolarHBondContact O-CA 3.32Å; N349-P353 WeakPolarHBondContact O-CB 3.35Å; P353-A357 WeakPolarHBondContact O-CB 3.29Å; P353-A357 PolarHBondContact O-N 3.48Å
354G87.2Confident89.5Confident54 Ų5474.7 Ų74.756%0.55742%0.422SS*.Hα-helixtrans-68.7-40179.400000113H352 S358H352-G354 VanDerWaalsContact C-N 3.31Å; H352-G354 PolarHBondContact O-N 3.5Å; G354-S358 PolarHBondContact O-N 3.1Å
355D86.7Confident89.5Confident68 Ų6874.1 Ų74.136%0.36442%0.424SS..Hα-helixtrans-72.3-42.8-178.8-59.9-37.1000110.4F329 H352 A357 S358 L359F329-D355 HydrophobicContact CZ-CB 4.24Å; H352-D355 HydrophobicContact CB-CB 4.28Å; H352-D355 IonicContact CD2-OD2 3.73Å; H352-D355 PolarHBondContact O-N 2.89Å; D355-A357 VanDerWaalsContact C-N 3.34Å; D355-A357 PolarHBondContact O-N 2.94Å; D355-S358 PolarHBondContact O-N 3.36Å; D355-S358 VanDerWaalsContact O-N 3.08Å; D355-S358 PolarHBondContact O-OG 2.68Å; D355-L359 WeakPolarHBondContact O-CG 3.18Å; D355-L359 PolarHBondContact O-N 3.32Å
356I88.3Confident89.4Confident12 Ų1273.1 Ų73.16%0.06242%0.421CS..Hα-helixtrans-57-45.6174.3-69.2-116.6000111.5L325 F329 F345 L348 N349 H352 S358 L359 L361L325-I356 HydrophobicContact CD2-CD1 4.26Å; F329-I356 HydrophobicContact CZ-CG1 4.4Å; F345-I356 HydrophobicContact CD2-CD1 4.28Å; F345-I356 HydrophobicContact CE2-CD1 4.09Å; F345-I356 HydrophobicContact CE2-CG2 4.11Å; F345-I356 HydrophobicContact CZ-CG2 4.23Å; L348-I356 HydrophobicContact CB-CD1 3.65Å; L348-I356 HydrophobicContact CB-CG1 4.36Å; N349-I356 HydrophobicContact CB-CD1 4.35Å; H352-I356 WeakPolarHBondContact O-CG1 3.48Å; H352-I356 PolarHBondContact O-N 3.47Å; I356-S358 PolarHBondContact O-N 2.85Å; I356-L359 PolarHBondContact O-N 3.42Å; I356-L361 HydrophobicContact CG2-CD1 4.43Å
357A86.1Confident89.2Confident88 Ų8872.5 Ų72.573%0.72742%0.415SS*.Hα-helixtrans-65.7-22.2-179.900000113.3P353 D355P353-A357 WeakPolarHBondContact O-CB 3.29Å; P353-A357 PolarHBondContact O-N 3.48Å; D355-A357 VanDerWaalsContact C-N 3.34Å; D355-A357 PolarHBondContact O-N 2.94Å
358S88.2Confident89Confident87 Ų8770 Ų7061%0.60841%0.411SS*.Hα-helixtrans-87.2-17.5178.177.80000113.7G354 D355 I356G354-S358 PolarHBondContact O-N 3.1Å; D355-S358 PolarHBondContact O-N 3.36Å; D355-S358 VanDerWaalsContact O-N 3.08Å; D355-S358 PolarHBondContact O-OG 2.68Å; I356-S358 PolarHBondContact O-N 2.85Å
359L89.4Confident88.8Confident25 Ų2571.8 Ų71.813%0.13142%0.418CS..SBendtrans-79.5139.9-177.3-73.6170.6000111.4T324 L325 H328 F329 D355 I356 L361T324-L359 HydrophobicContact CG2-CD2 4.29Å; L325-L359 HydrophobicContact CD2-CD1 3.88Å; H328-L359 HydrophobicContact CB-CD1 4.31Å; H328-L359 HydrophobicContact CB-CD2 4.15Å; F329-L359 HydrophobicContact CE2-CD1 4.11Å; D355-L359 WeakPolarHBondContact O-CG 3.18Å; D355-L359 PolarHBondContact O-N 3.32Å; I356-L359 PolarHBondContact O-N 3.42Å; L359-L361 HydrophobicContact CB-CD2 4.4Å; L359-L361 HydrophobicContact CB-CG 4.06Å; L359-L361 PolarHBondContact O-N 2.95Å
360P87.4Confident88.5Confident108 Ų10869.2 Ų69.270%0.70141%0.405SS*.  trans-78.766.1178.434.2-36.1000111.2
361L88.1Confident88Confident43 Ų4367 Ų6723%0.22539%0.389CS..  trans-79137.8178.2-60.4178.2000111.1N321 T324 L325 F345 I356 L359N321-L361 HydrophobicContact CB-CD2 4.26Å; T324-L361 HydrophobicContact CG2-CD2 4.35Å; L325-L361 HydrophobicContact CD1-CD2 4.48Å; L325-L361 HydrophobicContact CD2-CD1 4.36Å; L325-L361 HydrophobicContact CD2-CD2 4.26Å; L325-L361 HydrophobicContact CG-CD2 4.08Å; F345-L361 HydrophobicContact CD2-CD1 4.4Å; F345-L361 HydrophobicContact CE2-CD1 3.64Å; I356-L361 HydrophobicContact CG2-CD1 4.43Å; L359-L361 HydrophobicContact CB-CD2 4.4Å; L359-L361 HydrophobicContact CB-CG 4.06Å; L359-L361 PolarHBondContact O-N 2.95Å
362R87.5Confident87.4Confident152 Ų15270 Ų7057%0.57440%0.399SS*.  trans-84.7141.3177.2-61.8-179.3-179.4-159.9-5.2110.1N321 C364N321-R362 PolarHBondContact ND2-O 3.49Å; N321-R362 PolarHBondContact OD1-N 3.08Å; R362-C364 PolarHBondContact O-N 3.28Å
363V87.3Confident86.1Confident133 Ų13368.3 Ų68.381%0.80640%0.397SS*.  trans-78.7109.1171.3-178.60000108.3
364C90Very high84.9Confident26 Ų2665.7 Ų65.718%0.17638%0.381CS..  trans-101.3106.7179.1-50.80000109F314 C317 L318 R362F314-C364 HydrophobicContact CD2-CB 4.26Å; F314-C364 HydrophobicContact CE2-CB 4.19Å; C317-C364 HydrophobicContact CB-CB 3.83Å; C317-C364 WeakPolarHBondContact CB-SG 3.3Å; C317-C364 VanDerWaalsContact SG-CA 3.54Å; C317-C364 WeakPolarHBondContact SG-CB 3.32Å; C317-C364 CovalentContact SG-SG 2.04Å; C317-C364 PolarHBondContact SG-SG 2.88Å; L318-C364 HydrophobicContact CD2-CB 3.87Å; L318-C364 HydrophobicContact CG-CB 4.24Å; R362-C364 PolarHBondContact O-N 3.28Å
365D90.8Very high83.7Confident62 Ų6265.9 Ų65.933%0.33237%0.374SS..  trans-128.4124.6175.9173.927.7000110.1Q367 N368 F369D365-Q367 VanDerWaalsContact C-N 3.3Å; D365-Q367 PolarHBondContact O-N 3.29Å; D365-Q367 PolarHBondContact OD1-N 3.5Å; D365-Q367 VanDerWaalsContact OD1-N 3.14Å; D365-N368 HydrophobicContact CB-CB 4.24Å; D365-N368 PolarHBondContact O-N 2.94Å; D365-N368 VanDerWaalsContact OD2-CG 3.28Å; D365-N368 PolarHBondContact OD2-N 3.49Å; D365-N368 PolarHBondContact OD2-ND2 3.41Å; D365-N368 VanDerWaalsContact OD2-ND2 3.14Å; D365-F369 WeakPolarHBondContact O-CD2 3.28Å; D365-F369 PolarHBondContact O-N 3.48Å
366L88.7Confident82.9Confident31 Ų3163.3 Ų63.316%0.16236%0.364CS..Hα-helixtrans-63.8-37-178.6-177.864.4000111.6A310 F314 F369 L370A310-L366 HydrophobicContact CB-CD1 4.05Å; F314-L366 HydrophobicContact CB-CD1 4.12Å; F314-L366 HydrophobicContact CD2-CB 4.1Å; F314-L366 HydrophobicContact CE2-CB 4.44Å; F314-L366 HydrophobicContact CG-CB 4.45Å; F314-L366 HydrophobicContact CG-CD1 4.45Å; L366-F369 PolarHBondContact O-N 3.27Å; L366-L370 HydrophobicContact CG-CD1 4.2Å; L366-L370 WeakPolarHBondContact O-CG 3.34Å; L366-L370 PolarHBondContact O-N 2.93Å
367Q87.9Confident82.5Confident86 Ų8663.2 Ų63.240%0.40236%0.364SS..Hα-helixtrans-64.8-45.3-178.5-172.760.138.100110.6Y234 D365 F369 L370 D371Y234-Q367 VanDerWaalsContact CE2-NE2 3.32Å; D365-Q367 VanDerWaalsContact C-N 3.3Å; D365-Q367 PolarHBondContact O-N 3.29Å; D365-Q367 PolarHBondContact OD1-N 3.5Å; D365-Q367 VanDerWaalsContact OD1-N 3.14Å; Q367-F369 VanDerWaalsContact C-N 3.25Å; Q367-F369 PolarHBondContact O-N 2.98Å; Q367-L370 CarbonylContact O-C 3.43Å; Q367-L370 WeakPolarHBondContact O-CB 3.45Å; Q367-L370 PolarHBondContact O-N 3.25Å; Q367-D371 PolarHBondContact NE2-OD1 3.19Å; Q367-D371 WeakPolarHBondContact O-CB 3.36Å; Q367-D371 PolarHBondContact O-N 3.07Å
368N87Confident82.3Confident84 Ų8459.3 Ų59.345%0.44933%0.331SS..Hα-helixtrans-56.9-36.6173.6-72.9-30.3000113.2D365 Q372D365-N368 HydrophobicContact CB-CB 4.24Å; D365-N368 PolarHBondContact O-N 2.94Å; D365-N368 VanDerWaalsContact OD2-CG 3.28Å; D365-N368 PolarHBondContact OD2-N 3.49Å; D365-N368 PolarHBondContact OD2-ND2 3.41Å; D365-N368 VanDerWaalsContact OD2-ND2 3.14Å; N368-Q372 VanDerWaalsContact O-CG 3.27Å; N368-Q372 WeakPolarHBondContact O-CG 3.49Å; N368-Q372 PolarHBondContact O-N 3.28Å; N368-Q372 VanDerWaalsContact O-N 3.15Å
369F87.3Confident82.1Confident43 Ų4355.5 Ų55.519%0.18930%0.304CS..Hα-helixtrans-72.5-29.1175.5-70.4-61.2000113.5A310 N313 F314 C317 D365 L366 Q367A310-F369 HydrophobicContact CB-CB 3.89Å; N313-F369 HydrophobicContact CB-CD1 4.05Å; N313-F369 HydrophobicContact CB-CE1 4.11Å; N313-F369 HydrophobicContact CB-CG 4.36Å; N313-F369 HydrophobicContact CB-CZ 4.46Å; F314-F369 HydrophobicContact CB-CD2 4.1Å; F314-F369 HydrophobicContact CB-CE2 4.28Å; F314-F369 HydrophobicContact CD2-CE2 4.49Å; C317-F369 HydrophobicContact CB-CE2 4.44Å; C317-F369 HydrophobicContact CB-CZ 4.29Å; D365-F369 WeakPolarHBondContact O-CD2 3.28Å; D365-F369 PolarHBondContact O-N 3.48Å; L366-F369 PolarHBondContact O-N 3.27Å; Q367-F369 VanDerWaalsContact C-N 3.25Å; Q367-F369 PolarHBondContact O-N 2.98Å
370L85.6Confident81.9Confident13 Ų1354.5 Ų54.57%0.06830%0.3CS..Hα-helixtrans-76.5-33.4173.4-70.7168.4000112Q43 Y234 A310 L366 Q367 Q372Q43-L370 PolarHBondContact NE2-O 3.45Å; Y234-L370 HydrophobicContact CD2-CB 4.04Å; Y234-L370 HydrophobicContact CD2-CD1 4.4Å; Y234-L370 HydrophobicContact CE2-CB 4.31Å; Y234-L370 HydrophobicContact CG-CB 4.48Å; A310-L370 HydrophobicContact CB-CD2 3.61Å; A310-L370 HydrophobicContact CB-CG 3.89Å; L366-L370 HydrophobicContact CG-CD1 4.2Å; L366-L370 WeakPolarHBondContact O-CG 3.34Å; L366-L370 PolarHBondContact O-N 2.93Å; Q367-L370 CarbonylContact O-C 3.43Å; Q367-L370 WeakPolarHBondContact O-CB 3.45Å; Q367-L370 PolarHBondContact O-N 3.25Å; L370-Q372 VanDerWaalsContact C-N 3.31Å
371D82.5Confident82.1Confident73 Ų7349.4 Ų49.439%0.3927%0.266SS..Hα-helixtrans-75-22.4178.1-65.9-17.7000112.1Y234 Q367 S373Y234-D371 VanDerWaalsContact CE2-OD1 3.29Å; Y234-D371 WeakPolarHBondContact CE2-OD1 3.28Å; Y234-D371 PolarHBondContact OH-OD1 3.37Å; Q367-D371 PolarHBondContact NE2-OD1 3.19Å; Q367-D371 WeakPolarHBondContact O-CB 3.36Å; Q367-D371 PolarHBondContact O-N 3.07Å; D371-S373 PolarHBondContact O-N 3.33Å
372Q79.1Confident82.2Confident123 Ų12348 Ų4858%0.57526%0.259SS*.  trans-64.295.9171.8-80.1172.319.800110.5Q43 N368 L370Q43-Q372 PolarHBondContact NE2-O 3.11Å; N368-Q372 VanDerWaalsContact O-CG 3.27Å; N368-Q372 WeakPolarHBondContact O-CG 3.49Å; N368-Q372 PolarHBondContact O-N 3.28Å; N368-Q372 VanDerWaalsContact O-N 3.15Å; L370-Q372 VanDerWaalsContact C-N 3.31Å
373S63.7Low82.2Confident49 Ų4941.1 Ų41.134%0.34323%0.234SC..PPolyproline II helixtrans-96.9141.2178.763.90000111.7Q43 D371Q43-S373 VanDerWaalsContact OE1-CB 3.22Å; D371-S373 PolarHBondContact O-N 3.33Å
374A63.5Low82.2Confident20 Ų2035.7 Ų35.717%0.16520%0.2CC..PPolyproline II helixtrans-92.7124.8163.100000108.8Y40 V383Y40-A374 WeakPolarHBondContact CD2-O 3.45Å; A374-V383 HydrophobicContact CB-CG2 3.34Å
375S62Low82.3Confident58 Ų5834.5 Ų34.541%0.40619%0.192SC..PPolyproline II helixtrans-79.1139.3-179.558.90000112.5Y40 T377 G378Y40-S375 VanDerWaalsContact CE2-CA 3.45Å; S375-T377 PolarHBondContact O-N 3.47Å; S375-G378 PolarHBondContact O-N 3.41Å; S375-G378 VanDerWaalsContact O-N 3.07Å
376G71.6Confident82.2Confident14 Ų1433.5 Ų33.514%0.14419%0.185CC..THydrogen-bonded Turntrans56.1-117.9167.600000113.5G378 L379G376-G378 PolarHBondContact O-N 3.05Å; G376-L379 PolarHBondContact O-N 2.95Å
377T79.6Confident82.1Confident10 Ų1032.1 Ų32.16%0.06118%0.178CC..THydrogen-bonded Turntrans-62.6-28.6-178.453.30000113W115 S375 L379 A380 F381W115-T377 HydrophobicContact CE3-CG2 4.22Å; W115-T377 HydrophobicContact CZ3-CG2 3.59Å; S375-T377 PolarHBondContact O-N 3.47Å; T377-L379 PolarHBondContact O-N 3.26Å; T377-A380 PolarHBondContact O-N 3.08Å; T377-F381 VanDerWaalsContact O-CD2 3.24Å; T377-F381 WeakPolarHBondContact O-CD2 3.49Å; T377-F381 PolarHBondContact O-N 3.18Å; T377-F381 VanDerWaalsContact O-N 3.09Å
378G82.1Confident82.2Confident5 Ų528.1 Ų28.15%0.05216%0.16CC..Hα-helixtrans-62-27.9-18000000113.9S375 G376 A380 I382 V383S375-G378 PolarHBondContact O-N 3.41Å; S375-G378 VanDerWaalsContact O-N 3.07Å; G376-G378 PolarHBondContact O-N 3.05Å; G378-A380 PolarHBondContact O-N 3.37Å; G378-I382 WeakPolarHBondContact O-CA 3.48Å; G378-I382 VanDerWaalsContact O-CB 3.22Å; G378-I382 WeakPolarHBondContact O-CB 3.36Å; G378-I382 PolarHBondContact O-N 2.82Å; G378-V383 PolarHBondContact O-N 3.46Å
379L82.6Confident82.3Confident7 Ų726.2 Ų26.24%0.03715%0.149CC..Iπ-helixtrans-64.9-39.9179.2-172.261.7000112W36 P39 I302 L306 G376 T377 V383 F384W36-L379 HydrophobicContact CB-CB 4.13Å; W36-L379 HydrophobicContact CB-CD2 4Å; W36-L379 HydrophobicContact CB-CG 4.48Å; W36-L379 WeakPolarHBondContact O-CD2 3.48Å; P39-L379 HydrophobicContact CB-CD2 4.11Å; I302-L379 HydrophobicContact CG2-CD1 4.28Å; I302-L379 HydrophobicContact CG2-CD2 4.14Å; I302-L379 HydrophobicContact CG2-CG 4.49Å; L306-L379 HydrophobicContact CD2-CD1 4.47Å; G376-L379 PolarHBondContact O-N 2.95Å; T377-L379 PolarHBondContact O-N 3.26Å; L379-V383 HydrophobicContact CD1-CB 4.08Å; L379-V383 HydrophobicContact CD1-CG1 4.11Å; L379-V383 HydrophobicContact CD1-CG2 4.32Å; L379-F384 WeakPolarHBondContact O-CB 3.1Å; L379-F384 PolarHBondContact O-N 3.31Å
380A86.5Confident82.2Confident5 Ų529.8 Ų29.84%0.04117%0.167CC..Iπ-helixtrans-85.5-40.9178.100000113.5W36 T377 G378 F401 L405W36-A380 HydrophobicContact CE3-CB 3.5Å; W36-A380 HydrophobicContact CZ3-CB 3.77Å; T377-A380 PolarHBondContact O-N 3.08Å; G378-A380 PolarHBondContact O-N 3.37Å; A380-F401 HydrophobicContact CB-CE1 4.2Å; A380-F401 HydrophobicContact CB-CZ 3.96Å; A380-L405 HydrophobicContact CB-CD1 4.1Å
381F91.8Very high82.1Confident0 Ų029.5 Ų29.50%017%0.165CC..Iπ-helixtrans-90.9-15.3-172.4-62.1-65.1000114.2W36 W115 V116 Y119 W157 T377 T385 F402W36-F381 HydrophobicContact CZ3-CE2 4.34Å; W115-F381 HydrophobicContact CB-CE1 4.02Å; W115-F381 HydrophobicContact CB-CE2 4.07Å; W115-F381 HydrophobicContact CB-CZ 3.53Å; W115-F381 HydrophobicContact CE3-CE2 4.07Å; V116-F381 HydrophobicContact CG2-CE1 4.24Å; V116-F381 HydrophobicContact CG2-CZ 3.89Å; Y119-F381 AromaticContact CD2-CD1 3.44Å; Y119-F381 HydrophobicContact CD2-CD1 3.44Å; Y119-F381 VanDerWaalsContact CD2-CD1 3.44Å; Y119-F381 AromaticContact CD2-CE1 3.68Å; Y119-F381 HydrophobicContact CD2-CE1 3.68Å; Y119-F381 HydrophobicContact CE1-CD1 4.44Å; Y119-F381 HydrophobicContact CE2-CB 4.18Å; Y119-F381 AromaticContact CE2-CD1 3.34Å; Y119-F381 HydrophobicContact CE2-CD1 3.34Å; Y119-F381 AromaticContact CE2-CE1 4Å; Y119-F381 HydrophobicContact CE2-CE1 4Å; Y119-F381 HydrophobicContact CE2-CG 4.03Å; Y119-F381 HydrophobicContact CG-CD1 4.03Å; Y119-F381 HydrophobicContact CG-CE1 4.31Å; Y119-F381 AromaticContact CZ-CD1 3.87Å; Y119-F381 PolarHBondContact OH-O 3.37Å; W157-F381 HydrophobicContact CD2-CB 4Å; W157-F381 HydrophobicContact CE3-CB 3.66Å; W157-F381 HydrophobicContact CE3-CD2 4.34Å; W157-F381 AromaticContact CE3-CG 3.95Å; W157-F381 HydrophobicContact CE3-CG 3.95Å; W157-F381 HydrophobicContact CH2-CB 4.21Å; W157-F381 AromaticContact CH2-CD2 3.39Å; W157-F381 HydrophobicContact CH2-CD2 3.39Å; W157-F381 AromaticContact CH2-CE2 3.86Å; W157-F381 HydrophobicContact CH2-CE2 3.86Å; W157-F381 AromaticContact CH2-CG 3.85Å; W157-F381 HydrophobicContact CH2-CG 3.85Å; W157-F381 HydrophobicContact CZ2-CD2 4.05Å; W157-F381 HydrophobicContact CZ3-CB 3.77Å; W157-F381 HydrophobicContact CZ3-CD1 4.03Å; W157-F381 AromaticContact CZ3-CD2 3.56Å; W157-F381 HydrophobicContact CZ3-CD2 3.56Å; W157-F381 HydrophobicContact CZ3-CE2 4.13Å; W157-F381 AromaticContact CZ3-CG 3.51Å; W157-F381 HydrophobicContact CZ3-CG 3.51Å; T377-F381 VanDerWaalsContact O-CD2 3.24Å; T377-F381 WeakPolarHBondContact O-CD2 3.49Å; T377-F381 PolarHBondContact O-N 3.18Å; T377-F381 VanDerWaalsContact O-N 3.09Å; F381-T385 PolarHBondContact O-OG1 3.48Å; F381-F402 AromaticContact CD1-CE1 3.99Å; F381-F402 HydrophobicContact CD1-CE1 3.99Å; F381-F402 AromaticContact CE1-CE1 3.91Å; F381-F402 HydrophobicContact CE1-CE1 3.91Å
382I90.3Very high82.3Confident13 Ų1330.7 Ų30.77%0.06718%0.177CC..Iπ-helixtrans-116.6-62.9178.5-54.5166.4000110.6V153 N154 W157 Y158 G378 F384 T385 E386V153-I382 HydrophobicContact CG1-CB 4.41Å; V153-I382 HydrophobicContact CG1-CG2 4.21Å; N154-I382 WeakPolarHBondContact OD1-CD1 3.34Å; N154-I382 WeakPolarHBondContact OD1-CG2 3.22Å; W157-I382 HydrophobicContact CB-CG1 4.23Å; W157-I382 HydrophobicContact CG-CD1 4.35Å; W157-I382 HydrophobicContact CG-CG1 4.19Å; Y158-I382 HydrophobicContact CE2-CD1 4.19Å; G378-I382 WeakPolarHBondContact O-CA 3.48Å; G378-I382 VanDerWaalsContact O-CB 3.22Å; G378-I382 WeakPolarHBondContact O-CB 3.36Å; G378-I382 PolarHBondContact O-N 2.82Å; I382-F384 PolarHBondContact O-N 2.95Å; I382-T385 WeakPolarHBondContact CA-OG1 3.38Å; I382-T385 PolarHBondContact N-OG1 3.45Å; I382-T385 PolarHBondContact O-OG1 3.36Å; I382-E386 WeakPolarHBondContact O-CB 3.36Å; I382-E386 PolarHBondContact O-N 3.17Å
383V87.2Confident82.9Confident9 Ų927.1 Ų27.16%0.05517%0.173CC..Iπ-helixtrans-66.4-46.5-172.1173.90000111.8L306 K309 A374 G378 L379 A387L306-V383 HydrophobicContact CD2-CG1 3.53Å; K309-V383 HydrophobicContact CD-CG1 4.25Å; A374-V383 HydrophobicContact CB-CG2 3.34Å; G378-V383 PolarHBondContact O-N 3.46Å; L379-V383 HydrophobicContact CD1-CB 4.08Å; L379-V383 HydrophobicContact CD1-CG1 4.11Å; L379-V383 HydrophobicContact CD1-CG2 4.32Å; V383-A387 PolarHBondContact O-N 3.08Å
384F87.3Confident84.2Confident18 Ų1826 Ų268%0.07917%0.165CC..Iπ-helixtrans-70.2-42.7-178-167.5-84.2000112.4F218 I305 L379 I382 E386 A387 V388 F401F218-F384 HydrophobicContact CD1-CE2 4.46Å; F218-F384 AromaticContact CD1-CZ 3.85Å; F218-F384 HydrophobicContact CD1-CZ 3.85Å; F218-F384 HydrophobicContact CE1-CE1 4.12Å; F218-F384 HydrophobicContact CE1-CE2 4.41Å; F218-F384 AromaticContact CE1-CZ 3.43Å; F218-F384 HydrophobicContact CE1-CZ 3.43Å; F218-F384 VanDerWaalsContact CE1-CZ 3.43Å; F218-F384 HydrophobicContact CE2-CZ 4.38Å; F218-F384 HydrophobicContact CZ-CE1 4.18Å; F218-F384 AromaticContact CZ-CZ 3.73Å; F218-F384 HydrophobicContact CZ-CZ 3.73Å; I305-F384 HydrophobicContact CD1-CD2 4.04Å; I305-F384 HydrophobicContact CD1-CE2 3.55Å; I305-F384 HydrophobicContact CD1-CZ 4.34Å; L379-F384 WeakPolarHBondContact O-CB 3.1Å; L379-F384 PolarHBondContact O-N 3.31Å; I382-F384 PolarHBondContact O-N 2.95Å; F384-E386 VanDerWaalsContact C-N 3.31Å; F384-E386 PolarHBondContact O-N 3.23Å; F384-A387 PolarHBondContact O-N 3.06Å; F384-V388 HydrophobicContact CD1-CG2 3.67Å; F384-V388 HydrophobicContact CE1-CG2 3.36Å; F384-V388 HydrophobicContact CZ-CG2 4.23Å; F384-V388 VanDerWaalsContact O-CG2 3.31Å; F384-V388 WeakPolarHBondContact O-CG2 3.39Å; F384-V388 PolarHBondContact O-N 3.45Å; F384-F401 HydrophobicContact CB-CE1 4.13Å; F384-F401 HydrophobicContact CB-CZ 3.92Å; F384-F401 HydrophobicContact CD1-CB 4.32Å; F384-F401 AromaticContact CD1-CD1 3.4Å; F384-F401 HydrophobicContact CD1-CD1 3.4Å; F384-F401 AromaticContact CD1-CD2 3.68Å; F384-F401 HydrophobicContact CD1-CD2 3.68Å; F384-F401 AromaticContact CD1-CE1 3.37Å; F384-F401 HydrophobicContact CD1-CE1 3.37Å; F384-F401 AromaticContact CD1-CE2 3.67Å; F384-F401 HydrophobicContact CD1-CE2 3.67Å; F384-F401 AromaticContact CD1-CG 3.54Å; F384-F401 HydrophobicContact CD1-CG 3.54Å; F384-F401 AromaticContact CD1-CZ 3.51Å; F384-F401 HydrophobicContact CD1-CZ 3.51Å; F384-F401 HydrophobicContact CD2-CD2 4.22Å; F384-F401 AromaticContact CD2-CE2 3.72Å; F384-F401 HydrophobicContact CD2-CE2 3.72Å; F384-F401 AromaticContact CD2-CZ 3.93Å; F384-F401 HydrophobicContact CD2-CZ 3.93Å; F384-F401 HydrophobicContact CE1-CB 3.51Å; F384-F401 AromaticContact CE1-CD1 3.5Å; F384-F401 HydrophobicContact CE1-CD1 3.5Å; F384-F401 VanDerWaalsContact CE1-CD1 3.5Å; F384-F401 AromaticContact CE1-CD2 3.18Å; F384-F401 HydrophobicContact CE1-CD2 3.18Å; F384-F401 AromaticContact CE1-CE1 3.9Å; F384-F401 HydrophobicContact CE1-CE1 3.9Å; F384-F401 AromaticContact CE1-CE2 3.64Å; F384-F401 HydrophobicContact CE1-CE2 3.64Å; F384-F401 AromaticContact CE1-CG 3.09Å; F384-F401 HydrophobicContact CE1-CG 3.09Å; F384-F401 AromaticContact CE1-CZ 3.95Å; F384-F401 HydrophobicContact CE1-CZ 3.95Å; F384-F401 AromaticContact CE2-CD2 3.77Å; F384-F401 HydrophobicContact CE2-CD2 3.77Å; F384-F401 AromaticContact CE2-CE2 3.66Å; F384-F401 HydrophobicContact CE2-CE2 3.66Å; F384-F401 HydrophobicContact CE2-CZ 4.31Å; F384-F401 HydrophobicContact CG-CD1 4.25Å; F384-F401 HydrophobicContact CG-CD2 4.16Å; F384-F401 AromaticContact CG-CE1 3.79Å; F384-F401 HydrophobicContact CG-CE1 3.79Å; F384-F401 AromaticContact CG-CE2 3.71Å; F384-F401 HydrophobicContact CG-CE2 3.71Å; F384-F401 HydrophobicContact CG-CG 4.41Å; F384-F401 AromaticContact CG-CZ 3.49Å; F384-F401 HydrophobicContact CG-CZ 3.49Å; F384-F401 VanDerWaalsContact CG-CZ 3.49Å; F384-F401 HydrophobicContact CZ-CB 4.07Å; F384-F401 HydrophobicContact CZ-CD1 4.38Å; F384-F401 AromaticContact CZ-CD2 3.21Å; F384-F401 HydrophobicContact CZ-CD2 3.21Å; F384-F401 AromaticContact CZ-CE2 3.6Å; F384-F401 HydrophobicContact CZ-CE2 3.6Å; F384-F401 AromaticContact CZ-CG 3.66Å; F384-F401 HydrophobicContact CZ-CG 3.66Å; F384-F401 HydrophobicContact CZ-CZ 4.3Å
385T91.5Very high85.7Confident2 Ų227.6 Ų27.61%0.01217%0.169CC..Hα-helixtrans-63.7-37.517845.30000111.9Y119 W130 V153 F381 I382 V388 L389 F402Y119-T385 HydrophobicContact CD1-CG2 4.09Å; Y119-T385 HydrophobicContact CE1-CG2 3.84Å; W130-T385 HydrophobicContact CZ2-CG2 4.44Å; V153-T385 WeakPolarHBondContact CG1-OG1 3.33Å; F381-T385 PolarHBondContact O-OG1 3.48Å; I382-T385 WeakPolarHBondContact CA-OG1 3.38Å; I382-T385 PolarHBondContact N-OG1 3.45Å; I382-T385 PolarHBondContact O-OG1 3.36Å; T385-V388 PolarHBondContact O-N 3.17Å; T385-L389 WeakPolarHBondContact O-CG 3.27Å; T385-L389 PolarHBondContact O-N 3.32Å; T385-F402 HydrophobicContact CG2-CE2 4.17Å; T385-F402 HydrophobicContact CG2-CZ 3.61Å
386E89.1Confident87.3Confident40 Ų4029.2 Ų29.219%0.18718%0.176CC..Hα-helixtrans-62.7-48.8171.6-171.6179.2163.200111.3V153 K309 I382 F384 V388 L389V153-E386 HydrophobicContact CG2-CB 4Å; V153-E386 HydrophobicContact CG2-CG 4.38Å; K309-E386 VanDerWaalsContact CE-CD 3.42Å; K309-E386 WeakPolarHBondContact CE-OE1 3.43Å; K309-E386 WeakPolarHBondContact CE-OE2 3.37Å; K309-E386 IonicContact NZ-OE1 2.8Å; K309-E386 PolarHBondContact NZ-OE1 3.16Å; K309-E386 IonicContact NZ-OE2 2.79Å; K309-E386 PolarHBondContact NZ-OE2 3.27Å; I382-E386 WeakPolarHBondContact O-CB 3.36Å; I382-E386 PolarHBondContact O-N 3.17Å; F384-E386 VanDerWaalsContact C-N 3.31Å; F384-E386 PolarHBondContact O-N 3.23Å; E386-V388 VanDerWaalsContact C-N 3.27Å; E386-V388 PolarHBondContact O-N 3.38Å; E386-L389 WeakPolarHBondContact O-CB 3.5Å; E386-L389 PolarHBondContact O-N 3.09Å; E386-L389 VanDerWaalsContact O-N 3.1Å
387A86.1Confident88.3Confident3 Ų330.6 Ų30.63%0.02518%0.177CC..Hα-helixtrans-62.6-32.7177.100000113.6I305 V383 F384 L389 E390 M391I305-A387 HydrophobicContact CG2-CB 3.18Å; V383-A387 PolarHBondContact O-N 3.08Å; F384-A387 PolarHBondContact O-N 3.06Å; A387-L389 VanDerWaalsContact C-N 3.28Å; A387-L389 PolarHBondContact O-N 3.21Å; A387-E390 PolarHBondContact O-N 3.38Å; A387-M391 HydrophobicContact CB-CE 4.48Å; A387-M391 WeakPolarHBondContact O-CG 3.3Å
