A0A096N634_PAPAN Loading...

Interleukin

AlphaFold DB (A0A2K5ZYR7), UniProt , Accession A0A096N634, Species PAPAN (Papio anubis, Olive baboon), Gene IL15, Length 162 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
1M34.9Very low43.8Very low243 Ų243160.5 Ų160.5100%1.19778%0.783SS**  0106.70-156.8168.3-179.400107.2
2R39.2Very low44.8Very low253 Ų253152.3 Ų152.396%0.95575%0.754SS**  trans-80.5119.9-179-86.6-178.6178.2167-0.6108.7
3I40.7Very low45.7Very low168 Ų168149.6 Ų149.686%0.86274%0.743SS**  trans-82.6115.9174.7-61.2170.8000107.6
4S42Very low46.5Very low109 Ų109148.2 Ų148.276%0.76273%0.733SS**  trans-74.7134.5175.3-177.40000110.5
5K44.9Very low47.3Very low193 Ų193143.2 Ų143.284%0.83972%0.717SS**  trans-65.5141172-91.7175.1174.3174.30110H7K5-H7 PolarHBondContact O-N 2.7Å; K5-H7 VanDerWaalsContact O-N 3.13Å
6P45.3Very low48Very low108 Ų108143.9 Ų143.970%0.70171%0.71SS**  trans-74.3111.5-178.330-31000110L8P6-L8 PolarHBondContact O-N 2.73Å
7H47.4Very low48.9Very low161 Ų161140 Ų14075%0.74569%0.692SS**THydrogen-bonded Turntrans-7524.1172.1-159.836.1000112.7K5K5-H7 PolarHBondContact O-N 2.7Å; K5-H7 VanDerWaalsContact O-N 3.13Å
8L44.4Very low49.6Very low138 Ų138136 Ų13672%0.72368%0.679SS**THydrogen-bonded Turntrans-96.8-1.6-166.2-80.8164.6000115.1P6P6-L8 PolarHBondContact O-N 2.73Å
9R47.8Very low50.2Low224 Ų224135.2 Ų135.285%0.84568%0.677SS**Hα-helixtrans-88.1-21.3179.7-109.4-179.7173.5-179.7-2.6114.9
10S46.6Very low50.7Low67 Ų67131.7 Ų131.747%0.46966%0.66SS.*Hα-helixtrans-83.5-35.9-175.7-165.30000113.4S12 Q14S10-S12 PolarHBondContact O-N 3.15Å; S10-Q14 PolarHBondContact O-N 2.96Å
11I48.8Very low51.2Low101 Ų101130.6 Ų130.652%0.51866%0.655SS.*Hα-helixtrans-69.8-35.6-174-62170.9000111.4Q14 C15I11-Q14 PolarHBondContact O-N 3.08Å; I11-C15 PolarHBondContact O-N 2.82Å
12S55.7Low52.3Low62 Ų62125.3 Ų125.343%0.43463%0.632SS.*Hα-helixtrans-60.8-48.1179.2-176.90000111.6S10 Q14 C15 Y16S10-S12 PolarHBondContact O-N 3.15Å; S12-Q14 PolarHBondContact O-N 3.4Å; S12-C15 PolarHBondContact O-N 3.21Å; S12-Y16 WeakPolarHBondContact O-CD2 3.46Å; S12-Y16 PolarHBondContact O-N 2.9Å
13I56.6Low53.2Low118 Ų118115.6 Ų115.661%0.60560%0.603SS**Hα-helixtrans-65.2-41.2-178.1-60.4172.5000111Y16 L17I13-Y16 PolarHBondContact O-N 2.83Å; I13-L17 WeakPolarHBondContact O-CB 3.45Å; I13-L17 PolarHBondContact O-N 3.14Å
14Q57.3Low54Low130 Ų130116.7 Ų116.761%0.60760%0.604SS**Hα-helixtrans-65.1-37.6177.4-93.7169.3-48.700113.2S10 I11 S12 C18S10-Q14 PolarHBondContact O-N 2.96Å; I11-Q14 PolarHBondContact O-N 3.08Å; S12-Q14 PolarHBondContact O-N 3.4Å; Q14-C18 VanDerWaalsContact O-CB 3.28Å; Q14-C18 WeakPolarHBondContact O-CB 3.47Å; Q14-C18 PolarHBondContact O-N 3.12Å
15C57.3Low54.4Low73 Ų73117 Ų11749%0.49359%0.592SS.*Hα-helixtrans-68.2-40.6174.9-82.20000112.6I11 S12 C18 L19I11-C15 PolarHBondContact O-N 2.82Å; S12-C15 PolarHBondContact O-N 3.21Å; C15-C18 PolarHBondContact O-N 2.91Å; C15-L19 WeakPolarHBondContact O-CB 3.23Å; C15-L19 WeakPolarHBondContact O-CG 3.26Å; C15-L19 PolarHBondContact O-N 3Å
16Y59.8Low55Low155 Ų155112 Ų11261%0.60857%0.574SS**Hα-helixtrans-64.7-41.7174.6-85.2-75.8000112S12 I13 C18 L19 L20S12-Y16 WeakPolarHBondContact O-CD2 3.46Å; S12-Y16 PolarHBondContact O-N 2.9Å; I13-Y16 PolarHBondContact O-N 2.83Å; Y16-C18 VanDerWaalsContact C-N 3.33Å; Y16-C18 PolarHBondContact O-N 3.12Å; Y16-L19 PolarHBondContact O-N 2.81Å; Y16-L20 WeakPolarHBondContact O-CB 3.49Å; Y16-L20 VanDerWaalsContact O-CG 3.3Å; Y16-L20 WeakPolarHBondContact O-CG 3.32Å; Y16-L20 PolarHBondContact O-N 3.14Å
17L62.2Low56.3Low77 Ų77110.8 Ų110.840%0.40357%0.565SS.*Hα-helixtrans-61.1-43.2175.2-13989.3000111.4I13 L20 L21 F34I13-L17 WeakPolarHBondContact O-CB 3.45Å; I13-L17 PolarHBondContact O-N 3.14Å; L17-L20 PolarHBondContact O-N 3.2Å; L17-L21 HydrophobicContact CD2-CD1 4.21Å; L17-L21 HydrophobicContact CG-CD1 4.32Å; L17-L21 WeakPolarHBondContact O-CB 3.39Å; L17-L21 WeakPolarHBondContact O-CD1 2.9Å; L17-L21 VanDerWaalsContact O-CG 3.3Å; L17-L21 WeakPolarHBondContact O-CG 3.43Å; L17-L21 PolarHBondContact O-N 2.79Å; L17-F34 HydrophobicContact CD1-CZ 3.78Å
18C61.9Low57.5Low68 Ų68110.5 Ų110.546%0.45956%0.564SS.*Hα-helixtrans-68.9-36.7-179.1-160.50000112.4Q14 C15 Y16 N22Q14-C18 VanDerWaalsContact O-CB 3.28Å; Q14-C18 WeakPolarHBondContact O-CB 3.47Å; Q14-C18 PolarHBondContact O-N 3.12Å; C15-C18 PolarHBondContact O-N 2.91Å; Y16-C18 VanDerWaalsContact C-N 3.33Å; Y16-C18 PolarHBondContact O-N 3.12Å; C18-N22 WeakPolarHBondContact O-CB 3.4Å; C18-N22 PolarHBondContact O-N 3.36Å; C18-N22 VanDerWaalsContact O-N 3.09Å; C18-N22 PolarHBondContact O-ND2 2.85Å; C18-N22 PolarHBondContact SG-ND2 2.87Å
19L60.8Low59Low120 Ų120106.9 Ų106.963%0.62855%0.554SS**Hα-helixtrans-68.8-39173.7-78.3163.7000112.1C15 Y16 S23C15-L19 WeakPolarHBondContact O-CB 3.23Å; C15-L19 WeakPolarHBondContact O-CG 3.26Å; C15-L19 PolarHBondContact O-N 3Å; Y16-L19 PolarHBondContact O-N 2.81Å; L19-S23 WeakPolarHBondContact O-CB 3.43Å; L19-S23 PolarHBondContact O-N 3.45Å; L19-S23 PolarHBondContact O-OG 3.17Å
20L60.8Low60.2Low66 Ų6696.6 Ų96.635%0.34652%0.517SS..Hα-helixtrans-65.3-44.4175-74166.2000111.4Y16 L17 N22 S23 F25 L26 F34Y16-L20 WeakPolarHBondContact O-CB 3.49Å; Y16-L20 VanDerWaalsContact O-CG 3.3Å; Y16-L20 WeakPolarHBondContact O-CG 3.32Å; Y16-L20 PolarHBondContact O-N 3.14Å; L17-L20 PolarHBondContact O-N 3.2Å; L20-N22 PolarHBondContact O-N 3.16Å; L20-S23 PolarHBondContact O-N 2.93Å; L20-S23 PolarHBondContact O-OG 2.87Å; L20-F25 HydrophobicContact CD2-CD1 4.25Å; L20-L26 VanDerWaalsContact O-CD1 3.24Å; L20-L26 WeakPolarHBondContact O-CD1 3.09Å; L20-F34 HydrophobicContact CD1-CD2 4.08Å; L20-F34 HydrophobicContact CD1-CE2 3.79Å
21L61Low61.8Low108 Ų10896.6 Ų96.657%0.56551%0.511SS*.Hα-helixtrans-65.8-30.3178.3-77.6159.8000114.2L17 L26L17-L21 HydrophobicContact CD2-CD1 4.21Å; L17-L21 HydrophobicContact CG-CD1 4.32Å; L17-L21 WeakPolarHBondContact O-CB 3.39Å; L17-L21 WeakPolarHBondContact O-CD1 2.9Å; L17-L21 VanDerWaalsContact O-CG 3.3Å; L17-L21 WeakPolarHBondContact O-CG 3.43Å; L17-L21 PolarHBondContact O-N 2.79Å; L21-L26 HydrophobicContact CD2-CD2 4.46Å
22N57.7Low63.2Low132 Ų13296.6 Ų96.671%0.70651%0.509SS*.Hα-helixtrans-94.5-6.7-179.5-77.4-64.4000114.3C18 L20C18-N22 WeakPolarHBondContact O-CB 3.4Å; C18-N22 PolarHBondContact O-N 3.36Å; C18-N22 VanDerWaalsContact O-N 3.09Å; C18-N22 PolarHBondContact O-ND2 2.85Å; C18-N22 PolarHBondContact SG-ND2 2.87Å; L20-N22 PolarHBondContact O-N 3.16Å
23S59.1Low64.3Low49 Ų4998.1 Ų98.134%0.34352%0.515SS..SBendtrans-90.1148.617569.60000110.3L19 L20 F25L19-S23 WeakPolarHBondContact O-CB 3.43Å; L19-S23 PolarHBondContact O-N 3.45Å; L19-S23 PolarHBondContact O-OG 3.17Å; L20-S23 PolarHBondContact O-N 2.93Å; L20-S23 PolarHBondContact O-OG 2.87Å; S23-F25 PolarHBondContact O-N 2.86Å; S23-F25 WeakPolarHBondContact OG-CB 3.42Å
24H55.8Low65.5Low192 Ų19296.5 Ų96.589%0.88950%0.504SS*.THydrogen-bonded Turntrans-59.911171-80.6-88.2000114.2L26H24-L26 PolarHBondContact O-N 3.39Å
25F51.8Low66.7Low116 Ų11693.9 Ų93.951%0.50949%0.494SS..THydrogen-bonded Turntrans-70.7-12.3174.9-162.4-100.9000113.1L20 S23 T27L20-F25 HydrophobicContact CD2-CD1 4.25Å; S23-F25 PolarHBondContact O-N 2.86Å; S23-F25 WeakPolarHBondContact OG-CB 3.42Å; F25-T27 PolarHBondContact O-N 3.46Å
26L57.3Low67.8Low87 Ų8796 Ų9646%0.45550%0.499SS..  trans-75.752.9167.5-78.498.9000112.6L20 L21 H24 I31L20-L26 VanDerWaalsContact O-CD1 3.24Å; L20-L26 WeakPolarHBondContact O-CD1 3.09Å; L21-L26 HydrophobicContact CD2-CD2 4.46Å; H24-L26 PolarHBondContact O-N 3.39Å; L26-I31 HydrophobicContact CB-CD1 4.43Å; L26-I31 HydrophobicContact CB-CG1 4.37Å; L26-I31 HydrophobicContact CD2-CD1 3.92Å; L26-I31 HydrophobicContact CD2-CG1 3.99Å; L26-I31 HydrophobicContact CG-CD1 4.4Å; L26-I31 HydrophobicContact CG-CG1 4.1Å
27T72.1Confident68.7Low83 Ų8390.2 Ų90.251%0.50949%0.487SS..SBendtrans-72.6155.5150.258.30000107.9F25 A29 G30 I31F25-T27 PolarHBondContact O-N 3.46Å; T27-A29 PolarHBondContact O-N 3.33Å; T27-A29 VanDerWaalsContact O-N 3.14Å; T27-G30 PolarHBondContact O-N 3.16Å; T27-G30 PolarHBondContact OG1-N 3.29Å; T27-I31 PolarHBondContact O-N 3.03Å; T27-I31 VanDerWaalsContact O-N 3.17Å
28E72.3Confident69.6Low154 Ų15489.6 Ų89.672%0.7249%0.488SS*.Hα-helixtrans-46.9-44.2175.7-174.2177.6173.300111.4G30 I31 H32E28-G30 PolarHBondContact O-N 3.29Å; E28-I31 PolarHBondContact O-N 3.24Å; E28-H32 PolarHBondContact O-CD2 2.86Å; E28-H32 PolarHBondContact O-N 3.14Å; E28-H32 VanDerWaalsContact O-N 3.15Å
29A75.9Confident70.3Confident63 Ų6392.9 Ų92.952%0.52150%0.495SS..Hα-helixtrans-60.8-40.4175.800000114T27 H32 V33T27-A29 PolarHBondContact O-N 3.33Å; T27-A29 VanDerWaalsContact O-N 3.14Å; A29-H32 PolarHBondContact O-N 3.22Å; A29-V33 WeakPolarHBondContact O-CG2 3.45Å; A29-V33 PolarHBondContact O-N 2.95Å
30G74.5Confident70.7Confident7 Ų791.1 Ų91.17%0.07249%0.493CS..Hα-helixtrans-67-35.517900000113.1T27 E28 F34T27-G30 PolarHBondContact O-N 3.16Å; T27-G30 PolarHBondContact OG1-N 3.29Å; E28-G30 PolarHBondContact O-N 3.29Å; G30-F34 WeakPolarHBondContact O-CB 3.41Å; G30-F34 PolarHBondContact O-N 3.38Å
31I79.1Confident71.3Confident68 Ų6892.3 Ų92.335%0.34951%0.512SS..Hα-helixtrans-65.5-44.9173.7-61.7172000110.1L26 T27 E28 V33 F34 I35L26-I31 HydrophobicContact CB-CD1 4.43Å; L26-I31 HydrophobicContact CB-CG1 4.37Å; L26-I31 HydrophobicContact CD2-CD1 3.92Å; L26-I31 HydrophobicContact CD2-CG1 3.99Å; L26-I31 HydrophobicContact CG-CD1 4.4Å; L26-I31 HydrophobicContact CG-CG1 4.1Å; T27-I31 PolarHBondContact O-N 3.03Å; T27-I31 VanDerWaalsContact O-N 3.17Å; E28-I31 PolarHBondContact O-N 3.24Å; I31-V33 PolarHBondContact O-N 3.48Å; I31-F34 PolarHBondContact O-N 3.13Å; I31-I35 HydrophobicContact CG2-CD1 3.63Å; I31-I35 HydrophobicContact CG2-CG1 4.26Å; I31-I35 WeakPolarHBondContact O-CB 3.28Å; I31-I35 VanDerWaalsContact O-CG1 3.26Å; I31-I35 WeakPolarHBondContact O-CG1 3.41Å; I31-I35 PolarHBondContact O-N 3.08Å
32H77.6Confident71.4Confident101 Ų10190 Ų9047%0.46852%0.515SS..Hα-helixtrans-60.6-45.7177-74.4-65.6000112.4E28 A29 F34 I35 L36E28-H32 PolarHBondContact O-CD2 2.86Å; E28-H32 PolarHBondContact O-N 3.14Å; E28-H32 VanDerWaalsContact O-N 3.15Å; A29-H32 PolarHBondContact O-N 3.22Å; H32-F34 VanDerWaalsContact C-N 3.34Å; H32-F34 PolarHBondContact O-N 3.02Å; H32-I35 PolarHBondContact O-N 3.17Å; H32-L36 WeakPolarHBondContact O-CB 3.41Å; H32-L36 WeakPolarHBondContact O-CG 3.36Å; H32-L36 PolarHBondContact O-N 3.32Å
33V80.6Confident72Confident94 Ų9489.3 Ų89.357%0.5751%0.51SS*.Hα-helixtrans-63-41.2177.5172.90000111.3A29 I31 L36 G37A29-V33 WeakPolarHBondContact O-CG2 3.45Å; A29-V33 PolarHBondContact O-N 2.95Å; I31-V33 PolarHBondContact O-N 3.48Å; V33-L36 PolarHBondContact O-N 2.81Å; V33-G37 PolarHBondContact O-N 3.37Å
34F80.4Confident71.9Confident84 Ų8491.7 Ų91.737%0.36853%0.525SS..Hα-helixtrans-64.1-46.9177-179.7-102.4000111.9L17 L20 G30 I31 H32 G37 C38L17-F34 HydrophobicContact CD1-CZ 3.78Å; L20-F34 HydrophobicContact CD1-CD2 4.08Å; L20-F34 HydrophobicContact CD1-CE2 3.79Å; G30-F34 WeakPolarHBondContact O-CB 3.41Å; G30-F34 PolarHBondContact O-N 3.38Å; I31-F34 PolarHBondContact O-N 3.13Å; H32-F34 VanDerWaalsContact C-N 3.34Å; H32-F34 PolarHBondContact O-N 3.02Å; F34-G37 PolarHBondContact O-N 3.13Å; F34-C38 PolarHBondContact O-N 3.44Å; F34-C38 PolarHBondContact O-SG 2.94Å; F34-C38 VanDerWaalsContact O-SG 3.38Å