388V89.1Confident89.1Confident2 Ų230.1 Ų30.11%0.01218%0.175CC..Hα-helixtrans-65.5-30.8176.3163.50000112L128 F384 T385 E386 E390 M391 S394 W397 A398L128-V388 HydrophobicContact CD1-CG1 4.39Å; F384-V388 HydrophobicContact CD1-CG2 3.67Å; F384-V388 HydrophobicContact CE1-CG2 3.36Å; F384-V388 HydrophobicContact CZ-CG2 4.23Å; F384-V388 VanDerWaalsContact O-CG2 3.31Å; F384-V388 WeakPolarHBondContact O-CG2 3.39Å; F384-V388 PolarHBondContact O-N 3.45Å; T385-V388 PolarHBondContact O-N 3.17Å; E386-V388 VanDerWaalsContact C-N 3.27Å; E386-V388 PolarHBondContact O-N 3.38Å; V388-E390 VanDerWaalsContact C-N 3.26Å; V388-E390 PolarHBondContact O-N 2.93Å; V388-M391 PolarHBondContact O-N 3.33Å; V388-S394 WeakPolarHBondContact CG1-O 3.07Å; V388-S394 WeakPolarHBondContact O-CB 3.21Å; V388-W397 HydrophobicContact CG1-CB 4.02Å; V388-W397 HydrophobicContact CG2-CB 4.23Å; V388-A398 HydrophobicContact CG1-CB 4.16Å
389L90.2Very high89.7Confident43 Ų4331.4 Ų31.423%0.22518%0.181CC..Hα-helixtrans-63.1-34.4177.1-66.3175.8000112.3L128 V153 T385 E386 A387 M391L128-L389 HydrophobicContact CB-CD2 4.23Å; L128-L389 HydrophobicContact CD1-CD2 4.02Å; V153-L389 HydrophobicContact CG2-CD1 3.84Å; T385-L389 WeakPolarHBondContact O-CG 3.27Å; T385-L389 PolarHBondContact O-N 3.32Å; E386-L389 WeakPolarHBondContact O-CB 3.5Å; E386-L389 PolarHBondContact O-N 3.09Å; E386-L389 VanDerWaalsContact O-N 3.1Å; A387-L389 VanDerWaalsContact C-N 3.28Å; A387-L389 PolarHBondContact O-N 3.21Å; L389-M391 PolarHBondContact O-N 3.09Å
390E84.3Confident90.4Very high119 Ų11933.2 Ų33.256%0.55619%0.191SC*.THydrogen-bonded Turntrans-75.8-10179.6-61.3-59.2146.900113.2F308 A387 V388F308-E390 HydrophobicContact CE1-CB 3.64Å; F308-E390 HydrophobicContact CE1-CG 4.07Å; F308-E390 HydrophobicContact CZ-CB 3.74Å; F308-E390 HydrophobicContact CZ-CG 4.31Å; A387-E390 PolarHBondContact O-N 3.38Å; V388-E390 VanDerWaalsContact C-N 3.26Å; V388-E390 PolarHBondContact O-N 2.93Å
391M84.3Confident90.7Very high6 Ų633.5 Ų33.53%0.0319%0.191CC..SBendtrans-92.9138.1-179.7-56.6-168.6-157.200111.5R221 L225 I305 A387 V388 L389 G393 S394 W397R221-M391 HydrophobicContact CG-SD 4.05Å; L225-M391 HydrophobicContact CD1-CE 3.75Å; I305-M391 HydrophobicContact CD1-CE 4.25Å; I305-M391 HydrophobicContact CG1-CE 4.27Å; A387-M391 HydrophobicContact CB-CE 4.48Å; A387-M391 WeakPolarHBondContact O-CG 3.3Å; V388-M391 PolarHBondContact O-N 3.33Å; L389-M391 PolarHBondContact O-N 3.09Å; M391-G393 PolarHBondContact O-N 2.86Å; M391-S394 PolarHBondContact O-N 3.49Å; M391-W397 HydrophobicContact SD-CD2 4.5Å
392P87.4Confident91Very high98 Ų9833.5 Ų33.564%0.63619%0.191SC*.THydrogen-bonded Turntrans-63134.7174.127.2-33.6000110.3W397P392-W397 PolarHBondContact O-NE1 3.17Å
393G90.1Very high91.2Very high49 Ų4934.6 Ų34.651%0.50520%0.198SC..THydrogen-bonded Turntrans71.336.5-175.100000113.5M391 Q395 V396M391-G393 PolarHBondContact O-N 2.86Å; G393-Q395 PolarHBondContact O-N 3.43Å; G393-V396 PolarHBondContact O-N 3.19Å
394S92.1Very high91.6Very high25 Ų2534.3 Ų34.318%0.17520%0.197CC..Hα-helixtrans-43-36.2-176.758.10000115.1V388 M391 V396 W397 A398V388-S394 WeakPolarHBondContact CG1-O 3.07Å; V388-S394 WeakPolarHBondContact O-CB 3.21Å; M391-S394 PolarHBondContact O-N 3.49Å; S394-V396 PolarHBondContact O-N 3.49Å; S394-W397 PolarHBondContact O-N 3.01Å; S394-A398 WeakPolarHBondContact O-CB 3.36Å; S394-A398 PolarHBondContact O-N 2.88Å
395Q94.6Very high92Very high54 Ų5433.5 Ų33.525%0.25219%0.193SC..Hα-helixtrans-57.6-43.4176.3-55.3-177.6-75.900113.6Q125 N126 L128 G393 A398 V399Q125-Q395 PolarHBondContact O-NE2 3.49Å; N126-Q395 VanDerWaalsContact N-NE2 3.18Å; L128-Q395 HydrophobicContact CD2-CG 4.27Å; L128-Q395 HydrophobicContact CG-CG 4.32Å; G393-Q395 PolarHBondContact O-N 3.43Å; Q395-A398 PolarHBondContact O-N 3.33Å; Q395-V399 WeakPolarHBondContact O-CG2 3.39Å; Q395-V399 PolarHBondContact O-N 3.37Å
396V94.6Very high92.2Very high91 Ų9134.8 Ų34.855%0.55220%0.2SC*.Hα-helixtrans-67-42.7-177.4178.40000110G393 S394 V399 L400G393-V396 PolarHBondContact O-N 3.19Å; S394-V396 PolarHBondContact O-N 3.49Å; V396-V399 PolarHBondContact O-N 3.11Å; V396-L400 HydrophobicContact CG1-CD1 4.13Å; V396-L400 WeakPolarHBondContact O-CB 2.84Å; V396-L400 WeakPolarHBondContact O-CG 3.44Å; V396-L400 PolarHBondContact O-N 3.09Å
397W93.8Very high92.5Very high43 Ų4333.4 Ų33.416%0.16319%0.194CC..Hα-helixtrans-63.5-43.5176.2-59.5106.9000111.4I217 F218 R221 V388 M391 P392 S394 L400 F401I217-W397 HydrophobicContact CG2-CH2 4.4Å; I217-W397 HydrophobicContact CG2-CZ3 3.93Å; F218-W397 HydrophobicContact CD1-CE3 4.08Å; F218-W397 HydrophobicContact CD1-CZ3 4.36Å; F218-W397 HydrophobicContact CE1-CB 4.38Å; F218-W397 HydrophobicContact CE1-CD2 4.43Å; F218-W397 AromaticContact CE1-CE3 3.54Å; F218-W397 HydrophobicContact CE1-CE3 3.54Å; F218-W397 HydrophobicContact CE1-CZ3 4.25Å; F218-W397 HydrophobicContact CZ-CB 4.43Å; F218-W397 AromaticContact CZ-CE3 3.97Å; F218-W397 HydrophobicContact CZ-CE3 3.97Å; F218-W397 WeakPolarHBondContact CZ-O 3.49Å; R221-W397 HydrophobicContact CB-CH2 3.55Å; R221-W397 HydrophobicContact CB-CZ2 4.36Å; R221-W397 HydrophobicContact CB-CZ3 3.77Å; R221-W397 HydrophobicContact CG-CH2 3.52Å; R221-W397 HydrophobicContact CG-CZ2 3.85Å; R221-W397 HydrophobicContact CG-CZ3 3.89Å; V388-W397 HydrophobicContact CG1-CB 4.02Å; V388-W397 HydrophobicContact CG2-CB 4.23Å; M391-W397 HydrophobicContact SD-CD2 4.5Å; P392-W397 PolarHBondContact O-NE1 3.17Å; S394-W397 PolarHBondContact O-N 3.01Å; W397-L400 PolarHBondContact O-N 3.34Å; W397-F401 VanDerWaalsContact O-CB 3.3Å; W397-F401 WeakPolarHBondContact O-CB 3.08Å; W397-F401 PolarHBondContact O-N 3.04Å
398A95.3Very high92.9Very high1 Ų133.6 Ų33.61%0.00820%0.195CC..Hα-helixtrans-59.5-49.7175.800000111.8L128 W130 V388 S394 Q395 L400 F401 F402L128-A398 HydrophobicContact CD1-CB 4.37Å; L128-A398 HydrophobicContact CD2-CB 4.38Å; W130-A398 HydrophobicContact CH2-CB 4.45Å; W130-A398 HydrophobicContact CZ2-CB 4.01Å; V388-A398 HydrophobicContact CG1-CB 4.16Å; S394-A398 WeakPolarHBondContact O-CB 3.36Å; S394-A398 PolarHBondContact O-N 2.88Å; Q395-A398 PolarHBondContact O-N 3.33Å; A398-L400 PolarHBondContact O-N 3.2Å; A398-F401 PolarHBondContact O-N 3.43Å; A398-F402 HydrophobicContact CB-CD2 4.47Å; A398-F402 HydrophobicContact CB-CE2 4.45Å; A398-F402 WeakPolarHBondContact O-CD2 3.41Å; A398-F402 PolarHBondContact O-N 3.27Å
399V96.5Very high93.2Very high32 Ų3233.5 Ų33.519%0.19419%0.194CC..Hα-helixtrans-59.1-48.8178.4171.90000111.2F120 F124 Q395 V396 F401 F402 V403F120-V399 HydrophobicContact CE2-CG1 4.23Å; F124-V399 HydrophobicContact CD1-CG2 4.33Å; F124-V399 HydrophobicContact CE1-CG1 4.44Å; F124-V399 HydrophobicContact CE1-CG2 4.05Å; F124-V399 HydrophobicContact CZ-CG1 4.28Å; F124-V399 HydrophobicContact CZ-CG2 4.18Å; Q395-V399 WeakPolarHBondContact O-CG2 3.39Å; Q395-V399 PolarHBondContact O-N 3.37Å; V396-V399 PolarHBondContact O-N 3.11Å; V399-F401 VanDerWaalsContact C-N 3.33Å; V399-F401 PolarHBondContact O-N 2.89Å; V399-F402 PolarHBondContact O-N 3.18Å; V399-V403 HydrophobicContact CG1-CG2 4.31Å; V399-V403 WeakPolarHBondContact O-CB 3.42Å; V399-V403 WeakPolarHBondContact O-CG2 3.38Å; V399-V403 PolarHBondContact O-N 2.87Å
400L95.5Very high93.4Very high44 Ų4432.1 Ų32.123%0.2319%0.187CC..Hα-helixtrans-59.8-44.3179-72.9174.5000111.7V214 F218 V396 W397 A398 M404V214-L400 HydrophobicContact CG1-CB 4.16Å; V214-L400 HydrophobicContact CG2-CD2 4.46Å; F218-L400 HydrophobicContact CE2-CB 4.23Å; V396-L400 HydrophobicContact CG1-CD1 4.13Å; V396-L400 WeakPolarHBondContact O-CB 2.84Å; V396-L400 WeakPolarHBondContact O-CG 3.44Å; V396-L400 PolarHBondContact O-N 3.09Å; W397-L400 PolarHBondContact O-N 3.34Å; A398-L400 PolarHBondContact O-N 3.2Å; L400-M404 WeakPolarHBondContact O-CB 3.34Å; L400-M404 PolarHBondContact O-N 3.4Å
401F94.7Very high93.9Very high11 Ų1126.6 Ų26.65%0.04816%0.161CC..Hα-helixtrans-62.6-50.9179.8179.6-112.9000112.4F218 A380 F384 W397 A398 V399 V403 M404 L405F218-F401 HydrophobicContact CE2-CB 4.05Å; F218-F401 HydrophobicContact CZ-CB 3.84Å; A380-F401 HydrophobicContact CB-CE1 4.2Å; A380-F401 HydrophobicContact CB-CZ 3.96Å; F384-F401 HydrophobicContact CB-CE1 4.13Å; F384-F401 HydrophobicContact CB-CZ 3.92Å; F384-F401 HydrophobicContact CD1-CB 4.32Å; F384-F401 AromaticContact CD1-CD1 3.4Å; F384-F401 HydrophobicContact CD1-CD1 3.4Å; F384-F401 AromaticContact CD1-CD2 3.68Å; F384-F401 HydrophobicContact CD1-CD2 3.68Å; F384-F401 AromaticContact CD1-CE1 3.37Å; F384-F401 HydrophobicContact CD1-CE1 3.37Å; F384-F401 AromaticContact CD1-CE2 3.67Å; F384-F401 HydrophobicContact CD1-CE2 3.67Å; F384-F401 AromaticContact CD1-CG 3.54Å; F384-F401 HydrophobicContact CD1-CG 3.54Å; F384-F401 AromaticContact CD1-CZ 3.51Å; F384-F401 HydrophobicContact CD1-CZ 3.51Å; F384-F401 HydrophobicContact CD2-CD2 4.22Å; F384-F401 AromaticContact CD2-CE2 3.72Å; F384-F401 HydrophobicContact CD2-CE2 3.72Å; F384-F401 AromaticContact CD2-CZ 3.93Å; F384-F401 HydrophobicContact CD2-CZ 3.93Å; F384-F401 HydrophobicContact CE1-CB 3.51Å; F384-F401 AromaticContact CE1-CD1 3.5Å; F384-F401 HydrophobicContact CE1-CD1 3.5Å; F384-F401 VanDerWaalsContact CE1-CD1 3.5Å; F384-F401 AromaticContact CE1-CD2 3.18Å; F384-F401 HydrophobicContact CE1-CD2 3.18Å; F384-F401 AromaticContact CE1-CE1 3.9Å; F384-F401 HydrophobicContact CE1-CE1 3.9Å; F384-F401 AromaticContact CE1-CE2 3.64Å; F384-F401 HydrophobicContact CE1-CE2 3.64Å; F384-F401 AromaticContact CE1-CG 3.09Å; F384-F401 HydrophobicContact CE1-CG 3.09Å; F384-F401 AromaticContact CE1-CZ 3.95Å; F384-F401 HydrophobicContact CE1-CZ 3.95Å; F384-F401 AromaticContact CE2-CD2 3.77Å; F384-F401 HydrophobicContact CE2-CD2 3.77Å; F384-F401 AromaticContact CE2-CE2 3.66Å; F384-F401 HydrophobicContact CE2-CE2 3.66Å; F384-F401 HydrophobicContact CE2-CZ 4.31Å; F384-F401 HydrophobicContact CG-CD1 4.25Å; F384-F401 HydrophobicContact CG-CD2 4.16Å; F384-F401 AromaticContact CG-CE1 3.79Å; F384-F401 HydrophobicContact CG-CE1 3.79Å; F384-F401 AromaticContact CG-CE2 3.71Å; F384-F401 HydrophobicContact CG-CE2 3.71Å; F384-F401 HydrophobicContact CG-CG 4.41Å; F384-F401 AromaticContact CG-CZ 3.49Å; F384-F401 HydrophobicContact CG-CZ 3.49Å; F384-F401 VanDerWaalsContact CG-CZ 3.49Å; F384-F401 HydrophobicContact CZ-CB 4.07Å; F384-F401 HydrophobicContact CZ-CD1 4.38Å; F384-F401 AromaticContact CZ-CD2 3.21Å; F384-F401 HydrophobicContact CZ-CD2 3.21Å; F384-F401 AromaticContact CZ-CE2 3.6Å; F384-F401 HydrophobicContact CZ-CE2 3.6Å; F384-F401 AromaticContact CZ-CG 3.66Å; F384-F401 HydrophobicContact CZ-CG 3.66Å; F384-F401 HydrophobicContact CZ-CZ 4.3Å; W397-F401 VanDerWaalsContact O-CB 3.3Å; W397-F401 WeakPolarHBondContact O-CB 3.08Å; W397-F401 PolarHBondContact O-N 3.04Å; A398-F401 PolarHBondContact O-N 3.43Å; V399-F401 VanDerWaalsContact C-N 3.33Å; V399-F401 PolarHBondContact O-N 2.89Å; F401-V403 PolarHBondContact O-N 3.1Å; F401-M404 HydrophobicContact CD2-CE 3.48Å; F401-M404 VanDerWaalsContact CD2-CE 3.48Å; F401-M404 HydrophobicContact CE2-CE 3.81Å; F401-M404 WeakPolarHBondContact O-CB 3.29Å; F401-M404 PolarHBondContact O-N 3.46Å; F401-L405 HydrophobicContact CD1-CD1 3.99Å; F401-L405 HydrophobicContact CD1-CG 4.48Å; F401-L405 HydrophobicContact CE1-CD1 3.41Å; F401-L405 VanDerWaalsContact CE1-CD1 3.41Å; F401-L405 HydrophobicContact CE1-CG 4.18Å; F401-L405 HydrophobicContact CE2-CD1 4.24Å; F401-L405 HydrophobicContact CE2-CD2 4.31Å; F401-L405 HydrophobicContact CE2-CG 4.23Å; F401-L405 HydrophobicContact CZ-CD1 3.56Å; F401-L405 HydrophobicContact CZ-CD2 4.27Å; F401-L405 HydrophobicContact CZ-CG 4.05Å; F401-L405 WeakPolarHBondContact O-CG 3.34Å; F401-L405 PolarHBondContact O-N 3.36Å
402F96.2Very high94.4Very high1 Ų126.6 Ų26.60%0.00416%0.162CC..Hα-helixtrans-71.1-30.1-177.4-69.6-64.5000112.8V116 Y119 F120 W130 F381 T385 A398 V399 L405 L406V116-F402 HydrophobicContact CG1-CB 4.26Å; V116-F402 HydrophobicContact CG1-CD1 4.23Å; V116-F402 WeakPolarHBondContact CG1-O 3.09Å; Y119-F402 VanDerWaalsContact CB-CE1 3.4Å; Y119-F402 HydrophobicContact CD1-CE1 4.05Å; Y119-F402 AromaticContact CD1-CE2 3.79Å; Y119-F402 HydrophobicContact CD1-CE2 3.79Å; Y119-F402 AromaticContact CD1-CZ 3.34Å; Y119-F402 HydrophobicContact CD1-CZ 3.34Å; Y119-F402 HydrophobicContact CD2-CE1 4.47Å; Y119-F402 HydrophobicContact CE1-CZ 4.24Å; Y119-F402 HydrophobicContact CG-CD1 4.46Å; Y119-F402 AromaticContact CG-CE1 3.75Å; Y119-F402 HydrophobicContact CG-CE1 3.75Å; Y119-F402 HydrophobicContact CG-CE2 4.07Å; Y119-F402 AromaticContact CG-CZ 3.52Å; Y119-F402 HydrophobicContact CG-CZ 3.52Å; F120-F402 HydrophobicContact CB-CB 4Å; W130-F402 HydrophobicContact CH2-CE2 4.11Å; W130-F402 HydrophobicContact CZ2-CE2 4.27Å; F381-F402 AromaticContact CD1-CE1 3.99Å; F381-F402 HydrophobicContact CD1-CE1 3.99Å; F381-F402 AromaticContact CE1-CE1 3.91Å; F381-F402 HydrophobicContact CE1-CE1 3.91Å; T385-F402 HydrophobicContact CG2-CE2 4.17Å; T385-F402 HydrophobicContact CG2-CZ 3.61Å; A398-F402 HydrophobicContact CB-CD2 4.47Å; A398-F402 HydrophobicContact CB-CE2 4.45Å; A398-F402 WeakPolarHBondContact O-CD2 3.41Å; A398-F402 PolarHBondContact O-N 3.27Å; V399-F402 PolarHBondContact O-N 3.18Å; F402-L405 HydrophobicContact CD1-CD1 4.11Å; F402-L405 HydrophobicContact CE1-CD1 4.32Å; F402-L405 PolarHBondContact O-N 3.42Å; F402-L406 VanDerWaalsContact O-CB 3.3Å; F402-L406 WeakPolarHBondContact O-CB 3.37Å; F402-L406 PolarHBondContact O-N 2.98Å
403V96.1Very high94.8Very high36 Ų3621.9 Ų21.922%0.21813%0.132CC..Hα-helixtrans-69.1-37.1171.41800000111.4F120 F210 V399 F401 L406 S407F120-V403 HydrophobicContact CD2-CG2 3.58Å; F120-V403 HydrophobicContact CE2-CG2 3.28Å; F120-V403 HydrophobicContact CZ-CG2 4.24Å; F210-V403 HydrophobicContact CD1-CG1 4.08Å; F210-V403 HydrophobicContact CE1-CB 3.93Å; F210-V403 HydrophobicContact CE1-CG1 3.37Å; F210-V403 HydrophobicContact CZ-CB 4.47Å; F210-V403 HydrophobicContact CZ-CG1 3.93Å; V399-V403 HydrophobicContact CG1-CG2 4.31Å; V399-V403 WeakPolarHBondContact O-CB 3.42Å; V399-V403 WeakPolarHBondContact O-CG2 3.38Å; V399-V403 PolarHBondContact O-N 2.87Å; F401-V403 PolarHBondContact O-N 3.1Å; V403-L406 PolarHBondContact O-N 2.86Å; V403-S407 WeakPolarHBondContact O-CB 3.41Å; V403-S407 PolarHBondContact O-N 2.84Å; V403-S407 PolarHBondContact O-OG 3.5Å
404M95.4Very high95Very high3 Ų319.7 Ų19.72%0.01511%0.108CC..Hα-helixtrans-61.6-49.1172.1169.4-174.675.800111.3L35 P211 V214 L215 L400 F401 L406 S407 L408L35-M404 HydrophobicContact CD1-CE 3.59Å; L35-M404 HydrophobicContact CD1-SD 4.09Å; P211-M404 HydrophobicContact CB-CG 3.99Å; V214-M404 HydrophobicContact CB-CB 3.94Å; V214-M404 HydrophobicContact CB-CG 4.23Å; V214-M404 HydrophobicContact CB-SD 3.94Å; V214-M404 HydrophobicContact CG1-CB 3.73Å; V214-M404 HydrophobicContact CG1-CG 4.21Å; V214-M404 HydrophobicContact CG1-SD 3.67Å; V214-M404 HydrophobicContact CG2-CB 4.31Å; L215-M404 HydrophobicContact CD2-CE 4.13Å; L215-M404 HydrophobicContact CD2-SD 3.55Å; L215-M404 VanDerWaalsContact CD2-SD 3.55Å; L215-M404 HydrophobicContact CG-SD 3.58Å; L215-M404 VanDerWaalsContact CG-SD 3.58Å; L400-M404 WeakPolarHBondContact O-CB 3.34Å; L400-M404 PolarHBondContact O-N 3.4Å; F401-M404 HydrophobicContact CD2-CE 3.48Å; F401-M404 VanDerWaalsContact CD2-CE 3.48Å; F401-M404 HydrophobicContact CE2-CE 3.81Å; F401-M404 WeakPolarHBondContact O-CB 3.29Å; F401-M404 PolarHBondContact O-N 3.46Å; M404-L406 VanDerWaalsContact C-N 3.3Å; M404-L406 PolarHBondContact O-N 3.17Å; M404-S407 WeakPolarHBondContact O-CB 3.25Å; M404-S407 PolarHBondContact O-N 3.29Å; M404-L408 HydrophobicContact CG-CD1 4.21Å; M404-L408 WeakPolarHBondContact O-CG 3.35Å; M404-L408 PolarHBondContact O-N 3.42Å
405L95.1Very high95.1Very high1 Ų118.5 Ų18.51%0.00510%0.1CC..Hα-helixtrans-60.4-40.1177-68.8-174.7000112I32 L35 V116 A380 F401 F402 S407 L408 G409I32-L405 HydrophobicContact CG2-CD2 3.82Å; L35-L405 HydrophobicContact CD1-CD2 4.02Å; V116-L405 HydrophobicContact CG1-CB 3.86Å; V116-L405 HydrophobicContact CG2-CB 3.92Å; V116-L405 HydrophobicContact CG2-CD1 4.19Å; A380-L405 HydrophobicContact CB-CD1 4.1Å; F401-L405 HydrophobicContact CD1-CD1 3.99Å; F401-L405 HydrophobicContact CD1-CG 4.48Å; F401-L405 HydrophobicContact CE1-CD1 3.41Å; F401-L405 VanDerWaalsContact CE1-CD1 3.41Å; F401-L405 HydrophobicContact CE1-CG 4.18Å; F401-L405 HydrophobicContact CE2-CD1 4.24Å; F401-L405 HydrophobicContact CE2-CD2 4.31Å; F401-L405 HydrophobicContact CE2-CG 4.23Å; F401-L405 HydrophobicContact CZ-CD1 3.56Å; F401-L405 HydrophobicContact CZ-CD2 4.27Å; F401-L405 HydrophobicContact CZ-CG 4.05Å; F401-L405 WeakPolarHBondContact O-CG 3.34Å; F401-L405 PolarHBondContact O-N 3.36Å; F402-L405 HydrophobicContact CD1-CD1 4.11Å; F402-L405 HydrophobicContact CE1-CD1 4.32Å; F402-L405 PolarHBondContact O-N 3.42Å; L405-S407 VanDerWaalsContact C-N 3.35Å; L405-S407 PolarHBondContact O-N 3.41Å; L405-L408 PolarHBondContact O-N 3.25Å; L405-G409 PolarHBondContact O-N 2.82Å
406L96Very high95.1Very high29 Ų2916.1 Ų16.115%0.1529%0.089CC..Hα-helixtrans-61.5-44.3175.9178.261.7000111I113 V116 L117 F402 V403 M404 G409 L410I113-L406 HydrophobicContact CG2-CD1 3.61Å; V116-L406 HydrophobicContact CG1-CB 3.95Å; L117-L406 HydrophobicContact CD2-CD1 3.93Å; L117-L406 HydrophobicContact CD2-CD2 3.89Å; L117-L406 HydrophobicContact CG-CD1 4.19Å; F402-L406 VanDerWaalsContact O-CB 3.3Å; F402-L406 WeakPolarHBondContact O-CB 3.37Å; F402-L406 PolarHBondContact O-N 2.98Å; V403-L406 PolarHBondContact O-N 2.86Å; M404-L406 VanDerWaalsContact C-N 3.3Å; M404-L406 PolarHBondContact O-N 3.17Å; L406-G409 PolarHBondContact O-N 3.44Å; L406-L410 HydrophobicContact CD1-CD1 4.1Å; L406-L410 HydrophobicContact CD1-CG 4.17Å; L406-L410 HydrophobicContact CG-CD1 4.03Å; L406-L410 HydrophobicContact CG-CG 4.5Å; L406-L410 WeakPolarHBondContact O-CB 3.15Å; L406-L410 VanDerWaalsContact O-CG 3.25Å; L406-L410 WeakPolarHBondContact O-CG 3.19Å; L406-L410 PolarHBondContact O-N 3.38Å
407S95.6Very high95.1Very high11 Ų1111.9 Ų11.98%0.0776%0.063CC..Hα-helixtrans-64.6-42.1179.8-60.20000112.5V403 M404 L405 S411V403-S407 WeakPolarHBondContact O-CB 3.41Å; V403-S407 PolarHBondContact O-N 2.84Å; V403-S407 PolarHBondContact O-OG 3.5Å; M404-S407 WeakPolarHBondContact O-CB 3.25Å; M404-S407 PolarHBondContact O-N 3.29Å; L405-S407 VanDerWaalsContact C-N 3.35Å; L405-S407 PolarHBondContact O-N 3.41Å; S407-S411 PolarHBondContact O-N 2.86Å; S407-S411 VanDerWaalsContact O-N 3.11Å; S407-S411 PolarHBondContact O-OG 3.15Å
408L94.6Very high95.2Very high7 Ų710 Ų104%0.0376%0.056CC..Hα-helixtrans-65-44.3173.8-70.8172000111.5V30 I32 L35 P211 M404 L405 S411 S412V30-L408 HydrophobicContact CG1-CD2 3.91Å; I32-L408 HydrophobicContact CG1-CB 4.22Å; L35-L408 HydrophobicContact CD1-CD1 3.29Å; L35-L408 HydrophobicContact CG-CD1 3.91Å; P211-L408 HydrophobicContact CB-CD1 4.26Å; P211-L408 HydrophobicContact CB-CD2 3.63Å; P211-L408 HydrophobicContact CB-CG 3.77Å; P211-L408 HydrophobicContact CG-CD2 3.68Å; P211-L408 HydrophobicContact CG-CG 3.71Å; M404-L408 HydrophobicContact CG-CD1 4.21Å; M404-L408 WeakPolarHBondContact O-CG 3.35Å; M404-L408 PolarHBondContact O-N 3.42Å; L405-L408 PolarHBondContact O-N 3.25Å; L408-S411 PolarHBondContact O-N 3.12Å; L408-S412 PolarHBondContact O-N 2.75Å; L408-S412 PolarHBondContact O-OG 3.28Å
409G95Very high95.1Very high0 Ų010 Ų100%06%0.056CC..Hα-helixtrans-58.8-49.4177.100000112.5Y109 I113 L405 L406 S411 S412 M413Y109-G409 WeakPolarHBondContact CE1-O 3.28Å; I113-G409 VanDerWaalsContact CD1-C 3.49Å; L405-G409 PolarHBondContact O-N 2.82Å; L406-G409 PolarHBondContact O-N 3.44Å; G409-S411 PolarHBondContact O-N 3.26Å; G409-S412 PolarHBondContact O-N 2.9Å; G409-M413 WeakPolarHBondContact O-CG 3.43Å; G409-M413 PolarHBondContact O-N 3.26Å
410L95Very high95Very high13 Ų138.7 Ų8.77%0.0685%0.048CC..Hα-helixtrans-61.6-42.3179-71.7172.6000112.1V188 I189 T207 L406 S412 M413 F414V188-L410 HydrophobicContact CG1-CD1 3.92Å; V188-L410 HydrophobicContact CG1-CD2 3.72Å; V188-L410 HydrophobicContact CG1-CG 4.5Å; I189-L410 HydrophobicContact CG1-CD2 4Å; T207-L410 HydrophobicContact CG2-CB 4.4Å; L406-L410 HydrophobicContact CD1-CD1 4.1Å; L406-L410 HydrophobicContact CD1-CG 4.17Å; L406-L410 HydrophobicContact CG-CD1 4.03Å; L406-L410 HydrophobicContact CG-CG 4.5Å; L406-L410 WeakPolarHBondContact O-CB 3.15Å; L406-L410 VanDerWaalsContact O-CG 3.25Å; L406-L410 WeakPolarHBondContact O-CG 3.19Å; L406-L410 PolarHBondContact O-N 3.38Å; L410-S412 PolarHBondContact O-N 2.92Å; L410-M413 PolarHBondContact O-N 3.21Å; L410-F414 HydrophobicContact CB-CE1 4.4Å; L410-F414 HydrophobicContact CB-CZ 4.34Å; L410-F414 WeakPolarHBondContact O-CD1 3.35Å; L410-F414 WeakPolarHBondContact O-CE1 3.05Å; L410-F414 VanDerWaalsContact O-CG 3.29Å; L410-F414 WeakPolarHBondContact O-CG 3.47Å; L410-F414 PolarHBondContact O-N 2.74Å; L410-F414 VanDerWaalsContact O-N 3.09Å
411S94.3Very high94.9Very high3 Ų36.6 Ų6.62%0.0214%0.038CC..Hα-helixtrans-62.1-41.2-179.8-56.80000112.3G27 T207 S407 L408 G409 F414G27-S411 CarbonylContact O-C 3.57Å; G27-S411 VanDerWaalsContact O-C 3.23Å; G27-S411 WeakPolarHBondContact O-CB 3.5Å; T207-S411 VanDerWaalsContact C-OG 3.31Å; T207-S411 WeakPolarHBondContact CB-OG 3.35Å; T207-S411 PolarHBondContact O-OG 3.2Å; T207-S411 PolarHBondContact OG1-OG 2.96Å; S407-S411 PolarHBondContact O-N 2.86Å; S407-S411 VanDerWaalsContact O-N 3.11Å; S407-S411 PolarHBondContact O-OG 3.15Å; L408-S411 PolarHBondContact O-N 3.12Å; G409-S411 PolarHBondContact O-N 3.26Å; S411-F414 WeakPolarHBondContact O-CB 3.42Å; S411-F414 PolarHBondContact O-N 3.49Å