35I82.2Confident72Confident75 Ų7591.3 Ų91.339%0.38552%0.52SS..Hα-helixtrans-59.6-48.5176.5-71.1173.2000110.4I31 H32 G37 C38 F39I31-I35 HydrophobicContact CG2-CD1 3.63Å; I31-I35 HydrophobicContact CG2-CG1 4.26Å; I31-I35 WeakPolarHBondContact O-CB 3.28Å; I31-I35 VanDerWaalsContact O-CG1 3.26Å; I31-I35 WeakPolarHBondContact O-CG1 3.41Å; I31-I35 PolarHBondContact O-N 3.08Å; H32-I35 PolarHBondContact O-N 3.17Å; I35-G37 VanDerWaalsContact C-N 3.3Å; I35-G37 PolarHBondContact O-N 3.3Å; I35-C38 PolarHBondContact O-N 3.04Å; I35-C38 VanDerWaalsContact O-N 3.16Å; I35-F39 HydrophobicContact CG2-CD2 3.51Å; I35-F39 HydrophobicContact CG2-CE2 3.41Å; I35-F39 VanDerWaalsContact CG2-CE2 3.41Å; I35-F39 WeakPolarHBondContact O-CD2 3.24Å; I35-F39 PolarHBondContact O-N 3.06Å
36L80.1Confident72.3Confident117 Ų11792.1 Ų92.161%0.61354%0.535SS*.Hα-helixtrans-61.3-36.8176.8-71.7168.2000112.3H32 V33 F39 S40H32-L36 WeakPolarHBondContact O-CB 3.41Å; H32-L36 WeakPolarHBondContact O-CG 3.36Å; H32-L36 PolarHBondContact O-N 3.32Å; V33-L36 PolarHBondContact O-N 2.81Å; L36-F39 PolarHBondContact O-N 3.15Å; L36-S40 WeakPolarHBondContact O-CB 3.36Å; L36-S40 PolarHBondContact O-N 2.98Å; L36-S40 PolarHBondContact O-OG 2.82Å
37G80.6Confident72.7Confident33 Ų3395.3 Ų95.334%0.3455%0.548SS..Hα-helixtrans-64.8-41.917300000112.8V33 F34 I35 S40 A41V33-G37 PolarHBondContact O-N 3.37Å; F34-G37 PolarHBondContact O-N 3.13Å; I35-G37 VanDerWaalsContact C-N 3.3Å; I35-G37 PolarHBondContact O-N 3.3Å; G37-S40 WeakPolarHBondContact CA-OG 3.25Å; G37-S40 PolarHBondContact O-N 3Å; G37-S40 PolarHBondContact O-OG 2.94Å; G37-A41 WeakPolarHBondContact O-CB 3.42Å; G37-A41 PolarHBondContact O-N 3.3Å
38C79.6Confident72.7Confident65 Ų6592.8 Ų92.844%0.43954%0.536SS..Hα-helixtrans-67.4-39.7174.9-69.70000112.3F34 I35 G42F34-C38 PolarHBondContact O-N 3.44Å; F34-C38 PolarHBondContact O-SG 2.94Å; F34-C38 VanDerWaalsContact O-SG 3.38Å; I35-C38 PolarHBondContact O-N 3.04Å; I35-C38 VanDerWaalsContact O-N 3.16Å; C38-G42 PolarHBondContact O-N 3.38Å
39F77.3Confident73.4Confident136 Ų13689 Ų8960%0.59652%0.52SS*.Hα-helixtrans-62.7-48.1173.5-85.8-72.5000111.1I35 L36 A41 G42 L43I35-F39 HydrophobicContact CG2-CD2 3.51Å; I35-F39 HydrophobicContact CG2-CE2 3.41Å; I35-F39 VanDerWaalsContact CG2-CE2 3.41Å; I35-F39 WeakPolarHBondContact O-CD2 3.24Å; I35-F39 PolarHBondContact O-N 3.06Å; L36-F39 PolarHBondContact O-N 3.15Å; F39-A41 VanDerWaalsContact C-N 3.33Å; F39-A41 PolarHBondContact O-N 3.14Å; F39-G42 PolarHBondContact O-N 2.04Å; F39-G42 VanDerWaalsContact O-N 3.16Å; F39-L43 VanDerWaalsContact O-CG 3.26Å; F39-L43 WeakPolarHBondContact O-CG 3.05Å; F39-L43 PolarHBondContact O-N 3.13Å
40S69.1Low74.2Confident84 Ų8486.3 Ų86.359%0.58750%0.496SS*.Hα-helixtrans-64.5-34179.555.80000113.5L36 G37L36-S40 WeakPolarHBondContact O-CB 3.36Å; L36-S40 PolarHBondContact O-N 2.98Å; L36-S40 PolarHBondContact O-OG 2.82Å; G37-S40 WeakPolarHBondContact CA-OG 3.25Å; G37-S40 PolarHBondContact O-N 3Å; G37-S40 PolarHBondContact O-OG 2.94Å
41A73.4Confident75Confident90 Ų9089.8 Ų89.874%0.74452%0.516SS*.Hα-helixtrans-77.5-25.8173.900000113.9G37 F39G37-A41 WeakPolarHBondContact O-CB 3.42Å; G37-A41 PolarHBondContact O-N 3.3Å; F39-A41 VanDerWaalsContact C-N 3.33Å; F39-A41 PolarHBondContact O-N 3.14Å
42G64.1Low75.7Confident61 Ų6190 Ų9063%0.62952%0.518SS*.Hα-helixtrans-93.3-16-177.600000114.4C38 F39C38-G42 PolarHBondContact O-N 3.38Å; F39-G42 PolarHBondContact O-N 2.04Å; F39-G42 VanDerWaalsContact O-N 3.16Å
43L69.6Low76.6Confident116 Ų11685.2 Ų85.261%0.60750%0.496SS*.SBendtrans-64.2125.2172.7-79169.4000108.7F39 K45F39-L43 VanDerWaalsContact O-CG 3.26Å; F39-L43 WeakPolarHBondContact O-CG 3.05Å; F39-L43 PolarHBondContact O-N 3.13Å; L43-K45 PolarHBondContact O-N 3Å
44P57.3Low77.3Confident100 Ų10082 Ų8265%0.64948%0.475SS*.  trans-57.2133.1171.724.9-31.3000107.3T46P44-T46 VanDerWaalsContact C-N 3.29Å; P44-T46 PolarHBondContact O-N 3.02Å
45K56.2Low78.1Confident183 Ų18381.4 Ų81.480%0.79648%0.481SS*.  trans-61.8101.7165.5-69.9-176.2179.7-178.40106.3L43 E47L43-K45 PolarHBondContact O-N 3Å; K45-E47 HydrophobicContact CB-CG 4.22Å; K45-E47 PolarHBondContact O-N 3.3Å
46T59.8Low78.8Confident134 Ų13479.2 Ų79.282%0.82247%0.471SS*.  trans-70.583.4163.837.70000106.2P44 A48P44-T46 VanDerWaalsContact C-N 3.29Å; P44-T46 PolarHBondContact O-N 3.02Å; T46-A48 PolarHBondContact O-N 3.25Å
47E65.2Low79.6Confident153 Ų15373.8 Ų73.872%0.71544%0.442SS*.  trans-63.3124.6173.6-70.3-177.9174.900107.9K45 N49K45-E47 HydrophobicContact CB-CG 4.22Å; K45-E47 PolarHBondContact O-N 3.3Å; E47-N49 PolarHBondContact O-N 3.33Å
48A72.6Confident80.3Confident31 Ų3177.8 Ų77.826%0.25645%0.45SS..  trans-61.1127.8174.300000108.2T46 L117 N120 I121T46-A48 PolarHBondContact O-N 3.25Å; A48-L117 HydrophobicContact CB-CD2 3.91Å; A48-N120 HydrophobicContact CB-CB 3.9Å; A48-I121 HydrophobicContact CB-CD1 4.12Å; A48-I121 HydrophobicContact CB-CG1 3.55Å; A48-I121 WeakPolarHBondContact O-CG1 3.43Å
49N86.2Confident81.2Confident74 Ų7479.3 Ų79.340%0.39645%0.449SS..  trans-133.4135.6-174.4-175.3-9.3000109.6E47 V51 N52 V53E47-N49 PolarHBondContact O-N 3.33Å; N49-V51 PolarHBondContact O-N 3Å; N49-V51 VanDerWaalsContact O-N 3.12Å; N49-V51 WeakPolarHBondContact OD1-CG2 3.18Å; N49-V51 PolarHBondContact OD1-N 3.11Å; N49-N52 WeakPolarHBondContact O-CB 3.49Å; N49-N52 PolarHBondContact O-N 3.12Å; N49-V53 PolarHBondContact O-N 3.31Å
50W92.3Very high82.1Confident6 Ų672.8 Ų72.82%0.02342%0.421CS..Hα-helixtrans-55.5-25173.6-68118.4000113.6N52 V53 I54 M88 A118 I121 L122 V155 F158 I159W50-N52 VanDerWaalsContact C-N 3.3Å; W50-N52 PolarHBondContact O-N 2.89Å; W50-V53 HydrophobicContact CE3-CB 4.23Å; W50-V53 HydrophobicContact CE3-CG1 4.35Å; W50-V53 HydrophobicContact CE3-CG2 3.96Å; W50-V53 HydrophobicContact CZ3-CG2 4.37Å; W50-V53 WeakPolarHBondContact O-CB 3.45Å; W50-V53 PolarHBondContact O-N 3.36Å; W50-I54 PolarHBondContact O-N 3.33Å; W50-M88 HydrophobicContact CH2-CE 3.95Å; W50-M88 HydrophobicContact CH2-CG 4.29Å; W50-M88 HydrophobicContact CH2-SD 4.3Å; W50-M88 HydrophobicContact CZ3-CE 3.75Å; W50-M88 HydrophobicContact CZ3-SD 4.11Å; W50-A118 HydrophobicContact CH2-CB 4.49Å; W50-A118 HydrophobicContact CZ3-CB 4.19Å; W50-I121 HydrophobicContact CD2-CD1 3.82Å; W50-I121 HydrophobicContact CD2-CG2 4.37Å; W50-I121 VanDerWaalsContact CE2-CG2 3.45Å; W50-I121 HydrophobicContact CE3-CD1 4.1Å; W50-I121 HydrophobicContact CG-CD1 4.13Å; W50-I121 HydrophobicContact CZ2-CB 3.94Å; W50-I121 HydrophobicContact CZ2-CD1 4.42Å; W50-I121 HydrophobicContact CZ2-CG2 3.59Å; W50-I121 VanDerWaalsContact NE1-CG2 3.26Å; W50-L122 HydrophobicContact CH2-CD2 4.05Å; W50-L122 HydrophobicContact CH2-CG 4.13Å; W50-L122 HydrophobicContact CZ2-CD2 4.12Å; W50-L122 HydrophobicContact CZ2-CG 4.44Å; W50-V155 HydrophobicContact CB-CG1 3.9Å; W50-V155 HydrophobicContact CD2-CG1 4.36Å; W50-V155 HydrophobicContact CE3-CG1 3.86Å; W50-V155 HydrophobicContact CE3-CG2 4.37Å; W50-V155 HydrophobicContact CG-CG1 4.43Å; W50-F158 HydrophobicContact CD2-CB 3.9Å; W50-F158 VanDerWaalsContact CE2-CB 3.48Å; W50-F158 AromaticContact CE2-CG 3.83Å; W50-F158 HydrophobicContact CG-CB 4.11Å; W50-F158 HydrophobicContact CH2-CD1 4.41Å; W50-F158 HydrophobicContact CH2-CD2 4.45Å; W50-F158 HydrophobicContact CH2-CG 4.26Å; W50-F158 HydrophobicContact CZ2-CB 3.91Å; W50-F158 AromaticContact CZ2-CD1 3.63Å; W50-F158 HydrophobicContact CZ2-CD1 3.63Å; W50-F158 HydrophobicContact CZ2-CD2 4.32Å; W50-F158 HydrophobicContact CZ2-CE1 4.2Å; W50-F158 AromaticContact CZ2-CG 3.7Å; W50-F158 HydrophobicContact CZ2-CG 3.7Å; W50-I159 HydrophobicContact CB-CD1 3.93Å; W50-I159 HydrophobicContact CB-CG1 3.4Å; W50-I159 HydrophobicContact CG-CG1 4.18Å
51V92.8Very high83.3Confident81 Ų8172.4 Ų72.449%0.49141%0.41SS..Hα-helixtrans-61.9-38.7172.61780000111.8N49 I54 S55N49-V51 PolarHBondContact O-N 3Å; N49-V51 VanDerWaalsContact O-N 3.12Å; N49-V51 WeakPolarHBondContact OD1-CG2 3.18Å; N49-V51 PolarHBondContact OD1-N 3.11Å; V51-I54 PolarHBondContact O-N 2.98Å; V51-S55 PolarHBondContact O-N 2.85Å; V51-S55 VanDerWaalsContact O-N 3.12Å
52N92.9Very high84.3Confident73 Ų7373 Ų7339%0.3940%0.401SS..Hα-helixtrans-69.2-38.3177-62.4-19.8000110.5N49 W50 I54 S55 D56 L117N49-N52 WeakPolarHBondContact O-CB 3.49Å; N49-N52 PolarHBondContact O-N 3.12Å; W50-N52 VanDerWaalsContact C-N 3.3Å; W50-N52 PolarHBondContact O-N 2.89Å; N52-I54 VanDerWaalsContact C-N 3.33Å; N52-I54 PolarHBondContact O-N 3.38Å; N52-S55 WeakPolarHBondContact O-CA 3.46Å; N52-S55 VanDerWaalsContact O-CB 3.31Å; N52-S55 WeakPolarHBondContact O-CB 3.32Å; N52-S55 PolarHBondContact O-N 3.11Å; N52-D56 PolarHBondContact O-N 2.04Å; N52-L117 HydrophobicContact CB-CD1 3.82Å
53V95.6Very high85.7Confident0 Ų072.4 Ų72.40%038%0.382CS..Hα-helixtrans-57.6-44.5173.3175.90000111.1N49 W50 S55 D56 L57 L114 L117 V155N49-V53 PolarHBondContact O-N 3.31Å; W50-V53 HydrophobicContact CE3-CB 4.23Å; W50-V53 HydrophobicContact CE3-CG1 4.35Å; W50-V53 HydrophobicContact CE3-CG2 3.96Å; W50-V53 HydrophobicContact CZ3-CG2 4.37Å; W50-V53 WeakPolarHBondContact O-CB 3.45Å; W50-V53 PolarHBondContact O-N 3.36Å; V53-S55 VanDerWaalsContact C-N 3.31Å; V53-S55 PolarHBondContact O-N 2.86Å; V53-D56 PolarHBondContact O-N 2.93Å; V53-L57 HydrophobicContact CG1-CD1 4.39Å; V53-L57 WeakPolarHBondContact O-CG 3.35Å; V53-L57 PolarHBondContact O-N 3.02Å; V53-L114 HydrophobicContact CG1-CD1 4.24Å; V53-L114 HydrophobicContact CG1-CD2 4.1Å; V53-L114 HydrophobicContact CG1-CG 3.98Å; V53-L117 HydrophobicContact CG2-CB 4.1Å; V53-V155 HydrophobicContact CB-CG1 4.42Å; V53-V155 HydrophobicContact CG1-CG1 4.27Å; V53-V155 HydrophobicContact CG1-CG2 3.77Å
54I96.2Very high86.8Confident26 Ų2668 Ų6813%0.13336%0.359CS..Hα-helixtrans-62.3-38.9175-66.7179.1000111.6W50 V51 N52 D56 L57 K58 V155 Q156 I159W50-I54 PolarHBondContact O-N 3.33Å; V51-I54 PolarHBondContact O-N 2.98Å; N52-I54 VanDerWaalsContact C-N 3.33Å; N52-I54 PolarHBondContact O-N 3.38Å; I54-D56 VanDerWaalsContact C-N 3.35Å; I54-L57 PolarHBondContact O-N 3.43Å; I54-K58 HydrophobicContact CG2-CD 4.44Å; I54-K58 WeakPolarHBondContact O-CG 3.2Å; I54-K58 PolarHBondContact O-N 2.9Å; I54-K58 VanDerWaalsContact O-N 3.13Å; I54-V155 HydrophobicContact CD1-CG1 4Å; I54-V155 HydrophobicContact CG1-CB 4.24Å; I54-V155 HydrophobicContact CG1-CG1 3.57Å; I54-Q156 HydrophobicContact CD1-CG 4.24Å; I54-I159 HydrophobicContact CD1-CD1 3.5Å; I54-I159 VanDerWaalsContact CD1-CD1 3.5Å; I54-I159 HydrophobicContact CG1-CD1 4.49Å
55S96.1Very high88.3Confident71 Ų7170 Ų7050%0.49736%0.36SS..Hα-helixtrans-62.7-43.5177.4-170.30000111.5V51 N52 V53 K58 K59V51-S55 PolarHBondContact O-N 2.85Å; V51-S55 VanDerWaalsContact O-N 3.12Å; N52-S55 WeakPolarHBondContact O-CA 3.46Å; N52-S55 VanDerWaalsContact O-CB 3.31Å; N52-S55 WeakPolarHBondContact O-CB 3.32Å; N52-S55 PolarHBondContact O-N 3.11Å; V53-S55 VanDerWaalsContact C-N 3.31Å; V53-S55 PolarHBondContact O-N 2.86Å; S55-K58 PolarHBondContact O-N 3.01Å; S55-K59 PolarHBondContact O-N 3.34Å