412S94.5Very high94.7Very high6 Ų66.2 Ų6.24%0.0424%0.036CC..Hα-helixtrans-69.3-38.1175.4-44.80000112.3G27 F28 G31 Y109 L408 G409 L410 F414 G415 N416G27-S412 PolarHBondContact O-N 3.34Å; F28-S412 WeakPolarHBondContact CD2-O 3.38Å; G31-S412 WeakPolarHBondContact CA-OG 3.45Å; Y109-S412 WeakPolarHBondContact OH-CB 3.37Å; Y109-S412 PolarHBondContact OH-OG 2.77Å; L408-S412 PolarHBondContact O-N 2.75Å; L408-S412 PolarHBondContact O-OG 3.28Å; G409-S412 PolarHBondContact O-N 2.9Å; L410-S412 PolarHBondContact O-N 2.92Å; S412-F414 PolarHBondContact O-N 3.45Å; S412-G415 PolarHBondContact O-N 3.06Å; S412-N416 PolarHBondContact O-N 3.38Å
413M95.5Very high94.4Very high0 Ų06.3 Ų6.30%04%0.036CC..Hα-helixtrans-61.3-27.1176.2-75.1-58.5-65.400112.6S106 Y109 N110 I113 W186 I189 G409 L410 N416 I417S106-M413 WeakPolarHBondContact O-CE 3.44Å; Y109-M413 HydrophobicContact CD1-CG 3.89Å; Y109-M413 HydrophobicContact CD1-SD 3.71Å; Y109-M413 HydrophobicContact CE1-CG 4.39Å; Y109-M413 HydrophobicContact CG-SD 4.31Å; N110-M413 HydrophobicContact CB-CE 3.94Å; N110-M413 HydrophobicContact CB-SD 4.41Å; I113-M413 HydrophobicContact CD1-CG 3.51Å; W186-M413 HydrophobicContact CH2-CE 4.07Å; W186-M413 HydrophobicContact CZ3-CE 4.4Å; I189-M413 HydrophobicContact CD1-CB 3.97Å; I189-M413 HydrophobicContact CD1-CE 3.58Å; I189-M413 HydrophobicContact CD1-CG 3.93Å; I189-M413 HydrophobicContact CG1-CB 4.37Å; G409-M413 WeakPolarHBondContact O-CG 3.43Å; G409-M413 PolarHBondContact O-N 3.26Å; L410-M413 PolarHBondContact O-N 3.21Å; M413-N416 PolarHBondContact O-N 2.9Å; M413-I417 HydrophobicContact CE-CD1 4.35Å; M413-I417 HydrophobicContact CE-CG1 4.26Å; M413-I417 WeakPolarHBondContact O-CB 3.21Å; M413-I417 VanDerWaalsContact O-CG1 3.29Å; M413-I417 WeakPolarHBondContact O-CG1 3.16Å; M413-I417 PolarHBondContact O-N 3.46Å
414F94.9Very high94.2Very high2 Ų26.4 Ų6.41%0.0094%0.036CC..Hα-helixtrans-61.1-48.9174.9-61.7-13.2000112.3C192 F193 M200 A203 L410 S411 S412 N416 E418C192-F414 HydrophobicContact CB-CE1 3.51Å; C192-F414 HydrophobicContact CB-CZ 3.76Å; F193-F414 HydrophobicContact CD2-CD1 4.28Å; F193-F414 HydrophobicContact CE2-CB 4.11Å; F193-F414 AromaticContact CE2-CD1 3.53Å; F193-F414 HydrophobicContact CE2-CD1 3.53Å; F193-F414 HydrophobicContact CE2-CE1 4.33Å; F193-F414 HydrophobicContact CE2-CG 4.12Å; F193-F414 HydrophobicContact CZ-CB 4Å; F193-F414 HydrophobicContact CZ-CD1 4.26Å; F193-F414 HydrophobicContact CZ-CG 4.41Å; F193-F414 VanDerWaalsContact CZ-O 3.27Å; F193-F414 WeakPolarHBondContact CZ-O 3.39Å; M200-F414 HydrophobicContact CG-CB 3.88Å; M200-F414 HydrophobicContact CG-CD1 4.28Å; M200-F414 HydrophobicContact CG-CD2 3.61Å; M200-F414 HydrophobicContact CG-CE2 4.19Å; M200-F414 HydrophobicContact CG-CG 3.66Å; M200-F414 HydrophobicContact SD-CB 3.77Å; M200-F414 HydrophobicContact SD-CG 4.25Å; A203-F414 HydrophobicContact CB-CE2 4.02Å; A203-F414 HydrophobicContact CB-CZ 3.93Å; L410-F414 HydrophobicContact CB-CE1 4.4Å; L410-F414 HydrophobicContact CB-CZ 4.34Å; L410-F414 WeakPolarHBondContact O-CD1 3.35Å; L410-F414 WeakPolarHBondContact O-CE1 3.05Å; L410-F414 VanDerWaalsContact O-CG 3.29Å; L410-F414 WeakPolarHBondContact O-CG 3.47Å; L410-F414 PolarHBondContact O-N 2.74Å; L410-F414 VanDerWaalsContact O-N 3.09Å; S411-F414 WeakPolarHBondContact O-CB 3.42Å; S411-F414 PolarHBondContact O-N 3.49Å; S412-F414 PolarHBondContact O-N 3.45Å; F414-N416 PolarHBondContact O-N 2.84Å; F414-E418 WeakPolarHBondContact O-CB 3.43Å; F414-E418 PolarHBondContact O-N 3.13Å; F414-E418 VanDerWaalsContact O-N 3.09Å
415G94Very high93.8Very high0 Ų010.2 Ų10.20%05%0.054CC..Hα-helixtrans-68.7-34.7177.200000113.9F28 S412 G419F28-G415 VanDerWaalsContact CD2-CA 3.44Å; S412-G415 PolarHBondContact O-N 3.06Å; G415-G419 PolarHBondContact O-N 3.37Å
416N94.7Very high93.2Very high5 Ų512.7 Ų12.73%0.0277%0.065CC..Hα-helixtrans-65.6-44.8177.6-71.1-29.5000112.1F28 S106 S412 M413 F414 G419 V420F28-N416 WeakPolarHBondContact CE2-OD1 3.34Å; S106-N416 VanDerWaalsContact OG-CB 3.29Å; S106-N416 WeakPolarHBondContact OG-CB 3.42Å; S412-N416 PolarHBondContact O-N 3.38Å; M413-N416 PolarHBondContact O-N 2.9Å; F414-N416 PolarHBondContact O-N 2.84Å; N416-G419 PolarHBondContact O-N 3Å; N416-V420 WeakPolarHBondContact O-CG2 3.46Å; N416-V420 PolarHBondContact O-N 3.11Å
417I95Very high92.4Very high2 Ų213.3 Ų13.31%0.017%0.068CC..Hα-helixtrans-68-39.5178.8-67.2-65.8000111.1W186 I189 F193 M413 G419 V420 L421W186-I417 HydrophobicContact CH2-CD1 4.19Å; W186-I417 HydrophobicContact CZ3-CD1 3.82Å; I189-I417 HydrophobicContact CG2-CG1 4.01Å; F193-I417 HydrophobicContact CD1-CG2 4.23Å; F193-I417 HydrophobicContact CD2-CB 4.49Å; F193-I417 HydrophobicContact CD2-CG2 4.1Å; F193-I417 HydrophobicContact CE1-CG2 4.15Å; F193-I417 HydrophobicContact CE2-CB 3.94Å; F193-I417 HydrophobicContact CE2-CG2 3.97Å; F193-I417 HydrophobicContact CG-CG2 4.21Å; F193-I417 HydrophobicContact CZ-CB 4.03Å; F193-I417 HydrophobicContact CZ-CG2 4.04Å; M413-I417 HydrophobicContact CE-CD1 4.35Å; M413-I417 HydrophobicContact CE-CG1 4.26Å; M413-I417 WeakPolarHBondContact O-CB 3.21Å; M413-I417 VanDerWaalsContact O-CG1 3.29Å; M413-I417 WeakPolarHBondContact O-CG1 3.16Å; M413-I417 PolarHBondContact O-N 3.46Å; I417-G419 VanDerWaalsContact C-N 3.29Å; I417-G419 PolarHBondContact O-N 3.17Å; I417-V420 PolarHBondContact O-N 2.82Å; I417-L421 HydrophobicContact CG2-CD1 3.5Å; I417-L421 HydrophobicContact CG2-CG 3.89Å; I417-L421 WeakPolarHBondContact O-CG 3.5Å; I417-L421 PolarHBondContact O-N 3.23Å
418E94.5Very high91.3Very high3 Ų322.8 Ų22.81%0.01411%0.108CC..Hα-helixtrans-60.8-41.6173-16767.8-167.600111.2A269 F270 Y273 F414 V420 L421 T422A269-E418 HydrophobicContact CB-CG 3.81Å; F270-E418 HydrophobicContact CD1-CG 3.99Å; F270-E418 HydrophobicContact CE1-CB 3.73Å; F270-E418 HydrophobicContact CE1-CG 3.6Å; F270-E418 HydrophobicContact CZ-CB 4Å; F270-E418 HydrophobicContact CZ-CG 4.35Å; Y273-E418 WeakPolarHBondContact CE2-OE1 3.19Å; Y273-E418 PolarHBondContact OH-OE1 2.64Å; F414-E418 WeakPolarHBondContact O-CB 3.43Å; F414-E418 PolarHBondContact O-N 3.13Å; F414-E418 VanDerWaalsContact O-N 3.09Å; E418-V420 PolarHBondContact O-N 3.32Å; E418-V420 VanDerWaalsContact O-N 3.09Å; E418-L421 PolarHBondContact O-N 3.46Å; E418-T422 PolarHBondContact O-N 3.02Å; E418-T422 PolarHBondContact O-OG1 3.41Å; E418-T422 PolarHBondContact OE1-OG1 2.74Å
419G93.4Very high90.2Very high1 Ų129 Ų291%0.0114%0.141CC..Hα-helixtrans-60.8-15.1173.400000114.7G415 N416 I417 P423G415-G419 PolarHBondContact O-N 3.37Å; N416-G419 PolarHBondContact O-N 3Å; I417-G419 VanDerWaalsContact C-N 3.29Å; I417-G419 PolarHBondContact O-N 3.17Å; G419-P423 WeakPolarHBondContact O-CD 3.18Å; G419-P423 VanDerWaalsContact O-CG 3.26Å; G419-P423 WeakPolarHBondContact O-CG 3.46Å
420V95.1Very high89.3Confident5 Ų530.7 Ų30.73%0.0315%0.151CC..Hα-helixtrans-101.2-45.21741770000111.7F103 N416 I417 E418 P423 L424 V443F103-V420 HydrophobicContact CB-CG2 3.92Å; N416-V420 WeakPolarHBondContact O-CG2 3.46Å; N416-V420 PolarHBondContact O-N 3.11Å; I417-V420 PolarHBondContact O-N 2.82Å; E418-V420 PolarHBondContact O-N 3.32Å; E418-V420 VanDerWaalsContact O-N 3.09Å; V420-P423 WeakPolarHBondContact O-CD 3.23Å; V420-L424 HydrophobicContact CG1-CD1 3.74Å; V420-L424 HydrophobicContact CG1-CG 4.44Å; V420-L424 WeakPolarHBondContact O-CB 3.46Å; V420-L424 VanDerWaalsContact O-CG 3.23Å; V420-L424 WeakPolarHBondContact O-CG 3.46Å; V420-L424 PolarHBondContact O-N 3.05Å; V420-V443 HydrophobicContact CG1-CG1 4.08Å
421L92.5Very high88.6Confident0 Ų033 Ų330%017%0.166CC..Hα-helixtrans-68.8-46.8-175.3-69.9177000112.6F193 I417 E418 L424 Q425 L439 T440 V443F193-L421 HydrophobicContact CD1-CD1 4.21Å; I417-L421 HydrophobicContact CG2-CD1 3.5Å; I417-L421 HydrophobicContact CG2-CG 3.89Å; I417-L421 WeakPolarHBondContact O-CG 3.5Å; I417-L421 PolarHBondContact O-N 3.23Å; E418-L421 PolarHBondContact O-N 3.46Å; L421-L424 PolarHBondContact O-N 2.7Å; L421-Q425 WeakPolarHBondContact O-CG 3.48Å; L421-Q425 PolarHBondContact O-N 2.98Å; L421-L439 HydrophobicContact CD2-CD2 4.46Å; L421-L439 HydrophobicContact CD2-CG 4.24Å; L421-T440 HydrophobicContact CD1-CG2 4.19Å; L421-V443 HydrophobicContact CD2-CB 4.23Å; L421-V443 HydrophobicContact CD2-CG2 3.9Å
422T91.1Very high87.7Confident3 Ų343.2 Ų43.22%0.01821%0.21CC..Hα-helixtrans-61.1-48.4-177.8-410000111.1A269 E418 L424 Q425 E426A269-T422 HydrophobicContact CB-CG2 4.32Å; E418-T422 PolarHBondContact O-N 3.02Å; E418-T422 PolarHBondContact O-OG1 3.41Å; E418-T422 PolarHBondContact OE1-OG1 2.74Å; T422-L424 PolarHBondContact O-N 2.93Å; T422-Q425 PolarHBondContact O-N 3.32Å; T422-E426 WeakPolarHBondContact O-CG 3.29Å; T422-E426 PolarHBondContact O-N 3.05Å
423P91.1Very high87.1Confident2 Ų252.7 Ų52.71%0.01325%0.245CC..Hα-helixtrans-68.2-32.9179.4-21.236.2000113.4I81 M99 G419 V420 Q425 E426 L427I81-P423 HydrophobicContact CB-CB 4.3Å; I81-P423 HydrophobicContact CD1-CB 3.51Å; I81-P423 HydrophobicContact CG1-CB 3.79Å; M99-P423 HydrophobicContact CB-CB 4.22Å; M99-P423 HydrophobicContact CB-CG 4.37Å; M99-P423 HydrophobicContact CG-CB 4.11Å; M99-P423 HydrophobicContact CG-CG 4.41Å; M99-P423 HydrophobicContact SD-CB 3.96Å; G419-P423 WeakPolarHBondContact O-CD 3.18Å; G419-P423 VanDerWaalsContact O-CG 3.26Å; G419-P423 WeakPolarHBondContact O-CG 3.46Å; V420-P423 WeakPolarHBondContact O-CD 3.23Å; P423-Q425 VanDerWaalsContact C-N 3.33Å; P423-Q425 PolarHBondContact O-N 2.78Å; P423-E426 PolarHBondContact O-N 2.87Å; P423-L427 WeakPolarHBondContact O-CG 3.32Å; P423-L427 PolarHBondContact O-N 3.46Å
424L90.5Very high86.5Confident39 Ų3954.3 Ų54.320%0.20425%0.254CS..Hα-helixtrans-63.6-36174.2-79.9175.5000113M99 V420 L421 T422 E426 V430 V443M99-L424 HydrophobicContact SD-CD2 3.98Å; M99-L424 HydrophobicContact SD-CG 3.94Å; V420-L424 HydrophobicContact CG1-CD1 3.74Å; V420-L424 HydrophobicContact CG1-CG 4.44Å; V420-L424 WeakPolarHBondContact O-CB 3.46Å; V420-L424 VanDerWaalsContact O-CG 3.23Å; V420-L424 WeakPolarHBondContact O-CG 3.46Å; V420-L424 PolarHBondContact O-N 3.05Å; L421-L424 PolarHBondContact O-N 2.7Å; T422-L424 PolarHBondContact O-N 2.93Å; L424-E426 VanDerWaalsContact C-N 3.34Å; L424-V430 WeakPolarHBondContact O-CG2 3.44Å; L424-V443 HydrophobicContact CD1-CG2 3.78Å
425Q86.8Confident86.2Confident83 Ų8357 Ų5739%0.38827%0.272SS..Hα-helixtrans-71.4-30.3175.2-70.8168.1-4.700112.3L421 T422 P423 H436 L439L421-Q425 WeakPolarHBondContact O-CG 3.48Å; L421-Q425 PolarHBondContact O-N 2.98Å; T422-Q425 PolarHBondContact O-N 3.32Å; P423-Q425 VanDerWaalsContact C-N 3.33Å; P423-Q425 PolarHBondContact O-N 2.78Å; Q425-H436 PolarHBondContact NE2-CD2 3.24Å; Q425-H436 PolarHBondContact NE2-NE2 2.85Å; Q425-L439 HydrophobicContact CG-CD2 3.5Å
426E83.9Confident85.8Confident53 Ų5359.6 Ų59.625%0.24828%0.284CS..Hα-helixtrans-77.2-35177.3-70.4-177156.300112.7R12 G79 G82 T422 P423 L424 K428R12-E426 IonicContact NH2-OE1 3.52Å; R12-E426 PolarHBondContact NH2-OE1 3.33Å; G79-E426 WeakPolarHBondContact CA-OE1 3.47Å; G79-E426 PolarHBondContact N-OE1 3.3Å; G82-E426 PolarHBondContact N-OE2 3.33Å; T422-E426 WeakPolarHBondContact O-CG 3.29Å; T422-E426 PolarHBondContact O-N 3.05Å; P423-E426 PolarHBondContact O-N 2.87Å; L424-E426 VanDerWaalsContact C-N 3.34Å; E426-K428 PolarHBondContact O-N 2.72Å; E426-K428 VanDerWaalsContact O-N 3.12Å
427L79Confident85.7Confident42 Ų4263 Ų6322%0.2230%0.3CS..SBendtrans-65.4110.3166.4-69.2171.2000107.1I81 M99 P423 L429 V430I81-L427 HydrophobicContact CD1-CD1 3.74Å; I81-L427 HydrophobicContact CD1-CD2 4.06Å; I81-L427 HydrophobicContact CD1-CG 3.77Å; I81-L427 HydrophobicContact CG2-CD2 4.42Å; M99-L427 HydrophobicContact CE-CD1 4.33Å; M99-L427 HydrophobicContact SD-CD1 4.16Å; P423-L427 WeakPolarHBondContact O-CG 3.32Å; P423-L427 PolarHBondContact O-N 3.46Å; L427-L429 HydrophobicContact CB-CB 4.5Å; L427-L429 HydrophobicContact CB-CD1 4.03Å; L427-L429 HydrophobicContact CB-CG 4.12Å; L427-L429 HydrophobicContact CD1-CD1 4.25Å; L427-L429 PolarHBondContact O-N 3.08Å; L427-V430 PolarHBondContact O-N 3.34Å
428K71.5Confident85.5Confident209 Ų20965.9 Ų65.991%0.90932%0.317SS*.THydrogen-bonded Turntrans-59.518.7177.7-59.7179.4-179.91780115E426E426-K428 PolarHBondContact O-N 2.72Å; E426-K428 VanDerWaalsContact O-N 3.12Å
429L72.7Confident85.4Confident139 Ų13966.4 Ų66.473%0.72832%0.32SS*.THydrogen-bonded Turntrans-71.7-32.3171.1-61.4174.9000111.7L427L427-L429 HydrophobicContact CB-CB 4.5Å; L427-L429 HydrophobicContact CB-CD1 4.03Å; L427-L429 HydrophobicContact CB-CG 4.12Å; L427-L429 HydrophobicContact CD1-CD1 4.25Å; L427-L429 PolarHBondContact O-N 3.08Å
430V75.5Confident85.4Confident35 Ų3566.3 Ų66.321%0.21232%0.319CS..SBendtrans-84.1126177.8-176.20000109.7L424 L427 K432 L434 L439L424-V430 WeakPolarHBondContact O-CG2 3.44Å; L427-V430 PolarHBondContact O-N 3.34Å; V430-K432 PolarHBondContact O-N 3.24Å; V430-L434 HydrophobicContact CG1-CB 4.07Å; V430-L434 HydrophobicContact CG1-CD2 3.73Å; V430-L439 HydrophobicContact CG1-CD1 4.24Å; V430-L439 HydrophobicContact CG1-CD2 4.44Å; V430-L439 HydrophobicContact CG2-CD1 3.91Å; V430-L439 HydrophobicContact CG2-CD2 4.39Å
431P79.8Confident85.4Confident60 Ų6067.9 Ų67.939%0.3933%0.332SS..  trans-62.5134.6175-19.631.2000111.3W433 L434P431-W433 HydrophobicContact CB-CD2 4.45Å; P431-W433 HydrophobicContact CB-CG 4.18Å; P431-W433 PolarHBondContact O-N 3.39Å; P431-L434 WeakPolarHBondContact O-CB 3.5Å; P431-L434 PolarHBondContact O-N 3.19Å
432K75.6Confident85.4Confident218 Ų21871.7 Ų71.795%0.94835%0.352SS*.THydrogen-bonded Turntrans-59.9-17-178.8-68-171.4173.4-167.90115.4V430 L434V430-K432 PolarHBondContact O-N 3.24Å; K432-L434 VanDerWaalsContact C-N 3.32Å
433W81.3Confident85.6Confident205 Ų20572.2 Ų72.278%0.77736%0.355SS*.THydrogen-bonded Turntrans-82.2-12.7177.364-95.1000112.8P431 P435P431-W433 HydrophobicContact CB-CD2 4.45Å; P431-W433 HydrophobicContact CB-CG 4.18Å; P431-W433 PolarHBondContact O-N 3.39Å; W433-P435 WeakPolarHBondContact O-CD 3.4Å
434L84.5Confident85.8Confident35 Ų3572.5 Ų72.518%0.18336%0.357CS..SBendtrans-76118.3-180-166.274.2000109.1V430 P431 K432 V438 L439 I442V430-L434 HydrophobicContact CG1-CB 4.07Å; V430-L434 HydrophobicContact CG1-CD2 3.73Å; P431-L434 WeakPolarHBondContact O-CB 3.5Å; P431-L434 PolarHBondContact O-N 3.19Å; K432-L434 VanDerWaalsContact C-N 3.32Å; L434-V438 HydrophobicContact CD1-CB 4.06Å; L434-V438 HydrophobicContact CD1-CG1 3.6Å; L434-V438 HydrophobicContact CG-CB 4.32Å; L434-V438 HydrophobicContact CG-CG1 4.26Å; L434-L439 HydrophobicContact CD2-CB 4.01Å; L434-L439 HydrophobicContact CD2-CD1 4.19Å; L434-I442 HydrophobicContact CD2-CD1 4.22Å
435P88.1Confident86.1Confident59 Ų5975.4 Ų75.438%0.38337%0.372SS..  trans-71.7152.3-179.833.9-37.8000110.4W433 E437 V438 L439W433-P435 WeakPolarHBondContact O-CD 3.4Å; P435-E437 WeakPolarHBondContact CB-OE2 3.47Å; P435-E437 PolarHBondContact O-N 3.2Å; P435-E437 VanDerWaalsContact O-N 3.17Å; P435-V438 HydrophobicContact CG-CB 3.98Å; P435-V438 HydrophobicContact CG-CG2 3.58Å; P435-V438 PolarHBondContact O-N 3.04Å; P435-V438 VanDerWaalsContact O-N 3.08Å; P435-L439 PolarHBondContact O-N 3.18Å
436H85.5Confident86.6Confident53 Ų5374.6 Ų74.625%0.24537%0.373CS..Hα-helixtrans-54-38.5-175.5-179.5-73.7000112.3Q425 V438 L439 T440Q425-H436 PolarHBondContact NE2-CD2 3.24Å; Q425-H436 PolarHBondContact NE2-NE2 2.85Å; H436-V438 VanDerWaalsContact C-N 3.34Å; H436-V438 PolarHBondContact O-N 3.22Å; H436-L439 PolarHBondContact O-N 3.01Å; H436-T440 PolarHBondContact CE1-OG1 3.31Å; H436-T440 VanDerWaalsContact CE1-OG1 3.26Å; H436-T440 PolarHBondContact ND1-OG1 3.4Å; H436-T440 WeakPolarHBondContact O-CB 3.31Å; H436-T440 PolarHBondContact O-N 3.02Å; H436-T440 PolarHBondContact O-OG1 2.87Å
437E91.4Very high87.1Confident77 Ų7772.1 Ų72.136%0.3636%0.361SS..Hα-helixtrans-62.1-42.4-178.9-56.794.915600111.5I194 P435 T440 A441I194-E437 HydrophobicContact CG1-CG 4.43Å; I194-E437 WeakPolarHBondContact O-CG 3.43Å; P435-E437 WeakPolarHBondContact CB-OE2 3.47Å; P435-E437 PolarHBondContact O-N 3.2Å; P435-E437 VanDerWaalsContact O-N 3.17Å; E437-T440 PolarHBondContact O-N 3.01Å; E437-A441 WeakPolarHBondContact O-CB 3.38Å; E437-A441 PolarHBondContact O-N 3.42Å
438V92.1Very high88Confident63 Ų6372 Ų7238%0.38236%0.359SS..Hα-helixtrans-72.4-39.7179.7177.70000110.6L434 P435 H436 T440 A441 I442L434-V438 HydrophobicContact CD1-CB 4.06Å; L434-V438 HydrophobicContact CD1-CG1 3.6Å; L434-V438 HydrophobicContact CG-CB 4.32Å; L434-V438 HydrophobicContact CG-CG1 4.26Å; P435-V438 HydrophobicContact CG-CB 3.98Å; P435-V438 HydrophobicContact CG-CG2 3.58Å; P435-V438 PolarHBondContact O-N 3.04Å; P435-V438 VanDerWaalsContact O-N 3.08Å; H436-V438 VanDerWaalsContact C-N 3.34Å; H436-V438 PolarHBondContact O-N 3.22Å; V438-T440 VanDerWaalsContact C-N 3.31Å; V438-T440 PolarHBondContact O-N 3Å; V438-A441 PolarHBondContact O-N 3.49Å; V438-I442 HydrophobicContact CG1-CD1 3.95Å; V438-I442 HydrophobicContact CG1-CG1 4.44Å; V438-I442 VanDerWaalsContact O-CG1 3.28Å; V438-I442 WeakPolarHBondContact O-CG1 3.44Å; V438-I442 PolarHBondContact O-N 3.48Å
439L91.8Very high89.2Confident13 Ų1366.7 Ų66.77%0.06834%0.34CS..Hα-helixtrans-59.5-45.4174.1-179.463.6000111.2L421 Q425 V430 L434 P435 H436 A441 I442 V443L421-L439 HydrophobicContact CD2-CD2 4.46Å; L421-L439 HydrophobicContact CD2-CG 4.24Å; Q425-L439 HydrophobicContact CG-CD2 3.5Å; V430-L439 HydrophobicContact CG1-CD1 4.24Å; V430-L439 HydrophobicContact CG1-CD2 4.44Å; V430-L439 HydrophobicContact CG2-CD1 3.91Å; V430-L439 HydrophobicContact CG2-CD2 4.39Å; L434-L439 HydrophobicContact CD2-CB 4.01Å; L434-L439 HydrophobicContact CD2-CD1 4.19Å; P435-L439 PolarHBondContact O-N 3.18Å; H436-L439 PolarHBondContact O-N 3.01Å; L439-A441 PolarHBondContact O-N 3.41Å; L439-I442 PolarHBondContact O-N 3.25Å; L439-V443 WeakPolarHBondContact O-CG2 3.4Å; L439-V443 PolarHBondContact O-N 3.41Å
440T93.1Very high90.4Very high0 Ų063.8 Ų63.80%033%0.325CS..Hα-helixtrans-60.2-45.8176.8-54.20000110.9Y190 F193 L421 H436 E437 V438 I442 V443 C444Y190-T440 HydrophobicContact CD2-CG2 3.99Å; F193-T440 HydrophobicContact CB-CG2 3.69Å; L421-T440 HydrophobicContact CD1-CG2 4.19Å; H436-T440 PolarHBondContact CE1-OG1 3.31Å; H436-T440 VanDerWaalsContact CE1-OG1 3.26Å; H436-T440 PolarHBondContact ND1-OG1 3.4Å; H436-T440 WeakPolarHBondContact O-CB 3.31Å; H436-T440 PolarHBondContact O-N 3.02Å; H436-T440 PolarHBondContact O-OG1 2.87Å; E437-T440 PolarHBondContact O-N 3.01Å; V438-T440 VanDerWaalsContact C-N 3.31Å; V438-T440 PolarHBondContact O-N 3Å; T440-I442 VanDerWaalsContact C-N 3.33Å; T440-I442 PolarHBondContact O-N 2.92Å; T440-V443 PolarHBondContact O-N 2.93Å; T440-C444 WeakPolarHBondContact O-CB 3.25Å; T440-C444 PolarHBondContact O-N 3.49Å; T440-C444 PolarHBondContact O-SG 3.11Å; T440-C444 VanDerWaalsContact O-SG 3.37Å
441A94.7Very high91.3Very high37 Ų3762.1 Ų62.131%0.30631%0.314SS..Hα-helixtrans-59.7-4217700000112.2Y190 E437 V438 L439 C444 L445Y190-A441 HydrophobicContact CD2-CB 4.14Å; Y190-A441 HydrophobicContact CE2-CB 3.6Å; E437-A441 WeakPolarHBondContact O-CB 3.38Å; E437-A441 PolarHBondContact O-N 3.42Å; V438-A441 PolarHBondContact O-N 3.49Å; L439-A441 PolarHBondContact O-N 3.41Å; A441-C444 PolarHBondContact O-N 3.42Å; A441-L445 VanDerWaalsContact O-CB 3.25Å; A441-L445 WeakPolarHBondContact O-CB 3.43Å; A441-L445 PolarHBondContact O-N 3.21Å
442I94.3Very high92.1Very high81 Ų8161.2 Ų61.242%0.41531%0.306SS..Hα-helixtrans-63.5-47.1177.3-68.7164.6000110.7L434 V438 L439 T440 C444 L445 V446L434-I442 HydrophobicContact CD2-CD1 4.22Å; V438-I442 HydrophobicContact CG1-CD1 3.95Å; V438-I442 HydrophobicContact CG1-CG1 4.44Å; V438-I442 VanDerWaalsContact O-CG1 3.28Å; V438-I442 WeakPolarHBondContact O-CG1 3.44Å; V438-I442 PolarHBondContact O-N 3.48Å; L439-I442 PolarHBondContact O-N 3.25Å; T440-I442 VanDerWaalsContact C-N 3.33Å; T440-I442 PolarHBondContact O-N 2.92Å; I442-C444 PolarHBondContact O-N 3.32Å; I442-L445 PolarHBondContact O-N 2.79Å; I442-V446 HydrophobicContact CG2-CG2 4.34Å; I442-V446 WeakPolarHBondContact O-CB 3.35Å; I442-V446 VanDerWaalsContact O-CG2 3.32Å; I442-V446 WeakPolarHBondContact O-CG2 3.22Å; I442-V446 PolarHBondContact O-N 2.04Å
443V94Very high93.1Very high13 Ų1353.7 Ų53.78%0.07928%0.276CS..Hα-helixtrans-61.7-45.4178.8172.20000111V420 L421 L424 L439 T440 L445 V446 S447V420-V443 HydrophobicContact CG1-CG1 4.08Å; L421-V443 HydrophobicContact CD2-CB 4.23Å; L421-V443 HydrophobicContact CD2-CG2 3.9Å; L424-V443 HydrophobicContact CD1-CG2 3.78Å; L439-V443 WeakPolarHBondContact O-CG2 3.4Å; L439-V443 PolarHBondContact O-N 3.41Å; T440-V443 PolarHBondContact O-N 2.93Å; V443-L445 PolarHBondContact O-N 2.83Å; V443-V446 PolarHBondContact O-N 2.63Å; V443-S447 VanDerWaalsContact O-CB 3.3Å; V443-S447 WeakPolarHBondContact O-CB 3.24Å; V443-S447 PolarHBondContact O-N 3.02Å; V443-S447 PolarHBondContact O-OG 2.95Å
444C96.3Very high93.8Very high8 Ų844 Ų445%0.05424%0.239CC..Hα-helixtrans-62.3-41.9175.9-70.10000112W186 T440 A441 I442 S447 F448W186-C444 HydrophobicContact CE3-CB 3.87Å; W186-C444 HydrophobicContact CZ3-CB 4.45Å; T440-C444 WeakPolarHBondContact O-CB 3.25Å; T440-C444 PolarHBondContact O-N 3.49Å; T440-C444 PolarHBondContact O-SG 3.11Å; T440-C444 VanDerWaalsContact O-SG 3.37Å; A441-C444 PolarHBondContact O-N 3.42Å; I442-C444 PolarHBondContact O-N 3.32Å; C444-S447 PolarHBondContact O-N 2.99Å; C444-F448 WeakPolarHBondContact O-CB 3.47Å; C444-F448 PolarHBondContact O-N 3.49Å
445L96.7Very high94.4Very high101 Ų10142.5 Ų42.553%0.52923%0.231SC..Hα-helixtrans-65.9-45.8179.2-179.463.8000111.9A441 I442 V443 S447 F448 L449A441-L445 VanDerWaalsContact O-CB 3.25Å; A441-L445 WeakPolarHBondContact O-CB 3.43Å; A441-L445 PolarHBondContact O-N 3.21Å; I442-L445 PolarHBondContact O-N 2.79Å; V443-L445 PolarHBondContact O-N 2.83Å; L445-S447 VanDerWaalsContact C-N 3.32Å; L445-S447 PolarHBondContact O-N 2.9Å; L445-F448 PolarHBondContact O-N 3.24Å; L445-L449 HydrophobicContact CG-CD1 4.39Å; L445-L449 WeakPolarHBondContact O-CG 3.49Å; L445-L449 PolarHBondContact O-N 2.93Å