56D96.9Very high89.6Confident30 Ų3066.3 Ų66.316%0.1636%0.357CS..Hα-helixtrans-67.6-39.9178.7-68.3-20.7000111.4N52 V53 I54 K58 K59 I60 T110 L114N52-D56 PolarHBondContact O-N 2.04Å; V53-D56 PolarHBondContact O-N 2.93Å; I54-D56 VanDerWaalsContact C-N 3.35Å; D56-K58 VanDerWaalsContact C-N 3.32Å; D56-K58 PolarHBondContact O-N 3.21Å; D56-K59 PolarHBondContact O-N 3.46Å; D56-I60 VanDerWaalsContact O-CG1 3.31Å; D56-I60 WeakPolarHBondContact O-CG1 3.46Å; D56-I60 PolarHBondContact O-N 2.62Å; D56-T110 HydrophobicContact CB-CG2 3.88Å; D56-L114 HydrophobicContact CB-CB 4.08Å; D56-L114 HydrophobicContact CB-CD1 3.87Å; D56-L114 HydrophobicContact CB-CG 4.26Å
57L97.7Very high91Very high2 Ų262.4 Ų62.41%0.0133%0.33CS..Hα-helixtrans-58.1-42.8173.6-72.6174000112.4V53 I54 I60 E61 L114 L148 F151 V152 V155V53-L57 HydrophobicContact CG1-CD1 4.39Å; V53-L57 WeakPolarHBondContact O-CG 3.35Å; V53-L57 PolarHBondContact O-N 3.02Å; I54-L57 PolarHBondContact O-N 3.43Å; L57-I60 PolarHBondContact O-N 2.9Å; L57-E61 PolarHBondContact O-N 3.29Å; L57-L114 HydrophobicContact CD2-CD1 3.64Å; L57-L114 HydrophobicContact CG-CD1 3.78Å; L57-L148 HydrophobicContact CD2-CD2 4.03Å; L57-F151 HydrophobicContact CD1-CB 4.16Å; L57-F151 HydrophobicContact CD1-CD1 4.45Å; L57-F151 HydrophobicContact CD1-CD2 3.94Å; L57-F151 HydrophobicContact CD1-CE2 4.43Å; L57-F151 HydrophobicContact CD1-CG 3.91Å; L57-F151 HydrophobicContact CD2-CB 4.31Å; L57-F151 HydrophobicContact CD2-CD1 3.5Å; L57-F151 VanDerWaalsContact CD2-CD1 3.5Å; L57-F151 HydrophobicContact CD2-CD2 4.39Å; L57-F151 HydrophobicContact CD2-CE1 3.81Å; L57-F151 HydrophobicContact CD2-CG 3.81Å; L57-F151 HydrophobicContact CD2-CZ 4.35Å; L57-V152 HydrophobicContact CB-CG2 4.28Å; L57-V152 HydrophobicContact CD1-CG2 3.84Å; L57-V155 HydrophobicContact CD1-CG2 4.18Å
58K96.5Very high91.9Very high117 Ų11763.5 Ų63.551%0.50934%0.335SS..Hα-helixtrans-66.7-40.6176.7-72.3176.6178.8-178.70112.2I54 S55 D56 I60 E61 D62I54-K58 HydrophobicContact CG2-CD 4.44Å; I54-K58 WeakPolarHBondContact O-CG 3.2Å; I54-K58 PolarHBondContact O-N 2.9Å; I54-K58 VanDerWaalsContact O-N 3.13Å; S55-K58 PolarHBondContact O-N 3.01Å; D56-K58 VanDerWaalsContact C-N 3.32Å; D56-K58 PolarHBondContact O-N 3.21Å; K58-I60 VanDerWaalsContact C-N 3.3Å; K58-I60 PolarHBondContact O-N 3.46Å; K58-E61 WeakPolarHBondContact O-CB 3.49Å; K58-E61 PolarHBondContact O-N 3.35Å; K58-D62 PolarHBondContact O-N 3.03Å
59K96.4Very high92.5Very high97 Ų9763.2 Ų63.242%0.42233%0.329SS..Hα-helixtrans-61.1-42.3175.6-174.4-175.7174.1-152.50110.8S55 D56 D62 L63 T110S55-K59 PolarHBondContact O-N 3.34Å; D56-K59 PolarHBondContact O-N 3.46Å; K59-D62 PolarHBondContact O-N 3.33Å; K59-L63 HydrophobicContact CG-CD1 4.17Å; K59-L63 VanDerWaalsContact O-CG 3.26Å; K59-L63 WeakPolarHBondContact O-CG 3.4Å; K59-L63 PolarHBondContact O-N 3.32Å; K59-T110 HydrophobicContact CB-CG2 4.34Å; K59-T110 HydrophobicContact CD-CG2 3.97Å; K59-T110 HydrophobicContact CG-CG2 4.43Å; K59-T110 PolarHBondContact NZ-OG1 2.89Å
60I96.2Very high92.7Very high0 Ų066.9 Ų66.90%035%0.348CS..Hα-helixtrans-60.9-49.3174.4-67.2164.2000110D56 L57 K58 D62 L63 I64 L95 I98 T110 V111 L114 L148D56-I60 VanDerWaalsContact O-CG1 3.31Å; D56-I60 WeakPolarHBondContact O-CG1 3.46Å; D56-I60 PolarHBondContact O-N 2.62Å; L57-I60 PolarHBondContact O-N 2.9Å; K58-I60 VanDerWaalsContact C-N 3.3Å; K58-I60 PolarHBondContact O-N 3.46Å; I60-D62 VanDerWaalsContact C-N 3.29Å; I60-D62 PolarHBondContact O-N 3.37Å; I60-L63 PolarHBondContact O-N 2.96Å; I60-L63 VanDerWaalsContact O-N 3.17Å; I60-I64 HydrophobicContact CG2-CG2 4.27Å; I60-I64 WeakPolarHBondContact O-CG1 3.33Å; I60-I64 WeakPolarHBondContact O-CG2 3.43Å; I60-I64 PolarHBondContact O-N 3.19Å; I60-L95 HydrophobicContact CD1-CD1 4.08Å; I60-L95 HydrophobicContact CD1-CD2 4.4Å; I60-I98 HydrophobicContact CG2-CG2 4.36Å; I60-T110 HydrophobicContact CD1-CG2 4.06Å; I60-T110 HydrophobicContact CG1-CG2 3.7Å; I60-V111 HydrophobicContact CD1-CG2 3.67Å; I60-V111 HydrophobicContact CG1-CG2 4.36Å; I60-L114 HydrophobicContact CD1-CD1 4.19Å; I60-L148 HydrophobicContact CG2-CD1 4.48Å; I60-L148 HydrophobicContact CG2-CD2 4.44Å
61E95.4Very high92.7Very high76 Ų7667.1 Ų67.136%0.35535%0.352SS..Hα-helixtrans-53.3-44.7176.9-170.7179.9-172.600112.1L57 K58 I64 Q65 L148L57-E61 PolarHBondContact O-N 3.29Å; K58-E61 WeakPolarHBondContact O-CB 3.49Å; K58-E61 PolarHBondContact O-N 3.35Å; E61-I64 WeakPolarHBondContact O-CG1 3.45Å; E61-Q65 WeakPolarHBondContact O-CG 3.44Å; E61-Q65 PolarHBondContact O-N 3.24Å; E61-L148 HydrophobicContact CB-CD1 3.93Å; E61-L148 HydrophobicContact CG-CD1 4.27Å
62D94.7Very high92.9Very high103 Ų10367 Ų6755%0.55135%0.351SS*.Hα-helixtrans-67.4-40.4179.1-72.3-25.4000112.5K58 K59 I60K58-D62 PolarHBondContact O-N 3.03Å; K59-D62 PolarHBondContact O-N 3.33Å; I60-D62 VanDerWaalsContact C-N 3.29Å; I60-D62 PolarHBondContact O-N 3.37Å
63L93.3Very high93.1Very high47 Ų4763.5 Ų63.525%0.24633%0.333CS..Hα-helixtrans-66-44.2179.8-71.1169.8000111.6K59 I60 Q65 S66 D106 I107K59-L63 HydrophobicContact CG-CD1 4.17Å; K59-L63 VanDerWaalsContact O-CG 3.26Å; K59-L63 WeakPolarHBondContact O-CG 3.4Å; K59-L63 PolarHBondContact O-N 3.32Å; I60-L63 PolarHBondContact O-N 2.96Å; I60-L63 VanDerWaalsContact O-N 3.17Å; L63-Q65 VanDerWaalsContact C-N 3.27Å; L63-Q65 PolarHBondContact O-N 2.94Å; L63-S66 PolarHBondContact O-OG 3.04Å; L63-S66 VanDerWaalsContact O-OG 3.13Å; L63-D106 HydrophobicContact CD1-CB 4.17Å; L63-I107 HydrophobicContact CB-CD1 4.04Å; L63-I107 HydrophobicContact CB-CG1 3.83Å; L63-I107 HydrophobicContact CD1-CG1 3.8Å; L63-I107 HydrophobicContact CG-CG1 4.44Å
64I92.1Very high93.3Very high23 Ų2366.3 Ų66.312%0.11834%0.343CS..Hα-helixtrans-71.5-16.7-176.965.4171.6000113.7I60 E61 S66 M67 I69 I98 I107 I144 L148I60-I64 HydrophobicContact CG2-CG2 4.27Å; I60-I64 WeakPolarHBondContact O-CG1 3.33Å; I60-I64 WeakPolarHBondContact O-CG2 3.43Å; I60-I64 PolarHBondContact O-N 3.19Å; E61-I64 WeakPolarHBondContact O-CG1 3.45Å; I64-S66 PolarHBondContact O-N 3.01Å; I64-S66 VanDerWaalsContact O-N 3.12Å; I64-M67 PolarHBondContact O-N 3.37Å; I64-I69 HydrophobicContact CG2-CD1 4.01Å; I64-I98 HydrophobicContact CG2-CG2 4.29Å; I64-I107 HydrophobicContact CG2-CD1 3.73Å; I64-I144 HydrophobicContact CD1-CB 4.41Å; I64-I144 HydrophobicContact CD1-CG2 3.32Å; I64-L148 HydrophobicContact CD1-CD1 3.6Å
65Q88.4Confident93.4Very high144 Ų14465.1 Ų65.167%0.67334%0.338SS*.THydrogen-bonded Turntrans-57.3-29.2178.5-79.9179.215.300113.2E61 L63E61-Q65 WeakPolarHBondContact O-CG 3.44Å; E61-Q65 PolarHBondContact O-N 3.24Å; L63-Q65 VanDerWaalsContact C-N 3.27Å; L63-Q65 PolarHBondContact O-N 2.94Å
66S84.7Confident93.4Very high105 Ų10563.4 Ų63.473%0.73432%0.322SS*.THydrogen-bonded Turntrans-88.7-4.8178.668.40000113.6L63 I64L63-S66 PolarHBondContact O-OG 3.04Å; L63-S66 VanDerWaalsContact O-OG 3.13Å; I64-S66 PolarHBondContact O-N 3.01Å; I64-S66 VanDerWaalsContact O-N 3.12Å
67M87.8Confident93.1Very high51 Ų5164.8 Ų64.825%0.25133%0.334SS..SBendtrans-108.3158.8-174.5-53.4-177.682.800110.4I64 I69 S102 D104 I107I64-M67 PolarHBondContact O-N 3.37Å; M67-I69 HydrophobicContact CB-CD1 4.44Å; M67-I69 HydrophobicContact CB-CG1 4.21Å; M67-S102 WeakPolarHBondContact CE-O 3.3Å; M67-D104 HydrophobicContact CE-CB 3.97Å; M67-D104 HydrophobicContact SD-CB 4.49Å; M67-I107 HydrophobicContact CE-CD1 4.32Å; M67-I107 HydrophobicContact SD-CD1 3.32Å; M67-I107 WeakPolarHBondContact SD-CD1 3.39Å
68H84.1Confident92.9Very high176 Ų17671.4 Ų71.482%0.81537%0.369SS*.  trans-11694.5173.2-69.526.2000107
69I86.4Confident92.7Very high25 Ų2566.7 Ų66.713%0.12835%0.35CS..  trans-112.9110176-51.7173.5000105.5I64 M67 A71 I98 E101 I144I64-I69 HydrophobicContact CG2-CD1 4.01Å; M67-I69 HydrophobicContact CB-CD1 4.44Å; M67-I69 HydrophobicContact CB-CG1 4.21Å; I69-A71 VanDerWaalsContact C-N 3.3Å; I69-A71 HydrophobicContact CG2-CB 4.17Å; I69-I98 HydrophobicContact CD1-CG2 4.43Å; I69-E101 HydrophobicContact CG2-CB 3.95Å; I69-E101 VanDerWaalsContact CG2-OE2 3.26Å; I69-E101 WeakPolarHBondContact CG2-OE2 3.46Å; I69-I144 HydrophobicContact CB-CD1 3.43Å; I69-I144 VanDerWaalsContact CB-CD1 3.43Å; I69-I144 HydrophobicContact CD1-CD1 4.4Å; I69-I144 HydrophobicContact CG1-CD1 4.48Å; I69-I144 HydrophobicContact CG2-CD1 3.41Å; I69-I144 VanDerWaalsContact CG2-CD1 3.41Å; I69-I144 WeakPolarHBondContact O-CD1 3.4Å
70D89.2Confident92.5Very high151 Ų15167.9 Ų67.981%0.80736%0.357SS*.  trans-94.515.6-174.2-66.2-27.8000112.4
71A92.9Very high92.3Very high11 Ų1172 Ų729%0.09138%0.384CS..  trans-61.8141.9176.400000112.7I69 L73 V97 E101I69-A71 VanDerWaalsContact C-N 3.3Å; I69-A71 HydrophobicContact CG2-CB 4.17Å; A71-L73 HydrophobicContact CB-CD2 4.27Å; A71-L73 HydrophobicContact CB-CG 4.49Å; A71-V97 HydrophobicContact CB-CG1 4.48Å; A71-E101 VanDerWaalsContact CB-OE2 3.23Å; A71-E101 WeakPolarHBondContact CB-OE2 3.35Å
72T96.8Very high92.1Very high79 Ų7971.3 Ų71.349%0.48539%0.387SS..EExtended strand (participates in β ladder)trans-105132.8162.453.20000108.3E141 K142T72-E141 PolarHBondContact OG1-OE2 3.13Å; T72-K142 CarbonylContact C-O 3.54Å; T72-K142 VanDerWaalsContact CA-O 3.32Å; T72-K142 WeakPolarHBondContact CA-O 3.21Å
73L98.3Very high92.1Very high0 Ų067.5 Ų67.50%037%0.368CS..EExtended strand (participates in β ladder)trans-122.8140.5-168.6-61169.9000110.3A71 T75 E94 V97 I98 E141 K142 I144 F147A71-L73 HydrophobicContact CB-CD2 4.27Å; A71-L73 HydrophobicContact CB-CG 4.49Å; L73-T75 PolarHBondContact O-N 3.15Å; L73-T75 VanDerWaalsContact O-N 3.14Å; L73-T75 PolarHBondContact O-OG1 2.61Å; L73-E94 WeakPolarHBondContact CA-OE2 3.45Å; L73-E94 HydrophobicContact CB-CB 4.34Å; L73-E94 HydrophobicContact CD2-CB 4.33Å; L73-V97 HydrophobicContact CD2-CB 3.75Å; L73-V97 HydrophobicContact CD2-CG1 3.84Å; L73-V97 HydrophobicContact CD2-CG2 4.33Å; L73-I98 HydrophobicContact CD1-CD1 3.6Å; L73-I98 HydrophobicContact CD1-CG1 3.65Å; L73-E141 WeakPolarHBondContact O-CA 3.26Å; L73-K142 PolarHBondContact N-O 3.32Å; L73-K142 PolarHBondContact O-N 3.42Å; L73-I144 HydrophobicContact CD1-CG1 4.06Å; L73-F147 HydrophobicContact CB-CB 4.28Å; L73-F147 HydrophobicContact CB-CD2 3.71Å; L73-F147 HydrophobicContact CB-CE2 4.2Å; L73-F147 HydrophobicContact CB-CG 4.01Å; L73-F147 HydrophobicContact CD1-CB 4.06Å; L73-F147 HydrophobicContact CD1-CD1 3.64Å; L73-F147 HydrophobicContact CD1-CD2 4.09Å; L73-F147 HydrophobicContact CD1-CE1 4.05Å; L73-F147 HydrophobicContact CD1-CE2 4.45Å; L73-F147 HydrophobicContact CD1-CG 3.65Å; L73-F147 HydrophobicContact CD1-CZ 4.43Å
74Y98.6Very high92.2Very high58 Ų5867.4 Ų67.423%0.22737%0.366CS..EExtended strand (participates in β ladder)trans-61.9115.9176.9-65.8-55.4000110.7E94 C136 E137 E141Y74-E94 HydrophobicContact CD2-CG 4.48Å; Y74-E94 PolarHBondContact N-OE2 3.36Å; Y74-C136 WeakPolarHBondContact CB-O 3.38Å; Y74-C136 WeakPolarHBondContact CD1-O 3.03Å; Y74-C136 VanDerWaalsContact CG-O 3.27Å; Y74-E137 HydrophobicContact CE2-CB 4.32Å; Y74-E137 HydrophobicContact CE2-CG 3.92Å; Y74-E141 HydrophobicContact CD1-CG 3.64Å; Y74-E141 HydrophobicContact CE1-CG 3.5Å; Y74-E141 VanDerWaalsContact CE1-CG 3.5Å
75T98.2Very high92.3Very high2 Ų266.9 Ų66.91%0.01236%0.364CS..EExtended strand (participates in β ladder)trans-130.3114.1-168.3-54.60000111.6L73 S77 F91 E140 K142 F147 S150L73-T75 PolarHBondContact O-N 3.15Å; L73-T75 VanDerWaalsContact O-N 3.14Å; L73-T75 PolarHBondContact O-OG1 2.61Å; T75-S77 PolarHBondContact O-N 3.07Å; T75-F91 HydrophobicContact CG2-CE1 4.13Å; T75-F91 HydrophobicContact CG2-CZ 4.22Å; T75-E140 PolarHBondContact N-O 3.33Å; T75-K142 HydrophobicContact CG2-CD 4.02Å; T75-K142 HydrophobicContact CG2-CG 4.42Å; T75-F147 HydrophobicContact CG2-CD2 4.5Å; T75-F147 WeakPolarHBondContact OG1-CD2 3.42Å; T75-S150 WeakPolarHBondContact CG2-OG 3.46Å
76E95.9Very high92.6Very high35 Ų3561.9 Ų61.916%0.16434%0.343CS..  trans-84.8112.5169.6-175.253.9-8700110.2D78 V79 A87 F91 K134 L139E76-D78 PolarHBondContact OE1-N 2.77Å; E76-D78 VanDerWaalsContact OE1-N 3.08Å; E76-V79 HydrophobicContact CB-CG2 4.12Å; E76-V79 HydrophobicContact CG-CB 4.28Å; E76-V79 HydrophobicContact CG-CG2 3.6Å; E76-A87 HydrophobicContact CB-CB 4.32Å; E76-A87 HydrophobicContact CG-CB 4.38Å; E76-F91 HydrophobicContact CB-CE2 4.35Å; E76-F91 WeakPolarHBondContact O-CZ 3.39Å; E76-K134 IonicContact OE2-NZ 3.12Å; E76-L139 HydrophobicContact CB-CD1 4.07Å; E76-L139 HydrophobicContact CB-CD2 4.03Å; E76-L139 HydrophobicContact CG-CD2 4.42Å; E76-L139 WeakPolarHBondContact OE2-CD2 3.33Å
77S92.1Very high93.2Very high58 Ų5857.3 Ų57.341%0.40631%0.312SS..SBendtrans-94.5-23.7-178-600000113.4T75 K142T75-S77 PolarHBondContact O-N 3.07Å; S77-K142 WeakPolarHBondContact OG-CE 3.44Å; S77-K142 PolarHBondContact OG-NZ 3.15Å
78D92.6Very high93.6Very high142 Ų14254.9 Ų54.976%0.75930%0.3SS*.SBendtrans-12471.7179.8-171.223.7000109.8E76 H80E76-D78 PolarHBondContact OE1-N 2.77Å; E76-D78 VanDerWaalsContact OE1-N 3.08Å; D78-H80 PolarHBondContact O-N 3.42Å; D78-H80 VanDerWaalsContact O-N 3.13Å
79V92.3Very high94.2Very high17 Ų1752.1 Ų52.110%0.10329%0.285CS..  trans-68.2111.7-174.4-178.30000110.1E76 K84 A87 I154 M157E76-V79 HydrophobicContact CB-CG2 4.12Å; E76-V79 HydrophobicContact CG-CB 4.28Å; E76-V79 HydrophobicContact CG-CG2 3.6Å; V79-K84 HydrophobicContact CG1-CB 4.01Å; V79-A87 HydrophobicContact CG1-CB 3.98Å; V79-A87 HydrophobicContact CG2-CB 4.26Å; V79-I154 HydrophobicContact CG1-CD1 3.99Å; V79-I154 HydrophobicContact CG1-CG1 4.26Å; V79-I154 HydrophobicContact CG2-CB 4.26Å; V79-I154 HydrophobicContact CG2-CD1 3.92Å; V79-I154 HydrophobicContact CG2-CG1 4.14Å; V79-M157 HydrophobicContact CB-CE 4.31Å; V79-M157 HydrophobicContact CB-SD 3.9Å; V79-M157 HydrophobicContact CG1-CE 4.2Å; V79-M157 HydrophobicContact CG1-SD 4.16Å
80H93.2Very high94.8Very high123 Ų12351.1 Ų51.157%0.56928%0.28SS*.  trans-67.7133.8170.6-168.3-92.5000110.5D78 S82 C83 K84D78-H80 PolarHBondContact O-N 3.42Å; D78-H80 VanDerWaalsContact O-N 3.13Å; H80-S82 PolarHBondContact CE1-OG 3.07Å; H80-S82 PolarHBondContact ND1-N 3.36Å; H80-S82 PolarHBondContact ND1-OG 2.76Å; H80-S82 PolarHBondContact O-N 3.37Å; H80-C83 PolarHBondContact O-N 3.21Å; H80-K84 PolarHBondContact O-N 2.94Å
81P90.9Very high95.2Very high86 Ų8644 Ų4456%0.55824%0.242SC*.G310 helixtrans-56.9-26-175.3-28.635.1000115.6C83 K84 M157P81-C83 VanDerWaalsContact C-N 3.28Å; P81-K84 WeakPolarHBondContact O-CG 3.25Å; P81-M157 HydrophobicContact CG-CE 4.48Å
82S92.1Very high95.5Very high62 Ų6244 Ų4443%0.43424%0.241SC..G310 helixtrans-78.8-8177.371.60000114.6H80 E130H80-S82 PolarHBondContact CE1-OG 3.07Å; H80-S82 PolarHBondContact ND1-N 3.36Å; H80-S82 PolarHBondContact ND1-OG 2.76Å; H80-S82 PolarHBondContact O-N 3.37Å; S82-E130 WeakPolarHBondContact O-CB 3.32Å; S82-E130 WeakPolarHBondContact O-CG 3.45Å
83C95.1Very high95.5Very high22 Ų2244.7 Ų44.715%0.14924%0.241CC..G310 helixtrans-123.113.5-178-68.50000112.1H80 P81 V85 T86 A87 E130 C133H80-C83 PolarHBondContact O-N 3.21Å; P81-C83 VanDerWaalsContact C-N 3.28Å; C83-V85 VanDerWaalsContact C-N 3.29Å; C83-V85 PolarHBondContact O-N 2.89Å; C83-T86 PolarHBondContact O-N 3.25Å; C83-A87 WeakPolarHBondContact O-CB 3.47Å; C83-A87 PolarHBondContact O-N 3.47Å; C83-E130 VanDerWaalsContact C-OE2 3.28Å; C83-E130 VanDerWaalsContact CA-OE2 3.32Å; C83-E130 WeakPolarHBondContact CA-OE2 3.31Å; C83-C133 WeakPolarHBondContact CA-SG 3.26Å; C83-C133 HydrophobicContact CB-CB 3.75Å; C83-C133 WeakPolarHBondContact CB-SG 3.46Å; C83-C133 WeakPolarHBondContact SG-CA 3.28Å; C83-C133 WeakPolarHBondContact SG-CB 3.42Å; C83-C133 CovalentContact SG-SG 2.04Å; C83-C133 PolarHBondContact SG-SG 3.37Å
84K94Very high95.5Very high45 Ų4545.9 Ų45.920%0.19625%0.247CC..Hα-helixtrans-66.1-30.9-173.369.2179.3-176.51760112.5V79 H80 P81 M88 E130 F158 T161V79-K84 HydrophobicContact CG1-CB 4.01Å; H80-K84 PolarHBondContact O-N 2.94Å; P81-K84 WeakPolarHBondContact O-CG 3.25Å; K84-M88 VanDerWaalsContact O-CB 3.24Å; K84-M88 WeakPolarHBondContact O-CB 2.98Å; K84-M88 PolarHBondContact O-N 3.26Å; K84-E130 PolarHBondContact N-OE1 2.97Å; K84-F158 HydrophobicContact CB-CE2 4.2Å; K84-F158 HydrophobicContact CB-CZ 4.12Å; K84-F158 HydrophobicContact CD-CE1 4.23Å; K84-F158 HydrophobicContact CD-CE2 4.48Å; K84-F158 HydrophobicContact CD-CZ 4.11Å; K84-F158 HydrophobicContact CG-CE1 4.27Å; K84-F158 HydrophobicContact CG-CE2 4.31Å; K84-F158 HydrophobicContact CG-CZ 3.79Å; K84-F158 WeakPolarHBondContact O-CZ 3.43Å; K84-T161 PolarHBondContact NZ-OG1 2.97Å
85V94.7Very high95.5Very high13 Ų1343.1 Ų43.18%0.07924%0.236CC..Hα-helixtrans-74-41.1177.7178.70000110.4C83 M88 K89 L122 I128 E130 F158C83-V85 VanDerWaalsContact C-N 3.29Å; C83-V85 PolarHBondContact O-N 2.89Å; V85-M88 PolarHBondContact O-N 3Å; V85-K89 WeakPolarHBondContact O-CG 3.4Å; V85-K89 PolarHBondContact O-N 3.32Å; V85-L122 HydrophobicContact CG1-CD2 4.36Å; V85-I128 HydrophobicContact CG2-CD1 4.02Å; V85-I128 HydrophobicContact CG2-CG2 4.43Å; V85-E130 WeakPolarHBondContact CB-OE1 3.41Å; V85-E130 PolarHBondContact N-OE1 2.97Å; V85-E130 PolarHBondContact N-OE2 2.86Å; V85-F158 HydrophobicContact CG2-CE1 4.35Å; V85-F158 HydrophobicContact CG2-CZ 4.29Å
86T95.7Very high95.5Very high39 Ų3947.9 Ų47.924%0.23926%0.258CS..Hα-helixtrans-63.6-49.5176-56.50000110.7C83 M88 K89 C90 E130 C133C83-T86 PolarHBondContact O-N 3.25Å; T86-M88 VanDerWaalsContact C-N 3.33Å; T86-M88 PolarHBondContact O-N 3.08Å; T86-K89 WeakPolarHBondContact O-CB 3.26Å; T86-K89 PolarHBondContact O-N 2.78Å; T86-K89 VanDerWaalsContact O-N 3.11Å; T86-C90 PolarHBondContact O-N 3.02Å; T86-C90 VanDerWaalsContact O-N 3.11Å; T86-E130 VanDerWaalsContact CB-OE2 3.26Å; T86-E130 WeakPolarHBondContact CB-OE2 3.45Å; T86-E130 PolarHBondContact N-OE2 3.34Å; T86-E130 PolarHBondContact OG1-OE2 2.96Å; T86-C133 HydrophobicContact CG2-CB 3.99Å
87A96.9Very high95.5Very high9 Ų948.4 Ų48.47%0.07426%0.263CS..Hα-helixtrans-59.1-42.9175.700000112E76 V79 C83 K89 C90 F91 I154E76-A87 HydrophobicContact CB-CB 4.32Å; E76-A87 HydrophobicContact CG-CB 4.38Å; V79-A87 HydrophobicContact CG1-CB 3.98Å; V79-A87 HydrophobicContact CG2-CB 4.26Å; C83-A87 WeakPolarHBondContact O-CB 3.47Å; C83-A87 PolarHBondContact O-N 3.47Å; A87-K89 VanDerWaalsContact C-N 3.3Å; A87-K89 PolarHBondContact O-N 3.41Å; A87-C90 WeakPolarHBondContact O-CB 3.04Å; A87-C90 PolarHBondContact O-N 2.9Å; A87-C90 VanDerWaalsContact O-N 3.12Å; A87-F91 VanDerWaalsContact O-CD2 3.22Å; A87-F91 WeakPolarHBondContact O-CD2 3.43Å; A87-F91 PolarHBondContact O-N 3.47Å; A87-I154 HydrophobicContact CB-CD1 3.61Å
88M96.6Very high95.7Very high0 Ų045.6 Ų45.60%024%0.244CC..Hα-helixtrans-59.2-39.8175.8-179.760.770.500112.2W50 K84 V85 T86 C90 F91 L92 L122 F151 I154 V155 F158W50-M88 HydrophobicContact CH2-CE 3.95Å; W50-M88 HydrophobicContact CH2-CG 4.29Å; W50-M88 HydrophobicContact CH2-SD 4.3Å; W50-M88 HydrophobicContact CZ3-CE 3.75Å; W50-M88 HydrophobicContact CZ3-SD 4.11Å; K84-M88 VanDerWaalsContact O-CB 3.24Å; K84-M88 WeakPolarHBondContact O-CB 2.98Å; K84-M88 PolarHBondContact O-N 3.26Å; V85-M88 PolarHBondContact O-N 3Å; T86-M88 VanDerWaalsContact C-N 3.33Å; T86-M88 PolarHBondContact O-N 3.08Å; M88-C90 VanDerWaalsContact C-N 3.34Å; M88-F91 PolarHBondContact O-N 2.95Å; M88-L92 HydrophobicContact CG-CD1 4.38Å; M88-L92 WeakPolarHBondContact O-CG 3.38Å; M88-L92 PolarHBondContact O-N 3.21Å; M88-L122 HydrophobicContact CG-CD1 3.91Å; M88-L122 HydrophobicContact CG-CD2 4.32Å; M88-F151 HydrophobicContact CE-CE2 4.41Å; M88-F151 HydrophobicContact SD-CD2 4.48Å; M88-F151 HydrophobicContact SD-CE2 3.64Å; M88-F151 HydrophobicContact SD-CZ 4.4Å; M88-I154 HydrophobicContact CB-CD1 4.09Å; M88-I154 HydrophobicContact CE-CB 4.48Å; M88-I154 HydrophobicContact CE-CD1 4.37Å; M88-I154 HydrophobicContact CE-CG1 4.11Å; M88-I154 HydrophobicContact CE-CG2 3.85Å; M88-V155 HydrophobicContact CE-CG2 3.83Å; M88-F158 HydrophobicContact CB-CE2 3.95Å; M88-F158 HydrophobicContact CB-CZ 4.13Å; M88-F158 HydrophobicContact CE-CD2 3.49Å; M88-F158 VanDerWaalsContact CE-CD2 3.49Å; M88-F158 HydrophobicContact CE-CE2 3.47Å; M88-F158 VanDerWaalsContact CE-CE2 3.47Å; M88-F158 HydrophobicContact CE-CZ 4.46Å; M88-F158 HydrophobicContact CG-CE2 4.28Å
89K96.6Very high95.9Very high117 Ų11739.6 Ų39.651%0.50921%0.213SC..Hα-helixtrans-64.1-39.6175.4-72.3173.7178.9177.70112V85 T86 A87 L92 L93V85-K89 WeakPolarHBondContact O-CG 3.4Å; V85-K89 PolarHBondContact O-N 3.32Å; T86-K89 WeakPolarHBondContact O-CB 3.26Å; T86-K89 PolarHBondContact O-N 2.78Å; T86-K89 VanDerWaalsContact O-N 3.11Å; A87-K89 VanDerWaalsContact C-N 3.3Å; A87-K89 PolarHBondContact O-N 3.41Å; K89-L92 PolarHBondContact O-N 3.39Å; K89-L93 WeakPolarHBondContact O-CG 3.47Å; K89-L93 PolarHBondContact O-N 3.42Å
90C98.1Very high96.1Very high4 Ų446.4 Ų46.43%0.02724%0.243CC..Hα-helixtrans-60.8-46.7173.8-61.10000111.4T86 A87 M88 L92 L93 E94 C136 L139T86-C90 PolarHBondContact O-N 3.02Å; T86-C90 VanDerWaalsContact O-N 3.11Å; A87-C90 WeakPolarHBondContact O-CB 3.04Å; A87-C90 PolarHBondContact O-N 2.9Å; A87-C90 VanDerWaalsContact O-N 3.12Å; M88-C90 VanDerWaalsContact C-N 3.34Å; C90-L92 VanDerWaalsContact C-N 3.29Å; C90-L92 PolarHBondContact O-N 3.3Å; C90-L93 PolarHBondContact O-N 3.1Å; C90-L93 VanDerWaalsContact O-N 3.14Å; C90-E94 WeakPolarHBondContact O-CG 3.32Å; C90-E94 PolarHBondContact O-N 3.4Å; C90-C136 WeakPolarHBondContact CA-SG 3.4Å; C90-C136 HydrophobicContact CB-CB 3.74Å; C90-C136 WeakPolarHBondContact CB-SG 3.42Å; C90-C136 WeakPolarHBondContact SG-CA 3.31Å; C90-C136 WeakPolarHBondContact SG-CB 3.47Å; C90-C136 CovalentContact SG-SG 2.04Å; C90-C136 PolarHBondContact SG-SG 3.47Å; C90-L139 HydrophobicContact CB-CD1 4.07Å
91F98.4Very high96.1Very high2 Ų245.3 Ų45.31%0.00924%0.238CC..Hα-helixtrans-56.8-40.8174.6-81.6-72.4000112.8T75 E76 A87 M88 L95 F147 F151 I154T75-F91 HydrophobicContact CG2-CE1 4.13Å; T75-F91 HydrophobicContact CG2-CZ 4.22Å; E76-F91 HydrophobicContact CB-CE2 4.35Å; E76-F91 WeakPolarHBondContact O-CZ 3.39Å; A87-F91 VanDerWaalsContact O-CD2 3.22Å; A87-F91 WeakPolarHBondContact O-CD2 3.43Å; A87-F91 PolarHBondContact O-N 3.47Å; M88-F91 PolarHBondContact O-N 2.95Å; F91-L95 WeakPolarHBondContact O-CB 3.33Å; F91-L95 PolarHBondContact O-N 3.47Å; F91-F147 AromaticContact CD1-CD2 3.92Å; F91-F147 HydrophobicContact CD1-CD2 3.92Å; F91-F147 AromaticContact CD1-CE2 3.37Å; F91-F147 HydrophobicContact CD1-CE2 3.37Å; F91-F147 AromaticContact CD1-CZ 3.75Å; F91-F147 HydrophobicContact CD1-CZ 3.75Å; F91-F147 AromaticContact CE1-CD2 3.92Å; F91-F147 HydrophobicContact CE1-CD2 3.92Å; F91-F147 AromaticContact CE1-CE2 3.86Å; F91-F147 HydrophobicContact CE1-CE2 3.86Å; F91-F147 HydrophobicContact CG-CE2 4.37Å; F91-F147 WeakPolarHBondContact O-CZ 3.26Å; F91-F151 HydrophobicContact CB-CD1 3.95Å; F91-F151 HydrophobicContact CB-CD2 3.92Å; F91-F151 HydrophobicContact CB-CE1 3.82Å; F91-F151 HydrophobicContact CB-CE2 3.83Å; F91-F151 HydrophobicContact CB-CG 4.01Å; F91-F151 HydrophobicContact CB-CZ 3.78Å; F91-F151 HydrophobicContact CD1-CB 3.68Å; F91-F151 AromaticContact CD1-CD1 3.87Å; F91-F151 HydrophobicContact CD1-CD1 3.87Å; F91-F151 HydrophobicContact CD1-CD2 4.2Å; F91-F151 AromaticContact CD1-CG 3.67Å; F91-F151 HydrophobicContact CD1-CG 3.67Å; F91-F151 HydrophobicContact CE1-CB 3.93Å; F91-F151 HydrophobicContact CE1-CG 4.4Å; F91-F151 HydrophobicContact CG-CB 4.38Å; F91-F151 HydrophobicContact CG-CD1 4.26Å; F91-F151 HydrophobicContact CG-CD2 4.06Å; F91-F151 HydrophobicContact CG-CE2 4.46Å; F91-F151 AromaticContact CG-CG 3.99Å; F91-F151 HydrophobicContact CG-CG 3.99Å; F91-I154 HydrophobicContact CD2-CD1 4Å; F91-I154 HydrophobicContact CD2-CG2 3.69Å; F91-I154 HydrophobicContact CE2-CB 4.26Å; F91-I154 HydrophobicContact CE2-CD1 4.09Å; F91-I154 HydrophobicContact CE2-CG2 3.75Å; F91-I154 HydrophobicContact CG-CG2 4.35Å; F91-I154 HydrophobicContact CZ-CG2 4.44Å