446V96.1Very high94.8Very high65 Ų6541.4 Ų41.439%0.39422%0.222SC..Hα-helixtrans-61.3-44.3176170.60000110.4F103 I442 V443 F448 L449 I450F103-V446 HydrophobicContact CZ-CG1 4.49Å; I442-V446 HydrophobicContact CG2-CG2 4.34Å; I442-V446 WeakPolarHBondContact O-CB 3.35Å; I442-V446 VanDerWaalsContact O-CG2 3.32Å; I442-V446 WeakPolarHBondContact O-CG2 3.22Å; I442-V446 PolarHBondContact O-N 2.04Å; V443-V446 PolarHBondContact O-N 2.63Å; V446-F448 VanDerWaalsContact C-N 3.34Å; V446-F448 PolarHBondContact O-N 3.37Å; V446-L449 PolarHBondContact O-N 3.48Å; V446-I450 HydrophobicContact CG1-CD1 3.76Å; V446-I450 WeakPolarHBondContact O-CG1 3.42Å; V446-I450 PolarHBondContact O-N 3.04Å
447S96.2Very high95.3Very high1 Ų138.9 Ų38.91%0.00721%0.211CC..Hα-helixtrans-65.5-36.9178.8-52.40000112.3F103 V443 C444 L445 G451F103-S447 WeakPolarHBondContact CE2-OG 3.21Å; V443-S447 VanDerWaalsContact O-CB 3.3Å; V443-S447 WeakPolarHBondContact O-CB 3.24Å; V443-S447 PolarHBondContact O-N 3.02Å; V443-S447 PolarHBondContact O-OG 2.95Å; C444-S447 PolarHBondContact O-N 2.99Å; L445-S447 VanDerWaalsContact C-N 3.32Å; L445-S447 PolarHBondContact O-N 2.9Å; S447-G451 WeakPolarHBondContact O-CA 3.48Å; S447-G451 PolarHBondContact O-N 3.35Å
448F97.4Very high95.5Very high39 Ų3935.2 Ų35.217%0.17119%0.194CC..Hα-helixtrans-61.8-49.4172.2168.3-105.3000111.9V179 L182 A183 W186 C444 L445 V446 I450 G451 L452V179-F448 HydrophobicContact CG1-CE2 4.47Å; V179-F448 HydrophobicContact CG1-CZ 4.15Å; L182-F448 HydrophobicContact CB-CE2 4.46Å; L182-F448 HydrophobicContact CD2-CD2 4.17Å; L182-F448 HydrophobicContact CD2-CE2 4.34Å; L182-F448 HydrophobicContact CG-CD2 4.03Å; L182-F448 HydrophobicContact CG-CE2 4.29Å; A183-F448 HydrophobicContact CB-CD2 4.33Å; A183-F448 HydrophobicContact CB-CE2 3.65Å; A183-F448 HydrophobicContact CB-CZ 4.05Å; W186-F448 HydrophobicContact CB-CB 4.48Å; W186-F448 AromaticContact CD1-CD2 3.92Å; W186-F448 HydrophobicContact CG-CB 4.01Å; C444-F448 WeakPolarHBondContact O-CB 3.47Å; C444-F448 PolarHBondContact O-N 3.49Å; L445-F448 PolarHBondContact O-N 3.24Å; V446-F448 VanDerWaalsContact C-N 3.34Å; V446-F448 PolarHBondContact O-N 3.37Å; F448-I450 PolarHBondContact O-N 3.44Å; F448-G451 PolarHBondContact O-N 3.01Å; F448-L452 HydrophobicContact CE2-CD2 4.15Å; F448-L452 HydrophobicContact CZ-CD2 3.99Å; F448-L452 PolarHBondContact O-N 3.28Å
449L97.4Very high95.6Very high99 Ų9932.2 Ų32.252%0.51818%0.175SC..Hα-helixtrans-61.9-41.7-178.3-70.3174.4000112.3L445 V446 L452L445-L449 HydrophobicContact CG-CD1 4.39Å; L445-L449 WeakPolarHBondContact O-CG 3.49Å; L445-L449 PolarHBondContact O-N 2.93Å; V446-L449 PolarHBondContact O-N 3.48Å; L449-L452 HydrophobicContact CD2-CD1 4.49Å; L449-L452 WeakPolarHBondContact O-CB 3.44Å; L449-L452 WeakPolarHBondContact O-CG 3.22Å
450I95.9Very high95.7Very high77 Ų7732.4 Ų32.440%0.39518%0.176SC..Hα-helixtrans-71.8-38.6176.3-58.7165.4000110.2F103 M107 V446 F448 L452 I453F103-I450 HydrophobicContact CE1-CD1 4.27Å; F103-I450 HydrophobicContact CZ-CD1 3.84Å; M107-I450 HydrophobicContact CE-CB 4.16Å; M107-I450 HydrophobicContact CE-CG2 3.3Å; M107-I450 HydrophobicContact SD-CB 4.3Å; M107-I450 HydrophobicContact SD-CG2 3.75Å; V446-I450 HydrophobicContact CG1-CD1 3.76Å; V446-I450 WeakPolarHBondContact O-CG1 3.42Å; V446-I450 PolarHBondContact O-N 3.04Å; F448-I450 PolarHBondContact O-N 3.44Å; I450-L452 PolarHBondContact O-N 3.47Å; I450-L452 VanDerWaalsContact O-N 3.09Å; I450-I453 VanDerWaalsContact O-CG2 3.29Å; I450-I453 WeakPolarHBondContact O-CG2 3.46Å; I450-I453 PolarHBondContact O-N 3.37Å
451G95.8Very high95.8Very high0 Ų032.7 Ų32.70%018%0.177CC..Hα-helixtrans-61.2-14.7177.400000114.9S447 F448 I453 F454S447-G451 WeakPolarHBondContact O-CA 3.48Å; S447-G451 PolarHBondContact O-N 3.35Å; F448-G451 PolarHBondContact O-N 3.01Å; G451-I453 PolarHBondContact O-N 3.14Å; G451-I453 VanDerWaalsContact O-N 3.14Å; G451-F454 WeakPolarHBondContact O-CD2 3.44Å; G451-F454 PolarHBondContact O-N 3.44Å
452L96.8Very high95.8Very high42 Ų4231.5 Ų31.522%0.2217%0.165CC..G310 helixtrans-57-27.3174.1-67.6178.8000112.7L174 V179 F448 L449 I450 F454 T455L174-L452 HydrophobicContact CD2-CB 4.37Å; L174-L452 WeakPolarHBondContact CD2-O 3.33Å; V179-L452 HydrophobicContact CG1-CD2 3.93Å; V179-L452 HydrophobicContact CG2-CD2 4.07Å; F448-L452 HydrophobicContact CE2-CD2 4.15Å; F448-L452 HydrophobicContact CZ-CD2 3.99Å; F448-L452 PolarHBondContact O-N 3.28Å; L449-L452 HydrophobicContact CD2-CD1 4.49Å; L449-L452 WeakPolarHBondContact O-CB 3.44Å; L449-L452 WeakPolarHBondContact O-CG 3.22Å; I450-L452 PolarHBondContact O-N 3.47Å; I450-L452 VanDerWaalsContact O-N 3.09Å; L452-F454 PolarHBondContact O-N 3.17Å; L452-F454 VanDerWaalsContact O-N 3.17Å; L452-T455 PolarHBondContact O-N 3.37Å; L452-T455 PolarHBondContact O-OG1 2.99Å
453I96Very high95.8Very high59 Ų5927.8 Ų27.830%0.30315%0.146SC..G310 helixtrans-55.9-31.9175.1-165.1173.6000112.5I450 G451 T455 L456 W462I450-I453 VanDerWaalsContact O-CG2 3.29Å; I450-I453 WeakPolarHBondContact O-CG2 3.46Å; I450-I453 PolarHBondContact O-N 3.37Å; G451-I453 PolarHBondContact O-N 3.14Å; G451-I453 VanDerWaalsContact O-N 3.14Å; I453-T455 VanDerWaalsContact C-N 3.28Å; I453-T455 PolarHBondContact O-N 3.03Å; I453-L456 HydrophobicContact CG1-CD1 4.11Å; I453-L456 WeakPolarHBondContact O-CB 3.42Å; I453-L456 WeakPolarHBondContact O-CD1 3.46Å; I453-W462 HydrophobicContact CD1-CD2 4.39Å; I453-W462 HydrophobicContact CG1-CG 4.48Å
454F96.6Very high95.6Very high3 Ų329.6 Ų29.61%0.01315%0.153CC..G310 helixtrans-82.6-6-179.5-51.7-60.6000113.8M107 F108 T111 G451 L452 G459 W462 V463 F466M107-F454 HydrophobicContact CB-CE2 3.9Å; M107-F454 HydrophobicContact CE-CE2 3.68Å; M107-F454 HydrophobicContact CE-CZ 3.91Å; F108-F454 HydrophobicContact CB-CE2 4.35Å; F108-F454 HydrophobicContact CB-CZ 4.12Å; T111-F454 HydrophobicContact CG2-CB 3.54Å; T111-F454 HydrophobicContact CG2-CG 4.36Å; T111-F454 WeakPolarHBondContact OG1-CD2 3.44Å; G451-F454 WeakPolarHBondContact O-CD2 3.44Å; G451-F454 PolarHBondContact O-N 3.44Å; L452-F454 PolarHBondContact O-N 3.17Å; L452-F454 VanDerWaalsContact O-N 3.17Å; F454-G459 WeakPolarHBondContact O-CA 3.06Å; F454-W462 HydrophobicContact CD1-CB 3.74Å; F454-W462 HydrophobicContact CE1-CB 3.87Å; F454-V463 HydrophobicContact CB-CG2 3.83Å; F454-V463 HydrophobicContact CD1-CB 4.49Å; F454-V463 HydrophobicContact CD1-CG2 3.53Å; F454-V463 HydrophobicContact CE1-CG2 4.25Å; F454-V463 HydrophobicContact CG-CG2 3.79Å; F454-F466 AromaticContact CE1-CD2 3.97Å; F454-F466 HydrophobicContact CE1-CD2 3.97Å; F454-F466 HydrophobicContact CE1-CE2 4.16Å; F454-F466 HydrophobicContact CE1-CG 4.14Å; F454-F466 AromaticContact CZ-CD1 3.92Å; F454-F466 HydrophobicContact CZ-CD1 3.92Å; F454-F466 HydrophobicContact CZ-CD2 4.16Å; F454-F466 HydrophobicContact CZ-CE1 4Å; F454-F466 HydrophobicContact CZ-CE2 4.23Å; F454-F466 HydrophobicContact CZ-CG 4Å; F454-F466 HydrophobicContact CZ-CZ 4.15Å
455T96.9Very high95.4Very high2 Ų229.2 Ų29.21%0.01215%0.151CC..G310 helixtrans-97.92.5176.268.60000113L174 Q175 M178 V179 L182 L452 I453L174-T455 VanDerWaalsContact CD2-OG1 3.29Å; L174-T455 WeakPolarHBondContact CD2-OG1 3.44Å; Q175-T455 WeakPolarHBondContact CG-O 3.46Å; Q175-T455 PolarHBondContact N-O 3.39Å; M178-T455 HydrophobicContact CB-CG2 4.25Å; M178-T455 HydrophobicContact CG-CG2 3.97Å; V179-T455 HydrophobicContact CG2-CG2 4.29Å; V179-T455 WeakPolarHBondContact CG2-OG1 3.49Å; L182-T455 HydrophobicContact CB-CG2 4.36Å; L182-T455 HydrophobicContact CD2-CG2 3.8Å; L452-T455 PolarHBondContact O-N 3.37Å; L452-T455 PolarHBondContact O-OG1 2.99Å; I453-T455 VanDerWaalsContact C-N 3.28Å; I453-T455 PolarHBondContact O-N 3.03Å
456L96.7Very high95.2Very high36 Ų3625.1 Ų25.119%0.18813%0.129CC..BIsolated β-bridgetrans-71.6163.7170.2-67.6171000110.9S171 S173 L174 I453 S458 G459S171-L456 WeakPolarHBondContact O-CB 3.39Å; S173-L456 WeakPolarHBondContact O-CA 3.41Å; L174-L456 HydrophobicContact CD2-CD2 3.64Å; L174-L456 HydrophobicContact CD2-CG 4.06Å; L174-L456 HydrophobicContact CG-CD2 3.89Å; I453-L456 HydrophobicContact CG1-CD1 4.11Å; I453-L456 WeakPolarHBondContact O-CB 3.42Å; I453-L456 WeakPolarHBondContact O-CD1 3.46Å; L456-S458 PolarHBondContact O-N 3.03Å; L456-G459 WeakPolarHBondContact O-CA 3.09Å; L456-G459 PolarHBondContact O-N 2.83Å
457G94.9Very high94.8Very high1 Ų123.6 Ų23.61%0.0112%0.119CC..THydrogen-bonded Turntrans-60.2-31173.500000113.4N163 I164 T165 S171 S173 G459N163-G457 WeakPolarHBondContact O-CA 3.48Å; I164-G457 VanDerWaalsContact CA-O 3.32Å; I164-G457 WeakPolarHBondContact CA-O 3.46Å; T165-G457 PolarHBondContact N-O 3.38Å; T165-G457 VanDerWaalsContact N-O 3.11Å; S171-G457 PolarHBondContact O-N 3.34Å; S173-G457 PolarHBondContact O-N 2.77Å; G457-G459 VanDerWaalsContact C-N 3.26Å; G457-G459 PolarHBondContact O-N 3.3Å
458S95.5Very high94.2Very high0 Ų025.7 Ų25.70%014%0.136CC..THydrogen-bonded Turntrans-85.26.4170.574.80000113.8T165 I170 S171 L456 N460 Y461 W462T165-S458 WeakPolarHBondContact OG1-CA 3.36Å; T165-S458 PolarHBondContact OG1-N 2.92Å; I170-S458 WeakPolarHBondContact O-CB 2.95Å; S171-S458 PolarHBondContact O-N 3.37Å; S171-S458 VanDerWaalsContact O-N 3.1Å; L456-S458 PolarHBondContact O-N 3.03Å; S458-N460 PolarHBondContact O-N 3.45Å; S458-Y461 PolarHBondContact O-N 3.33Å; S458-W462 PolarHBondContact O-N 2.98Å; S458-W462 PolarHBondContact OG-NE1 2.89Å
459G95.3Very high93.8Very high0 Ų025.1 Ų25.10%013%0.133CC..Hα-helixtrans-62.2-37.8-167.700000113.9F454 L456 G457 Y461 W462 V463F454-G459 WeakPolarHBondContact O-CA 3.06Å; L456-G459 WeakPolarHBondContact O-CA 3.09Å; L456-G459 PolarHBondContact O-N 2.83Å; G457-G459 VanDerWaalsContact C-N 3.26Å; G457-G459 PolarHBondContact O-N 3.3Å; G459-Y461 VanDerWaalsContact C-N 3.33Å; G459-Y461 PolarHBondContact O-N 3.04Å; G459-W462 WeakPolarHBondContact O-CB 3.43Å; G459-W462 PolarHBondContact O-N 3.4Å; G459-W462 VanDerWaalsContact O-N 3.14Å; G459-V463 PolarHBondContact O-N 2.89Å
460N93.8Very high93.3Very high16 Ų1620.4 Ų20.49%0.08611%0.108CC..Hα-helixtrans-59.5-42.2176.2-177.567.5000112.1L162 I164 S458 W462 V463 E464L162-N460 HydrophobicContact CD1-CB 3.81Å; L162-N460 HydrophobicContact CD2-CB 4.33Å; I164-N460 HydrophobicContact CD1-CB 4.08Å; S458-N460 PolarHBondContact O-N 3.45Å; N460-W462 VanDerWaalsContact C-N 3.29Å; N460-W462 PolarHBondContact O-N 3.45Å; N460-V463 PolarHBondContact O-N 3.45Å; N460-E464 PolarHBondContact O-N 2.93Å
461Y94.3Very high92.5Very high6 Ų616.8 Ų16.82%0.0249%0.09CC..Hα-helixtrans-63.2-36.8177.1-53.5-53.7000111.9I164 T165 I168 S458 G459 E464 V465 Y541 P542 W544I164-Y461 HydrophobicContact CD1-CE1 3.83Å; I164-Y461 HydrophobicContact CD1-CE2 4.11Å; I164-Y461 HydrophobicContact CG1-CE2 3.96Å; T165-Y461 VanDerWaalsContact O-CE2 3.26Å; T165-Y461 WeakPolarHBondContact O-CE2 3.34Å; T165-Y461 PolarHBondContact O-OH 3.01Å; I168-Y461 HydrophobicContact CB-CD2 4.09Å; I168-Y461 HydrophobicContact CB-CG 4.3Å; S458-Y461 PolarHBondContact O-N 3.33Å; G459-Y461 VanDerWaalsContact C-N 3.33Å; G459-Y461 PolarHBondContact O-N 3.04Å; Y461-E464 PolarHBondContact O-N 3.29Å; Y461-V465 WeakPolarHBondContact O-CG2 3.36Å; Y461-V465 PolarHBondContact O-N 3.17Å; Y461-Y541 AromaticContact CD1-CD2 3.83Å; Y461-Y541 HydrophobicContact CD1-CD2 3.83Å; Y461-Y541 AromaticContact CD1-CE2 3.97Å; Y461-Y541 HydrophobicContact CD1-CE2 3.97Å; Y461-Y541 HydrophobicContact CE1-CD2 4.13Å; Y461-Y541 HydrophobicContact CE1-CE2 4.07Å; Y461-Y541 HydrophobicContact CG-CD2 4.42Å; Y461-Y541 HydrophobicContact CG-CE2 4.3Å; Y461-P542 WeakPolarHBondContact CE1-O 3.26Å; Y461-W544 PolarHBondContact OH-N 3.36Å; Y461-W544 VanDerWaalsContact OH-N 3.11Å
462W95.1Very high91.9Very high13 Ų1317.1 Ų17.15%0.0499%0.092CC..Hα-helixtrans-67.5-39.2174.3-73116.1000112.9I168 I453 F454 S458 G459 N460 E464 V465 F466 W562 V563 I566I168-W462 HydrophobicContact CD1-CD2 4.39Å; I453-W462 HydrophobicContact CD1-CD2 4.39Å; I453-W462 HydrophobicContact CG1-CG 4.48Å; F454-W462 HydrophobicContact CD1-CB 3.74Å; F454-W462 HydrophobicContact CE1-CB 3.87Å; S458-W462 PolarHBondContact O-N 2.98Å; S458-W462 PolarHBondContact OG-NE1 2.89Å; G459-W462 WeakPolarHBondContact O-CB 3.43Å; G459-W462 PolarHBondContact O-N 3.4Å; G459-W462 VanDerWaalsContact O-N 3.14Å; N460-W462 VanDerWaalsContact C-N 3.29Å; N460-W462 PolarHBondContact O-N 3.45Å; W462-E464 VanDerWaalsContact C-N 3.33Å; W462-V465 PolarHBondContact O-N 2.91Å; W462-F466 HydrophobicContact CE3-CE2 4.43Å; W462-F466 VanDerWaalsContact O-CD2 3.23Å; W462-F466 WeakPolarHBondContact O-CD2 3.16Å; W462-F466 PolarHBondContact O-N 3.42Å; W462-W562 AromaticContact CH2-CH2 3.92Å; W462-W562 HydrophobicContact CH2-CH2 3.92Å; W462-W562 AromaticContact CH2-CZ3 3.59Å; W462-W562 HydrophobicContact CH2-CZ3 3.59Å; W462-W562 AromaticContact CZ2-CH2 3.61Å; W462-W562 HydrophobicContact CZ2-CH2 3.61Å; W462-W562 AromaticContact CZ2-CZ3 3.69Å; W462-W562 HydrophobicContact CZ2-CZ3 3.69Å; W462-V563 HydrophobicContact CH2-CG1 4.34Å; W462-V563 HydrophobicContact CH2-CG2 4.28Å; W462-V563 HydrophobicContact CZ3-CG1 4.29Å; W462-I566 HydrophobicContact CH2-CD1 3.64Å; W462-I566 HydrophobicContact CZ3-CD1 4.17Å; W462-I566 HydrophobicContact CZ3-CG2 4.02Å
463V93.9Very high91.5Very high2 Ų215.7 Ų15.71%0.0129%0.085CC..Hα-helixtrans-60.7-44.8174.6171.60000110.5F108 T111 I112 W115 F454 G459 N460 F466 N467F108-V463 HydrophobicContact CB-CG1 4.33Å; F108-V463 HydrophobicContact CD2-CG1 4.33Å; T111-V463 HydrophobicContact CG2-CG2 4Å; I112-V463 HydrophobicContact CD1-CG1 4.49Å; I112-V463 HydrophobicContact CG1-CG1 4.29Å; W115-V463 HydrophobicContact CH2-CB 3.76Å; W115-V463 HydrophobicContact CH2-CG1 3.66Å; W115-V463 HydrophobicContact CH2-CG2 3.7Å; W115-V463 HydrophobicContact CZ2-CB 4.47Å; W115-V463 HydrophobicContact CZ2-CG2 3.96Å; W115-V463 HydrophobicContact CZ3-CG1 3.96Å; F454-V463 HydrophobicContact CB-CG2 3.83Å; F454-V463 HydrophobicContact CD1-CB 4.49Å; F454-V463 HydrophobicContact CD1-CG2 3.53Å; F454-V463 HydrophobicContact CE1-CG2 4.25Å; F454-V463 HydrophobicContact CG-CG2 3.79Å; G459-V463 PolarHBondContact O-N 2.89Å; N460-V463 PolarHBondContact O-N 3.45Å; V463-F466 PolarHBondContact O-N 2.84Å; V463-N467 VanDerWaalsContact O-CB 3.26Å; V463-N467 WeakPolarHBondContact O-CB 3.35Å; V463-N467 PolarHBondContact O-N 3.05Å
464E89.8Confident91.3Very high51 Ų5112.9 Ų12.924%0.2387%0.071CC..Hα-helixtrans-64.2-40.7177.5-69.5-59.9156.300112.3N460 Y461 W462 F466 N467 A468N460-E464 PolarHBondContact O-N 2.93Å; Y461-E464 PolarHBondContact O-N 3.29Å; W462-E464 VanDerWaalsContact C-N 3.33Å; E464-F466 PolarHBondContact O-N 3.31Å; E464-N467 PolarHBondContact O-N 3.44Å; E464-A468 VanDerWaalsContact O-CB 3.27Å; E464-A468 WeakPolarHBondContact O-CB 3.14Å; E464-A468 PolarHBondContact O-N 3.46Å
465V92.3Very high91Very high0 Ų012.8 Ų12.80%07%0.071CC..Hα-helixtrans-57.3-49.6172.61660000110.9I168 Y461 W462 A468 Y469 Y559 I567 L570I168-V465 HydrophobicContact CD1-CG2 4.24Å; Y461-V465 WeakPolarHBondContact O-CG2 3.36Å; Y461-V465 PolarHBondContact O-N 3.17Å; W462-V465 PolarHBondContact O-N 2.91Å; V465-A468 PolarHBondContact O-N 3.5Å; V465-Y469 HydrophobicContact CG1-CD2 4.25Å; V465-Y469 VanDerWaalsContact O-CD2 3.25Å; V465-Y469 WeakPolarHBondContact O-CD2 3.36Å; V465-Y469 PolarHBondContact O-N 3.41Å; V465-Y469 VanDerWaalsContact O-N 3.12Å; V465-Y559 HydrophobicContact CG2-CD1 4.44Å; V465-Y559 HydrophobicContact CG2-CE1 3.46Å; V465-Y559 VanDerWaalsContact CG2-CE1 3.46Å; V465-Y559 VanDerWaalsContact CG2-OH 3.32Å; V465-Y559 WeakPolarHBondContact CG2-OH 3.48Å; V465-I567 HydrophobicContact CG1-CD1 4.47Å; V465-I567 HydrophobicContact CG1-CG1 3.76Å; V465-L570 HydrophobicContact CG1-CD1 3.99Å
466F92.6Very high90.7Very high16 Ų1612.9 Ų12.97%0.077%0.071CC..Hα-helixtrans-64.6-44.2-179.6-85.3-120.5000111.4L104 M107 F108 F454 W462 V463 E464 A468 V470 L570L104-F466 HydrophobicContact CD2-CE1 4.07Å; M107-F466 HydrophobicContact CE-CE1 4.05Å; F108-F466 HydrophobicContact CB-CB 3.97Å; F108-F466 HydrophobicContact CD1-CB 3.74Å; F108-F466 HydrophobicContact CE1-CB 4.49Å; F108-F466 HydrophobicContact CG-CB 4.03Å; F454-F466 AromaticContact CE1-CD2 3.97Å; F454-F466 HydrophobicContact CE1-CD2 3.97Å; F454-F466 HydrophobicContact CE1-CE2 4.16Å; F454-F466 HydrophobicContact CE1-CG 4.14Å; F454-F466 AromaticContact CZ-CD1 3.92Å; F454-F466 HydrophobicContact CZ-CD1 3.92Å; F454-F466 HydrophobicContact CZ-CD2 4.16Å; F454-F466 HydrophobicContact CZ-CE1 4Å; F454-F466 HydrophobicContact CZ-CE2 4.23Å; F454-F466 HydrophobicContact CZ-CG 4Å; F454-F466 HydrophobicContact CZ-CZ 4.15Å; W462-F466 HydrophobicContact CE3-CE2 4.43Å; W462-F466 VanDerWaalsContact O-CD2 3.23Å; W462-F466 WeakPolarHBondContact O-CD2 3.16Å; W462-F466 PolarHBondContact O-N 3.42Å; V463-F466 PolarHBondContact O-N 2.84Å; E464-F466 PolarHBondContact O-N 3.31Å; F466-A468 PolarHBondContact O-N 3.44Å; F466-V470 HydrophobicContact CB-CG2 4.25Å; F466-V470 HydrophobicContact CD1-CG2 4.05Å; F466-V470 HydrophobicContact CG-CG2 4.28Å; F466-V470 WeakPolarHBondContact O-CB 3.43Å; F466-V470 VanDerWaalsContact O-CG2 3.31Å; F466-V470 WeakPolarHBondContact O-CG2 3.48Å; F466-V470 PolarHBondContact O-N 3.46Å; F466-L570 HydrophobicContact CD1-CD2 4.37Å; F466-L570 HydrophobicContact CD2-CD1 3.79Å; F466-L570 HydrophobicContact CE1-CD2 3.78Å; F466-L570 HydrophobicContact CE2-CD1 3.65Å; F466-L570 HydrophobicContact CE2-CD2 4.16Å; F466-L570 HydrophobicContact CG-CD1 4.32Å; F466-L570 HydrophobicContact CZ-CD1 4.06Å; F466-L570 HydrophobicContact CZ-CD2 3.66Å; F466-L570 HydrophobicContact CZ-CG 4.5Å
467N87.4Confident90.6Very high33 Ų3313 Ų1318%0.1767%0.071CC..Hα-helixtrans-62.5-39.9179.6178.545.7000113R37 F108 V463 E464R37-N467 PolarHBondContact NH1-OD1 3Å; F108-N467 HydrophobicContact CD2-CB 4.13Å; F108-N467 HydrophobicContact CE2-CB 3.76Å; F108-N467 HydrophobicContact CZ-CB 4.12Å; V463-N467 VanDerWaalsContact O-CB 3.26Å; V463-N467 WeakPolarHBondContact O-CB 3.35Å; V463-N467 PolarHBondContact O-N 3.05Å; E464-N467 PolarHBondContact O-N 3.44Å
468A84.5Confident90.6Very high45 Ų4513 Ų1337%0.3727%0.071SC..Hα-helixtrans-73.5-42.7-179.100000112.6E464 V465 F466 S472E464-A468 VanDerWaalsContact O-CB 3.27Å; E464-A468 WeakPolarHBondContact O-CB 3.14Å; E464-A468 PolarHBondContact O-N 3.46Å; V465-A468 PolarHBondContact O-N 3.5Å; F466-A468 PolarHBondContact O-N 3.44Å; A468-S472 PolarHBondContact O-OG 2.82Å
469Y87.9Confident90.6Very high26 Ų2613 Ų1310%0.1027%0.071CC..Hα-helixtrans-101-37.9-167.6-64.9-74.5000114.5V465 G471 S472 P539 I567V465-Y469 HydrophobicContact CG1-CD2 4.25Å; V465-Y469 VanDerWaalsContact O-CD2 3.25Å; V465-Y469 WeakPolarHBondContact O-CD2 3.36Å; V465-Y469 PolarHBondContact O-N 3.41Å; V465-Y469 VanDerWaalsContact O-N 3.12Å; Y469-G471 PolarHBondContact O-N 3.44Å; Y469-S472 PolarHBondContact O-N 2.9Å; Y469-S472 PolarHBondContact O-OG 3.49Å; Y469-P539 WeakPolarHBondContact OH-CB 3.49Å; Y469-I567 HydrophobicContact CD1-CG2 3.59Å; Y469-I567 HydrophobicContact CD2-CB 4.46Å; Y469-I567 HydrophobicContact CD2-CD1 4.22Å; Y469-I567 HydrophobicContact CD2-CG1 3.99Å; Y469-I567 HydrophobicContact CD2-CG2 3.72Å; Y469-I567 HydrophobicContact CE1-CG2 3.76Å; Y469-I567 HydrophobicContact CE2-CD1 3.72Å; Y469-I567 HydrophobicContact CE2-CG1 4.03Å; Y469-I567 HydrophobicContact CE2-CG2 3.91Å; Y469-I567 HydrophobicContact CG-CG2 3.58Å
470V88.4Confident90.6Very high0 Ų016.4 Ų16.40%09%0.086CC..THydrogen-bonded Turntrans-63.7-41.7-171.8172.60000112.6V101 L104 V105 F466 P474 L570V101-V470 HydrophobicContact CG1-CG1 4.35Å; L104-V470 HydrophobicContact CB-CG1 3.59Å; L104-V470 HydrophobicContact CB-CG2 4.26Å; L104-V470 HydrophobicContact CD1-CG1 4.16Å; L104-V470 HydrophobicContact CD1-CG2 4.39Å; V105-V470 HydrophobicContact CG2-CG1 3.76Å; F466-V470 HydrophobicContact CB-CG2 4.25Å; F466-V470 HydrophobicContact CD1-CG2 4.05Å; F466-V470 HydrophobicContact CG-CG2 4.28Å; F466-V470 WeakPolarHBondContact O-CB 3.43Å; F466-V470 VanDerWaalsContact O-CG2 3.31Å; F466-V470 WeakPolarHBondContact O-CG2 3.48Å; F466-V470 PolarHBondContact O-N 3.46Å; V470-P474 WeakPolarHBondContact O-CD 3.38Å; V470-P474 VanDerWaalsContact O-CG 3.25Å; V470-P474 WeakPolarHBondContact O-CG 2.98Å; V470-L570 HydrophobicContact CG2-CB 4.31Å; V470-L570 HydrophobicContact CG2-CD2 4.31Å
471G77.6Confident90.7Very high1 Ų116.8 Ų16.81%0.019%0.09CC..THydrogen-bonded Turntrans-101.321.7179.400000114.5F258 Y469 L475F258-G471 WeakPolarHBondContact CE2-O 3.16Å; Y469-G471 PolarHBondContact O-N 3.44Å; G471-L475 WeakPolarHBondContact O-CD1 3.29Å
472S84.3Confident90.8Very high7 Ų716.5 Ų16.55%0.0499%0.089CC..SBendtrans-91.6-97.9171.763.10000110.4A468 Y469 L475 L476 Y530A468-S472 PolarHBondContact O-OG 2.82Å; Y469-S472 PolarHBondContact O-N 2.9Å; Y469-S472 PolarHBondContact O-OG 3.49Å; S472-L475 PolarHBondContact O-N 2.92Å; S472-L476 PolarHBondContact O-N 3.19Å; S472-Y530 PolarHBondContact OG-OH 3.48Å
473V87.4Confident90.8Very high13 Ų1315.9 Ų15.98%0.0799%0.086CC..Hα-helixtrans-57.5-43.3-177.5-177.90000113.8L475 L476 I477 F527 Y530 V571 I575V473-L475 VanDerWaalsContact C-N 3.35Å; V473-L475 PolarHBondContact O-N 2.97Å; V473-L476 PolarHBondContact O-N 2.81Å; V473-I477 HydrophobicContact CG1-CD1 3.88Å; V473-I477 HydrophobicContact CG1-CG1 4.19Å; V473-I477 PolarHBondContact O-N 2.9Å; V473-F527 HydrophobicContact CG1-CD2 4.4Å; V473-F527 HydrophobicContact CG1-CE2 3.93Å; V473-Y530 HydrophobicContact CB-CE1 4.49Å; V473-Y530 HydrophobicContact CG2-CD1 3.35Å; V473-Y530 HydrophobicContact CG2-CE1 2.98Å; V473-Y530 HydrophobicContact CG2-CE2 4.37Å; V473-Y530 HydrophobicContact CG2-CG 4.19Å; V473-V571 HydrophobicContact CB-CG1 3.73Å; V473-V571 HydrophobicContact CG1-CG1 3.92Å; V473-V571 HydrophobicContact CG2-CG1 4.36Å; V473-I575 HydrophobicContact CG1-CD1 3.94Å
474P91.9Very high90.9Very high0 Ų017.7 Ų17.70%010%0.097CC..Hα-helixtrans-56.8-46-179.7-27.738.3000113.2V101 V470 I477 I478 V571 P574 I575V101-P474 HydrophobicContact CG2-CB 3.68Å; V470-P474 WeakPolarHBondContact O-CD 3.38Å; V470-P474 VanDerWaalsContact O-CG 3.25Å; V470-P474 WeakPolarHBondContact O-CG 2.98Å; P474-I477 PolarHBondContact O-N 3.37Å; P474-I478 WeakPolarHBondContact O-CB 3.43Å; P474-I478 WeakPolarHBondContact O-CD1 3.44Å; P474-I478 WeakPolarHBondContact O-CG1 3.29Å; P474-I478 PolarHBondContact O-N 3.32Å; P474-V571 HydrophobicContact CG-CG1 4.3Å; P474-P574 HydrophobicContact CB-CB 4.42Å; P474-I575 HydrophobicContact CB-CD1 4.15Å; P474-I575 HydrophobicContact CB-CG1 4.11Å; P474-I575 HydrophobicContact CG-CD1 4.08Å; P474-I575 HydrophobicContact CG-CG1 4.43Å
475L91.1Very high91.2Very high1 Ų115.2 Ų15.21%0.0059%0.086CC..Hα-helixtrans-66-39.6179.5-69.2-179.7000112.3V101 F257 A263 F264 G471 S472 V473 I477 I478 A479V101-L475 HydrophobicContact CG1-CD2 3.75Å; V101-L475 HydrophobicContact CG1-CG 4.25Å; F257-L475 HydrophobicContact CB-CD1 4.35Å; A263-L475 HydrophobicContact CB-CD2 4.04Å; F264-L475 HydrophobicContact CD2-CD1 4.38Å; F264-L475 HydrophobicContact CD2-CD2 3.9Å; F264-L475 HydrophobicContact CE2-CD1 3.42Å; F264-L475 VanDerWaalsContact CE2-CD1 3.42Å; F264-L475 HydrophobicContact CE2-CD2 3.71Å; F264-L475 HydrophobicContact CE2-CG 4.24Å; F264-L475 HydrophobicContact CG-CD2 4.46Å; F264-L475 HydrophobicContact CZ-CD1 3.63Å; F264-L475 HydrophobicContact CZ-CD2 4.12Å; F264-L475 HydrophobicContact CZ-CG 4.49Å; G471-L475 WeakPolarHBondContact O-CD1 3.29Å; S472-L475 PolarHBondContact O-N 2.92Å; V473-L475 VanDerWaalsContact C-N 3.35Å; V473-L475 PolarHBondContact O-N 2.97Å; L475-I477 PolarHBondContact O-N 2.8Å; L475-I478 PolarHBondContact O-N 3.45Å; L475-A479 VanDerWaalsContact O-CB 3.23Å; L475-A479 WeakPolarHBondContact O-CB 3.47Å; L475-A479 PolarHBondContact O-N 2.79Å
476L90.8Very high91.4Very high3 Ų315.2 Ų15.22%0.0169%0.086CC..Hα-helixtrans-60.6-45.4176.5-69.4173.4000112T254 F257 S472 V473 F480 L523 V526T254-L476 HydrophobicContact CG2-CD1 4.35Å; F257-L476 HydrophobicContact CD2-CD2 3.83Å; F257-L476 HydrophobicContact CE2-CD2 3.41Å; F257-L476 VanDerWaalsContact CE2-CD2 3.41Å; F257-L476 HydrophobicContact CZ-CD2 3.99Å; S472-L476 PolarHBondContact O-N 3.19Å; V473-L476 PolarHBondContact O-N 2.81Å; L476-F480 WeakPolarHBondContact O-CB 3.42Å; L476-F480 PolarHBondContact O-N 3.08Å; L476-L523 HydrophobicContact CD2-CD2 4Å; L476-V526 HydrophobicContact CD1-CG1 3.99Å; L476-V526 HydrophobicContact CD2-CG1 3.89Å
477I93.5Very high91.5Very high39 Ų3914.8 Ų14.820%0.29%0.085CC..Hα-helixtrans-69.4-42.3179.9-64.4-171.5000111V473 P474 L475 F480 C481 F527 I575 I578V473-I477 HydrophobicContact CG1-CD1 3.88Å; V473-I477 HydrophobicContact CG1-CG1 4.19Å; V473-I477 PolarHBondContact O-N 2.9Å; P474-I477 PolarHBondContact O-N 3.37Å; L475-I477 PolarHBondContact O-N 2.8Å; I477-F480 PolarHBondContact O-N 3.23Å; I477-C481 WeakPolarHBondContact O-CB 3.47Å; I477-C481 PolarHBondContact O-N 3.1Å; I477-C481 PolarHBondContact O-SG 3.34Å; I477-C481 VanDerWaalsContact O-SG 3.41Å; I477-F527 HydrophobicContact CD1-CD2 4.43Å; I477-F527 HydrophobicContact CD1-CE2 3.7Å; I477-F527 HydrophobicContact CD1-CZ 4.13Å; I477-F527 HydrophobicContact CG1-CD2 4.15Å; I477-F527 HydrophobicContact CG1-CE2 3.92Å; I477-I575 HydrophobicContact CB-CD1 4.33Å; I477-I575 HydrophobicContact CB-CG1 4.45Å; I477-I575 HydrophobicContact CD1-CD1 3.65Å; I477-I575 HydrophobicContact CD1-CG1 4.42Å; I477-I575 HydrophobicContact CD1-CG2 4.02Å; I477-I575 HydrophobicContact CG1-CD1 4.28Å; I477-I575 HydrophobicContact CG2-CG2 3.9Å; I477-I578 HydrophobicContact CG2-CD1 4.22Å
478I95.4Very high91.9Very high0 Ų019.4 Ų19.40%010%0.101CC..Hα-helixtrans-59.8-54.7176.3-66.6164000109.1V94 A97 S98 V101 A263 P474 L475 F480 C481 E482 I578V94-I478 HydrophobicContact CG1-CG2 4.01Å; A97-I478 HydrophobicContact CB-CD1 3.74Å; A97-I478 HydrophobicContact CB-CG1 3.77Å; S98-I478 WeakPolarHBondContact OG-CG2 3.25Å; V101-I478 HydrophobicContact CG2-CD1 3.81Å; A263-I478 HydrophobicContact CB-CB 4.05Å; A263-I478 HydrophobicContact CB-CG2 3.68Å; P474-I478 WeakPolarHBondContact O-CB 3.43Å; P474-I478 WeakPolarHBondContact O-CD1 3.44Å; P474-I478 WeakPolarHBondContact O-CG1 3.29Å; P474-I478 PolarHBondContact O-N 3.32Å; L475-I478 PolarHBondContact O-N 3.45Å; I478-F480 VanDerWaalsContact C-N 3.28Å; I478-F480 PolarHBondContact O-N 2.93Å; I478-C481 CarbonylContact O-C 3.6Å; I478-C481 WeakPolarHBondContact O-CA 3.47Å; I478-C481 WeakPolarHBondContact O-CB 3.49Å; I478-C481 PolarHBondContact O-N 3.32Å; I478-E482 HydrophobicContact CG2-CG 4.15Å; I478-E482 VanDerWaalsContact O-CG 3.32Å; I478-E482 WeakPolarHBondContact O-CG 3.28Å; I478-E482 PolarHBondContact O-N 3.02Å; I478-I578 HydrophobicContact CG1-CD1 4.48Å
479A94.9Very high92.4Very high0 Ų021.5 Ų21.50%011%0.105CC..Hα-helixtrans-55.6-41.6179.500000112.8L65 F257 A263 L475 E482 I483 L523L65-A479 HydrophobicContact CD1-CB 4.03Å; L65-A479 HydrophobicContact CD2-CB 4.13Å; F257-A479 HydrophobicContact CD1-CB 4.23Å; F257-A479 HydrophobicContact CE1-CB 3.51Å; F257-A479 HydrophobicContact CZ-CB 4.31Å; A263-A479 HydrophobicContact CB-CB 4.08Å; L475-A479 VanDerWaalsContact O-CB 3.23Å; L475-A479 WeakPolarHBondContact O-CB 3.47Å; L475-A479 PolarHBondContact O-N 2.79Å; A479-E482 PolarHBondContact O-N 2.92Å; A479-I483 WeakPolarHBondContact O-CG1 3.47Å; A479-I483 PolarHBondContact O-N 3.35Å; A479-L523 HydrophobicContact CB-CD1 4.38Å; A479-L523 HydrophobicContact CB-CD2 4.13Å
480F95.4Very high92.8Very high72 Ų7222.5 Ų22.532%0.31611%0.109SC..Hα-helixtrans-60-47.6173.8178.7-97000112L476 I477 I478 E482 V484 P520 L523L476-F480 WeakPolarHBondContact O-CB 3.42Å; L476-F480 PolarHBondContact O-N 3.08Å; I477-F480 PolarHBondContact O-N 3.23Å; I478-F480 VanDerWaalsContact C-N 3.28Å; I478-F480 PolarHBondContact O-N 2.93Å; F480-E482 VanDerWaalsContact C-N 3.31Å; F480-E482 PolarHBondContact O-N 3.02Å; F480-V484 HydrophobicContact CD1-CG2 4.32Å; F480-V484 HydrophobicContact CD2-CG2 4.36Å; F480-V484 HydrophobicContact CE1-CG2 3.95Å; F480-V484 HydrophobicContact CE2-CG2 4Å; F480-V484 HydrophobicContact CZ-CG2 3.78Å; F480-V484 WeakPolarHBondContact O-CB 3.44Å; F480-V484 VanDerWaalsContact O-CG2 3.25Å; F480-V484 WeakPolarHBondContact O-CG2 3.47Å; F480-V484 PolarHBondContact O-N 2.88Å; F480-P520 HydrophobicContact CE2-CB 4.41Å; F480-L523 HydrophobicContact CB-CD1 4.33Å; F480-L523 HydrophobicContact CD2-CB 4.21Å
481C96.3Very high93.1Very high25 Ų2523.4 Ų23.417%0.16912%0.118CC..Hα-helixtrans-62.5-35.5176.2-74.80000112.8V94 I477 I478 G485V94-C481 HydrophobicContact CG2-CB 3.77Å; I477-C481 WeakPolarHBondContact O-CB 3.47Å; I477-C481 PolarHBondContact O-N 3.1Å; I477-C481 PolarHBondContact O-SG 3.34Å; I477-C481 VanDerWaalsContact O-SG 3.41Å; I478-C481 CarbonylContact O-C 3.6Å; I478-C481 WeakPolarHBondContact O-CA 3.47Å; I478-C481 WeakPolarHBondContact O-CB 3.49Å; I478-C481 PolarHBondContact O-N 3.32Å; C481-G485 WeakPolarHBondContact O-CA 3.2Å; C481-G485 PolarHBondContact O-N 2.94Å
482E96.3Very high94Very high0 Ų024.3 Ų24.30%012%0.123CC..Hα-helixtrans-66.4-50.5178.3-66.8-171.7151.900111.9W84 V94 I478 A479 F480 V484 G485 V486W84-E482 VanDerWaalsContact CH2-CA 3.44Å; W84-E482 HydrophobicContact CH2-CB 3.49Å; W84-E482 VanDerWaalsContact CH2-CB 3.49Å; W84-E482 HydrophobicContact CH2-CG 3.64Å; W84-E482 HydrophobicContact CZ2-CB 3.7Å; W84-E482 HydrophobicContact CZ2-CG 3.29Å; W84-E482 HydrophobicContact CZ3-CB 4.39Å; V94-E482 HydrophobicContact CG1-CG 3.74Å; I478-E482 HydrophobicContact CG2-CG 4.15Å; I478-E482 VanDerWaalsContact O-CG 3.32Å; I478-E482 WeakPolarHBondContact O-CG 3.28Å; I478-E482 PolarHBondContact O-N 3.02Å; A479-E482 PolarHBondContact O-N 2.92Å; F480-E482 VanDerWaalsContact C-N 3.31Å; F480-E482 PolarHBondContact O-N 3.02Å; E482-V484 PolarHBondContact O-N 2.93Å; E482-G485 PolarHBondContact O-N 3.31Å; E482-V486 PolarHBondContact O-N 3.02Å
483I95.9Very high94.5Very high0 Ų032.8 Ų32.80%016%0.158CC..Hα-helixtrans-62.8-46.3177.4-58-178.9000110L65 L68 A479 G485 V486 A487 W515 P520 L523L65-I483 HydrophobicContact CD1-CD1 4.39Å; L65-I483 HydrophobicContact CD2-CD1 3.48Å; L65-I483 VanDerWaalsContact CD2-CD1 3.48Å; L65-I483 HydrophobicContact CD2-CG1 3.3Å; L65-I483 HydrophobicContact CG-CD1 3.76Å; L65-I483 HydrophobicContact CG-CG1 4.12Å; L68-I483 HydrophobicContact CD1-CG1 4.31Å; A479-I483 WeakPolarHBondContact O-CG1 3.47Å; A479-I483 PolarHBondContact O-N 3.35Å; I483-G485 VanDerWaalsContact C-N 3.29Å; I483-G485 PolarHBondContact O-N 3.48Å; I483-V486 PolarHBondContact O-N 3.36Å; I483-A487 HydrophobicContact CG2-CB 4.41Å; I483-A487 WeakPolarHBondContact O-CB 3.4Å; I483-A487 PolarHBondContact O-N 3.19Å; I483-W515 VanDerWaalsContact CG2-O 3.23Å; I483-W515 WeakPolarHBondContact CG2-O 3.25Å; I483-P520 HydrophobicContact CG2-CG 3.71Å; I483-L523 HydrophobicContact CD1-CD1 3.62Å; I483-L523 HydrophobicContact CG1-CD1 4.5Å
484V95.7Very high94.9Very high39 Ų3935.3 Ų35.324%0.23617%0.174CC..Hα-helixtrans-63.2-40.6-179.7171.60000111F480 E482 V486 Y488 I489F480-V484 HydrophobicContact CD1-CG2 4.32Å; F480-V484 HydrophobicContact CD2-CG2 4.36Å; F480-V484 HydrophobicContact CE1-CG2 3.95Å; F480-V484 HydrophobicContact CE2-CG2 4Å; F480-V484 HydrophobicContact CZ-CG2 3.78Å; F480-V484 WeakPolarHBondContact O-CB 3.44Å; F480-V484 VanDerWaalsContact O-CG2 3.25Å; F480-V484 WeakPolarHBondContact O-CG2 3.47Å; F480-V484 PolarHBondContact O-N 2.88Å; E482-V484 PolarHBondContact O-N 2.93Å; V484-V486 PolarHBondContact O-N 3.04Å; V484-Y488 HydrophobicContact CB-CD2 4.4Å; V484-Y488 HydrophobicContact CG1-CD2 4.17Å; V484-Y488 HydrophobicContact CG2-CD2 4.45Å; V484-Y488 HydrophobicContact CG2-CE2 4.5Å; V484-Y488 WeakPolarHBondContact O-CB 3.32Å; V484-Y488 PolarHBondContact O-N 3.4Å; V484-I489 PolarHBondContact O-N 3.27Å
485G95.5Very high95.1Very high0 Ų035.4 Ų35.40%017%0.174CC..Iπ-helixtrans-58.7-44.8176.500000113C481 E482 I483 I489 Y490C481-G485 WeakPolarHBondContact O-CA 3.2Å; C481-G485 PolarHBondContact O-N 2.94Å; E482-G485 PolarHBondContact O-N 3.31Å; I483-G485 VanDerWaalsContact C-N 3.29Å; I483-G485 PolarHBondContact O-N 3.48Å; G485-I489 VanDerWaalsContact O-CB 3.31Å; G485-I489 WeakPolarHBondContact O-CB 3.5Å; G485-I489 PolarHBondContact O-N 3.33Å; G485-Y490 PolarHBondContact O-N 3.3Å
486V96.5Very high95.4Very high0 Ų035.5 Ų35.50%018%0.175CC..Iπ-helixtrans-82.3-45.5-179.2170.60000112L68 I72 W84 I87 E482 I483 V484 Y490 G491 F495L68-V486 HydrophobicContact CD1-CB 4.02Å; L68-V486 HydrophobicContact CD1-CG1 4.07Å; L68-V486 HydrophobicContact CD2-CB 4.28Å; L68-V486 HydrophobicContact CD2-CG2 3.9Å; L68-V486 HydrophobicContact CG-CB 4.25Å; L68-V486 HydrophobicContact CG-CG1 4.13Å; L68-V486 HydrophobicContact CG-CG2 4.33Å; I72-V486 HydrophobicContact CD1-CG2 4.49Å; I72-V486 HydrophobicContact CG1-CG2 4.39Å; W84-V486 HydrophobicContact CH2-CG2 3.95Å; W84-V486 HydrophobicContact CZ3-CG2 3.9Å; I87-V486 HydrophobicContact CD1-CG2 4.04Å; E482-V486 PolarHBondContact O-N 3.02Å; I483-V486 PolarHBondContact O-N 3.36Å; V484-V486 PolarHBondContact O-N 3.04Å; V486-Y490 WeakPolarHBondContact O-CB 3.47Å; V486-G491 PolarHBondContact O-N 3.08Å; V486-G491 VanDerWaalsContact O-N 3.13Å; V486-F495 HydrophobicContact CG1-CB 4.37Å; V486-F495 HydrophobicContact CG1-CD1 4.09Å; V486-F495 HydrophobicContact CG1-CD2 3.65Å; V486-F495 HydrophobicContact CG1-CE1 4.15Å; V486-F495 HydrophobicContact CG1-CE2 3.81Å; V486-F495 HydrophobicContact CG1-CG 3.78Å; V486-F495 HydrophobicContact CG1-CZ 4.03Å
487A95.3Very high95.7Very high7 Ų739.4 Ų39.46%0.05819%0.193CC..Iπ-helixtrans-70.6-40.8-174.100000112.8I483 M492I483-A487 HydrophobicContact CG2-CB 4.41Å; I483-A487 WeakPolarHBondContact O-CB 3.4Å; I483-A487 PolarHBondContact O-N 3.19Å; A487-M492 PolarHBondContact O-N 3.13Å
488Y95.6Very high95.8Very high130 Ų13038.2 Ų38.251%0.5119%0.188SC..Iπ-helixtrans-109.7-37-172.9-58.3-88.5000114.4V484 M516V484-Y488 HydrophobicContact CB-CD2 4.4Å; V484-Y488 HydrophobicContact CG1-CD2 4.17Å; V484-Y488 HydrophobicContact CG2-CD2 4.45Å; V484-Y488 HydrophobicContact CG2-CE2 4.5Å; V484-Y488 WeakPolarHBondContact O-CB 3.32Å; V484-Y488 PolarHBondContact O-N 3.4Å; Y488-M516 PolarHBondContact OH-O 3.07Å
489I95.3Very high95.8Very high89 Ų8938.2 Ų38.246%0.45619%0.188SC..Iπ-helixtrans-84.9-53.7-177.9-62.5171.1000110.9I87 L91 V484 G485 G491I87-I489 HydrophobicContact CG2-CG2 4.27Å; L91-I489 HydrophobicContact CD1-CB 4.43Å; L91-I489 HydrophobicContact CD1-CD1 3.85Å; L91-I489 HydrophobicContact CD1-CG2 4.31Å; L91-I489 HydrophobicContact CD2-CD1 4Å; L91-I489 HydrophobicContact CG-CD1 4.17Å; V484-I489 PolarHBondContact O-N 3.27Å; G485-I489 VanDerWaalsContact O-CB 3.31Å; G485-I489 WeakPolarHBondContact O-CB 3.5Å; G485-I489 PolarHBondContact O-N 3.33Å; I489-G491 VanDerWaalsContact C-N 3.29Å
490Y95.4Very high95.9Very high47 Ų4743.6 Ų43.618%0.18421%0.209CC..Iπ-helixtrans-67.4-34.8173-169.2-113.2000111.6I87 G485 V486 T494 F495 D498I87-Y490 HydrophobicContact CB-CD2 4.39Å; I87-Y490 HydrophobicContact CG1-CD2 3.92Å; I87-Y490 HydrophobicContact CG1-CG 4.34Å; I87-Y490 HydrophobicContact CG2-CD2 4.18Å; I87-Y490 HydrophobicContact CG2-CG 4.4Å; G485-Y490 PolarHBondContact O-N 3.3Å; V486-Y490 WeakPolarHBondContact O-CB 3.47Å; Y490-T494 HydrophobicContact CD1-CG2 4.48Å; Y490-T494 HydrophobicContact CE1-CG2 3.79Å; Y490-T494 HydrophobicContact CE2-CG2 4.43Å; Y490-T494 PolarHBondContact O-OG1 3.37Å; Y490-F495 HydrophobicContact CD1-CB 4.05Å; Y490-F495 HydrophobicContact CD1-CD2 4.34Å; Y490-F495 HydrophobicContact CE1-CB 4.25Å; Y490-F495 HydrophobicContact CE1-CD2 4.34Å; Y490-D498 VanDerWaalsContact CE1-OD2 3.27Å; Y490-D498 WeakPolarHBondContact CE1-OD2 3.32Å; Y490-D498 VanDerWaalsContact CZ-OD2 3.32Å; Y490-D498 PolarHBondContact OH-OD2 3.18Å
491G95.3Very high95.9Very high19 Ų1944.7 Ų44.720%0.19621%0.213CC..Iπ-helixtrans93.9125.2173.200000112.4V486 I489 K493 T494 F495V486-G491 PolarHBondContact O-N 3.08Å; V486-G491 VanDerWaalsContact O-N 3.13Å; I489-G491 VanDerWaalsContact C-N 3.29Å; G491-K493 PolarHBondContact O-N 3.21Å; G491-K493 VanDerWaalsContact O-N 3.12Å; G491-T494 PolarHBondContact O-N 3.29Å; G491-T494 VanDerWaalsContact O-N 3.1Å; G491-F495 PolarHBondContact O-N 3.37Å; G491-F495 VanDerWaalsContact O-N 3.09Å
492M95.5Very high95.9Very high20 Ų2043.8 Ų43.810%0.09921%0.207CC..Hα-helixtrans-59.2-29.1-175.8-172.782.4-63.100114.6A487 F495 S496 K512 W515 M516A487-M492 PolarHBondContact O-N 3.13Å; M492-F495 HydrophobicContact CE-CB 3.78Å; M492-F495 HydrophobicContact CE-CD1 3.3Å; M492-F495 HydrophobicContact CE-CE1 4.21Å; M492-F495 HydrophobicContact CE-CG 3.94Å; M492-S496 VanDerWaalsContact O-CB 3.23Å; M492-S496 WeakPolarHBondContact O-CB 3.25Å; M492-S496 PolarHBondContact O-N 3.32Å; M492-K512 HydrophobicContact SD-CG 4.46Å; M492-W515 HydrophobicContact CE-CE3 3.77Å; M492-W515 HydrophobicContact CE-CZ3 4.25Å; M492-W515 HydrophobicContact SD-CB 4.25Å; M492-W515 HydrophobicContact SD-CE3 3.83Å; M492-M516 HydrophobicContact CB-CG 4.46Å; M492-M516 HydrophobicContact CB-SD 4.19Å; M492-M516 HydrophobicContact CG-CG 4.08Å; M492-M516 HydrophobicContact CG-SD 3.79Å; M492-M516 HydrophobicContact SD-CG 3.96Å; M492-M516 HydrophobicContact SD-SD 4.39Å
493K95Very high95.8Very high185 Ų18545.2 Ų45.280%0.80422%0.216SC*.Hα-helixtrans-65.2-51175.5-68.8-178.7-178.3176.80110.9G491 F495 S496 E497G491-K493 PolarHBondContact O-N 3.21Å; G491-K493 VanDerWaalsContact O-N 3.12Å; K493-F495 PolarHBondContact O-N 2.8Å; K493-S496 PolarHBondContact O-N 3.26Å; K493-E497 WeakPolarHBondContact O-CG 3.47Å; K493-E497 PolarHBondContact O-N 3.39Å; K493-E497 VanDerWaalsContact O-N 3.08Å
494T95.6Very high95.7Very high66 Ų6647.5 Ų47.541%0.40524%0.239SC..Hα-helixtrans-58.4-49.8178.3-45.30000110.5Y490 G491 S496 E497 D498Y490-T494 HydrophobicContact CD1-CG2 4.48Å; Y490-T494 HydrophobicContact CE1-CG2 3.79Å; Y490-T494 HydrophobicContact CE2-CG2 4.43Å; Y490-T494 PolarHBondContact O-OG1 3.37Å; G491-T494 PolarHBondContact O-N 3.29Å; G491-T494 VanDerWaalsContact O-N 3.1Å; T494-S496 VanDerWaalsContact C-N 3.31Å; T494-S496 PolarHBondContact O-N 3.01Å; T494-E497 PolarHBondContact O-N 2.81Å; T494-E497 VanDerWaalsContact O-N 3.08Å; T494-D498 PolarHBondContact O-N 2.76Å
495F96.7Very high95.5Very high1 Ų154 Ų540%0.00426%0.259CS..Hα-helixtrans-60.6-39.2178.4-169.7-111.6000113L68 A71 I72 V486 Y490 G491 M492 K493 E497 D498 I499 W515L68-F495 HydrophobicContact CG-CZ 4.37Å; A71-F495 HydrophobicContact CB-CE2 4.23Å; A71-F495 HydrophobicContact CB-CZ 3.83Å; I72-F495 HydrophobicContact CB-CE2 4.36Å; I72-F495 HydrophobicContact CD1-CD2 4.36Å; I72-F495 HydrophobicContact CD1-CE2 4.16Å; V486-F495 HydrophobicContact CG1-CB 4.37Å; V486-F495 HydrophobicContact CG1-CD1 4.09Å; V486-F495 HydrophobicContact CG1-CD2 3.65Å; V486-F495 HydrophobicContact CG1-CE1 4.15Å; V486-F495 HydrophobicContact CG1-CE2 3.81Å; V486-F495 HydrophobicContact CG1-CG 3.78Å; V486-F495 HydrophobicContact CG1-CZ 4.03Å; Y490-F495 HydrophobicContact CD1-CB 4.05Å; Y490-F495 HydrophobicContact CD1-CD2 4.34Å; Y490-F495 HydrophobicContact CE1-CB 4.25Å; Y490-F495 HydrophobicContact CE1-CD2 4.34Å; G491-F495 PolarHBondContact O-N 3.37Å; G491-F495 VanDerWaalsContact O-N 3.09Å; M492-F495 HydrophobicContact CE-CB 3.78Å; M492-F495 HydrophobicContact CE-CD1 3.3Å; M492-F495 HydrophobicContact CE-CE1 4.21Å; M492-F495 HydrophobicContact CE-CG 3.94Å; K493-F495 PolarHBondContact O-N 2.8Å; F495-E497 VanDerWaalsContact C-N 3.32Å; F495-E497 PolarHBondContact O-N 3.12Å; F495-D498 PolarHBondContact O-N 3.32Å; F495-I499 HydrophobicContact CD1-CD1 3.63Å; F495-I499 HydrophobicContact CD1-CG1 4.41Å; F495-I499 HydrophobicContact CE1-CD1 3.36Å; F495-I499 HydrophobicContact CE1-CG1 4.25Å; F495-I499 HydrophobicContact CG-CD1 4.45Å; F495-I499 HydrophobicContact CZ-CD1 3.91Å; F495-I499 HydrophobicContact CZ-CG1 4.41Å; F495-I499 WeakPolarHBondContact O-CG1 3.17Å; F495-I499 PolarHBondContact O-N 3.4Å; F495-W515 HydrophobicContact CD1-CH2 4.45Å; F495-W515 HydrophobicContact CD1-CZ3 4.13Å; F495-W515 HydrophobicContact CE1-CE3 4.28Å; F495-W515 AromaticContact CE1-CH2 3.69Å; F495-W515 HydrophobicContact CE1-CH2 3.69Å; F495-W515 HydrophobicContact CE1-CZ2 4.11Å; F495-W515 AromaticContact CE1-CZ3 3.79Å; F495-W515 HydrophobicContact CE1-CZ3 3.79Å
496S96.8Very high95.5Very high4 Ų460.2 Ų60.23%0.02828%0.283CS..Hα-helixtrans-65.7-32.7175.9-178.90000113M492 K493 T494 Y500 P507M492-S496 VanDerWaalsContact O-CB 3.23Å; M492-S496 WeakPolarHBondContact O-CB 3.25Å; M492-S496 PolarHBondContact O-N 3.32Å; K493-S496 PolarHBondContact O-N 3.26Å; T494-S496 VanDerWaalsContact C-N 3.31Å; T494-S496 PolarHBondContact O-N 3.01Å; S496-Y500 WeakPolarHBondContact O-CB 3.46Å; S496-Y500 PolarHBondContact O-N 3.38Å; S496-P507 WeakPolarHBondContact OG-CD 3.37Å
497E97.2Very high95.4Very high84 Ų8460.4 Ų60.439%0.39328%0.284SS..Hα-helixtrans-74.2-37.9173.7-64-57.7151.800111.3K493 T494 F495 Y500 F501 R506K493-E497 WeakPolarHBondContact O-CG 3.47Å; K493-E497 PolarHBondContact O-N 3.39Å; K493-E497 VanDerWaalsContact O-N 3.08Å; T494-E497 PolarHBondContact O-N 2.81Å; T494-E497 VanDerWaalsContact O-N 3.08Å; F495-E497 VanDerWaalsContact C-N 3.32Å; F495-E497 PolarHBondContact O-N 3.12Å; E497-Y500 WeakPolarHBondContact O-CB 3.47Å; E497-Y500 PolarHBondContact O-N 3.12Å; E497-F501 PolarHBondContact O-N 3.37Å; E497-R506 IonicContact OE1-CZ 3.09Å; E497-R506 IonicContact OE1-NH1 2.72Å; E497-R506 PolarHBondContact OE1-NH1 3.18Å; E497-R506 IonicContact OE1-NH2 2.62Å; E497-R506 PolarHBondContact OE1-NH2 2.88Å; E497-R506 IonicContact OE2-CZ 2.69Å; E497-R506 IonicContact OE2-NH2 2.99Å; E497-R506 PolarHBondContact OE2-NH2 3.23Å
498D96.2Very high95.4Very high15 Ų1563.7 Ų63.78%0.0830%0.3CS..Hα-helixtrans-63.5-42.7175.3-73.5-39.3000111.9R75 Y490 T494 F495 Y500 F501 M502R75-D498 HydrophobicContact CG-CB 3.98Å; R75-D498 IonicContact CZ-OD1 3.47Å; R75-D498 VanDerWaalsContact NE-CG 3.32Å; R75-D498 IonicContact NE-OD1 2.76Å; R75-D498 PolarHBondContact NE-OD1 3.09Å; R75-D498 IonicContact NH2-OD1 2.67Å; R75-D498 PolarHBondContact NH2-OD1 3.47Å; R75-D498 VanDerWaalsContact NH2-OD1 3.12Å; Y490-D498 VanDerWaalsContact CE1-OD2 3.27Å; Y490-D498 WeakPolarHBondContact CE1-OD2 3.32Å; Y490-D498 VanDerWaalsContact CZ-OD2 3.32Å; Y490-D498 PolarHBondContact OH-OD2 3.18Å; T494-D498 PolarHBondContact O-N 2.76Å; F495-D498 PolarHBondContact O-N 3.32Å; D498-Y500 VanDerWaalsContact C-N 3.33Å; D498-Y500 PolarHBondContact O-N 3.09Å; D498-F501 WeakPolarHBondContact O-CB 3.13Å; D498-F501 PolarHBondContact O-N 2.72Å; D498-M502 WeakPolarHBondContact O-CG 3.24Å; D498-M502 PolarHBondContact O-N 3.31Å
499I96.4Very high95.4Very high0 Ų064.6 Ų64.60%031%0.313CS..Hα-helixtrans-60.8-45.5172.3-70.8170.7000110.3Y67 A71 F495 F501 M502 T503 P507 W515Y67-I499 HydrophobicContact CE1-CD1 4.49Å; Y67-I499 VanDerWaalsContact OH-CG2 3.22Å; Y67-I499 WeakPolarHBondContact OH-CG2 3.26Å; A71-I499 HydrophobicContact CB-CG1 4.41Å; F495-I499 HydrophobicContact CD1-CD1 3.63Å; F495-I499 HydrophobicContact CD1-CG1 4.41Å; F495-I499 HydrophobicContact CE1-CD1 3.36Å; F495-I499 HydrophobicContact CE1-CG1 4.25Å; F495-I499 HydrophobicContact CG-CD1 4.45Å; F495-I499 HydrophobicContact CZ-CD1 3.91Å; F495-I499 HydrophobicContact CZ-CG1 4.41Å; F495-I499 WeakPolarHBondContact O-CG1 3.17Å; F495-I499 PolarHBondContact O-N 3.4Å; I499-F501 VanDerWaalsContact C-N 3.26Å; I499-F501 PolarHBondContact O-N 3.31Å; I499-M502 HydrophobicContact CG1-CE 4.25Å; I499-M502 PolarHBondContact O-N 3.11Å; I499-M502 VanDerWaalsContact O-N 3.08Å; I499-T503 HydrophobicContact CG2-CG2 4.42Å; I499-T503 PolarHBondContact O-N 2.58Å; I499-T503 PolarHBondContact O-OG1 3.11Å; I499-T503 VanDerWaalsContact O-OG1 3.07Å; I499-P507 HydrophobicContact CD1-CB 4.5Å; I499-P507 HydrophobicContact CD1-CG 4.12Å; I499-W515 HydrophobicContact CD1-CH2 3.8Å; I499-W515 HydrophobicContact CD1-CZ3 4.09Å
500Y96.6Very high95.5Very high113 Ų11363.8 Ų63.844%0.44330%0.304SS..Hα-helixtrans-60-37.7177.7178.4-106000112.1S496 E497 D498 G504 R506S496-Y500 WeakPolarHBondContact O-CB 3.46Å; S496-Y500 PolarHBondContact O-N 3.38Å; E497-Y500 WeakPolarHBondContact O-CB 3.47Å; E497-Y500 PolarHBondContact O-N 3.12Å; D498-Y500 VanDerWaalsContact C-N 3.33Å; D498-Y500 PolarHBondContact O-N 3.09Å; Y500-G504 VanDerWaalsContact CE2-O 3.29Å; Y500-G504 WeakPolarHBondContact CE2-O 3.12Å; Y500-G504 WeakPolarHBondContact O-CA 3.49Å; Y500-G504 PolarHBondContact O-N 3.25Å; Y500-R506 HydrophobicContact CD2-CG 3.87Å; Y500-R506 HydrophobicContact CG-CG 4.11Å