92L98.2Very high96.3Very high11 Ų1141.9 Ų41.96%0.05822%0.216CC..Hα-helixtrans-68.3-35.1177.8-66.5170.9000113M88 K89 C90 L114 I115 A118 L122 F151M88-L92 HydrophobicContact CG-CD1 4.38Å; M88-L92 WeakPolarHBondContact O-CG 3.38Å; M88-L92 PolarHBondContact O-N 3.21Å; K89-L92 PolarHBondContact O-N 3.39Å; C90-L92 VanDerWaalsContact C-N 3.29Å; C90-L92 PolarHBondContact O-N 3.3Å; L92-L114 HydrophobicContact CD2-CD2 3.61Å; L92-I115 HydrophobicContact CD2-CG1 4.1Å; L92-A118 HydrophobicContact CD1-CB 3.81Å; L92-A118 HydrophobicContact CD2-CB 3.66Å; L92-A118 HydrophobicContact CG-CB 4.35Å; L92-L122 HydrophobicContact CD1-CD1 4.15Å; L92-F151 HydrophobicContact CD2-CZ 3.9Å; L92-F151 HydrophobicContact CG-CZ 4.45Å
93L98.3Very high96.3Very high93 Ų9342.3 Ų42.349%0.48723%0.231SC..Hα-helixtrans-68-49.7175.6-72.6170.1000110.9K89 C90 L95 Q96K89-L93 WeakPolarHBondContact O-CG 3.47Å; K89-L93 PolarHBondContact O-N 3.42Å; C90-L93 PolarHBondContact O-N 3.1Å; C90-L93 VanDerWaalsContact O-N 3.14Å; L93-L95 VanDerWaalsContact C-N 3.25Å; L93-L95 PolarHBondContact O-N 3.06Å; L93-Q96 VanDerWaalsContact O-CB 3.25Å; L93-Q96 WeakPolarHBondContact O-CB 3.39Å; L93-Q96 PolarHBondContact O-N 3.31Å
94E98.3Very high96.3Very high26 Ų2643.8 Ų43.812%0.12124%0.238CC..Hα-helixtrans-65.3-29.2180-67.1-58.3107.300112.6L73 Y74 C90 Q96 V97 F147L73-E94 WeakPolarHBondContact CA-OE2 3.45Å; L73-E94 HydrophobicContact CB-CB 4.34Å; L73-E94 HydrophobicContact CD2-CB 4.33Å; Y74-E94 HydrophobicContact CD2-CG 4.48Å; Y74-E94 PolarHBondContact N-OE2 3.36Å; C90-E94 WeakPolarHBondContact O-CG 3.32Å; C90-E94 PolarHBondContact O-N 3.4Å; E94-Q96 PolarHBondContact O-N 3.37Å; E94-V97 VanDerWaalsContact O-CB 3.28Å; E94-V97 WeakPolarHBondContact O-CB 3.22Å; E94-V97 PolarHBondContact O-N 3.35Å; E94-F147 HydrophobicContact CB-CD2 4.48Å; E94-F147 HydrophobicContact CB-CE2 3.49Å; E94-F147 VanDerWaalsContact CB-CE2 3.49Å; E94-F147 HydrophobicContact CB-CZ 3.68Å; E94-F147 HydrophobicContact CG-CE2 4.29Å
95L97.8Very high96.3Very high0 Ų046.3 Ų46.30%026%0.257CS..Hα-helixtrans-61.3-28.5173-168.967.3000112.5I60 F91 L93 V97 I98 S99 V111 L114 F147 L148 F151I60-L95 HydrophobicContact CD1-CD1 4.08Å; I60-L95 HydrophobicContact CD1-CD2 4.4Å; F91-L95 WeakPolarHBondContact O-CB 3.33Å; F91-L95 PolarHBondContact O-N 3.47Å; L93-L95 VanDerWaalsContact C-N 3.25Å; L93-L95 PolarHBondContact O-N 3.06Å; L95-V97 VanDerWaalsContact C-N 3.27Å; L95-V97 PolarHBondContact O-N 3.12Å; L95-I98 HydrophobicContact CD1-CD1 4.08Å; L95-I98 WeakPolarHBondContact O-CB 3.3Å; L95-I98 PolarHBondContact O-N 3.05Å; L95-S99 PolarHBondContact O-N 3.01Å; L95-S99 VanDerWaalsContact O-N 3.16Å; L95-V111 HydrophobicContact CD1-CG2 4.24Å; L95-V111 HydrophobicContact CD2-CB 4.42Å; L95-V111 HydrophobicContact CD2-CG1 3.94Å; L95-V111 HydrophobicContact CD2-CG2 4.17Å; L95-V111 HydrophobicContact CG-CB 4.42Å; L95-V111 HydrophobicContact CG-CG1 3.84Å; L95-V111 HydrophobicContact CG-CG2 3.87Å; L95-L114 HydrophobicContact CD2-CB 4.45Å; L95-L114 HydrophobicContact CD2-CD1 3.82Å; L95-L114 HydrophobicContact CD2-CD2 3.68Å; L95-L114 HydrophobicContact CD2-CG 4.2Å; L95-F147 HydrophobicContact CD1-CE1 4.29Å; L95-L148 HydrophobicContact CD1-CD2 4.5Å; L95-F151 HydrophobicContact CB-CE1 4.2Å; L95-F151 HydrophobicContact CD1-CE1 4.31Å; L95-F151 HydrophobicContact CD2-CE1 3.99Å; L95-F151 HydrophobicContact CG-CE1 4.39Å
96Q97.5Very high96.4Very high101 Ų10149.8 Ų49.847%0.47228%0.275SS..Hα-helixtrans-68.1-29.2175.4-59.7-178.5-41.600111.9L93 E94 S99 H100 I115L93-Q96 VanDerWaalsContact O-CB 3.25Å; L93-Q96 WeakPolarHBondContact O-CB 3.39Å; L93-Q96 PolarHBondContact O-N 3.31Å; E94-Q96 PolarHBondContact O-N 3.37Å; Q96-S99 PolarHBondContact O-N 3.04Å; Q96-H100 WeakPolarHBondContact O-CB 3.39Å; Q96-H100 PolarHBondContact O-N 3.34Å; Q96-I115 HydrophobicContact CG-CD1 3.72Å
97V96.7Very high96.4Very high46 Ų4648 Ų4828%0.27926%0.264SS..Hα-helixtrans-63-45.1173.6-178.20000109.6A71 L73 E94 L95 S99 H100 E101A71-V97 HydrophobicContact CB-CG1 4.48Å; L73-V97 HydrophobicContact CD2-CB 3.75Å; L73-V97 HydrophobicContact CD2-CG1 3.84Å; L73-V97 HydrophobicContact CD2-CG2 4.33Å; E94-V97 VanDerWaalsContact O-CB 3.28Å; E94-V97 WeakPolarHBondContact O-CB 3.22Å; E94-V97 PolarHBondContact O-N 3.35Å; L95-V97 VanDerWaalsContact C-N 3.27Å; L95-V97 PolarHBondContact O-N 3.12Å; V97-S99 VanDerWaalsContact C-N 3.33Å; V97-S99 PolarHBondContact O-N 3.36Å; V97-H100 PolarHBondContact O-N 3.17Å; V97-H100 VanDerWaalsContact O-N 3.17Å; V97-E101 HydrophobicContact CG1-CG 4.18Å; V97-E101 WeakPolarHBondContact O-CB 3.31Å; V97-E101 WeakPolarHBondContact O-CG 3.45Å; V97-E101 PolarHBondContact O-N 3.25Å
98I96.2Very high96.4Very high0 Ų051.9 Ų51.90%028%0.28CS..Hα-helixtrans-57.8-46.6174.4-62.6174.6000110.7I60 I64 I69 L73 L95 H100 S102 I107 I144 F147 L148I60-I98 HydrophobicContact CG2-CG2 4.36Å; I64-I98 HydrophobicContact CG2-CG2 4.29Å; I69-I98 HydrophobicContact CD1-CG2 4.43Å; L73-I98 HydrophobicContact CD1-CD1 3.6Å; L73-I98 HydrophobicContact CD1-CG1 3.65Å; L95-I98 HydrophobicContact CD1-CD1 4.08Å; L95-I98 WeakPolarHBondContact O-CB 3.3Å; L95-I98 PolarHBondContact O-N 3.05Å; I98-H100 VanDerWaalsContact C-N 3.35Å; I98-H100 PolarHBondContact O-N 2.98Å; I98-S102 WeakPolarHBondContact O-CB 3.13Å; I98-S102 PolarHBondContact O-N 2.98Å; I98-S102 PolarHBondContact O-OG 3.47Å; I98-I107 HydrophobicContact CG2-CG2 4.36Å; I98-I144 HydrophobicContact CD1-CG2 3.81Å; I98-F147 HydrophobicContact CD1-CD1 3.94Å; I98-F147 HydrophobicContact CD1-CE1 3.87Å; I98-L148 HydrophobicContact CD1-CD2 4.42Å
99S96.6Very high96.4Very high16 Ų1655.7 Ų55.711%0.11230%0.301CS..Hα-helixtrans-59.5-46176.81760000111.8L95 Q96 V97 S102 H108L95-S99 PolarHBondContact O-N 3.01Å; L95-S99 VanDerWaalsContact O-N 3.16Å; Q96-S99 PolarHBondContact O-N 3.04Å; V97-S99 VanDerWaalsContact C-N 3.33Å; V97-S99 PolarHBondContact O-N 3.36Å; S99-S102 PolarHBondContact O-OG 3.23Å; S99-H108 WeakPolarHBondContact OG-CA 3.36Å; S99-H108 PolarHBondContact OG-ND1 2.92Å; S99-H108 VanDerWaalsContact OG-ND1 3.13Å
100H95.6Very high96.4Very high160 Ų16050.3 Ų50.374%0.74128%0.277SS*.Hα-helixtrans-65.3-46.4-177.9-173.568.5000112.5Q96 V97 I98Q96-H100 WeakPolarHBondContact O-CB 3.39Å; Q96-H100 PolarHBondContact O-N 3.34Å; V97-H100 PolarHBondContact O-N 3.17Å; V97-H100 VanDerWaalsContact O-N 3.17Å; I98-H100 VanDerWaalsContact C-N 3.35Å; I98-H100 PolarHBondContact O-N 2.98Å
101E94.6Very high96.4Very high99 Ų9950.3 Ų50.346%0.46328%0.277SS..Hα-helixtrans-75.8-29.1-176.7-68.2-166.6-178.500113.3I69 A71 V97 G103I69-E101 HydrophobicContact CG2-CB 3.95Å; I69-E101 VanDerWaalsContact CG2-OE2 3.26Å; I69-E101 WeakPolarHBondContact CG2-OE2 3.46Å; A71-E101 VanDerWaalsContact CB-OE2 3.23Å; A71-E101 WeakPolarHBondContact CB-OE2 3.35Å; V97-E101 HydrophobicContact CG1-CG 4.18Å; V97-E101 WeakPolarHBondContact O-CB 3.31Å; V97-E101 WeakPolarHBondContact O-CG 3.45Å; V97-E101 PolarHBondContact O-N 3.25Å; E101-G103 VanDerWaalsContact C-N 3.28Å; E101-G103 PolarHBondContact O-N 3.32Å
102S93.8Very high96.3Very high14 Ų1455 Ų5510%0.09830%0.3CS..Hα-helixtrans-62-37.3176.2710000112.3M67 I98 S99 D104M67-S102 WeakPolarHBondContact CE-O 3.3Å; I98-S102 WeakPolarHBondContact O-CB 3.13Å; I98-S102 PolarHBondContact O-N 2.98Å; I98-S102 PolarHBondContact O-OG 3.47Å; S99-S102 PolarHBondContact O-OG 3.23Å; S102-D104 PolarHBondContact O-N 3.21Å; S102-D104 VanDerWaalsContact O-N 3.14Å; S102-D104 PolarHBondContact OG-N 2.93Å
103G91.9Very high96.2Very high72 Ų7258.8 Ų58.874%0.74232%0.32SS*.  trans6016-171.500000114.1E101E101-G103 VanDerWaalsContact C-N 3.28Å; E101-G103 PolarHBondContact O-N 3.32Å
104D95.2Very high96.1Very high53 Ų5354.4 Ų54.428%0.28330%0.297SS..  trans-104.4134.8-175.2-179.7-89.1000111.4M67 S102 D106 I107 H108M67-D104 HydrophobicContact CE-CB 3.97Å; M67-D104 HydrophobicContact SD-CB 4.49Å; S102-D104 PolarHBondContact O-N 3.21Å; S102-D104 VanDerWaalsContact O-N 3.14Å; S102-D104 PolarHBondContact OG-N 2.93Å; D104-D106 WeakPolarHBondContact OD1-CA 3.26Å; D104-D106 WeakPolarHBondContact OD1-CB 3.43Å; D104-D106 PolarHBondContact OD1-N 3.27Å; D104-I107 HydrophobicContact CB-CB 4.21Å; D104-I107 HydrophobicContact CB-CD1 4.1Å; D104-I107 HydrophobicContact CB-CG1 4.21Å; D104-I107 PolarHBondContact OD1-N 2.86Å; D104-H108 WeakPolarHBondContact O-CB 3.43Å; D104-H108 PolarHBondContact O-N 3.46Å
105T95.7Very high96.1Very high98 Ų9854.4 Ų54.460%0.60130%0.297SS*.Hα-helixtrans-70.7-36.7-176.649.70000112.6H108 D109T105-H108 PolarHBondContact O-N 3.44Å; T105-D109 WeakPolarHBondContact O-CB 3.44Å; T105-D109 VanDerWaalsContact O-CG 3.29Å; T105-D109 PolarHBondContact O-N 2.96Å
106D95.1Very high95.9Very high86 Ų8658.1 Ų58.146%0.4632%0.316SS..Hα-helixtrans-70.9-36.4-178.9-69.9-9.4000110.7L63 D104 T110L63-D106 HydrophobicContact CD1-CB 4.17Å; D104-D106 WeakPolarHBondContact OD1-CA 3.26Å; D104-D106 WeakPolarHBondContact OD1-CB 3.43Å; D104-D106 PolarHBondContact OD1-N 3.27Å; D106-T110 VanDerWaalsContact O-CB 3.3Å; D106-T110 WeakPolarHBondContact O-CB 3.49Å; D106-T110 PolarHBondContact O-N 3.4Å; D106-T110 VanDerWaalsContact O-N 3.08Å; D106-T110 PolarHBondContact O-OG1 3.21Å
107I96.2Very high95.7Very high0 Ų055.1 Ų55.10%030%0.303CS..Hα-helixtrans-65.6-47.3171.1-67.5176.6000110.2L63 I64 M67 I98 D104 D109 T110 V111L63-I107 HydrophobicContact CB-CD1 4.04Å; L63-I107 HydrophobicContact CB-CG1 3.83Å; L63-I107 HydrophobicContact CD1-CG1 3.8Å; L63-I107 HydrophobicContact CG-CG1 4.44Å; I64-I107 HydrophobicContact CG2-CD1 3.73Å; M67-I107 HydrophobicContact CE-CD1 4.32Å; M67-I107 HydrophobicContact SD-CD1 3.32Å; M67-I107 WeakPolarHBondContact SD-CD1 3.39Å; I98-I107 HydrophobicContact CG2-CG2 4.36Å; D104-I107 HydrophobicContact CB-CB 4.21Å; D104-I107 HydrophobicContact CB-CD1 4.1Å; D104-I107 HydrophobicContact CB-CG1 4.21Å; D104-I107 PolarHBondContact OD1-N 2.86Å; I107-D109 PolarHBondContact O-N 2.87Å; I107-T110 PolarHBondContact O-N 3.11Å; I107-V111 HydrophobicContact CG2-CG2 4.13Å; I107-V111 WeakPolarHBondContact O-CB 3.33Å; I107-V111 WeakPolarHBondContact O-CG2 3.3Å; I107-V111 PolarHBondContact O-N 3.09Å
108H97.3Very high95.6Very high91 Ų9152.9 Ų52.942%0.42129%0.29SS..Hα-helixtrans-55.3-52.5178.4-17970.1000112.3S99 D104 T105 T110 V111 E112S99-H108 WeakPolarHBondContact OG-CA 3.36Å; S99-H108 PolarHBondContact OG-ND1 2.92Å; S99-H108 VanDerWaalsContact OG-ND1 3.13Å; D104-H108 WeakPolarHBondContact O-CB 3.43Å; D104-H108 PolarHBondContact O-N 3.46Å; T105-H108 PolarHBondContact O-N 3.44Å; H108-T110 VanDerWaalsContact C-N 3.28Å; H108-T110 PolarHBondContact O-N 3.46Å; H108-V111 PolarHBondContact O-N 2.94Å; H108-E112 WeakPolarHBondContact O-CB 3.2Å; H108-E112 PolarHBondContact O-N 3.12Å