501F95.6Very high95.6Very high94 Ų9461.9 Ų61.941%0.41230%0.297SS..Hα-helixtrans-64.3-39.3174173.6-98.5000112.7E497 D498 I499E497-F501 PolarHBondContact O-N 3.37Å; D498-F501 WeakPolarHBondContact O-CB 3.13Å; D498-F501 PolarHBondContact O-N 2.72Å; I499-F501 VanDerWaalsContact C-N 3.26Å; I499-F501 PolarHBondContact O-N 3.31Å
502M95.3Very high95.6Very high6 Ų664.2 Ų64.23%0.0330%0.301CS..Hα-helixtrans-77.8-45.7-178.5-67.7-173.7-6700113.5A71 Q74 R75 E276 R277 D498 I499A71-M502 HydrophobicContact CB-CE 4.22Å; Q74-M502 HydrophobicContact CB-SD 4.18Å; Q74-M502 HydrophobicContact CG-SD 4.04Å; R75-M502 HydrophobicContact CB-CE 3.99Å; R75-M502 HydrophobicContact CB-SD 3.74Å; E276-M502 WeakPolarHBondContact O-CB 3.27Å; E276-M502 WeakPolarHBondContact O-CG 3.47Å; R277-M502 WeakPolarHBondContact CA-O 3.34Å; D498-M502 WeakPolarHBondContact O-CG 3.24Å; D498-M502 PolarHBondContact O-N 3.31Å; I499-M502 HydrophobicContact CG1-CE 4.25Å; I499-M502 PolarHBondContact O-N 3.11Å; I499-M502 VanDerWaalsContact O-N 3.08Å
503T94.1Very high95.7Very high31 Ų3165 Ų6519%0.1931%0.311CS..Hα-helixtrans-107.7-12.1-170.3700000113.6I499 R505I499-T503 HydrophobicContact CG2-CG2 4.42Å; I499-T503 PolarHBondContact O-N 2.58Å; I499-T503 PolarHBondContact O-OG1 3.11Å; I499-T503 VanDerWaalsContact O-OG1 3.07Å; T503-R505 PolarHBondContact O-N 2.8Å; T503-R505 PolarHBondContact OG1-N 3.2Å; T503-R505 PolarHBondContact OG1-O 2.87Å; T503-R505 VanDerWaalsContact OG1-O 3.13Å
504G93.3Very high95.8Very high47 Ų4756.2 Ų56.249%0.48527%0.273SS..SBendtrans75.13.9-173.200000114.2Y500Y500-G504 VanDerWaalsContact CE2-O 3.29Å; Y500-G504 WeakPolarHBondContact CE2-O 3.12Å; Y500-G504 WeakPolarHBondContact O-CA 3.49Å; Y500-G504 PolarHBondContact O-N 3.25Å
505R93.5Very high95.9Very high177 Ų17753 Ų5367%0.66825%0.254SS*.SBendtrans-131.6137.9-178.6-62179.6-175.51731.8110.2T503T503-R505 PolarHBondContact O-N 2.8Å; T503-R505 PolarHBondContact OG1-N 3.2Å; T503-R505 PolarHBondContact OG1-O 2.87Å; T503-R505 VanDerWaalsContact OG1-O 3.13Å
506R94.3Very high95.9Very high130 Ų13056.9 Ų56.949%0.49127%0.272SS..  trans-78145.1173.1-69179.4-175.1-125.8-8.1109.4E497 Y500 N508E497-R506 IonicContact OE1-CZ 3.09Å; E497-R506 IonicContact OE1-NH1 2.72Å; E497-R506 PolarHBondContact OE1-NH1 3.18Å; E497-R506 IonicContact OE1-NH2 2.62Å; E497-R506 PolarHBondContact OE1-NH2 2.88Å; E497-R506 IonicContact OE2-CZ 2.69Å; E497-R506 IonicContact OE2-NH2 2.99Å; E497-R506 PolarHBondContact OE2-NH2 3.23Å; Y500-R506 HydrophobicContact CD2-CG 3.87Å; Y500-R506 HydrophobicContact CG-CG 4.11Å; R506-N508 PolarHBondContact O-N 3.19Å
507P94.9Very high95.9Very high4 Ų461 Ų613%0.02630%0.297CS..  trans-57.6136.3173.122.1-31.3000110.4S496 I499 W511 K512 W515S496-P507 WeakPolarHBondContact OG-CD 3.37Å; I499-P507 HydrophobicContact CD1-CB 4.5Å; I499-P507 HydrophobicContact CD1-CG 4.12Å; P507-W511 HydrophobicContact CB-CB 4.02Å; P507-K512 VanDerWaalsContact O-CE 3.25Å; P507-K512 WeakPolarHBondContact O-CE 3.35Å; P507-W515 HydrophobicContact CB-CH2 4.41Å; P507-W515 HydrophobicContact CB-CZ3 3.93Å; P507-W515 HydrophobicContact CG-CZ3 4.22Å
508N95.1Very high95.8Very high76 Ų7659.6 Ų59.641%0.40629%0.292SS..  trans-66.1175177.967.322.9000111.9R506 Y510 W511 K512R506-N508 PolarHBondContact O-N 3.19Å; N508-Y510 PolarHBondContact O-N 3.01Å; N508-Y510 WeakPolarHBondContact OD1-CB 3.25Å; N508-Y510 PolarHBondContact OD1-N 3.03Å; N508-Y510 VanDerWaalsContact OD1-N 3.15Å; N508-W511 VanDerWaalsContact CG-CD1 3.43Å; N508-W511 PolarHBondContact O-N 3Å; N508-W511 PolarHBondContact OD1-N 3.29Å; N508-K512 PolarHBondContact O-N 3.37Å
509I95.8Very high95.8Very high149 Ų14958.9 Ų58.976%0.76429%0.288SS*.Hα-helixtrans-63.3-34.6-179.2-62.1168.8000111.2K512 A513I509-K512 PolarHBondContact O-N 2.68Å; I509-A513 WeakPolarHBondContact O-CB 3.48Å; I509-A513 PolarHBondContact O-N 2.9Å
510Y96.9Very high95.7Very high71 Ų7159.4 Ų59.428%0.27829%0.291SS..Hα-helixtrans-59-54.1178.2163.6-94.9000111.7V59 F60 N508 K512 A513 C514V59-Y510 HydrophobicContact CG1-CE2 4.19Å; V59-Y510 WeakPolarHBondContact CG1-OH 3.29Å; V59-Y510 PolarHBondContact O-OH 3.26Å; F60-Y510 HydrophobicContact CE1-CE2 4.28Å; N508-Y510 PolarHBondContact O-N 3.01Å; N508-Y510 WeakPolarHBondContact OD1-CB 3.25Å; N508-Y510 PolarHBondContact OD1-N 3.03Å; N508-Y510 VanDerWaalsContact OD1-N 3.15Å; Y510-K512 VanDerWaalsContact C-N 3.3Å; Y510-K512 PolarHBondContact O-N 2.88Å; Y510-A513 PolarHBondContact O-N 2.95Å; Y510-A513 VanDerWaalsContact O-N 3.16Å; Y510-C514 PolarHBondContact O-N 3.37Å; Y510-C514 PolarHBondContact O-SG 3.3Å; Y510-C514 VanDerWaalsContact O-SG 3.38Å
511W97.3Very high95.6Very high7 Ų758.8 Ų58.83%0.02730%0.295CS..Hα-helixtrans-59-42.4179.3-65.1125.9000112L63 P64 Y67 E281 L285 P507 N508 C514 W515L63-W511 HydrophobicContact CB-CH2 4.27Å; L63-W511 HydrophobicContact CB-CZ3 4.28Å; P64-W511 HydrophobicContact CG-CE3 4.48Å; P64-W511 HydrophobicContact CG-CZ3 4.24Å; Y67-W511 AromaticContact CD1-CD2 3.75Å; Y67-W511 HydrophobicContact CD1-CD2 3.75Å; Y67-W511 AromaticContact CD1-CE2 3.93Å; Y67-W511 AromaticContact CD1-CE3 3.83Å; Y67-W511 HydrophobicContact CD1-CE3 3.83Å; Y67-W511 HydrophobicContact CD1-CG 4.22Å; Y67-W511 HydrophobicContact CD1-CH2 4.29Å; Y67-W511 HydrophobicContact CD1-CZ2 4.21Å; Y67-W511 HydrophobicContact CD1-CZ3 4.11Å; Y67-W511 HydrophobicContact CE1-CD2 4.06Å; Y67-W511 HydrophobicContact CE1-CG 4.1Å; E281-W511 HydrophobicContact CG-CZ2 4.38Å; E281-W511 PolarHBondContact OE1-NE1 3.18Å; L285-W511 HydrophobicContact CD2-CH2 3.96Å; L285-W511 HydrophobicContact CD2-CZ2 4.01Å; L285-W511 HydrophobicContact CG-CZ2 4.4Å; P507-W511 HydrophobicContact CB-CB 4.02Å; N508-W511 VanDerWaalsContact CG-CD1 3.43Å; N508-W511 PolarHBondContact O-N 3Å; N508-W511 PolarHBondContact OD1-N 3.29Å; W511-C514 PolarHBondContact O-N 3.37Å; W511-W515 HydrophobicContact CB-CE3 4.17Å; W511-W515 HydrophobicContact CB-CH2 4.04Å; W511-W515 HydrophobicContact CB-CZ2 4.48Å; W511-W515 HydrophobicContact CB-CZ3 3.86Å; W511-W515 VanDerWaalsContact O-CD2 3.29Å; W511-W515 PolarHBondContact O-N 2.93Å
512K96.4Very high95.5Very high68 Ų6856.5 Ų56.530%0.29629%0.286SS..Hα-helixtrans-63.9-43.4177.1-68.2177.2-179174.60112.1M492 P507 N508 I509 Y510 C514 M516M492-K512 HydrophobicContact SD-CG 4.46Å; P507-K512 VanDerWaalsContact O-CE 3.25Å; P507-K512 WeakPolarHBondContact O-CE 3.35Å; N508-K512 PolarHBondContact O-N 3.37Å; I509-K512 PolarHBondContact O-N 2.68Å; Y510-K512 VanDerWaalsContact C-N 3.3Å; Y510-K512 PolarHBondContact O-N 2.88Å; K512-C514 VanDerWaalsContact C-N 3.34Å; K512-M516 WeakPolarHBondContact O-CB 3.49Å; K512-M516 VanDerWaalsContact O-CG 3.25Å; K512-M516 WeakPolarHBondContact O-CG 3.43Å; K512-M516 PolarHBondContact O-N 3.01Å
513A97.3Very high95.3Very high37 Ų3756.3 Ų56.331%0.30629%0.286SS..Hα-helixtrans-64.2-39.9177.400000111.7I509 Y510 V517 I518I509-A513 WeakPolarHBondContact O-CB 3.48Å; I509-A513 PolarHBondContact O-N 2.9Å; Y510-A513 PolarHBondContact O-N 2.95Å; Y510-A513 VanDerWaalsContact O-N 3.16Å; A513-V517 PolarHBondContact O-N 3.27Å; A513-I518 HydrophobicContact CB-CD1 4.2Å; A513-I518 PolarHBondContact O-N 2.99Å
514C97.2Very high95.1Very high0 Ų058.7 Ų58.70%030%0.297CS..Iπ-helixtrans-60.9-56.2174.9-68.10000111.6P64 Y510 W511 K512 M516 I518 S519 P520P64-C514 HydrophobicContact CB-CB 3.81Å; P64-C514 HydrophobicContact CG-CB 3.56Å; Y510-C514 PolarHBondContact O-N 3.37Å; Y510-C514 PolarHBondContact O-SG 3.3Å; Y510-C514 VanDerWaalsContact O-SG 3.38Å; W511-C514 PolarHBondContact O-N 3.37Å; K512-C514 VanDerWaalsContact C-N 3.34Å; C514-M516 PolarHBondContact O-N 2.84Å; C514-I518 PolarHBondContact O-N 2.82Å; C514-S519 WeakPolarHBondContact O-CB 3.4Å; C514-S519 PolarHBondContact O-N 3.45Å; C514-S519 PolarHBondContact O-OG 3.44Å; C514-S519 VanDerWaalsContact O-OG 3.08Å; C514-P520 VanDerWaalsContact O-CD 3.3Å; C514-P520 WeakPolarHBondContact O-CD 3.48Å
515W97.5Very high95Very high0 Ų060.7 Ų60.70%030%0.299CS..Iπ-helixtrans-66.7-34-177.6-63.6-39.4000114.3P64 Y67 L68 I483 M492 F495 I499 P507 W511 P520P64-W515 PolarHBondContact O-NE1 3.3Å; Y67-W515 AromaticContact CD1-CH2 3.48Å; Y67-W515 HydrophobicContact CD1-CH2 3.48Å; Y67-W515 VanDerWaalsContact CD1-CH2 3.48Å; Y67-W515 AromaticContact CD1-CZ2 3.31Å; Y67-W515 HydrophobicContact CD1-CZ2 3.31Å; Y67-W515 AromaticContact CE1-CH2 3.38Å; Y67-W515 HydrophobicContact CE1-CH2 3.38Å; Y67-W515 AromaticContact CE1-CZ2 3.77Å; Y67-W515 HydrophobicContact CE1-CZ2 3.77Å; Y67-W515 HydrophobicContact CG-CH2 4.38Å; Y67-W515 AromaticContact CG-CZ2 3.95Å; Y67-W515 HydrophobicContact CG-CZ2 3.95Å; L68-W515 HydrophobicContact CB-CZ2 4.34Å; L68-W515 HydrophobicContact CD1-CG 4.36Å; I483-W515 VanDerWaalsContact CG2-O 3.23Å; I483-W515 WeakPolarHBondContact CG2-O 3.25Å; M492-W515 HydrophobicContact CE-CE3 3.77Å; M492-W515 HydrophobicContact CE-CZ3 4.25Å; M492-W515 HydrophobicContact SD-CB 4.25Å; M492-W515 HydrophobicContact SD-CE3 3.83Å; F495-W515 HydrophobicContact CD1-CH2 4.45Å; F495-W515 HydrophobicContact CD1-CZ3 4.13Å; F495-W515 HydrophobicContact CE1-CE3 4.28Å; F495-W515 AromaticContact CE1-CH2 3.69Å; F495-W515 HydrophobicContact CE1-CH2 3.69Å; F495-W515 HydrophobicContact CE1-CZ2 4.11Å; F495-W515 AromaticContact CE1-CZ3 3.79Å; F495-W515 HydrophobicContact CE1-CZ3 3.79Å; I499-W515 HydrophobicContact CD1-CH2 3.8Å; I499-W515 HydrophobicContact CD1-CZ3 4.09Å; P507-W515 HydrophobicContact CB-CH2 4.41Å; P507-W515 HydrophobicContact CB-CZ3 3.93Å; P507-W515 HydrophobicContact CG-CZ3 4.22Å; W511-W515 HydrophobicContact CB-CE3 4.17Å; W511-W515 HydrophobicContact CB-CH2 4.04Å; W511-W515 HydrophobicContact CB-CZ2 4.48Å; W511-W515 HydrophobicContact CB-CZ3 3.86Å; W511-W515 VanDerWaalsContact O-CD2 3.29Å; W511-W515 PolarHBondContact O-N 2.93Å; W515-P520 WeakPolarHBondContact O-CG 3.29Å
516M96.8Very high94.7Very high81 Ų8153 Ų5340%0.39927%0.272SS..Iπ-helixtrans-90.7-19.4-175.1-66.3-17464.200114.5Y488 M492 K512 C514Y488-M516 PolarHBondContact OH-O 3.07Å; M492-M516 HydrophobicContact CB-CG 4.46Å; M492-M516 HydrophobicContact CB-SD 4.19Å; M492-M516 HydrophobicContact CG-CG 4.08Å; M492-M516 HydrophobicContact CG-SD 3.79Å; M492-M516 HydrophobicContact SD-CG 3.96Å; M492-M516 HydrophobicContact SD-SD 4.39Å; K512-M516 WeakPolarHBondContact O-CB 3.49Å; K512-M516 VanDerWaalsContact O-CG 3.25Å; K512-M516 WeakPolarHBondContact O-CG 3.43Å; K512-M516 PolarHBondContact O-N 3.01Å; C514-M516 PolarHBondContact O-N 2.84Å
517V96.3Very high94.4Very high91 Ų9149.9 Ų49.955%0.55226%0.262SS*.Iπ-helixtrans-143.1-59-173.6-175.10000111.8A513 L521A513-V517 PolarHBondContact O-N 3.27Å; V517-L521 WeakPolarHBondContact O-CB 3.38Å; V517-L521 PolarHBondContact O-N 2.87Å; V517-L521 VanDerWaalsContact O-N 3.12Å
518I96.3Very high94.1Very high54 Ų5453.6 Ų53.628%0.27729%0.285SS..Iπ-helixtrans-68.6-54.2-164.9-53.2169.6000111.1F60 A513 C514 L521 M522F60-I518 HydrophobicContact CB-CG2 3.94Å; F60-I518 HydrophobicContact CD1-CD1 4.11Å; F60-I518 HydrophobicContact CD1-CG2 3.88Å; F60-I518 HydrophobicContact CE1-CD1 4.26Å; F60-I518 HydrophobicContact CG-CG2 4.13Å; A513-I518 HydrophobicContact CB-CD1 4.2Å; A513-I518 PolarHBondContact O-N 2.99Å; C514-I518 PolarHBondContact O-N 2.82Å; I518-L521 PolarHBondContact O-N 3.27Å; I518-M522 HydrophobicContact CG2-CG 4.39Å; I518-M522 HydrophobicContact CG2-SD 4.15Å; I518-M522 WeakPolarHBondContact O-CB 3.43Å; I518-M522 WeakPolarHBondContact O-CG 3.22Å; I518-M522 PolarHBondContact O-N 3.27Å
519S95.1Very high93.7Very high0 Ų051.4 Ų51.40%028%0.277CS..Hα-helixtrans-65.7-46.4-176.2-42.20000112.3F60 C514 L521 M522 L523F60-S519 WeakPolarHBondContact O-CB 3.38Å; F60-S519 PolarHBondContact O-OG 2.97Å; C514-S519 WeakPolarHBondContact O-CB 3.4Å; C514-S519 PolarHBondContact O-N 3.45Å; C514-S519 PolarHBondContact O-OG 3.44Å; C514-S519 VanDerWaalsContact O-OG 3.08Å; S519-L521 VanDerWaalsContact C-N 3.31Å; S519-L521 PolarHBondContact O-N 3.46Å; S519-M522 PolarHBondContact O-N 3.1Å; S519-L523 WeakPolarHBondContact O-CB 3.35Å; S519-L523 WeakPolarHBondContact O-CG 3.32Å; S519-L523 PolarHBondContact O-N 3.42Å
520P94.8Very high93.1Very high11 Ų1145.4 Ų45.47%0.07125%0.245CC..Hα-helixtrans-58.8-39.1174.5-24.833.8000113.7F480 I483 C514 W515 L524F480-P520 HydrophobicContact CE2-CB 4.41Å; I483-P520 HydrophobicContact CG2-CG 3.71Å; C514-P520 VanDerWaalsContact O-CD 3.3Å; C514-P520 WeakPolarHBondContact O-CD 3.48Å; W515-P520 WeakPolarHBondContact O-CG 3.29Å; P520-L524 WeakPolarHBondContact O-CB 3.42Å; P520-L524 PolarHBondContact O-N 3.22Å
521L94.8Very high92.6Very high100 Ų10045.4 Ų45.452%0.52425%0.252SS..Hα-helixtrans-69.9-44.4178.6-178.563.7000111.4V517 I518 S519 L524 V525V517-L521 WeakPolarHBondContact O-CB 3.38Å; V517-L521 PolarHBondContact O-N 2.87Å; V517-L521 VanDerWaalsContact O-N 3.12Å; I518-L521 PolarHBondContact O-N 3.27Å; S519-L521 VanDerWaalsContact C-N 3.31Å; S519-L521 PolarHBondContact O-N 3.46Å; L521-L524 PolarHBondContact O-N 2.9Å; L521-V525 HydrophobicContact CD1-CG2 4.48Å; L521-V525 VanDerWaalsContact O-CG2 3.32Å; L521-V525 WeakPolarHBondContact O-CG2 3.46Å; L521-V525 PolarHBondContact O-N 3.02Å
522M91.9Very high92.1Very high46 Ų4648.2 Ų48.223%0.22728%0.276CS..Hα-helixtrans-59.8-49.1175.6-79-169.166.400111.3I56 F60 I518 S519 L524 V525 V526I56-M522 HydrophobicContact CG2-CE 4.41Å; F60-M522 HydrophobicContact CB-SD 3.68Å; I518-M522 HydrophobicContact CG2-CG 4.39Å; I518-M522 HydrophobicContact CG2-SD 4.15Å; I518-M522 WeakPolarHBondContact O-CB 3.43Å; I518-M522 WeakPolarHBondContact O-CG 3.22Å; I518-M522 PolarHBondContact O-N 3.27Å; S519-M522 PolarHBondContact O-N 3.1Å; M522-L524 VanDerWaalsContact C-N 3.29Å; M522-L524 PolarHBondContact O-N 3.38Å; M522-V525 PolarHBondContact O-N 2.87Å; M522-V525 VanDerWaalsContact O-N 3.13Å; M522-V526 WeakPolarHBondContact O-CB 3.39Å; M522-V526 VanDerWaalsContact O-CG2 3.26Å; M522-V526 WeakPolarHBondContact O-CG2 3.45Å; M522-V526 PolarHBondContact O-N 3.07Å
523L91.4Very high91.4Very high2 Ų247.8 Ų47.81%0.0128%0.277CS..Hα-helixtrans-54-44.8175.1-84.6165.8000112.2E61 F257 L476 A479 F480 I483 S519 F527E61-L523 HydrophobicContact CG-CG 4.5Å; E61-L523 WeakPolarHBondContact OE1-CD2 3.28Å; E61-L523 VanDerWaalsContact OE1-CG 3.31Å; E61-L523 WeakPolarHBondContact OE1-CG 3.46Å; F257-L523 HydrophobicContact CE1-CD2 4.09Å; F257-L523 HydrophobicContact CE2-CD2 4.14Å; F257-L523 HydrophobicContact CZ-CD2 3.38Å; F257-L523 HydrophobicContact CZ-CG 4.4Å; L476-L523 HydrophobicContact CD2-CD2 4Å; A479-L523 HydrophobicContact CB-CD1 4.38Å; A479-L523 HydrophobicContact CB-CD2 4.13Å; F480-L523 HydrophobicContact CB-CD1 4.33Å; F480-L523 HydrophobicContact CD2-CB 4.21Å; I483-L523 HydrophobicContact CD1-CD1 3.62Å; I483-L523 HydrophobicContact CG1-CD1 4.5Å; S519-L523 WeakPolarHBondContact O-CB 3.35Å; S519-L523 WeakPolarHBondContact O-CG 3.32Å; S519-L523 PolarHBondContact O-N 3.42Å; L523-F527 VanDerWaalsContact O-CB 3.26Å; L523-F527 WeakPolarHBondContact O-CB 3.47Å; L523-F527 PolarHBondContact O-N 3.25Å
524L91.4Very high90.6Very high82 Ų8249.3 Ų49.343%0.42928%0.278SS..Hα-helixtrans-65-43.5178.2-176.865.7000111.9P520 L521 M522 F527 V528P520-L524 WeakPolarHBondContact O-CB 3.42Å; P520-L524 PolarHBondContact O-N 3.22Å; L521-L524 PolarHBondContact O-N 2.9Å; M522-L524 VanDerWaalsContact C-N 3.29Å; M522-L524 PolarHBondContact O-N 3.38Å; L524-F527 PolarHBondContact O-N 3.4Å; L524-V528 HydrophobicContact CD1-CG2 4.4Å; L524-V528 WeakPolarHBondContact O-CB 3.38Å; L524-V528 VanDerWaalsContact O-CG2 3.29Å; L524-V528 WeakPolarHBondContact O-CG2 3.37Å; L524-V528 PolarHBondContact O-N 3.3Å
525V89.9Confident89.9Confident88 Ų8853.4 Ų53.453%0.53331%0.312SS..Hα-helixtrans-63.2-46.6177.6169.50000110.7L521 M522 F527 V528 A529L521-V525 HydrophobicContact CD1-CG2 4.48Å; L521-V525 VanDerWaalsContact O-CG2 3.32Å; L521-V525 WeakPolarHBondContact O-CG2 3.46Å; L521-V525 PolarHBondContact O-N 3.02Å; M522-V525 PolarHBondContact O-N 2.87Å; M522-V525 VanDerWaalsContact O-N 3.13Å; V525-F527 VanDerWaalsContact C-N 3.35Å; V525-F527 PolarHBondContact O-N 3.24Å; V525-V528 PolarHBondContact O-N 3.09Å; V525-A529 VanDerWaalsContact O-CB 3.26Å; V525-A529 WeakPolarHBondContact O-CB 3.31Å; V525-A529 PolarHBondContact O-N 3.39Å
526V87.5Confident89Confident15 Ų1556.6 Ų56.69%0.09135%0.345CS..Hα-helixtrans-60.8-44.7177.6172.80000110.5L250 A253 L476 M522 A529 Y530L250-V526 HydrophobicContact CD1-CG1 3.43Å; L250-V526 VanDerWaalsContact CD1-CG1 3.43Å; A253-V526 HydrophobicContact CB-CG1 4Å; A253-V526 HydrophobicContact CB-CG2 3.94Å; L476-V526 HydrophobicContact CD1-CG1 3.99Å; L476-V526 HydrophobicContact CD2-CG1 3.89Å; M522-V526 WeakPolarHBondContact O-CB 3.39Å; M522-V526 VanDerWaalsContact O-CG2 3.26Å; M522-V526 WeakPolarHBondContact O-CG2 3.45Å; M522-V526 PolarHBondContact O-N 3.07Å; V526-A529 PolarHBondContact O-N 3.43Å; V526-Y530 WeakPolarHBondContact O-CB 3.26Å; V526-Y530 PolarHBondContact O-N 2.95Å
527F88.3Confident88.2Confident65 Ų6557.4 Ų57.429%0.28535%0.354SS..Hα-helixtrans-61.7-48.8176.5173.9-107000112.6V473 I477 L523 L524 V525 A529 Y530 V531V473-F527 HydrophobicContact CG1-CD2 4.4Å; V473-F527 HydrophobicContact CG1-CE2 3.93Å; I477-F527 HydrophobicContact CD1-CD2 4.43Å; I477-F527 HydrophobicContact CD1-CE2 3.7Å; I477-F527 HydrophobicContact CD1-CZ 4.13Å; I477-F527 HydrophobicContact CG1-CD2 4.15Å; I477-F527 HydrophobicContact CG1-CE2 3.92Å; L523-F527 VanDerWaalsContact O-CB 3.26Å; L523-F527 WeakPolarHBondContact O-CB 3.47Å; L523-F527 PolarHBondContact O-N 3.25Å; L524-F527 PolarHBondContact O-N 3.4Å; V525-F527 VanDerWaalsContact C-N 3.35Å; V525-F527 PolarHBondContact O-N 3.24Å; F527-A529 VanDerWaalsContact C-N 3.33Å; F527-A529 PolarHBondContact O-N 3.24Å; F527-Y530 PolarHBondContact O-N 3.3Å; F527-V531 HydrophobicContact CD2-CG2 4.32Å; F527-V531 HydrophobicContact CE1-CG2 4.33Å; F527-V531 HydrophobicContact CE2-CG2 3.84Å; F527-V531 HydrophobicContact CZ-CG2 3.86Å; F527-V531 WeakPolarHBondContact O-CG2 3.12Å; F527-V531 PolarHBondContact O-N 3.37Å
528V88.5Confident87.7Confident83 Ų8357.3 Ų57.350%0.50334%0.344SS..Hα-helixtrans-63.3-41.4178.8171.70000110.9L524 V525 V531 A532L524-V528 HydrophobicContact CD1-CG2 4.4Å; L524-V528 WeakPolarHBondContact O-CB 3.38Å; L524-V528 VanDerWaalsContact O-CG2 3.29Å; L524-V528 WeakPolarHBondContact O-CG2 3.37Å; L524-V528 PolarHBondContact O-N 3.3Å; V525-V528 PolarHBondContact O-N 3.09Å; V528-V531 PolarHBondContact O-N 3.46Å; V528-A532 WeakPolarHBondContact O-CB 3.5Å; V528-A532 PolarHBondContact O-N 2.93Å
529A85.9Confident87.3Confident29 Ų2955.3 Ų55.324%0.2434%0.335CS..Hα-helixtrans-62.2-44.3175.900000111.8V525 V526 F527 A532 L533V525-A529 VanDerWaalsContact O-CB 3.26Å; V525-A529 WeakPolarHBondContact O-CB 3.31Å; V525-A529 PolarHBondContact O-N 3.39Å; V526-A529 PolarHBondContact O-N 3.43Å; F527-A529 VanDerWaalsContact C-N 3.33Å; F527-A529 PolarHBondContact O-N 3.24Å; A529-A532 PolarHBondContact O-N 3.22Å; A529-L533 WeakPolarHBondContact O-CB 3.46Å; A529-L533 VanDerWaalsContact O-CG 3.3Å; A529-L533 WeakPolarHBondContact O-CG 3.39Å; A529-L533 PolarHBondContact O-N 3.34Å
530Y84.6Confident87.1Confident24 Ų2459 Ų599%0.09436%0.358CS..Hα-helixtrans-57.9-50.6175.8-174.8-82.2000111.2L250 S472 V473 V526 F527 A532 L533 Q534L250-Y530 HydrophobicContact CD1-CD2 3.91Å; L250-Y530 HydrophobicContact CD1-CG 4.34Å; L250-Y530 HydrophobicContact CD2-CD2 3.71Å; L250-Y530 HydrophobicContact CD2-CG 4.25Å; L250-Y530 HydrophobicContact CG-CD2 4.13Å; S472-Y530 PolarHBondContact OG-OH 3.48Å; V473-Y530 HydrophobicContact CB-CE1 4.49Å; V473-Y530 HydrophobicContact CG2-CD1 3.35Å; V473-Y530 HydrophobicContact CG2-CE1 2.98Å; V473-Y530 HydrophobicContact CG2-CE2 4.37Å; V473-Y530 HydrophobicContact CG2-CG 4.19Å; V526-Y530 WeakPolarHBondContact O-CB 3.26Å; V526-Y530 PolarHBondContact O-N 2.95Å; F527-Y530 PolarHBondContact O-N 3.3Å; Y530-A532 VanDerWaalsContact C-N 3.32Å; Y530-A532 PolarHBondContact O-N 2.95Å; Y530-L533 PolarHBondContact O-N 3.31Å; Y530-Q534 HydrophobicContact CD1-CG 3.81Å; Y530-Q534 HydrophobicContact CE1-CB 4.44Å; Y530-Q534 HydrophobicContact CE1-CG 3.4Å; Y530-Q534 HydrophobicContact CE2-CG 4.39Å; Y530-Q534 HydrophobicContact CG-CG 4.45Å; Y530-Q534 WeakPolarHBondContact O-CB 3.4Å; Y530-Q534 VanDerWaalsContact O-CG 3.3Å; Y530-Q534 WeakPolarHBondContact O-CG 3.4Å; Y530-Q534 PolarHBondContact O-N 2.89Å
531V85.4Confident86.8Confident71 Ų7158.8 Ų58.843%0.4336%0.356SS..Hα-helixtrans-62.3-41-179.8173.80000111.2F527 V528 A535F527-V531 HydrophobicContact CD2-CG2 4.32Å; F527-V531 HydrophobicContact CE1-CG2 4.33Å; F527-V531 HydrophobicContact CE2-CG2 3.84Å; F527-V531 HydrophobicContact CZ-CG2 3.86Å; F527-V531 WeakPolarHBondContact O-CG2 3.12Å; F527-V531 PolarHBondContact O-N 3.37Å; V528-V531 PolarHBondContact O-N 3.46Å; V531-A535 WeakPolarHBondContact O-CB 3.42Å; V531-A535 PolarHBondContact O-N 2.92Å
532A86.5Confident86.6Confident65 Ų6557.2 Ų57.254%0.53735%0.351SS..Hα-helixtrans-64.5-41.4178.200000112.5V528 A529 Y530V528-A532 WeakPolarHBondContact O-CB 3.5Å; V528-A532 PolarHBondContact O-N 2.93Å; A529-A532 PolarHBondContact O-N 3.22Å; Y530-A532 VanDerWaalsContact C-N 3.32Å; Y530-A532 PolarHBondContact O-N 2.95Å
533L82.9Confident86.6Confident59 Ų5955 Ų5531%0.30934%0.34SS..Hα-helixtrans-68.7-45.5178.3-71.2166.1000111.4L250 A529 Y530 A535 G536L250-L533 HydrophobicContact CD2-CD1 3.87Å; A529-L533 WeakPolarHBondContact O-CB 3.46Å; A529-L533 VanDerWaalsContact O-CG 3.3Å; A529-L533 WeakPolarHBondContact O-CG 3.39Å; A529-L533 PolarHBondContact O-N 3.34Å; Y530-L533 PolarHBondContact O-N 3.31Å; L533-A535 VanDerWaalsContact C-N 3.26Å; L533-A535 PolarHBondContact O-N 2.83Å; L533-G536 PolarHBondContact O-N 3.25Å; L533-G536 VanDerWaalsContact O-N 3.08Å
534Q80.3Confident86.6Confident70 Ų7055.2 Ų55.233%0.32734%0.341SS..Hα-helixtrans-67.3-25.2178.5-68.1-65.9-17.100113.5Y530 G536Y530-Q534 HydrophobicContact CD1-CG 3.81Å; Y530-Q534 HydrophobicContact CE1-CB 4.44Å; Y530-Q534 HydrophobicContact CE1-CG 3.4Å; Y530-Q534 HydrophobicContact CE2-CG 4.39Å; Y530-Q534 HydrophobicContact CG-CG 4.45Å; Y530-Q534 WeakPolarHBondContact O-CB 3.4Å; Y530-Q534 VanDerWaalsContact O-CG 3.3Å; Y530-Q534 WeakPolarHBondContact O-CG 3.4Å; Y530-Q534 PolarHBondContact O-N 2.89Å; Q534-G536 PolarHBondContact O-N 3.48Å
535A81.9Confident86.6Confident86 Ų8652.3 Ų52.371%0.71133%0.326SS*.THydrogen-bonded Turntrans-71.7-20.217400000113V531 L533V531-A535 WeakPolarHBondContact O-CB 3.42Å; V531-A535 PolarHBondContact O-N 2.92Å; L533-A535 VanDerWaalsContact C-N 3.26Å; L533-A535 PolarHBondContact O-N 2.83Å
536G77.8Confident86.5Confident67 Ų6749.6 Ų49.669%0.69131%0.31SS*.THydrogen-bonded Turntrans-92-20.2-174.200000115.2L533 Q534L533-G536 PolarHBondContact O-N 3.25Å; L533-G536 VanDerWaalsContact O-N 3.08Å; Q534-G536 PolarHBondContact O-N 3.48Å
537T81.3Confident86.6Confident97 Ų9754.9 Ų54.960%0.59534%0.338SS*.SBendtrans-133.1137-173.450.90000111.8
538Y85.3Confident86.7Confident89 Ų8955.2 Ų55.235%0.34934%0.338SS..  trans-76136.1170.7-165.8-93.8000109.3E558 Y559Y538-E558 HydrophobicContact CD1-CB 3.92Å; Y538-E558 HydrophobicContact CD1-CG 4.02Å; Y538-E558 HydrophobicContact CE1-CB 3.88Å; Y538-E558 HydrophobicContact CE1-CG 4.47Å; Y538-Y559 WeakPolarHBondContact CE1-O 3.45Å; Y538-Y559 VanDerWaalsContact CZ-O 3.32Å; Y538-Y559 PolarHBondContact OH-O 3.13Å
539P87.3Confident86.6Confident13 Ų1360.2 Ų60.28%0.08436%0.356CS..  trans-72.3135.4-173.329.2-35.7000111.8Y469 Y559 F564Y469-P539 WeakPolarHBondContact OH-CB 3.49Å; P539-Y559 HydrophobicContact CB-CD2 3.78Å; P539-Y559 HydrophobicContact CB-CE2 4.24Å; P539-Y559 HydrophobicContact CG-CD2 4.06Å; P539-Y559 WeakPolarHBondContact O-CD2 3.37Å; P539-Y559 PolarHBondContact O-N 3.45Å; P539-Y559 VanDerWaalsContact O-N 3.16Å; P539-F564 HydrophobicContact CG-CD2 3.79Å; P539-F564 HydrophobicContact CG-CE2 4.07Å
540T90.9Very high86.6Confident77 Ų7762.9 Ų62.947%0.47237%0.366SS..EExtended strand (participates in β ladder)trans-118.8162.4-179.857.40000111.5T556 K557 E558T540-T556 HydrophobicContact CG2-CG2 4.16Å; T540-K557 CarbonylContact C-O 3.5Å; T540-K557 WeakPolarHBondContact CA-O 3.25Å; T540-K557 WeakPolarHBondContact CB-O 3.5Å; T540-E558 HydrophobicContact CG2-CG 4.2Å
541Y90.3Very high86.6Confident6 Ų663 Ų632%0.02437%0.367CS..EExtended strand (participates in β ladder)trans-142.9150.7175.170.4-80.6000111.9D167 I168 Y461 A543 K557 Y559D167-Y541 PolarHBondContact OD1-OH 3.22Å; D167-Y541 PolarHBondContact OD2-OH 3.04Å; I168-Y541 HydrophobicContact CB-CE2 4.36Å; I168-Y541 HydrophobicContact CG2-CE1 3.96Å; I168-Y541 HydrophobicContact CG2-CE2 4.48Å; I168-Y541 WeakPolarHBondContact CG2-OH 3.35Å; I168-Y541 PolarHBondContact N-OH 3.46Å; Y461-Y541 AromaticContact CD1-CD2 3.83Å; Y461-Y541 HydrophobicContact CD1-CD2 3.83Å; Y461-Y541 AromaticContact CD1-CE2 3.97Å; Y461-Y541 HydrophobicContact CD1-CE2 3.97Å; Y461-Y541 HydrophobicContact CE1-CD2 4.13Å; Y461-Y541 HydrophobicContact CE1-CE2 4.07Å; Y461-Y541 HydrophobicContact CG-CD2 4.42Å; Y461-Y541 HydrophobicContact CG-CE2 4.3Å; Y541-A543 HydrophobicContact CD2-CB 4.45Å; Y541-A543 HydrophobicContact CE2-CB 3.89Å; Y541-K557 HydrophobicContact CD1-CB 4.38Å; Y541-K557 WeakPolarHBondContact CD1-O 3.37Å; Y541-K557 HydrophobicContact CE1-CB 3.8Å; Y541-K557 HydrophobicContact CE2-CB 4.43Å; Y541-K557 PolarHBondContact N-O 3.29Å; Y541-K557 PolarHBondContact O-N 3.1Å; Y541-Y559 WeakPolarHBondContact CB-OH 3.31Å; Y541-Y559 AromaticContact CD1-CD1 3.52Å; Y541-Y559 HydrophobicContact CD1-CD1 3.52Å; Y541-Y559 HydrophobicContact CD1-CD2 4.23Å; Y541-Y559 AromaticContact CD1-CE1 3.51Å; Y541-Y559 HydrophobicContact CD1-CE1 3.51Å; Y541-Y559 HydrophobicContact CD1-CE2 4.22Å; Y541-Y559 AromaticContact CD1-CG 3.92Å; Y541-Y559 HydrophobicContact CD1-CG 3.92Å; Y541-Y559 AromaticContact CD1-CZ 3.89Å; Y541-Y559 AromaticContact CE1-CD1 3.92Å; Y541-Y559 HydrophobicContact CE1-CD1 3.92Å; Y541-Y559 HydrophobicContact CE1-CE1 4.21Å; Y541-Y559 HydrophobicContact CE1-CG 4.44Å; Y541-Y559 HydrophobicContact CG-CD1 4.29Å; Y541-Y559 AromaticContact CG-CE1 3.8Å; Y541-Y559 HydrophobicContact CG-CE1 3.8Å; Y541-Y559 AromaticContact CG-CZ 3.95Å
542P89.9Confident86.4Confident67 Ų6762.5 Ų62.544%0.43537%0.365SS..EExtended strand (participates in β ladder)trans-77.1127.3173.130.5-32.6000110.5Y461 T554Y461-P542 WeakPolarHBondContact CE1-O 3.26Å; P542-T554 HydrophobicContact CB-CG2 4.34Å
543A91.7Very high86.3Confident0 Ų065.9 Ų65.90%037%0.37CS..EExtended strand (participates in β ladder)trans-112.1138.6178.300000111.2Y541 N545 E555 K557Y541-A543 HydrophobicContact CD2-CB 4.45Å; Y541-A543 HydrophobicContact CE2-CB 3.89Å; A543-N545 PolarHBondContact O-N 3.32Å; A543-E555 PolarHBondContact N-O 3.41Å; A543-E555 PolarHBondContact O-N 3.21Å; A543-K557 HydrophobicContact CB-CD 3.81Å; A543-K557 HydrophobicContact CB-CG 4.09Å
544W90.9Very high86.4Confident7 Ų765.7 Ų65.73%0.02737%0.371CS..  trans-90.298.6176.2-174-100.3000110.2E146 N154 Y158 R159 I164 Y461 F551 T554E146-W544 PolarHBondContact OE1-NE1 3.14Å; N154-W544 HydrophobicContact CB-CH2 4.16Å; Y158-W544 HydrophobicContact CD1-CB 3.94Å; Y158-W544 HydrophobicContact CD1-CD2 4.07Å; Y158-W544 AromaticContact CD1-CG 3.82Å; Y158-W544 HydrophobicContact CD1-CG 3.82Å; Y158-W544 AromaticContact CD2-CD2 3.46Å; Y158-W544 HydrophobicContact CD2-CD2 3.46Å; Y158-W544 VanDerWaalsContact CD2-CD2 3.46Å; Y158-W544 AromaticContact CD2-CE2 3.56Å; Y158-W544 AromaticContact CD2-CE3 3.58Å; Y158-W544 HydrophobicContact CD2-CE3 3.58Å; Y158-W544 HydrophobicContact CD2-CG 4.06Å; Y158-W544 AromaticContact CD2-CH2 3.89Å; Y158-W544 HydrophobicContact CD2-CH2 3.89Å; Y158-W544 AromaticContact CD2-CZ2 3.77Å; Y158-W544 HydrophobicContact CD2-CZ2 3.77Å; Y158-W544 AromaticContact CD2-CZ3 3.8Å; Y158-W544 HydrophobicContact CD2-CZ3 3.8Å; Y158-W544 HydrophobicContact CE1-CB 4.07Å; Y158-W544 HydrophobicContact CE1-CD2 4.3Å; Y158-W544 HydrophobicContact CE1-CE3 4.31Å; Y158-W544 HydrophobicContact CE1-CG 4.22Å; Y158-W544 AromaticContact CE2-CD2 3.74Å; Y158-W544 HydrophobicContact CE2-CD2 3.74Å; Y158-W544 AromaticContact CE2-CE3 3.35Å; Y158-W544 HydrophobicContact CE2-CE3 3.35Å; Y158-W544 HydrophobicContact CE2-CG 4.47Å; Y158-W544 HydrophobicContact CE2-CH2 4.04Å; Y158-W544 HydrophobicContact CE2-CZ2 4.36Å; Y158-W544 AromaticContact CE2-CZ3 3.53Å; Y158-W544 HydrophobicContact CE2-CZ3 3.53Å; Y158-W544 HydrophobicContact CG-CB 4.35Å; Y158-W544 AromaticContact CG-CD1 3.91Å; Y158-W544 AromaticContact CG-CD2 3.64Å; Y158-W544 HydrophobicContact CG-CD2 3.64Å; Y158-W544 AromaticContact CG-CE2 3.8Å; Y158-W544 HydrophobicContact CG-CE3 4.16Å; Y158-W544 AromaticContact CG-CG 3.71Å; Y158-W544 HydrophobicContact CG-CG 3.71Å; Y158-W544 HydrophobicContact CG-CZ2 4.42Å; Y158-W544 AromaticContact CG-NE1 3.96Å; Y158-W544 AromaticContact CZ-CE3 3.74Å; R159-W544 VanDerWaalsContact NH2-CD1 3.28Å; I164-W544 HydrophobicContact CD1-CB 4.43Å; I164-W544 HydrophobicContact CG2-CB 3.89Å; I164-W544 HydrophobicContact CG2-CG 4.05Å; Y461-W544 PolarHBondContact OH-N 3.36Å; Y461-W544 VanDerWaalsContact OH-N 3.11Å; W544-F551 HydrophobicContact CD2-CE2 4.47Å; W544-F551 AromaticContact CE2-CE2 3.86Å; W544-F551 AromaticContact CH2-CE2 3.64Å; W544-F551 HydrophobicContact CH2-CE2 3.64Å; W544-F551 AromaticContact CH2-CZ 3.79Å; W544-F551 HydrophobicContact CH2-CZ 3.79Å; W544-F551 AromaticContact CZ2-CE2 3.44Å; W544-F551 HydrophobicContact CZ2-CE2 3.44Å; W544-F551 VanDerWaalsContact CZ2-CE2 3.44Å; W544-F551 AromaticContact CZ2-CZ 3.55Å; W544-F551 HydrophobicContact CZ2-CZ 3.55Å; W544-F551 HydrophobicContact CZ3-CE2 4.24Å; W544-T554 HydrophobicContact CE3-CG2 4.08Å
545N91.5Very high86.8Confident21 Ų2164.6 Ų64.611%0.11237%0.366CS..  trans-121.1108.3-177.9-178-1000110.8A543 N547 Y548 E555A543-N545 PolarHBondContact O-N 3.32Å; N545-N547 PolarHBondContact O-N 3.45Å; N545-N547 WeakPolarHBondContact OD1-CB 3.39Å; N545-N547 PolarHBondContact OD1-N 3.46Å; N545-Y548 WeakPolarHBondContact O-CB 3.32Å; N545-Y548 PolarHBondContact O-N 3.35Å; N545-E555 WeakPolarHBondContact CB-OE2 3.33Å; N545-E555 PolarHBondContact ND2-OE2 2.91Å
546P88Confident87.3Confident31 Ų3165.3 Ų65.320%0.20136%0.362CS..THydrogen-bonded Turntrans-63-19.5178.9-24.435.6000114.9
547N88.8Confident87.9Confident126 Ų12663.8 Ų63.867%0.67434%0.336SS*.THydrogen-bonded Turntrans-92.92.8-178.4-58.2-52000112.6E166 N545E166-N547 PolarHBondContact OE1-ND2 2.68Å; N545-N547 PolarHBondContact O-N 3.45Å; N545-N547 WeakPolarHBondContact OD1-CB 3.39Å; N545-N547 PolarHBondContact OD1-N 3.46Å
548Y90.3Very high88.5Confident72 Ų7265.7 Ų65.728%0.28234%0.338SS..  trans-69.1143177.7-176.4-124.1000111.6N545 D550 F551 E555N545-Y548 WeakPolarHBondContact O-CB 3.32Å; N545-Y548 PolarHBondContact O-N 3.35Å; Y548-D550 HydrophobicContact CD1-CB 4.14Å; Y548-D550 HydrophobicContact CE1-CB 3.55Å; Y548-D550 PolarHBondContact O-N 2.87Å; Y548-D550 PolarHBondContact OH-OD2 2.8Å; Y548-F551 WeakPolarHBondContact O-CB 3.48Å; Y548-F551 PolarHBondContact O-N 3.41Å; Y548-E555 HydrophobicContact CD1-CB 4.34Å; Y548-E555 HydrophobicContact CD2-CB 4.05Å; Y548-E555 HydrophobicContact CD2-CG 3.86Å; Y548-E555 HydrophobicContact CE2-CB 4.4Å; Y548-E555 HydrophobicContact CE2-CG 4.02Å; Y548-E555 HydrophobicContact CG-CB 4.05Å; Y548-E555 HydrophobicContact CG-CG 4.38Å
549E87.9Confident88.9Confident187 Ų18762 Ų6287%0.87432%0.324SS*.THydrogen-bonded Turntrans-63-40.1-174.6-65.7-174.917400112.2F551E549-F551 PolarHBondContact O-N 3.42Å
550D84.7Confident89.2Confident86 Ų8663 Ų6346%0.4633%0.33SS..THydrogen-bonded Turntrans-95.223.2179.2-45.5-59000113.5Y548 Q553Y548-D550 HydrophobicContact CD1-CB 4.14Å; Y548-D550 HydrophobicContact CE1-CB 3.55Å; Y548-D550 PolarHBondContact O-N 2.87Å; Y548-D550 PolarHBondContact OH-OD2 2.8Å; D550-Q553 WeakPolarHBondContact O-CB 3.48Å; D550-Q553 PolarHBondContact O-N 2.88Å
551F85.3Confident89.4Confident26 Ų2668 Ų6811%0.11435%0.346CS..THydrogen-bonded Turntrans-54.2129.8174.1-175.4-88.9000110.1E146 K149 W544 Y548 E549E146-F551 HydrophobicContact CG-CZ 3.85Å; K149-F551 HydrophobicContact CB-CD1 3.62Å; K149-F551 HydrophobicContact CB-CE1 3.45Å; K149-F551 VanDerWaalsContact CB-CE1 3.45Å; K149-F551 HydrophobicContact CD-CD1 3.92Å; K149-F551 HydrophobicContact CD-CE1 4.32Å; K149-F551 HydrophobicContact CG-CD1 4.45Å; W544-F551 HydrophobicContact CD2-CE2 4.47Å; W544-F551 AromaticContact CE2-CE2 3.86Å; W544-F551 AromaticContact CH2-CE2 3.64Å; W544-F551 HydrophobicContact CH2-CE2 3.64Å; W544-F551 AromaticContact CH2-CZ 3.79Å; W544-F551 HydrophobicContact CH2-CZ 3.79Å; W544-F551 AromaticContact CZ2-CE2 3.44Å; W544-F551 HydrophobicContact CZ2-CE2 3.44Å; W544-F551 VanDerWaalsContact CZ2-CE2 3.44Å; W544-F551 AromaticContact CZ2-CZ 3.55Å; W544-F551 HydrophobicContact CZ2-CZ 3.55Å; W544-F551 HydrophobicContact CZ3-CE2 4.24Å; Y548-F551 WeakPolarHBondContact O-CB 3.48Å; Y548-F551 PolarHBondContact O-N 3.41Å; E549-F551 PolarHBondContact O-N 3.42Å
552P81.9Confident89.5Confident60 Ų6073.9 Ų73.939%0.3937%0.368SS..THydrogen-bonded Turncis-94.712.425.137.9-39.1000116.9K149K149-P552 WeakPolarHBondContact O-CG 3.36Å
553Q83.2Confident89.7Confident136 Ų13670.7 Ų70.764%0.63635%0.347SS*.SBendtrans-68.1148.3174.2-59.5-172.313.700110.9D550D550-Q553 WeakPolarHBondContact O-CB 3.48Å; D550-Q553 PolarHBondContact O-N 2.88Å
554T85Confident89.7Confident56 Ų5674.7 Ų74.734%0.34437%0.365SS..PPolyproline II helixtrans-76.5138.1177.646.60000110.9P542 W544P542-T554 HydrophobicContact CB-CG2 4.34Å; W544-T554 HydrophobicContact CE3-CG2 4.08Å
555E90Very high89.9Confident47 Ų4776.2 Ų76.222%0.2238%0.383CS..EExtended strand (participates in β ladder)trans-77.5125.9177.6-175.2-173.7173.800109A543 N545 Y548 K557A543-E555 PolarHBondContact N-O 3.41Å; A543-E555 PolarHBondContact O-N 3.21Å; N545-E555 WeakPolarHBondContact CB-OE2 3.33Å; N545-E555 PolarHBondContact ND2-OE2 2.91Å; Y548-E555 HydrophobicContact CD1-CB 4.34Å; Y548-E555 HydrophobicContact CD2-CB 4.05Å; Y548-E555 HydrophobicContact CD2-CG 3.86Å; Y548-E555 HydrophobicContact CE2-CB 4.4Å; Y548-E555 HydrophobicContact CE2-CG 4.02Å; Y548-E555 HydrophobicContact CG-CB 4.05Å; Y548-E555 HydrophobicContact CG-CG 4.38Å; E555-K557 HydrophobicContact CG-CG 4.14Å; E555-K557 PolarHBondContact O-N 3.12Å; E555-K557 WeakPolarHBondContact OE1-CE 3.13Å; E555-K557 WeakPolarHBondContact OE2-CE 3.36Å; E555-K557 IonicContact OE2-NZ 2.78Å
556T90.6Very high90Very high101 Ų10178.1 Ų78.162%0.6239%0.392SS*.EExtended strand (participates in β ladder)trans-83.2111.9176.4-60.30000109.8T540T540-T556 HydrophobicContact CG2-CG2 4.16Å
557K92Very high90.2Very high35 Ų3576.9 Ų76.915%0.15238%0.384CS..EExtended strand (participates in β ladder)trans-111.2150.5179.9-68.5-171.6178.1178.50112.3E166 D167 T540 Y541 A543 E555E166-K557 PolarHBondContact O-NZ 2.91Å; D167-K557 WeakPolarHBondContact OD2-CD 3.47Å; D167-K557 IonicContact OD2-NZ 3.54Å; D167-K557 PolarHBondContact OD2-NZ 3.42Å; T540-K557 CarbonylContact C-O 3.5Å; T540-K557 WeakPolarHBondContact CA-O 3.25Å; T540-K557 WeakPolarHBondContact CB-O 3.5Å; Y541-K557 HydrophobicContact CD1-CB 4.38Å; Y541-K557 WeakPolarHBondContact CD1-O 3.37Å; Y541-K557 HydrophobicContact CE1-CB 3.8Å; Y541-K557 HydrophobicContact CE2-CB 4.43Å; Y541-K557 PolarHBondContact N-O 3.29Å; Y541-K557 PolarHBondContact O-N 3.1Å; A543-K557 HydrophobicContact CB-CD 3.81Å; A543-K557 HydrophobicContact CB-CG 4.09Å; E555-K557 HydrophobicContact CG-CG 4.14Å; E555-K557 PolarHBondContact O-N 3.12Å; E555-K557 WeakPolarHBondContact OE1-CE 3.13Å; E555-K557 WeakPolarHBondContact OE2-CE 3.36Å; E555-K557 IonicContact OE2-NZ 2.78Å
558E93.6Very high90.3Very high136 Ų13673.9 Ų73.964%0.63637%0.37SS*.EExtended strand (participates in β ladder)trans-80141.2172-69.7-175.1174.400111.1Y538 T540Y538-E558 HydrophobicContact CD1-CB 3.92Å; Y538-E558 HydrophobicContact CD1-CG 4.02Å; Y538-E558 HydrophobicContact CE1-CB 3.88Å; Y538-E558 HydrophobicContact CE1-CG 4.47Å; T540-E558 HydrophobicContact CG2-CG 4.2Å
559Y93.1Very high90.5Very high12 Ų1272.6 Ų72.65%0.04737%0.374CS..PPolyproline II helixtrans-64.9134.6175.2-77.9-68.4000111.8I168 V465 Y538 P539 Y541 V563 I567I168-Y559 HydrophobicContact CD1-CD1 4.21Å; I168-Y559 HydrophobicContact CD1-CE1 3.93Å; V465-Y559 HydrophobicContact CG2-CD1 4.44Å; V465-Y559 HydrophobicContact CG2-CE1 3.46Å; V465-Y559 VanDerWaalsContact CG2-CE1 3.46Å; V465-Y559 VanDerWaalsContact CG2-OH 3.32Å; V465-Y559 WeakPolarHBondContact CG2-OH 3.48Å; Y538-Y559 WeakPolarHBondContact CE1-O 3.45Å; Y538-Y559 VanDerWaalsContact CZ-O 3.32Å; Y538-Y559 PolarHBondContact OH-O 3.13Å; P539-Y559 HydrophobicContact CB-CD2 3.78Å; P539-Y559 HydrophobicContact CB-CE2 4.24Å; P539-Y559 HydrophobicContact CG-CD2 4.06Å; P539-Y559 WeakPolarHBondContact O-CD2 3.37Å; P539-Y559 PolarHBondContact O-N 3.45Å; P539-Y559 VanDerWaalsContact O-N 3.16Å; Y541-Y559 WeakPolarHBondContact CB-OH 3.31Å; Y541-Y559 AromaticContact CD1-CD1 3.52Å; Y541-Y559 HydrophobicContact CD1-CD1 3.52Å; Y541-Y559 HydrophobicContact CD1-CD2 4.23Å; Y541-Y559 AromaticContact CD1-CE1 3.51Å; Y541-Y559 HydrophobicContact CD1-CE1 3.51Å; Y541-Y559 HydrophobicContact CD1-CE2 4.22Å; Y541-Y559 AromaticContact CD1-CG 3.92Å; Y541-Y559 HydrophobicContact CD1-CG 3.92Å; Y541-Y559 AromaticContact CD1-CZ 3.89Å; Y541-Y559 AromaticContact CE1-CD1 3.92Å; Y541-Y559 HydrophobicContact CE1-CD1 3.92Å; Y541-Y559 HydrophobicContact CE1-CE1 4.21Å; Y541-Y559 HydrophobicContact CE1-CG 4.44Å; Y541-Y559 HydrophobicContact CG-CD1 4.29Å; Y541-Y559 AromaticContact CG-CE1 3.8Å; Y541-Y559 HydrophobicContact CG-CE1 3.8Å; Y541-Y559 AromaticContact CG-CZ 3.95Å; Y559-V563 HydrophobicContact CD1-CB 4.38Å; Y559-V563 HydrophobicContact CD1-CG1 3.66Å; Y559-V563 HydrophobicContact CE1-CG1 4.25Å; Y559-V563 HydrophobicContact CG-CG1 4.3Å; Y559-I567 HydrophobicContact CD1-CD1 4.49Å; Y559-I567 HydrophobicContact CD2-CD1 4Å; Y559-I567 HydrophobicContact CE2-CD1 4.22Å; Y559-I567 HydrophobicContact CG-CD1 4.12Å
560P94.3Very high90.8Very high34 Ų3464.4 Ų64.422%0.22134%0.336CS..PPolyproline II helixtrans-58147.1171.7-24.933.7000112.4I168 W562 V563 F564I168-P560 HydrophobicContact CG2-CG 3.96Å; P560-W562 HydrophobicContact CB-CG 4.48Å; P560-W562 PolarHBondContact O-N 3.48Å; P560-W562 VanDerWaalsContact O-N 3.08Å; P560-V563 HydrophobicContact CB-CG2 4.14Å; P560-V563 HydrophobicContact CG-CG2 4.14Å; P560-V563 WeakPolarHBondContact O-CA 3.39Å; P560-V563 WeakPolarHBondContact O-CB 3.3Å; P560-V563 PolarHBondContact O-N 3.34Å; P560-F564 PolarHBondContact O-N 3.46Å
561K93.7Very high91.1Very high182 Ų18261.3 Ų61.379%0.79132%0.321SS*.Hα-helixtrans-54.6-34-176.2-66.2-177.5-179.6177.10114.3F564 G565K561-F564 PolarHBondContact O-N 3.25Å; K561-G565 PolarHBondContact O-N 2.96Å
562W93.9Very high91.4Very high130 Ų13063.6 Ų63.649%0.49234%0.336SS..Hα-helixtrans-73.4-34.1177.867.2-94.3000112W462 P560 G565 I566W462-W562 AromaticContact CH2-CH2 3.92Å; W462-W562 HydrophobicContact CH2-CH2 3.92Å; W462-W562 AromaticContact CH2-CZ3 3.59Å; W462-W562 HydrophobicContact CH2-CZ3 3.59Å; W462-W562 AromaticContact CZ2-CH2 3.61Å; W462-W562 HydrophobicContact CZ2-CH2 3.61Å; W462-W562 AromaticContact CZ2-CZ3 3.69Å; W462-W562 HydrophobicContact CZ2-CZ3 3.69Å; P560-W562 HydrophobicContact CB-CG 4.48Å; P560-W562 PolarHBondContact O-N 3.48Å; P560-W562 VanDerWaalsContact O-N 3.08Å; W562-G565 PolarHBondContact O-N 2.81Å; W562-I566 HydrophobicContact CE3-CD1 3.71Å; W562-I566 HydrophobicContact CZ3-CD1 3.67Å; W562-I566 PolarHBondContact O-N 2.73Å
563V93.8Very high92Very high0 Ų065 Ų650%034%0.344CS..Hα-helixtrans-66.2-42.2171.3179.90000109.7I168 W462 Y559 P560 G565 I566 I567I168-V563 HydrophobicContact CD1-CG1 3.97Å; I168-V563 HydrophobicContact CD1-CG2 4.28Å; I168-V563 HydrophobicContact CG2-CG2 4.18Å; W462-V563 HydrophobicContact CH2-CG1 4.34Å; W462-V563 HydrophobicContact CH2-CG2 4.28Å; W462-V563 HydrophobicContact CZ3-CG1 4.29Å; Y559-V563 HydrophobicContact CD1-CB 4.38Å; Y559-V563 HydrophobicContact CD1-CG1 3.66Å; Y559-V563 HydrophobicContact CE1-CG1 4.25Å; Y559-V563 HydrophobicContact CG-CG1 4.3Å; P560-V563 HydrophobicContact CB-CG2 4.14Å; P560-V563 HydrophobicContact CG-CG2 4.14Å; P560-V563 WeakPolarHBondContact O-CA 3.39Å; P560-V563 WeakPolarHBondContact O-CB 3.3Å; P560-V563 PolarHBondContact O-N 3.34Å; V563-G565 VanDerWaalsContact C-N 3.26Å; V563-G565 PolarHBondContact O-N 3.02Å; V563-I566 CarbonylContact O-C 3.44Å; V563-I566 WeakPolarHBondContact O-CA 3.3Å; V563-I566 WeakPolarHBondContact O-CB 3.21Å; V563-I566 PolarHBondContact O-N 3.39Å; V563-I567 HydrophobicContact CG1-CD1 4.2Å; V563-I567 HydrophobicContact CG1-CG1 4.46Å; V563-I567 WeakPolarHBondContact O-CG1 3.42Å; V563-I567 PolarHBondContact O-N 3.22Å
564F91.8Very high92.5Very high83 Ų8358.5 Ų58.536%0.36431%0.313SS..Hα-helixtrans-57.6-40.4173.8-177.6-107.2000112P539 P560 K561 I566 I567 V568P539-F564 HydrophobicContact CG-CD2 3.79Å; P539-F564 HydrophobicContact CG-CE2 4.07Å; P560-F564 PolarHBondContact O-N 3.46Å; K561-F564 PolarHBondContact O-N 3.25Å; F564-I566 VanDerWaalsContact C-N 3.29Å; F564-I566 PolarHBondContact O-N 3.46Å; F564-I567 WeakPolarHBondContact O-CB 3.48Å; F564-I567 PolarHBondContact O-N 3.28Å; F564-V568 HydrophobicContact CD1-CG2 4.36Å; F564-V568 HydrophobicContact CE1-CG2 3.93Å; F564-V568 HydrophobicContact CE2-CG2 4.34Å; F564-V568 HydrophobicContact CZ-CG2 3.93Å; F564-V568 WeakPolarHBondContact O-CG2 3.46Å; F564-V568 PolarHBondContact O-N 3.01Å
565G93.9Very high92.9Very high40 Ų4057.1 Ų57.141%0.41230%0.303SS..Hα-helixtrans-58-38.3171.400000113.5K561 W562 V563 A569K561-G565 PolarHBondContact O-N 2.96Å; W562-G565 PolarHBondContact O-N 2.81Å; V563-G565 VanDerWaalsContact C-N 3.26Å; V563-G565 PolarHBondContact O-N 3.02Å; G565-A569 WeakPolarHBondContact O-CB 3.33Å; G565-A569 PolarHBondContact O-N 3.3Å
566I93.9Very high93.2Very high60 Ų6059.2 Ų59.231%0.30832%0.316SS..Hα-helixtrans-69.8-41.4174.9-66.3165.3000111.2W462 W562 V563 F564 V568 A569 L570W462-I566 HydrophobicContact CH2-CD1 3.64Å; W462-I566 HydrophobicContact CZ3-CD1 4.17Å; W462-I566 HydrophobicContact CZ3-CG2 4.02Å; W562-I566 HydrophobicContact CE3-CD1 3.71Å; W562-I566 HydrophobicContact CZ3-CD1 3.67Å; W562-I566 PolarHBondContact O-N 2.73Å; V563-I566 CarbonylContact O-C 3.44Å; V563-I566 WeakPolarHBondContact O-CA 3.3Å; V563-I566 WeakPolarHBondContact O-CB 3.21Å; V563-I566 PolarHBondContact O-N 3.39Å; F564-I566 VanDerWaalsContact C-N 3.29Å; F564-I566 PolarHBondContact O-N 3.46Å; I566-V568 VanDerWaalsContact C-N 3.32Å; I566-V568 PolarHBondContact O-N 2.97Å; I566-A569 CarbonylContact O-C 3.56Å; I566-A569 WeakPolarHBondContact O-CB 3.5Å; I566-A569 PolarHBondContact O-N 3.24Å; I566-A569 VanDerWaalsContact O-N 3.12Å; I566-L570 HydrophobicContact CG2-CD1 4.09Å; I566-L570 HydrophobicContact CG2-CG 4.24Å; I566-L570 WeakPolarHBondContact O-CG 3.28Å; I566-L570 PolarHBondContact O-N 2.94Å
567I92.4Very high93.3Very high6 Ų655.3 Ų55.33%0.03129%0.292CS..Hα-helixtrans-56.2-48.9174.6-70.1167.9000110.2V465 Y469 Y559 V563 F564 A569 L570 V571V465-I567 HydrophobicContact CG1-CD1 4.47Å; V465-I567 HydrophobicContact CG1-CG1 3.76Å; Y469-I567 HydrophobicContact CD1-CG2 3.59Å; Y469-I567 HydrophobicContact CD2-CB 4.46Å; Y469-I567 HydrophobicContact CD2-CD1 4.22Å; Y469-I567 HydrophobicContact CD2-CG1 3.99Å; Y469-I567 HydrophobicContact CD2-CG2 3.72Å; Y469-I567 HydrophobicContact CE1-CG2 3.76Å; Y469-I567 HydrophobicContact CE2-CD1 3.72Å; Y469-I567 HydrophobicContact CE2-CG1 4.03Å; Y469-I567 HydrophobicContact CE2-CG2 3.91Å; Y469-I567 HydrophobicContact CG-CG2 3.58Å; Y559-I567 HydrophobicContact CD1-CD1 4.49Å; Y559-I567 HydrophobicContact CD2-CD1 4Å; Y559-I567 HydrophobicContact CE2-CD1 4.22Å; Y559-I567 HydrophobicContact CG-CD1 4.12Å; V563-I567 HydrophobicContact CG1-CD1 4.2Å; V563-I567 HydrophobicContact CG1-CG1 4.46Å; V563-I567 WeakPolarHBondContact O-CG1 3.42Å; V563-I567 PolarHBondContact O-N 3.22Å; F564-I567 WeakPolarHBondContact O-CB 3.48Å; F564-I567 PolarHBondContact O-N 3.28Å; I567-A569 VanDerWaalsContact C-N 3.31Å; I567-A569 PolarHBondContact O-N 3.43Å; I567-L570 PolarHBondContact O-N 2.66Å; I567-V571 PolarHBondContact O-N 3.03Å