109D96.8Very high95.4Very high81 Ų8156.6 Ų56.643%0.43331%0.31SS..Hα-helixtrans-62.1-37.7179.7-70.2-2.4000111.3T105 I107 N113T105-D109 WeakPolarHBondContact O-CB 3.44Å; T105-D109 VanDerWaalsContact O-CG 3.29Å; T105-D109 PolarHBondContact O-N 2.96Å; I107-D109 PolarHBondContact O-N 2.87Å; D109-N113 WeakPolarHBondContact O-CB 3.4Å; D109-N113 VanDerWaalsContact O-CG 3.28Å; D109-N113 PolarHBondContact O-N 2.68Å; D109-N113 PolarHBondContact O-ND2 3.04Å
110T96.9Very high95.1Very high3 Ų360.1 Ų60.12%0.01833%0.327CS..Hα-helixtrans-69.6-41.8178.8-54.10000111.4D56 K59 I60 D106 I107 H108 L114D56-T110 HydrophobicContact CB-CG2 3.88Å; K59-T110 HydrophobicContact CB-CG2 4.34Å; K59-T110 HydrophobicContact CD-CG2 3.97Å; K59-T110 HydrophobicContact CG-CG2 4.43Å; K59-T110 PolarHBondContact NZ-OG1 2.89Å; I60-T110 HydrophobicContact CD1-CG2 4.06Å; I60-T110 HydrophobicContact CG1-CG2 3.7Å; D106-T110 VanDerWaalsContact O-CB 3.3Å; D106-T110 WeakPolarHBondContact O-CB 3.49Å; D106-T110 PolarHBondContact O-N 3.4Å; D106-T110 VanDerWaalsContact O-N 3.08Å; D106-T110 PolarHBondContact O-OG1 3.21Å; I107-T110 PolarHBondContact O-N 3.11Å; H108-T110 VanDerWaalsContact C-N 3.28Å; H108-T110 PolarHBondContact O-N 3.46Å; T110-L114 WeakPolarHBondContact O-CB 3.32Å; T110-L114 PolarHBondContact O-N 3.27Å
111V97.7Very high94.8Very high4 Ų453.1 Ų53.12%0.02430%0.295CS..Hα-helixtrans-65.2-44.1176.2168.50000111.1I60 L95 I107 H108 L114 I115I60-V111 HydrophobicContact CD1-CG2 3.67Å; I60-V111 HydrophobicContact CG1-CG2 4.36Å; L95-V111 HydrophobicContact CD1-CG2 4.24Å; L95-V111 HydrophobicContact CD2-CB 4.42Å; L95-V111 HydrophobicContact CD2-CG1 3.94Å; L95-V111 HydrophobicContact CD2-CG2 4.17Å; L95-V111 HydrophobicContact CG-CB 4.42Å; L95-V111 HydrophobicContact CG-CG1 3.84Å; L95-V111 HydrophobicContact CG-CG2 3.87Å; I107-V111 HydrophobicContact CG2-CG2 4.13Å; I107-V111 WeakPolarHBondContact O-CB 3.33Å; I107-V111 WeakPolarHBondContact O-CG2 3.3Å; I107-V111 PolarHBondContact O-N 3.09Å; H108-V111 PolarHBondContact O-N 2.94Å; V111-L114 PolarHBondContact O-N 3.12Å; V111-I115 HydrophobicContact CG1-CD1 3.74Å; V111-I115 HydrophobicContact CG1-CG1 4.42Å; V111-I115 VanDerWaalsContact O-CG1 3.3Å; V111-I115 WeakPolarHBondContact O-CG1 3.44Å; V111-I115 PolarHBondContact O-N 3.47Å
112E96.8Very high94.6Very high102 Ų10249.4 Ų49.448%0.47728%0.278SS..Hα-helixtrans-60.4-48.3177.6-174.1178.9-157.700111.3H108 L114 I115 I116H108-E112 WeakPolarHBondContact O-CB 3.2Å; H108-E112 PolarHBondContact O-N 3.12Å; E112-L114 VanDerWaalsContact C-N 3.34Å; E112-L114 PolarHBondContact O-N 3.31Å; E112-I115 PolarHBondContact O-N 3.4Å; E112-I116 HydrophobicContact CG-CD1 4Å; E112-I116 WeakPolarHBondContact O-CG1 3.33Å; E112-I116 PolarHBondContact O-N 2.74Å
113N95.6Very high94.3Very high90 Ų9052.7 Ų52.748%0.48130%0.301SS..Hα-helixtrans-59-44.4176.8-78.1-49.9000112D109 I115 I116 L117D109-N113 WeakPolarHBondContact O-CB 3.4Å; D109-N113 VanDerWaalsContact O-CG 3.28Å; D109-N113 PolarHBondContact O-N 2.68Å; D109-N113 PolarHBondContact O-ND2 3.04Å; N113-I115 PolarHBondContact O-N 3.38Å; N113-I116 PolarHBondContact O-N 3.04Å; N113-L117 VanDerWaalsContact O-CG 3.31Å; N113-L117 WeakPolarHBondContact O-CG 3.44Å; N113-L117 PolarHBondContact O-N 3.29Å
114L96.8Very high93.9Very high0 Ų053.4 Ų53.40%030%0.295CS..Hα-helixtrans-59.6-46.9177.5-173.4161.6000111.3V53 D56 L57 I60 L92 L95 T110 V111 E112 I116 L117 A118 F151V53-L114 HydrophobicContact CG1-CD1 4.24Å; V53-L114 HydrophobicContact CG1-CD2 4.1Å; V53-L114 HydrophobicContact CG1-CG 3.98Å; D56-L114 HydrophobicContact CB-CB 4.08Å; D56-L114 HydrophobicContact CB-CD1 3.87Å; D56-L114 HydrophobicContact CB-CG 4.26Å; L57-L114 HydrophobicContact CD2-CD1 3.64Å; L57-L114 HydrophobicContact CG-CD1 3.78Å; I60-L114 HydrophobicContact CD1-CD1 4.19Å; L92-L114 HydrophobicContact CD2-CD2 3.61Å; L95-L114 HydrophobicContact CD2-CB 4.45Å; L95-L114 HydrophobicContact CD2-CD1 3.82Å; L95-L114 HydrophobicContact CD2-CD2 3.68Å; L95-L114 HydrophobicContact CD2-CG 4.2Å; T110-L114 WeakPolarHBondContact O-CB 3.32Å; T110-L114 PolarHBondContact O-N 3.27Å; V111-L114 PolarHBondContact O-N 3.12Å; E112-L114 VanDerWaalsContact C-N 3.34Å; E112-L114 PolarHBondContact O-N 3.31Å; L114-I116 PolarHBondContact O-N 3.46Å; L114-L117 PolarHBondContact O-N 2.95Å; L114-A118 WeakPolarHBondContact O-CB 3.48Å; L114-A118 PolarHBondContact O-N 3.33Å; L114-F151 HydrophobicContact CD2-CZ 4.05Å
115I96.5Very high92.9Very high26 Ų2654.6 Ų54.613%0.13330%0.301CS..Hα-helixtrans-62.5-42.6179.4-69.8169.1000111.1L92 Q96 V111 E112 N113 A118 N119L92-I115 HydrophobicContact CD2-CG1 4.1Å; Q96-I115 HydrophobicContact CG-CD1 3.72Å; V111-I115 HydrophobicContact CG1-CD1 3.74Å; V111-I115 HydrophobicContact CG1-CG1 4.42Å; V111-I115 VanDerWaalsContact O-CG1 3.3Å; V111-I115 WeakPolarHBondContact O-CG1 3.44Å; V111-I115 PolarHBondContact O-N 3.47Å; E112-I115 PolarHBondContact O-N 3.4Å; N113-I115 PolarHBondContact O-N 3.38Å; I115-A118 PolarHBondContact O-N 3.36Å; I115-N119 VanDerWaalsContact CG2-ND2 3.33Å; I115-N119 WeakPolarHBondContact CG2-ND2 3.36Å; I115-N119 VanDerWaalsContact O-CB 3.32Å; I115-N119 WeakPolarHBondContact O-CB 3.31Å; I115-N119 PolarHBondContact O-N 3.47Å; I115-N119 PolarHBondContact O-ND2 3.06Å
116I94Very high91.9Very high79 Ų7951.9 Ų51.941%0.40529%0.293SS..Hα-helixtrans-60.4-47.5176.1-69.4166.8000110.4E112 N113 L114 N120E112-I116 HydrophobicContact CG-CD1 4Å; E112-I116 WeakPolarHBondContact O-CG1 3.33Å; E112-I116 PolarHBondContact O-N 2.74Å; N113-I116 PolarHBondContact O-N 3.04Å; L114-I116 PolarHBondContact O-N 3.46Å; I116-N120 WeakPolarHBondContact O-CB 3.37Å; I116-N120 PolarHBondContact O-N 3.35Å; I116-N120 PolarHBondContact O-ND2 3.01Å; I116-N120 VanDerWaalsContact O-ND2 3.09Å
117L93.4Very high91Very high37 Ų3756 Ų5619%0.19432%0.315CS..Hα-helixtrans-60.1-50.7177.9-71.4172.1000111.4A48 N52 V53 N113 L114 N119 N120 I121A48-L117 HydrophobicContact CB-CD2 3.91Å; N52-L117 HydrophobicContact CB-CD1 3.82Å; V53-L117 HydrophobicContact CG2-CB 4.1Å; N113-L117 VanDerWaalsContact O-CG 3.31Å; N113-L117 WeakPolarHBondContact O-CG 3.44Å; N113-L117 PolarHBondContact O-N 3.29Å; L114-L117 PolarHBondContact O-N 2.95Å; L117-N119 PolarHBondContact O-N 2.82Å; L117-N120 PolarHBondContact O-N 3.34Å; L117-I121 WeakPolarHBondContact O-CD1 3.47Å; L117-I121 VanDerWaalsContact O-CG1 3.26Å; L117-I121 WeakPolarHBondContact O-CG1 3.24Å; L117-I121 PolarHBondContact O-N 3.46Å; L117-I121 VanDerWaalsContact O-N 3.11Å
118A94.1Very high90.2Very high0 Ų060.1 Ų60.10%034%0.336CS..Hα-helixtrans-61.3-45.2-178.700000111.9W50 L92 L114 I115 N120 I121 L122W50-A118 HydrophobicContact CH2-CB 4.49Å; W50-A118 HydrophobicContact CZ3-CB 4.19Å; L92-A118 HydrophobicContact CD1-CB 3.81Å; L92-A118 HydrophobicContact CD2-CB 3.66Å; L92-A118 HydrophobicContact CG-CB 4.35Å; L114-A118 WeakPolarHBondContact O-CB 3.48Å; L114-A118 PolarHBondContact O-N 3.33Å; I115-A118 PolarHBondContact O-N 3.36Å; A118-N120 PolarHBondContact O-N 3.39Å; A118-I121 PolarHBondContact O-N 3.03Å; A118-L122 WeakPolarHBondContact O-CB 3.32Å; A118-L122 VanDerWaalsContact O-CG 3.28Å; A118-L122 WeakPolarHBondContact O-CG 3.31Å; A118-L122 PolarHBondContact O-N 3.45Å
119N93.1Very high89.6Confident78 Ų7862.2 Ų62.242%0.41736%0.355SS..Hα-helixtrans-64.9-38.4178.7-78.1-34.4000112.9I115 L117 I121 L122 S123I115-N119 VanDerWaalsContact CG2-ND2 3.33Å; I115-N119 WeakPolarHBondContact CG2-ND2 3.36Å; I115-N119 VanDerWaalsContact O-CB 3.32Å; I115-N119 WeakPolarHBondContact O-CB 3.31Å; I115-N119 PolarHBondContact O-N 3.47Å; I115-N119 PolarHBondContact O-ND2 3.06Å; L117-N119 PolarHBondContact O-N 2.82Å; N119-I121 VanDerWaalsContact C-N 3.3Å; N119-I121 PolarHBondContact O-N 2.95Å; N119-L122 PolarHBondContact O-N 3.5Å; N119-S123 WeakPolarHBondContact O-CB 3.31Å; N119-S123 PolarHBondContact O-N 3.17Å; N119-S123 PolarHBondContact O-OG 3.31Å
120N90.7Very high89.3Confident89 Ų8960.5 Ų60.548%0.47635%0.345SS..Hα-helixtrans-62-39.5174.7-75.1-28.7000111.5A48 I116 L117 A118 S123 S124A48-N120 HydrophobicContact CB-CB 3.9Å; I116-N120 WeakPolarHBondContact O-CB 3.37Å; I116-N120 PolarHBondContact O-N 3.35Å; I116-N120 PolarHBondContact O-ND2 3.01Å; I116-N120 VanDerWaalsContact O-ND2 3.09Å; L117-N120 PolarHBondContact O-N 3.34Å; A118-N120 PolarHBondContact O-N 3.39Å; N120-S123 PolarHBondContact O-OG 3.3Å; N120-S123 VanDerWaalsContact O-OG 3.06Å; N120-S124 PolarHBondContact O-N 3.31Å
121I89.6Confident89Confident14 Ų1465.5 Ų65.57%0.07238%0.38CS..Hα-helixtrans-72.7-46.1178.1-56.2158.9000110.9A48 W50 L117 A118 N119 S123 S124 N125A48-I121 HydrophobicContact CB-CD1 4.12Å; A48-I121 HydrophobicContact CB-CG1 3.55Å; A48-I121 WeakPolarHBondContact O-CG1 3.43Å; W50-I121 HydrophobicContact CD2-CD1 3.82Å; W50-I121 HydrophobicContact CD2-CG2 4.37Å; W50-I121 VanDerWaalsContact CE2-CG2 3.45Å; W50-I121 HydrophobicContact CE3-CD1 4.1Å; W50-I121 HydrophobicContact CG-CD1 4.13Å; W50-I121 HydrophobicContact CZ2-CB 3.94Å; W50-I121 HydrophobicContact CZ2-CD1 4.42Å; W50-I121 HydrophobicContact CZ2-CG2 3.59Å; W50-I121 VanDerWaalsContact NE1-CG2 3.26Å; L117-I121 WeakPolarHBondContact O-CD1 3.47Å; L117-I121 VanDerWaalsContact O-CG1 3.26Å; L117-I121 WeakPolarHBondContact O-CG1 3.24Å; L117-I121 PolarHBondContact O-N 3.46Å; L117-I121 VanDerWaalsContact O-N 3.11Å; A118-I121 PolarHBondContact O-N 3.03Å; N119-I121 VanDerWaalsContact C-N 3.3Å; N119-I121 PolarHBondContact O-N 2.95Å; I121-S123 VanDerWaalsContact C-N 3.33Å; I121-S123 PolarHBondContact O-N 3.31Å; I121-S124 PolarHBondContact O-N 3.43Å; I121-S124 VanDerWaalsContact O-N 3.17Å; I121-S124 PolarHBondContact O-OG 2.85Å; I121-N125 PolarHBondContact O-N 3.26Å
122L90.4Very high88.8Confident20 Ų2069.5 Ų69.511%0.10542%0.422CS..Hα-helixtrans-61.4-40.2-179.8-70.9175.3000112.3W50 V85 M88 L92 A118 N119 S124 N125 F158W50-L122 HydrophobicContact CH2-CD2 4.05Å; W50-L122 HydrophobicContact CH2-CG 4.13Å; W50-L122 HydrophobicContact CZ2-CD2 4.12Å; W50-L122 HydrophobicContact CZ2-CG 4.44Å; V85-L122 HydrophobicContact CG1-CD2 4.36Å; M88-L122 HydrophobicContact CG-CD1 3.91Å; M88-L122 HydrophobicContact CG-CD2 4.32Å; L92-L122 HydrophobicContact CD1-CD1 4.15Å; A118-L122 WeakPolarHBondContact O-CB 3.32Å; A118-L122 VanDerWaalsContact O-CG 3.28Å; A118-L122 WeakPolarHBondContact O-CG 3.31Å; A118-L122 PolarHBondContact O-N 3.45Å; N119-L122 PolarHBondContact O-N 3.5Å; L122-S124 VanDerWaalsContact C-N 3.33Å; L122-S124 PolarHBondContact O-N 2.9Å; L122-N125 PolarHBondContact O-N 3.39Å; L122-F158 HydrophobicContact CD2-CE1 3.87Å; L122-F158 HydrophobicContact CD2-CZ 4.07Å
123S87.1Confident88.7Confident83 Ų8365.9 Ų65.958%0.5841%0.407SS*.Hα-helixtrans-68.9-30.1177.157.90000113.2N119 N120 I121 N125 G126N119-S123 WeakPolarHBondContact O-CB 3.31Å; N119-S123 PolarHBondContact O-N 3.17Å; N119-S123 PolarHBondContact O-OG 3.31Å; N120-S123 PolarHBondContact O-OG 3.3Å; N120-S123 VanDerWaalsContact O-OG 3.06Å; I121-S123 VanDerWaalsContact C-N 3.33Å; I121-S123 PolarHBondContact O-N 3.31Å; S123-N125 PolarHBondContact O-N 3.5Å; S123-G126 PolarHBondContact O-N 2.67Å