568V91.9Very high93.5Very high63 Ų6354.6 Ų54.638%0.38229%0.29SS..Hα-helixtrans-60.5-42.5176.5174.10000110.8F564 I566 V571 V572F564-V568 HydrophobicContact CD1-CG2 4.36Å; F564-V568 HydrophobicContact CE1-CG2 3.93Å; F564-V568 HydrophobicContact CE2-CG2 4.34Å; F564-V568 HydrophobicContact CZ-CG2 3.93Å; F564-V568 WeakPolarHBondContact O-CG2 3.46Å; F564-V568 PolarHBondContact O-N 3.01Å; I566-V568 VanDerWaalsContact C-N 3.32Å; I566-V568 PolarHBondContact O-N 2.97Å; V568-V571 PolarHBondContact O-N 3.08Å; V568-V572 HydrophobicContact CG1-CG2 3.99Å; V568-V572 WeakPolarHBondContact O-CB 3.46Å; V568-V572 VanDerWaalsContact O-CG2 3.28Å; V568-V572 WeakPolarHBondContact O-CG2 3.27Å; V568-V572 PolarHBondContact O-N 3.27Å
569A94.1Very high93.5Very high44 Ų4451.2 Ų51.236%0.36428%0.28SS..Hα-helixtrans-63.3-42.2177.200000112.7G565 I566 I567 V571 V572 V573G565-A569 WeakPolarHBondContact O-CB 3.33Å; G565-A569 PolarHBondContact O-N 3.3Å; I566-A569 CarbonylContact O-C 3.56Å; I566-A569 WeakPolarHBondContact O-CB 3.5Å; I566-A569 PolarHBondContact O-N 3.24Å; I566-A569 VanDerWaalsContact O-N 3.12Å; I567-A569 VanDerWaalsContact C-N 3.31Å; I567-A569 PolarHBondContact O-N 3.43Å; A569-V571 PolarHBondContact O-N 3.39Å; A569-V572 PolarHBondContact O-N 3.1Å; A569-V573 VanDerWaalsContact O-CB 3.25Å; A569-V573 WeakPolarHBondContact O-CB 3.44Å; A569-V573 WeakPolarHBondContact O-CG2 2.98Å; A569-V573 PolarHBondContact O-N 2.96Å
570L92.9Very high93.6Very high16 Ų1654.5 Ų54.58%0.08430%0.301CS..Hα-helixtrans-61-31.4178-73.9171.7000112.5L104 V465 F466 V470 I566 I567 P574L104-L570 HydrophobicContact CD1-CD2 4.31Å; L104-L570 HydrophobicContact CD2-CD2 4.22Å; V465-L570 HydrophobicContact CG1-CD1 3.99Å; F466-L570 HydrophobicContact CD1-CD2 4.37Å; F466-L570 HydrophobicContact CD2-CD1 3.79Å; F466-L570 HydrophobicContact CE1-CD2 3.78Å; F466-L570 HydrophobicContact CE2-CD1 3.65Å; F466-L570 HydrophobicContact CE2-CD2 4.16Å; F466-L570 HydrophobicContact CG-CD1 4.32Å; F466-L570 HydrophobicContact CZ-CD1 4.06Å; F466-L570 HydrophobicContact CZ-CD2 3.66Å; F466-L570 HydrophobicContact CZ-CG 4.5Å; V470-L570 HydrophobicContact CG2-CB 4.31Å; V470-L570 HydrophobicContact CG2-CD2 4.31Å; I566-L570 HydrophobicContact CG2-CD1 4.09Å; I566-L570 HydrophobicContact CG2-CG 4.24Å; I566-L570 WeakPolarHBondContact O-CG 3.28Å; I566-L570 PolarHBondContact O-N 2.94Å; I567-L570 PolarHBondContact O-N 2.66Å; L570-P574 WeakPolarHBondContact O-CD 3.43Å; L570-P574 WeakPolarHBondContact O-CG 3.35Å
571V91.5Very high93.5Very high21 Ų2154 Ų5413%0.12730%0.298CS..Hα-helixtrans-83.3-46.6176.2174.10000111.7V473 P474 I567 V568 A569 P574 I575V473-V571 HydrophobicContact CB-CG1 3.73Å; V473-V571 HydrophobicContact CG1-CG1 3.92Å; V473-V571 HydrophobicContact CG2-CG1 4.36Å; P474-V571 HydrophobicContact CG-CG1 4.3Å; I567-V571 PolarHBondContact O-N 3.03Å; V568-V571 PolarHBondContact O-N 3.08Å; A569-V571 PolarHBondContact O-N 3.39Å; V571-P574 WeakPolarHBondContact O-CD 3.39Å; V571-I575 HydrophobicContact CG1-CD1 4.15Å; V571-I575 VanDerWaalsContact O-CD1 3.25Å; V571-I575 WeakPolarHBondContact O-CD1 3.49Å
572V92.8Very high93.4Very high73 Ų7346.3 Ų46.344%0.44227%0.267SS..Hα-helixtrans-76.4-39.9-171.2173.40000112.4V568 A569 I575 L576V568-V572 HydrophobicContact CG1-CG2 3.99Å; V568-V572 WeakPolarHBondContact O-CB 3.46Å; V568-V572 VanDerWaalsContact O-CG2 3.28Å; V568-V572 WeakPolarHBondContact O-CG2 3.27Å; V568-V572 PolarHBondContact O-N 3.27Å; A569-V572 PolarHBondContact O-N 3.1Å; V572-I575 PolarHBondContact O-N 3.42Å; V572-L576 VanDerWaalsContact O-CB 3.29Å; V572-L576 WeakPolarHBondContact O-CB 3.43Å; V572-L576 PolarHBondContact O-N 3.26Å
573V93.6Very high93.3Very high90 Ų9043.9 Ų43.955%0.54527%0.267SS..Hα-helixtrans-58.5-47.9-174.3168.80000112.9A569 I575A569-V573 VanDerWaalsContact O-CB 3.25Å; A569-V573 WeakPolarHBondContact O-CB 3.44Å; A569-V573 WeakPolarHBondContact O-CG2 2.98Å; A569-V573 PolarHBondContact O-N 2.96Å; V573-I575 VanDerWaalsContact C-N 3.33Å; V573-I575 PolarHBondContact O-N 2.97Å
574P93.6Very high93.3Very high0 Ų050.6 Ų50.60%029%0.293CS..Hα-helixtrans-59.4-44.9176.6-20.329.5000112.1A97 V100 V101 L104 P474 L570 V571 S577A97-P574 WeakPolarHBondContact CA-O 3.38Å; A97-P574 WeakPolarHBondContact CB-O 3.09Å; V100-P574 HydrophobicContact CB-CB 4.29Å; V100-P574 HydrophobicContact CG1-CB 4.01Å; V100-P574 HydrophobicContact CG1-CG 3.89Å; V101-P574 HydrophobicContact CG2-CB 3.72Å; V101-P574 HydrophobicContact CG2-CG 4.2Å; L104-P574 HydrophobicContact CD1-CG 4.02Å; P474-P574 HydrophobicContact CB-CB 4.42Å; L570-P574 WeakPolarHBondContact O-CD 3.43Å; L570-P574 WeakPolarHBondContact O-CG 3.35Å; V571-P574 WeakPolarHBondContact O-CD 3.39Å; P574-S577 PolarHBondContact O-OG 2.86Å
575I94.1Very high93.1Very high26 Ų2647.8 Ų47.813%0.13328%0.282CS..Hα-helixtrans-72.9-33.1-173.7-62.9165.7000112V473 P474 I477 V571 V572 V573 S577 I578 P579V473-I575 HydrophobicContact CG1-CD1 3.94Å; P474-I575 HydrophobicContact CB-CD1 4.15Å; P474-I575 HydrophobicContact CB-CG1 4.11Å; P474-I575 HydrophobicContact CG-CD1 4.08Å; P474-I575 HydrophobicContact CG-CG1 4.43Å; I477-I575 HydrophobicContact CB-CD1 4.33Å; I477-I575 HydrophobicContact CB-CG1 4.45Å; I477-I575 HydrophobicContact CD1-CD1 3.65Å; I477-I575 HydrophobicContact CD1-CG1 4.42Å; I477-I575 HydrophobicContact CD1-CG2 4.02Å; I477-I575 HydrophobicContact CG1-CD1 4.28Å; I477-I575 HydrophobicContact CG2-CG2 3.9Å; V571-I575 HydrophobicContact CG1-CD1 4.15Å; V571-I575 VanDerWaalsContact O-CD1 3.25Å; V571-I575 WeakPolarHBondContact O-CD1 3.49Å; V572-I575 PolarHBondContact O-N 3.42Å; V573-I575 VanDerWaalsContact C-N 3.33Å; V573-I575 PolarHBondContact O-N 2.97Å; I575-S577 PolarHBondContact O-N 2.03Å; I575-S577 VanDerWaalsContact O-N 3.1Å; I575-I578 WeakPolarHBondContact O-CB 3.3Å; I575-I578 PolarHBondContact O-N 3.15Å; I575-P579 WeakPolarHBondContact O-CD 3.33Å
576L94.9Very high92.9Very high92 Ų9250.5 Ų50.548%0.48229%0.286SS..Hα-helixtrans-58.8-26.7-178.2-174.764.7000112.6V572 I578 P579 V580V572-L576 VanDerWaalsContact O-CB 3.29Å; V572-L576 WeakPolarHBondContact O-CB 3.43Å; V572-L576 PolarHBondContact O-N 3.26Å; L576-I578 PolarHBondContact O-N 3.43Å; L576-P579 HydrophobicContact CD1-CG 4.4Å; L576-P579 VanDerWaalsContact O-CD 3.22Å; L576-P579 WeakPolarHBondContact O-CD 3.36Å; L576-P579 WeakPolarHBondContact O-CG 3.08Å; L576-V580 HydrophobicContact CD1-CG2 4.07Å; L576-V580 HydrophobicContact CG-CG2 3.85Å; L576-V580 WeakPolarHBondContact O-CB 3.49Å; L576-V580 WeakPolarHBondContact O-CG2 3.42Å; L576-V580 PolarHBondContact O-N 3.05Å; L576-V580 VanDerWaalsContact O-N 3.12Å
577S93.9Very high92.7Very high18 Ų1852.3 Ų52.313%0.12630%0.296CS..Hα-helixtrans-59.5-31.1175.867.10000113.1G93 A97 P574 I575 V581G93-S577 PolarHBondContact O-OG 2.78Å; G93-S577 VanDerWaalsContact O-OG 3.1Å; A97-S577 WeakPolarHBondContact CB-OG 3.37Å; A97-S577 PolarHBondContact N-OG 3.17Å; P574-S577 PolarHBondContact O-OG 2.86Å; I575-S577 PolarHBondContact O-N 2.03Å; I575-S577 VanDerWaalsContact O-N 3.1Å; S577-V581 WeakPolarHBondContact O-CB 3.32Å; S577-V581 VanDerWaalsContact O-CG2 3.25Å; S577-V581 WeakPolarHBondContact O-CG2 3.49Å; S577-V581 PolarHBondContact O-N 3.01Å; S577-V581 VanDerWaalsContact O-N 3.07Å
578I95Very high92.4Very high21 Ų2158 Ų5811%0.10832%0.317CS..Hα-helixtrans-63.3-61.4179.1-57.6173.3000111.5V94 A97 I477 I478 I575 L576 V580 A582V94-I578 HydrophobicContact CG2-CD1 4.45Å; V94-I578 HydrophobicContact CG2-CG1 4.36Å; V94-I578 HydrophobicContact CG2-CG2 4.45Å; A97-I578 HydrophobicContact CB-CD1 4.22Å; A97-I578 HydrophobicContact CB-CG1 4.08Å; I477-I578 HydrophobicContact CG2-CD1 4.22Å; I478-I578 HydrophobicContact CG1-CD1 4.48Å; I575-I578 WeakPolarHBondContact O-CB 3.3Å; I575-I578 PolarHBondContact O-N 3.15Å; L576-I578 PolarHBondContact O-N 3.43Å; I578-V580 PolarHBondContact O-N 2.93Å; I578-A582 PolarHBondContact O-N 2.9Å
579P95.3Very high91.9Very high64 Ų6458.8 Ų58.842%0.41632%0.324SS..Hα-helixtrans-67.5-34.5178.826.9-35.2000112.7I575 L576 A582 V583I575-P579 WeakPolarHBondContact O-CD 3.33Å; L576-P579 HydrophobicContact CD1-CG 4.4Å; L576-P579 VanDerWaalsContact O-CD 3.22Å; L576-P579 WeakPolarHBondContact O-CD 3.36Å; L576-P579 WeakPolarHBondContact O-CG 3.08Å; P579-A582 PolarHBondContact O-N 3.5Å; P579-V583 WeakPolarHBondContact O-CB 3.31Å; P579-V583 VanDerWaalsContact O-CG2 3.3Å; P579-V583 WeakPolarHBondContact O-CG2 2.98Å; P579-V583 PolarHBondContact O-N 3.45Å
580V94.2Very high90.9Very high82 Ų8258.7 Ų58.750%0.49733%0.328SS..Hα-helixtrans-62.5-46.5-179.8168.40000111.4L576 I578 A582 V583 Y584L576-V580 HydrophobicContact CD1-CG2 4.07Å; L576-V580 HydrophobicContact CG-CG2 3.85Å; L576-V580 WeakPolarHBondContact O-CB 3.49Å; L576-V580 WeakPolarHBondContact O-CG2 3.42Å; L576-V580 PolarHBondContact O-N 3.05Å; L576-V580 VanDerWaalsContact O-N 3.12Å; I578-V580 PolarHBondContact O-N 2.93Å; V580-A582 VanDerWaalsContact C-N 3.35Å; V580-V583 PolarHBondContact O-N 3.26Å; V580-Y584 VanDerWaalsContact O-CB 3.29Å; V580-Y584 WeakPolarHBondContact O-CB 3.37Å; V580-Y584 PolarHBondContact O-N 2.8Å
581V92.4Very high89.9Confident24 Ų2463.1 Ų63.115%0.14535%0.35CS..Hα-helixtrans-65.4-40.4177.1171.80000111.1I96 S577 Y584 N585I96-V581 HydrophobicContact CD1-CG2 3.9Å; S577-V581 WeakPolarHBondContact O-CB 3.32Å; S577-V581 VanDerWaalsContact O-CG2 3.25Å; S577-V581 WeakPolarHBondContact O-CG2 3.49Å; S577-V581 PolarHBondContact O-N 3.01Å; S577-V581 VanDerWaalsContact O-N 3.07Å; V581-Y584 PolarHBondContact O-N 3.15Å; V581-N585 WeakPolarHBondContact O-CB 3.1Å; V581-N585 PolarHBondContact O-N 2.87Å; V581-N585 PolarHBondContact O-ND2 3.14Å
582A91.8Very high88.8Confident19 Ų1968.6 Ų68.616%0.15737%0.372CS..Hα-helixtrans-60.3-49.2176.600000111.8M90 I578 P579 V580 N585 L586M90-A582 HydrophobicContact CB-CB 4.43Å; M90-A582 HydrophobicContact CE-CB 4.14Å; I578-A582 PolarHBondContact O-N 2.9Å; P579-A582 PolarHBondContact O-N 3.5Å; V580-A582 VanDerWaalsContact C-N 3.35Å; A582-N585 PolarHBondContact O-N 3.23Å; A582-L586 WeakPolarHBondContact O-CB 3.48Å; A582-L586 VanDerWaalsContact O-CG 3.3Å; A582-L586 WeakPolarHBondContact O-CG 3.19Å; A582-L586 PolarHBondContact O-N 3.09Å
583V92.5Very high87.3Confident79 Ų7972.7 Ų72.748%0.47938%0.384SS..Hα-helixtrans-64-44.9178.3171.60000111.3P579 V580 N585 L586 I587P579-V583 WeakPolarHBondContact O-CB 3.31Å; P579-V583 VanDerWaalsContact O-CG2 3.3Å; P579-V583 WeakPolarHBondContact O-CG2 2.98Å; P579-V583 PolarHBondContact O-N 3.45Å; V580-V583 PolarHBondContact O-N 3.26Å; V583-N585 VanDerWaalsContact C-N 3.33Å; V583-N585 PolarHBondContact O-N 3Å; V583-L586 PolarHBondContact O-N 3.07Å; V583-I587 HydrophobicContact CG1-CD1 3.71Å; V583-I587 HydrophobicContact CG1-CG1 4.33Å; V583-I587 WeakPolarHBondContact O-CG1 3.36Å; V583-I587 PolarHBondContact O-N 3.49Å
584Y91.9Very high85.4Confident141 Ų14172 Ų7255%0.55338%0.383SS*.Hα-helixtrans-56.7-46.2177.2171.9-103.5000111.9V580 V581 I587 R588V580-Y584 VanDerWaalsContact O-CB 3.29Å; V580-Y584 WeakPolarHBondContact O-CB 3.37Å; V580-Y584 PolarHBondContact O-N 2.8Å; V581-Y584 PolarHBondContact O-N 3.15Å; Y584-I587 PolarHBondContact O-N 3.26Å; Y584-R588 WeakPolarHBondContact O-CB 3.18Å; Y584-R588 PolarHBondContact O-N 3.41Å
585N88.6Confident83.4Confident25 Ų2575.5 Ų75.513%0.13441%0.408CS..Hα-helixtrans-71.2-34.4178.8-77.9-38.1000112.7P89 V581 A582 V583 R588 C589P89-N585 PolarHBondContact O-ND2 2.97Å; V581-N585 WeakPolarHBondContact O-CB 3.1Å; V581-N585 PolarHBondContact O-N 2.87Å; V581-N585 PolarHBondContact O-ND2 3.14Å; A582-N585 PolarHBondContact O-N 3.23Å; V583-N585 VanDerWaalsContact C-N 3.33Å; V583-N585 PolarHBondContact O-N 3Å; N585-R588 PolarHBondContact O-N 3.4Å; N585-C589 WeakPolarHBondContact O-CB 3.44Å; N585-C589 PolarHBondContact O-N 2.99Å; N585-C589 PolarHBondContact O-SG 2.69Å; N585-C589 VanDerWaalsContact O-SG 3.33Å
586L89.1Confident81.3Confident96 Ų9677 Ų7750%0.50343%0.425SS..Hα-helixtrans-61.3-47.1172.1-76.1172.1000111.8M90 A582 V583 C589 G590M90-L586 HydrophobicContact CE-CD1 3.66Å; M90-L586 HydrophobicContact CE-CD2 3.71Å; M90-L586 HydrophobicContact CE-CG 3.58Å; M90-L586 HydrophobicContact SD-CD2 3.89Å; M90-L586 HydrophobicContact SD-CG 4.24Å; A582-L586 WeakPolarHBondContact O-CB 3.48Å; A582-L586 VanDerWaalsContact O-CG 3.3Å; A582-L586 WeakPolarHBondContact O-CG 3.19Å; A582-L586 PolarHBondContact O-N 3.09Å; V583-L586 PolarHBondContact O-N 3.07Å; L586-C589 PolarHBondContact O-N 3.24Å; L586-G590 PolarHBondContact O-N 3.37Å
587I89.8Confident79.2Confident99 Ų9979.4 Ų79.451%0.50844%0.438SS..Hα-helixtrans-61.4-46.7177.1-67.3168.3000110V583 Y584 C589 G590 I591V583-I587 HydrophobicContact CG1-CD1 3.71Å; V583-I587 HydrophobicContact CG1-CG1 4.33Å; V583-I587 WeakPolarHBondContact O-CG1 3.36Å; V583-I587 PolarHBondContact O-N 3.49Å; Y584-I587 PolarHBondContact O-N 3.26Å; I587-C589 VanDerWaalsContact C-N 3.33Å; I587-C589 PolarHBondContact O-N 2.66Å; I587-G590 PolarHBondContact O-N 3.37Å; I587-G590 VanDerWaalsContact O-N 3.16Å; I587-I591 HydrophobicContact CG2-CD1 3.71Å; I587-I591 HydrophobicContact CG2-CG1 4.34Å; I587-I591 VanDerWaalsContact O-CG1 3.32Å; I587-I591 WeakPolarHBondContact O-CG1 3.34Å; I587-I591 PolarHBondContact O-N 2.94Å
588R87Confident77.3Confident125 Ų12584.5 Ų84.547%0.47247%0.468SS..Hα-helixtrans-61.5-40.2179-169.2-179.5-177.1-1652.9112.5Y584 N585 K592Y584-R588 WeakPolarHBondContact O-CB 3.18Å; Y584-R588 PolarHBondContact O-N 3.41Å; N585-R588 PolarHBondContact O-N 3.4Å; R588-K592 PolarHBondContact O-N 3.36Å
589C80.4Confident74.8Confident80 Ų8087.8 Ų87.854%0.54149%0.493SS..Hα-helixtrans-67-40.2174.3-77.10000112N585 L586 I587 K592 K593N585-C589 WeakPolarHBondContact O-CB 3.44Å; N585-C589 PolarHBondContact O-N 2.99Å; N585-C589 PolarHBondContact O-SG 2.69Å; N585-C589 VanDerWaalsContact O-SG 3.33Å; L586-C589 PolarHBondContact O-N 3.24Å; I587-C589 VanDerWaalsContact C-N 3.33Å; I587-C589 PolarHBondContact O-N 2.66Å; C589-K592 PolarHBondContact O-N 3.39Å; C589-K593 PolarHBondContact O-N 3.35Å
590G73.9Confident71.9Confident42 Ų4287.1 Ų87.143%0.43350%0.497SS..Hα-helixtrans-61.4-44.8174.600000112.6L586 I587 K593 S594L586-G590 PolarHBondContact O-N 3.37Å; I587-G590 PolarHBondContact O-N 3.37Å; I587-G590 VanDerWaalsContact O-N 3.16Å; G590-K593 PolarHBondContact O-N 3.19Å; G590-S594 WeakPolarHBondContact O-CB 3.38Å; G590-S594 PolarHBondContact O-N 3.44Å
591I71.8Confident69.3Low109 Ų10988.8 Ų88.856%0.55951%0.51SS*.Hα-helixtrans-64.7-42.4176.4-65.9168.4000111I587 S594 S595I587-I591 HydrophobicContact CG2-CD1 3.71Å; I587-I591 HydrophobicContact CG2-CG1 4.34Å; I587-I591 VanDerWaalsContact O-CG1 3.32Å; I587-I591 WeakPolarHBondContact O-CG1 3.34Å; I587-I591 PolarHBondContact O-N 2.94Å; I591-S594 PolarHBondContact O-N 2.9Å; I591-S595 WeakPolarHBondContact O-CB 3.2Å; I591-S595 PolarHBondContact O-N 3.25Å
592K68.1Low66.7Low135 Ų13592.9 Ų92.959%0.58753%0.531SS*.Hα-helixtrans-63.4-41175.9-82.4-174.1174.4-173.40112.8R588 C589 S595 A596R588-K592 PolarHBondContact O-N 3.36Å; C589-K592 PolarHBondContact O-N 3.39Å; K592-S595 PolarHBondContact O-N 3.39Å; K592-A596 WeakPolarHBondContact O-CB 3.41Å; K592-A596 PolarHBondContact O-N 3.05Å
593K61.2Low64.3Low160 Ų16097.8 Ų97.870%0.69656%0.561SS**Hα-helixtrans-64.9-40.9173.6-88.5-175.2173.7-178.80111.9C589 G590 A596 N597C589-K593 PolarHBondContact O-N 3.35Å; G590-K593 PolarHBondContact O-N 3.19Å; K593-A596 PolarHBondContact O-N 3.41Å; K593-N597 WeakPolarHBondContact O-CB 3.3Å; K593-N597 PolarHBondContact O-N 2.97Å
594S53.4Low61.9Low74 Ų74103.5 Ų103.552%0.51758%0.575SS.*Hα-helixtrans-65.1-40.4175.7-166.40000112.1G590 I591 N597 V598G590-S594 WeakPolarHBondContact O-CB 3.38Å; G590-S594 PolarHBondContact O-N 3.44Å; I591-S594 PolarHBondContact O-N 2.9Å; S594-N597 PolarHBondContact O-N 3.49Å; S594-V598 VanDerWaalsContact O-CG2 3.28Å; S594-V598 WeakPolarHBondContact O-CG2 3.49Å; S594-V598 PolarHBondContact O-N 3.16Å; S594-V598 VanDerWaalsContact O-N 3.16Å
595S51.3Low59.3Low74 Ų7499.8 Ų99.852%0.51757%0.57SS.*Hα-helixtrans-68.2-38.8176.3-170.10000111.9I591 K592 N597 V598 S599I591-S595 WeakPolarHBondContact O-CB 3.2Å; I591-S595 PolarHBondContact O-N 3.25Å; K592-S595 PolarHBondContact O-N 3.39Å; S595-N597 VanDerWaalsContact C-N 3.33Å; S595-V598 PolarHBondContact O-N 3Å; S595-S599 PolarHBondContact O-N 3.4Å; S595-S599 VanDerWaalsContact O-N 3.1Å; S595-S599 PolarHBondContact O-OG 3Å
596A51.6Low56.9Low59 Ų59105.2 Ų105.249%0.48860%0.599SS.*Hα-helixtrans-66.8-33.1175.300000112.6K592 K593 V598K592-A596 WeakPolarHBondContact O-CB 3.41Å; K592-A596 PolarHBondContact O-N 3.05Å; K593-A596 PolarHBondContact O-N 3.41Å; A596-V598 VanDerWaalsContact C-N 3.34Å
597N49.7Very low54.6Low141 Ų141107.7 Ų107.775%0.75461%0.608SS**Hα-helixtrans-75-20.1174-76.7-4.2000113.5K593 S594 S595K593-N597 WeakPolarHBondContact O-CB 3.3Å; K593-N597 PolarHBondContact O-N 2.97Å; S594-N597 PolarHBondContact O-N 3.49Å; S595-N597 VanDerWaalsContact C-N 3.33Å
598V53.9Low52Low125 Ų125106.9 Ų106.976%0.75862%0.616SS**Hα-helixtrans-89.9-20.6175.5174.20000111.8S594 S595 A596S594-V598 VanDerWaalsContact O-CG2 3.28Å; S594-V598 WeakPolarHBondContact O-CG2 3.49Å; S594-V598 PolarHBondContact O-N 3.16Å; S594-V598 VanDerWaalsContact O-N 3.16Å; S595-V598 PolarHBondContact O-N 3Å; A596-V598 VanDerWaalsContact C-N 3.34Å
599S42.3Very low49.6Very low91 Ų91108.5 Ų108.564%0.63663%0.627SS**SBendtrans-109.921.9-176.667.50000115.1S595S595-S599 PolarHBondContact O-N 3.4Å; S595-S599 VanDerWaalsContact O-N 3.1Å; S595-S599 PolarHBondContact O-OG 3Å
600G36.2Very low47.6Very low49 Ų49111.7 Ų111.751%0.50563%0.634SS.*  trans-107.7120.8172.400000111N602G600-N602 PolarHBondContact O-N 2.75Å
601P37.8Very low46.1Very low118 Ų118115 Ų11577%0.76664%0.641SS**  trans-61.7130.5161.1-7.923000107.6P603P601-P603 WeakPolarHBondContact O-CD 3.49Å
602N39.3Very low44.5Very low110 Ų110115.6 Ų115.659%0.58864%0.641SS**  trans-53.6120.5174.4-164.81000109.2G600 Y604 S605G600-N602 PolarHBondContact O-N 2.75Å; N602-Y604 PolarHBondContact O-N 3.38Å; N602-S605 PolarHBondContact O-N 2.62Å; N602-S605 PolarHBondContact O-OG 2.84Å
603P41.3Very low43.1Very low121 Ų121112.9 Ų112.979%0.78664%0.635SS**THydrogen-bonded Turntrans-682.9-178-14.427.4000114.3P601P601-P603 WeakPolarHBondContact O-CD 3.49Å
604Y41.7Very low42Very low200 Ų200112.1 Ų112.178%0.78463%0.634SS**THydrogen-bonded Turntrans-125.816-177.5-69.2-77.1000113.9N602 N606N602-Y604 PolarHBondContact O-N 3.38Å; Y604-N606 PolarHBondContact O-N 2.99Å
605S37.7Very low41.4Very low63 Ų63115.1 Ų115.144%0.44164%0.64SS.*  trans-77.6105.3165.755.10000109.4N602 E607N602-S605 PolarHBondContact O-N 2.62Å; N602-S605 PolarHBondContact O-OG 2.84Å; S605-E607 PolarHBondContact O-N 2.76Å
606N38.5Very low40.8Very low139 Ų139120 Ų12074%0.74365%0.647SS**THydrogen-bonded Turntrans-63.830.1176.3-81.5-21.6000114.7Y604Y604-N606 PolarHBondContact O-N 2.99Å
607E39.4Very low40.2Very low147 Ų147122.7 Ų122.769%0.68765%0.654SS**THydrogen-bonded Turntrans-86-14.8179.9-72.3-178.4168.900112.9S605S605-E607 PolarHBondContact O-N 2.76Å
608A35.2Very low39.9Very low82 Ų82121.4 Ų121.468%0.67865%0.651SS**Hα-helixtrans-80.7-14.9179.200000114.2
609F37Very low39.4Very low159 Ų159124 Ų12470%0.69766%0.655SS**Hα-helixtrans-94.8-17.2-178-141.1-92.3000113.5T613F609-T613 PolarHBondContact O-OG1 3.35Å
610E38.5Very low39.5Very low148 Ų148124 Ų12469%0.69266%0.655SS**Hα-helixtrans-82.9-28.6177.4-76.2-173.7161.200112.8Q614E610-Q614 PolarHBondContact O-N 3.36Å
611I41.8Very low39.7Very low112 Ų112132.7 Ų132.757%0.57469%0.687SS**Hα-helixtrans-74.9-38.6-177.9-59.4172.9000111.6T613 Q614 E615I611-T613 VanDerWaalsContact C-N 3.28Å; I611-T613 PolarHBondContact O-N 3.45Å; I611-Q614 PolarHBondContact O-N 2.98Å; I611-E615 PolarHBondContact O-N 2.93Å
612E38.1Very low39.8Very low121 Ų121133.4 Ų133.457%0.56568%0.683SS**Hα-helixtrans-71.2-21.1178.3-101.6-172.8177.500113.9
613T38.7Very low39.8Very low77 Ų77134.6 Ų134.647%0.47269%0.688SS.*Hα-helixtrans-86.4-25.2178.2-420000111.5F609 I611F609-T613 PolarHBondContact O-OG1 3.35Å; I611-T613 VanDerWaalsContact C-N 3.28Å; I611-T613 PolarHBondContact O-N 3.45Å
614Q39.3Very low39.7Very low144 Ų144135.4 Ų135.467%0.67368%0.683SS**Hα-helixtrans-82-37.3178.4-136.6172.3-5.500112.4E610 I611 R616 N617 T618E610-Q614 PolarHBondContact O-N 3.36Å; I611-Q614 PolarHBondContact O-N 2.98Å; Q614-R616 PolarHBondContact O-N 3.4Å; Q614-N617 PolarHBondContact O-N 2.97Å; Q614-T618 PolarHBondContact O-OG1 3Å
615E40.7Very low39.6Very low138 Ų138131.6 Ų131.665%0.64568%0.677SS**Hα-helixtrans-69-32.2175.8-76.2-171157.500112.9I611 N617 T618I611-E615 PolarHBondContact O-N 2.93Å; E615-N617 VanDerWaalsContact C-N 3.34Å; E615-N617 PolarHBondContact O-N 2.83Å; E615-T618 PolarHBondContact O-N 3.03Å
616R38.4Very low39.7Very low176 Ų176135.9 Ų135.966%0.66469%0.692SS**Hα-helixtrans-72.2-25.5178.7-129.8179.7-74.5-167.9-3113.6Q614Q614-R616 PolarHBondContact O-N 3.4Å
617N39.4Very low39.8Very low115 Ų115135.7 Ų135.762%0.61569%0.688SS**Hα-helixtrans-85.5-11.7176.7-79.4-16.6000113.9Q614 E615Q614-N617 PolarHBondContact O-N 2.97Å; E615-N617 VanDerWaalsContact C-N 3.34Å; E615-N617 PolarHBondContact O-N 2.83Å
618T43.6Very low39.8Very low114 Ų114134.9 Ų134.970%0.69969%0.688SS**SBendtrans-93.5-6.5-179-31.80000113Q614 E615Q614-T618 PolarHBondContact O-OG1 3Å; E615-T618 PolarHBondContact O-N 3.03Å
619Q42.9Very low40.2Very low181 Ų181138.9 Ų138.985%0.84669%0.689SS**SBendtrans-101.513.3178-70.9-172.9-9.900114.2
620S44.7Very low40.5Very low90 Ų90137.3 Ų137.363%0.62969%0.688SS**  trans-131.243.8179.960.70000114.4
621I39.7Very low40.7Very low231 Ų231136.3 Ų136.3100%1.18569%0.688SS**  trans-131.80160.8-59.5-177.9000109

Retrieved 621 of 621 residues in 186.8 ms (Link to these results)

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