124S82.2Confident88.7Confident87 Ų8766.9 Ų66.961%0.60841%0.408SS*.Hα-helixtrans-67.7-22.9177.376.50000113.7N120 I121 L122 G126N120-S124 PolarHBondContact O-N 3.31Å; I121-S124 PolarHBondContact O-N 3.43Å; I121-S124 VanDerWaalsContact O-N 3.17Å; I121-S124 PolarHBondContact O-OG 2.85Å; L122-S124 VanDerWaalsContact C-N 3.33Å; L122-S124 PolarHBondContact O-N 2.9Å; S124-G126 PolarHBondContact O-N 3.47Å
125N74.8Confident88.7Confident79 Ų7972.7 Ų72.742%0.42244%0.435SS..THydrogen-bonded Turntrans-80.53.6179.3-71.2-23.5000114I121 L122 S123 I128I121-N125 PolarHBondContact O-N 3.26Å; L122-N125 PolarHBondContact O-N 3.39Å; S123-N125 PolarHBondContact O-N 3.5Å; N125-I128 HydrophobicContact CB-CD1 4.13Å
126G75.6Confident88.7Confident41 Ų4172.2 Ų72.242%0.42343%0.434SS..  trans80178.2-179.600000113.8S123 S124 I128S123-G126 PolarHBondContact O-N 2.67Å; S124-G126 PolarHBondContact O-N 3.47Å; G126-I128 PolarHBondContact O-N 2.89Å
127N74.7Confident88.8Confident171 Ų17174.8 Ų74.891%0.91444%0.444SS*.  trans-75.988.2178.7-79.1-6000110.5
128I79.9Confident89Confident88 Ų8878.9 Ų78.945%0.45146%0.462SS..  trans-81.3115.5171-57.7171.8000108V85 N125 G126 E130V85-I128 HydrophobicContact CG2-CD1 4.02Å; V85-I128 HydrophobicContact CG2-CG2 4.43Å; N125-I128 HydrophobicContact CB-CD1 4.13Å; G126-I128 PolarHBondContact O-N 2.89Å; I128-E130 HydrophobicContact CG2-CG 3.94Å
129T84.3Confident89.1Confident135 Ų13579.7 Ų79.783%0.82847%0.466SS*.  trans-96.6108.916948.40000109.2
130E91.4Very high89.3Confident44 Ų4482 Ų8221%0.20647%0.474CS..  trans-90.9150.1170.6-58.9-179.4153.700109.1S82 C83 K84 V85 T86 I128S82-E130 WeakPolarHBondContact O-CB 3.32Å; S82-E130 WeakPolarHBondContact O-CG 3.45Å; C83-E130 VanDerWaalsContact C-OE2 3.28Å; C83-E130 VanDerWaalsContact CA-OE2 3.32Å; C83-E130 WeakPolarHBondContact CA-OE2 3.31Å; K84-E130 PolarHBondContact N-OE1 2.97Å; V85-E130 WeakPolarHBondContact CB-OE1 3.41Å; V85-E130 PolarHBondContact N-OE1 2.97Å; V85-E130 PolarHBondContact N-OE2 2.86Å; T86-E130 VanDerWaalsContact CB-OE2 3.26Å; T86-E130 WeakPolarHBondContact CB-OE2 3.45Å; T86-E130 PolarHBondContact N-OE2 3.34Å; T86-E130 PolarHBondContact OG1-OE2 2.96Å; I128-E130 HydrophobicContact CG2-CG 3.94Å
131S91.3Very high89.7Confident108 Ų10882.6 Ų82.676%0.75547%0.474SS*.  trans-138.4141.6-177.664.50000110.9C133S131-C133 VanDerWaalsContact C-N 3.29Å
132G92.5Very high90.1Very high88 Ų8883.4 Ų83.491%0.90748%0.477SS*.SBendtrans73.921.2-179.800000113.8
133C95.8Very high90.3Very high26 Ų2686 Ų8618%0.17649%0.491CS..PPolyproline II helixtrans-84.3150.8171.1-55.60000109.7C83 T86 S131C83-C133 WeakPolarHBondContact CA-SG 3.26Å; C83-C133 HydrophobicContact CB-CB 3.75Å; C83-C133 WeakPolarHBondContact CB-SG 3.46Å; C83-C133 WeakPolarHBondContact SG-CA 3.28Å; C83-C133 WeakPolarHBondContact SG-CB 3.42Å; C83-C133 CovalentContact SG-SG 2.04Å; C83-C133 PolarHBondContact SG-SG 3.37Å; T86-C133 HydrophobicContact CG2-CB 3.99Å; S131-C133 VanDerWaalsContact C-N 3.29Å
134K94.9Very high90.7Very high112 Ų11282.7 Ų82.749%0.48747%0.467SS..PPolyproline II helixtrans-67.6147.6174-63.1176.6-172.2165.40110.3E76 E138 L139E76-K134 IonicContact OE2-NZ 3.12Å; K134-E138 HydrophobicContact CB-CB 4.2Å; K134-L139 HydrophobicContact CB-CD2 4.3Å; K134-L139 HydrophobicContact CD-CD2 4.06Å
135E96.2Very high91.3Very high122 Ų12285.5 Ų85.557%0.5747%0.468SS*.PPolyproline II helixtrans-70.5160.2163.8-59.3-61.1148.400110.2E137 E138E135-E137 VanDerWaalsContact C-N 3.3Å; E135-E137 PolarHBondContact O-N 2.86Å; E135-E138 HydrophobicContact CB-CG 4.31Å; E135-E138 WeakPolarHBondContact CB-OE1 3.39Å; E135-E138 PolarHBondContact N-OE1 2.99Å; E135-E138 WeakPolarHBondContact O-CB 3.48Å; E135-E138 PolarHBondContact O-N 3.16Å; E135-E138 VanDerWaalsContact O-N 3.15Å
136C97.4Very high92.4Very high16 Ų1685.7 Ų85.711%0.10847%0.467CS..G310 helixtrans-62.7-39.3-174-55.30000111.9Y74 C90 E138 L139Y74-C136 WeakPolarHBondContact CB-O 3.38Å; Y74-C136 WeakPolarHBondContact CD1-O 3.03Å; Y74-C136 VanDerWaalsContact CG-O 3.27Å; C90-C136 WeakPolarHBondContact CA-SG 3.4Å; C90-C136 HydrophobicContact CB-CB 3.74Å; C90-C136 WeakPolarHBondContact CB-SG 3.42Å; C90-C136 WeakPolarHBondContact SG-CA 3.31Å; C90-C136 WeakPolarHBondContact SG-CB 3.47Å; C90-C136 CovalentContact SG-SG 2.04Å; C90-C136 PolarHBondContact SG-SG 3.47Å; C136-E138 PolarHBondContact O-N 2.89Å; C136-L139 VanDerWaalsContact O-CB 3.25Å; C136-L139 WeakPolarHBondContact O-CB 3.42Å; C136-L139 VanDerWaalsContact O-CG 3.24Å; C136-L139 WeakPolarHBondContact O-CG 3.49Å; C136-L139 PolarHBondContact O-N 3.03Å; C136-L139 VanDerWaalsContact O-N 3.08Å
137E96.8Very high93.4Very high132 Ų13283.8 Ų83.862%0.61745%0.447SS*.G310 helixtrans-71.3-9.4-179.5-60.182.2173.600113.5Y74 E135Y74-E137 HydrophobicContact CE2-CB 4.32Å; Y74-E137 HydrophobicContact CE2-CG 3.92Å; E135-E137 VanDerWaalsContact C-N 3.3Å; E135-E137 PolarHBondContact O-N 2.86Å
138E96.4Very high94.5Very high124 Ų12475.8 Ų75.858%0.57940%0.404SS*.G310 helixtrans-88.5-5.8172.6-61.4179.4-99.300112.7K134 E135 C136K134-E138 HydrophobicContact CB-CB 4.2Å; E135-E138 HydrophobicContact CB-CG 4.31Å; E135-E138 WeakPolarHBondContact CB-OE1 3.39Å; E135-E138 PolarHBondContact N-OE1 2.99Å; E135-E138 WeakPolarHBondContact O-CB 3.48Å; E135-E138 PolarHBondContact O-N 3.16Å; E135-E138 VanDerWaalsContact O-N 3.15Å; C136-E138 PolarHBondContact O-N 2.89Å
139L97.1Very high95.3Very high17 Ų1776.7 Ų76.79%0.08941%0.406CS..SBendtrans-78.6160.5179.2-56.4177.4000111.5E76 C90 K134 C136E76-L139 HydrophobicContact CB-CD1 4.07Å; E76-L139 HydrophobicContact CB-CD2 4.03Å; E76-L139 HydrophobicContact CG-CD2 4.42Å; E76-L139 WeakPolarHBondContact OE2-CD2 3.33Å; C90-L139 HydrophobicContact CB-CD1 4.07Å; K134-L139 HydrophobicContact CB-CD2 4.3Å; K134-L139 HydrophobicContact CD-CD2 4.06Å; C136-L139 VanDerWaalsContact O-CB 3.25Å; C136-L139 WeakPolarHBondContact O-CB 3.42Å; C136-L139 VanDerWaalsContact O-CG 3.24Å; C136-L139 WeakPolarHBondContact O-CG 3.49Å; C136-L139 PolarHBondContact O-N 3.03Å; C136-L139 VanDerWaalsContact O-N 3.08Å
140E97.1Very high96Very high126 Ų12670.9 Ų70.959%0.58937%0.371SS*.EExtended strand (participates in β ladder)trans-70132.8173.8-173.8-179.7-165.800110T75 K142T75-E140 PolarHBondContact N-O 3.33Å; E140-K142 HydrophobicContact CG-CG 4.34Å; E140-K142 WeakPolarHBondContact OE2-CE 3.47Å; E140-K142 IonicContact OE2-NZ 3.83Å; E140-K142 PolarHBondContact OE2-NZ 3.02Å; E140-K142 VanDerWaalsContact OE2-NZ 3.12Å
141E97.6Very high96.3Very high101 Ų10168.8 Ų68.847%0.47236%0.361SS..EExtended strand (participates in β ladder)trans-79.8128.1172.5-70.8-177.2-136.700110.7T72 L73 Y74T72-E141 PolarHBondContact OG1-OE2 3.13Å; L73-E141 WeakPolarHBondContact O-CA 3.26Å; Y74-E141 HydrophobicContact CD1-CG 3.64Å; Y74-E141 HydrophobicContact CE1-CG 3.5Å; Y74-E141 VanDerWaalsContact CE1-CG 3.5Å
142K98Very high96.5Very high32 Ų3265 Ų6514%0.13933%0.333CS..EExtended strand (participates in β ladder)trans-130.1160.6179.5-59.2-166.3178.1-167.40112.1T72 L73 T75 S77 E140 E146T72-K142 CarbonylContact C-O 3.54Å; T72-K142 VanDerWaalsContact CA-O 3.32Å; T72-K142 WeakPolarHBondContact CA-O 3.21Å; L73-K142 PolarHBondContact N-O 3.32Å; L73-K142 PolarHBondContact O-N 3.42Å; T75-K142 HydrophobicContact CG2-CD 4.02Å; T75-K142 HydrophobicContact CG2-CG 4.42Å; S77-K142 WeakPolarHBondContact OG-CE 3.44Å; S77-K142 PolarHBondContact OG-NZ 3.15Å; E140-K142 HydrophobicContact CG-CG 4.34Å; E140-K142 WeakPolarHBondContact OE2-CE 3.47Å; E140-K142 IonicContact OE2-NZ 3.83Å; E140-K142 PolarHBondContact OE2-NZ 3.02Å; E140-K142 VanDerWaalsContact OE2-NZ 3.12Å; K142-E146 HydrophobicContact CB-CB 3.91Å; K142-E146 HydrophobicContact CD-CB 4.02Å
143N96.1Very high96.7Very high73 Ų7365.2 Ų65.239%0.3931%0.311SS..EExtended strand (participates in β ladder)trans-65.5161.9172.462.465000111.1K145 E146 F147N143-K145 PolarHBondContact O-N 3.47Å; N143-K145 VanDerWaalsContact O-N 3.16Å; N143-K145 WeakPolarHBondContact OD1-CB 3.34Å; N143-K145 PolarHBondContact OD1-N 2.88Å; N143-E146 PolarHBondContact ND2-OE2 3.38Å; N143-E146 PolarHBondContact O-N 3.3Å; N143-E146 VanDerWaalsContact O-N 3.14Å; N143-E146 PolarHBondContact OD1-N 3.49Å; N143-F147 PolarHBondContact O-N 2.88Å
144I95.6Very high96.7Very high14 Ų1464 Ų647%0.07230%0.302CS..Hα-helixtrans-56.5-37-175.3-59.8172.8000112.7I64 I69 L73 I98 F147 L148I64-I144 HydrophobicContact CD1-CB 4.41Å; I64-I144 HydrophobicContact CD1-CG2 3.32Å; I69-I144 HydrophobicContact CB-CD1 3.43Å; I69-I144 VanDerWaalsContact CB-CD1 3.43Å; I69-I144 HydrophobicContact CD1-CD1 4.4Å; I69-I144 HydrophobicContact CG1-CD1 4.48Å; I69-I144 HydrophobicContact CG2-CD1 3.41Å; I69-I144 VanDerWaalsContact CG2-CD1 3.41Å; I69-I144 WeakPolarHBondContact O-CD1 3.4Å; L73-I144 HydrophobicContact CD1-CG1 4.06Å; I98-I144 HydrophobicContact CD1-CG2 3.81Å; I144-F147 PolarHBondContact O-N 2.86Å; I144-L148 HydrophobicContact CG2-CD1 3.91Å; I144-L148 HydrophobicContact CG2-CG 4.1Å; I144-L148 WeakPolarHBondContact O-CB 3.41Å; I144-L148 WeakPolarHBondContact O-CG 3.19Å; I144-L148 PolarHBondContact O-N 3.49Å
145K94.6Very high96.7Very high146 Ų14658.7 Ų58.764%0.63528%0.279SS*.Hα-helixtrans-64.1-48-179.8-177.6-179.5178.6-179.90111.3N143 F147 Q149N143-K145 PolarHBondContact O-N 3.47Å; N143-K145 VanDerWaalsContact O-N 3.16Å; N143-K145 WeakPolarHBondContact OD1-CB 3.34Å; N143-K145 PolarHBondContact OD1-N 2.88Å; K145-F147 VanDerWaalsContact C-N 3.33Å; K145-Q149 WeakPolarHBondContact O-CB 3.21Å; K145-Q149 PolarHBondContact O-N 3.16Å
146E96.8Very high96.6Very high84 Ų8456.8 Ų56.839%0.39327%0.271SS..Hα-helixtrans-67.3-36.3177.2-70.8179.5118.100112K142 N143 S150K142-E146 HydrophobicContact CB-CB 3.91Å; K142-E146 HydrophobicContact CD-CB 4.02Å; N143-E146 PolarHBondContact ND2-OE2 3.38Å; N143-E146 PolarHBondContact O-N 3.3Å; N143-E146 VanDerWaalsContact O-N 3.14Å; N143-E146 PolarHBondContact OD1-N 3.49Å; E146-S150 WeakPolarHBondContact O-CB 3.24Å; E146-S150 PolarHBondContact O-N 2.88Å; E146-S150 PolarHBondContact O-OG 3.17Å
147F98Very high96.4Very high0 Ų058.7 Ų58.70%028%0.279CS..Hα-helixtrans-59.6-54.9173.1171.7-95.5000111.5L73 T75 F91 E94 L95 I98 N143 I144 K145 Q149 S150 F151L73-F147 HydrophobicContact CB-CB 4.28Å; L73-F147 HydrophobicContact CB-CD2 3.71Å; L73-F147 HydrophobicContact CB-CE2 4.2Å; L73-F147 HydrophobicContact CB-CG 4.01Å; L73-F147 HydrophobicContact CD1-CB 4.06Å; L73-F147 HydrophobicContact CD1-CD1 3.64Å; L73-F147 HydrophobicContact CD1-CD2 4.09Å; L73-F147 HydrophobicContact CD1-CE1 4.05Å; L73-F147 HydrophobicContact CD1-CE2 4.45Å; L73-F147 HydrophobicContact CD1-CG 3.65Å; L73-F147 HydrophobicContact CD1-CZ 4.43Å; T75-F147 HydrophobicContact CG2-CD2 4.5Å; T75-F147 WeakPolarHBondContact OG1-CD2 3.42Å; F91-F147 AromaticContact CD1-CD2 3.92Å; F91-F147 HydrophobicContact CD1-CD2 3.92Å; F91-F147 AromaticContact CD1-CE2 3.37Å; F91-F147 HydrophobicContact CD1-CE2 3.37Å; F91-F147 AromaticContact CD1-CZ 3.75Å; F91-F147 HydrophobicContact CD1-CZ 3.75Å; F91-F147 AromaticContact CE1-CD2 3.92Å; F91-F147 HydrophobicContact CE1-CD2 3.92Å; F91-F147 AromaticContact CE1-CE2 3.86Å; F91-F147 HydrophobicContact CE1-CE2 3.86Å; F91-F147 HydrophobicContact CG-CE2 4.37Å; F91-F147 WeakPolarHBondContact O-CZ 3.26Å; E94-F147 HydrophobicContact CB-CD2 4.48Å; E94-F147 HydrophobicContact CB-CE2 3.49Å; E94-F147 VanDerWaalsContact CB-CE2 3.49Å; E94-F147 HydrophobicContact CB-CZ 3.68Å; E94-F147 HydrophobicContact CG-CE2 4.29Å; L95-F147 HydrophobicContact CD1-CE1 4.29Å; I98-F147 HydrophobicContact CD1-CD1 3.94Å; I98-F147 HydrophobicContact CD1-CE1 3.87Å; N143-F147 PolarHBondContact O-N 2.88Å; I144-F147 PolarHBondContact O-N 2.86Å; K145-F147 VanDerWaalsContact C-N 3.33Å; F147-Q149 VanDerWaalsContact C-N 3.32Å; F147-Q149 PolarHBondContact O-N 3.38Å; F147-S150 PolarHBondContact O-N 3.42Å; F147-S150 VanDerWaalsContact O-N 3.15Å; F147-F151 AromaticContact CE1-CD1 3.89Å; F147-F151 HydrophobicContact CE1-CD1 3.89Å; F147-F151 AromaticContact CZ-CD1 3.98Å; F147-F151 HydrophobicContact CZ-CD1 3.98Å; F147-F151 HydrophobicContact CZ-CE1 4.42Å; F147-F151 WeakPolarHBondContact O-CB 3.38Å; F147-F151 PolarHBondContact O-N 3.21Å
148L97Very high96.1Very high3 Ų352.6 Ų52.62%0.01625%0.25CC..Hα-helixtrans-62.2-38.9-179.5-70.2177.5000112L57 I60 E61 I64 L95 I98 I144 F151 V152L57-L148 HydrophobicContact CD2-CD2 4.03Å; I60-L148 HydrophobicContact CG2-CD1 4.48Å; I60-L148 HydrophobicContact CG2-CD2 4.44Å; E61-L148 HydrophobicContact CB-CD1 3.93Å; E61-L148 HydrophobicContact CG-CD1 4.27Å; I64-L148 HydrophobicContact CD1-CD1 3.6Å; L95-L148 HydrophobicContact CD1-CD2 4.5Å; I98-L148 HydrophobicContact CD1-CD2 4.42Å; I144-L148 HydrophobicContact CG2-CD1 3.91Å; I144-L148 HydrophobicContact CG2-CG 4.1Å; I144-L148 WeakPolarHBondContact O-CB 3.41Å; I144-L148 WeakPolarHBondContact O-CG 3.19Å; I144-L148 PolarHBondContact O-N 3.49Å; L148-F151 WeakPolarHBondContact O-CB 3.37Å; L148-F151 PolarHBondContact O-N 2.99Å; L148-V152 WeakPolarHBondContact O-CG2 3.36Å; L148-V152 PolarHBondContact O-N 3.38Å
149Q96.8Very high95.8Very high107 Ų10749.2 Ų49.250%0.524%0.235SC..Hα-helixtrans-61.5-44.9174.8-174.4177.5-800111.7K145 F147 F151 V152 H153K145-Q149 WeakPolarHBondContact O-CB 3.21Å; K145-Q149 PolarHBondContact O-N 3.16Å; F147-Q149 VanDerWaalsContact C-N 3.32Å; F147-Q149 PolarHBondContact O-N 3.38Å; Q149-F151 VanDerWaalsContact C-N 3.32Å; Q149-V152 PolarHBondContact O-N 3.04Å; Q149-H153 PolarHBondContact O-N 3.34Å; Q149-H153 VanDerWaalsContact O-N 3.15Å
150S97.9Very high95.1Very high13 Ų1354.8 Ų54.89%0.09127%0.265CS..Hα-helixtrans-67.5-34.6177.1-55.50000111.8T75 E146 F147 H153 I154T75-S150 WeakPolarHBondContact CG2-OG 3.46Å; E146-S150 WeakPolarHBondContact O-CB 3.24Å; E146-S150 PolarHBondContact O-N 2.88Å; E146-S150 PolarHBondContact O-OG 3.17Å; F147-S150 PolarHBondContact O-N 3.42Å; F147-S150 VanDerWaalsContact O-N 3.15Å; S150-H153 WeakPolarHBondContact O-CB 3.3Å; S150-H153 PolarHBondContact O-N 2.9Å; S150-I154 PolarHBondContact O-N 3.14Å
151F98.1Very high93.9Very high0 Ų053.2 Ų53.20%026%0.264CS..Hα-helixtrans-62.6-45.3174.4-156.7160.2000110.8L57 M88 F91 L92 L95 L114 F147 L148 Q149 H153 I154 V155L57-F151 HydrophobicContact CD1-CB 4.16Å; L57-F151 HydrophobicContact CD1-CD1 4.45Å; L57-F151 HydrophobicContact CD1-CD2 3.94Å; L57-F151 HydrophobicContact CD1-CE2 4.43Å; L57-F151 HydrophobicContact CD1-CG 3.91Å; L57-F151 HydrophobicContact CD2-CB 4.31Å; L57-F151 HydrophobicContact CD2-CD1 3.5Å; L57-F151 VanDerWaalsContact CD2-CD1 3.5Å; L57-F151 HydrophobicContact CD2-CD2 4.39Å; L57-F151 HydrophobicContact CD2-CE1 3.81Å; L57-F151 HydrophobicContact CD2-CG 3.81Å; L57-F151 HydrophobicContact CD2-CZ 4.35Å; M88-F151 HydrophobicContact CE-CE2 4.41Å; M88-F151 HydrophobicContact SD-CD2 4.48Å; M88-F151 HydrophobicContact SD-CE2 3.64Å; M88-F151 HydrophobicContact SD-CZ 4.4Å; F91-F151 HydrophobicContact CB-CD1 3.95Å; F91-F151 HydrophobicContact CB-CD2 3.92Å; F91-F151 HydrophobicContact CB-CE1 3.82Å; F91-F151 HydrophobicContact CB-CE2 3.83Å; F91-F151 HydrophobicContact CB-CG 4.01Å; F91-F151 HydrophobicContact CB-CZ 3.78Å; F91-F151 HydrophobicContact CD1-CB 3.68Å; F91-F151 AromaticContact CD1-CD1 3.87Å; F91-F151 HydrophobicContact CD1-CD1 3.87Å; F91-F151 HydrophobicContact CD1-CD2 4.2Å; F91-F151 AromaticContact CD1-CG 3.67Å; F91-F151 HydrophobicContact CD1-CG 3.67Å; F91-F151 HydrophobicContact CE1-CB 3.93Å; F91-F151 HydrophobicContact CE1-CG 4.4Å; F91-F151 HydrophobicContact CG-CB 4.38Å; F91-F151 HydrophobicContact CG-CD1 4.26Å; F91-F151 HydrophobicContact CG-CD2 4.06Å; F91-F151 HydrophobicContact CG-CE2 4.46Å; F91-F151 AromaticContact CG-CG 3.99Å; F91-F151 HydrophobicContact CG-CG 3.99Å; L92-F151 HydrophobicContact CD2-CZ 3.9Å; L92-F151 HydrophobicContact CG-CZ 4.45Å; L95-F151 HydrophobicContact CB-CE1 4.2Å; L95-F151 HydrophobicContact CD1-CE1 4.31Å; L95-F151 HydrophobicContact CD2-CE1 3.99Å; L95-F151 HydrophobicContact CG-CE1 4.39Å; L114-F151 HydrophobicContact CD2-CZ 4.05Å; F147-F151 AromaticContact CE1-CD1 3.89Å; F147-F151 HydrophobicContact CE1-CD1 3.89Å; F147-F151 AromaticContact CZ-CD1 3.98Å; F147-F151 HydrophobicContact CZ-CD1 3.98Å; F147-F151 HydrophobicContact CZ-CE1 4.42Å; F147-F151 WeakPolarHBondContact O-CB 3.38Å; F147-F151 PolarHBondContact O-N 3.21Å; L148-F151 WeakPolarHBondContact O-CB 3.37Å; L148-F151 PolarHBondContact O-N 2.99Å; Q149-F151 VanDerWaalsContact C-N 3.32Å; F151-H153 VanDerWaalsContact C-N 3.28Å; F151-H153 PolarHBondContact O-N 2.91Å; F151-I154 HydrophobicContact CD2-CG2 3.98Å; F151-I154 WeakPolarHBondContact O-CG2 3.3Å; F151-I154 PolarHBondContact O-N 3.39Å; F151-V155 HydrophobicContact CD2-CG2 3.84Å; F151-V155 HydrophobicContact CE2-CG2 3.92Å; F151-V155 VanDerWaalsContact O-CG2 3.3Å; F151-V155 WeakPolarHBondContact O-CG2 3.35Å; F151-V155 PolarHBondContact O-N 2.75Å
152V96.9Very high92Very high28 Ų2854.5 Ų54.517%0.1729%0.285CS..Hα-helixtrans-59.1-41.3174172.60000111.3L57 L148 Q149 V155 Q156L57-V152 HydrophobicContact CB-CG2 4.28Å; L57-V152 HydrophobicContact CD1-CG2 3.84Å; L148-V152 WeakPolarHBondContact O-CG2 3.36Å; L148-V152 PolarHBondContact O-N 3.38Å; Q149-V152 PolarHBondContact O-N 3.04Å; V152-V155 PolarHBondContact O-N 3Å; V152-Q156 VanDerWaalsContact O-CG 3.31Å; V152-Q156 WeakPolarHBondContact O-CG 3.44Å; V152-Q156 PolarHBondContact O-N 2.93Å
153H95.9Very high91.7Very high93 Ų9355.7 Ų55.743%0.43129%0.292SS..Hα-helixtrans-62-46.3178.2-65.8160.9000112.8Q149 S150 F151 V155 Q156 M157Q149-H153 PolarHBondContact O-N 3.34Å; Q149-H153 VanDerWaalsContact O-N 3.15Å; S150-H153 WeakPolarHBondContact O-CB 3.3Å; S150-H153 PolarHBondContact O-N 2.9Å; F151-H153 VanDerWaalsContact C-N 3.28Å; F151-H153 PolarHBondContact O-N 2.91Å; H153-V155 VanDerWaalsContact C-N 3.34Å; H153-V155 PolarHBondContact O-N 2.93Å; H153-Q156 WeakPolarHBondContact O-CB 3.21Å; H153-Q156 PolarHBondContact O-N 3.41Å; H153-M157 PolarHBondContact O-N 3.44Å; H153-M157 VanDerWaalsContact O-N 3.17Å
154I96Very high91.4Very high1 Ų154.7 Ų54.71%0.00529%0.287CS..Hα-helixtrans-65.5-38.9178.2-168.3176.5000111.3V79 A87 M88 F91 S150 F151 Q156 M157 F158V79-I154 HydrophobicContact CG1-CD1 3.99Å; V79-I154 HydrophobicContact CG1-CG1 4.26Å; V79-I154 HydrophobicContact CG2-CB 4.26Å; V79-I154 HydrophobicContact CG2-CD1 3.92Å; V79-I154 HydrophobicContact CG2-CG1 4.14Å; A87-I154 HydrophobicContact CB-CD1 3.61Å; M88-I154 HydrophobicContact CB-CD1 4.09Å; M88-I154 HydrophobicContact CE-CB 4.48Å; M88-I154 HydrophobicContact CE-CD1 4.37Å; M88-I154 HydrophobicContact CE-CG1 4.11Å; M88-I154 HydrophobicContact CE-CG2 3.85Å; F91-I154 HydrophobicContact CD2-CD1 4Å; F91-I154 HydrophobicContact CD2-CG2 3.69Å; F91-I154 HydrophobicContact CE2-CB 4.26Å; F91-I154 HydrophobicContact CE2-CD1 4.09Å; F91-I154 HydrophobicContact CE2-CG2 3.75Å; F91-I154 HydrophobicContact CG-CG2 4.35Å; F91-I154 HydrophobicContact CZ-CG2 4.44Å; S150-I154 PolarHBondContact O-N 3.14Å; F151-I154 HydrophobicContact CD2-CG2 3.98Å; F151-I154 WeakPolarHBondContact O-CG2 3.3Å; F151-I154 PolarHBondContact O-N 3.39Å; I154-Q156 VanDerWaalsContact C-N 3.28Å; I154-Q156 PolarHBondContact O-N 3.45Å; I154-M157 VanDerWaalsContact O-CB 3.31Å; I154-M157 WeakPolarHBondContact O-CB 3.37Å; I154-M157 PolarHBondContact O-N 3.46Å; I154-F158 HydrophobicContact CD1-CE2 4.41Å; I154-F158 HydrophobicContact CG1-CD2 4.4Å; I154-F158 HydrophobicContact CG1-CE2 4.04Å; I154-F158 VanDerWaalsContact O-CD2 3.31Å; I154-F158 WeakPolarHBondContact O-CD2 3.28Å; I154-F158 PolarHBondContact O-N 3.39Å
155V95.6Very high91.2Very high0 Ų057 Ų570%030%0.299CS..Hα-helixtrans-60.5-39.1175.4175.60000111.1W50 V53 I54 L57 M88 F151 V152 H153 M157 F158 I159W50-V155 HydrophobicContact CB-CG1 3.9Å; W50-V155 HydrophobicContact CD2-CG1 4.36Å; W50-V155 HydrophobicContact CE3-CG1 3.86Å; W50-V155 HydrophobicContact CE3-CG2 4.37Å; W50-V155 HydrophobicContact CG-CG1 4.43Å; V53-V155 HydrophobicContact CB-CG1 4.42Å; V53-V155 HydrophobicContact CG1-CG1 4.27Å; V53-V155 HydrophobicContact CG1-CG2 3.77Å; I54-V155 HydrophobicContact CD1-CG1 4Å; I54-V155 HydrophobicContact CG1-CB 4.24Å; I54-V155 HydrophobicContact CG1-CG1 3.57Å; L57-V155 HydrophobicContact CD1-CG2 4.18Å; M88-V155 HydrophobicContact CE-CG2 3.83Å; F151-V155 HydrophobicContact CD2-CG2 3.84Å; F151-V155 HydrophobicContact CE2-CG2 3.92Å; F151-V155 VanDerWaalsContact O-CG2 3.3Å; F151-V155 WeakPolarHBondContact O-CG2 3.35Å; F151-V155 PolarHBondContact O-N 2.75Å; V152-V155 PolarHBondContact O-N 3Å; H153-V155 VanDerWaalsContact C-N 3.34Å; H153-V155 PolarHBondContact O-N 2.93Å; V155-M157 VanDerWaalsContact C-N 3.3Å; V155-M157 PolarHBondContact O-N 3.37Å; V155-F158 WeakPolarHBondContact O-CB 3.34Å; V155-F158 PolarHBondContact O-N 3Å; V155-F158 VanDerWaalsContact O-N 3.1Å; V155-I159 HydrophobicContact CG1-CD1 4.33Å; V155-I159 PolarHBondContact O-N 3.47Å
156Q93.7Very high91Very high83 Ų8351.8 Ų51.839%0.38828%0.279SS..Hα-helixtrans-62.9-34.3174.4-71.7170.9-700112.9I54 V152 H153 I154 F158 I159 N160I54-Q156 HydrophobicContact CD1-CG 4.24Å; V152-Q156 VanDerWaalsContact O-CG 3.31Å; V152-Q156 WeakPolarHBondContact O-CG 3.44Å; V152-Q156 PolarHBondContact O-N 2.93Å; H153-Q156 WeakPolarHBondContact O-CB 3.21Å; H153-Q156 PolarHBondContact O-N 3.41Å; I154-Q156 VanDerWaalsContact C-N 3.28Å; I154-Q156 PolarHBondContact O-N 3.45Å; Q156-F158 VanDerWaalsContact C-N 3.25Å; Q156-F158 PolarHBondContact O-N 3.3Å; Q156-I159 PolarHBondContact O-N 3.38Å; Q156-N160 VanDerWaalsContact O-CG 3.29Å; Q156-N160 PolarHBondContact O-N 3.06Å; Q156-N160 PolarHBondContact O-ND2 3.47Å
157M92.1Very high90.6Very high56 Ų5649.8 Ų49.828%0.27627%0.272SS..Hα-helixtrans-61.4-36.2173.3-62.9174.966.600111.8V79 P81 H153 I154 V155 T161V79-M157 HydrophobicContact CB-CE 4.31Å; V79-M157 HydrophobicContact CB-SD 3.9Å; V79-M157 HydrophobicContact CG1-CE 4.2Å; V79-M157 HydrophobicContact CG1-SD 4.16Å; P81-M157 HydrophobicContact CG-CE 4.48Å; H153-M157 PolarHBondContact O-N 3.44Å; H153-M157 VanDerWaalsContact O-N 3.17Å; I154-M157 VanDerWaalsContact O-CB 3.31Å; I154-M157 WeakPolarHBondContact O-CB 3.37Å; I154-M157 PolarHBondContact O-N 3.46Å; V155-M157 VanDerWaalsContact C-N 3.3Å; V155-M157 PolarHBondContact O-N 3.37Å; M157-T161 WeakPolarHBondContact O-CG2 3.4Å; M157-T161 PolarHBondContact O-N 3.41Å; M157-T161 PolarHBondContact O-OG1 3.43Å
158F91.3Very high90.1Very high3 Ų353.1 Ų53.11%0.01329%0.29CS..Hα-helixtrans-71.1-40.2175-77.2-88000112.4W50 K84 V85 M88 L122 I154 V155 Q156 N160 T161 S162W50-F158 HydrophobicContact CD2-CB 3.9Å; W50-F158 VanDerWaalsContact CE2-CB 3.48Å; W50-F158 AromaticContact CE2-CG 3.83Å; W50-F158 HydrophobicContact CG-CB 4.11Å; W50-F158 HydrophobicContact CH2-CD1 4.41Å; W50-F158 HydrophobicContact CH2-CD2 4.45Å; W50-F158 HydrophobicContact CH2-CG 4.26Å; W50-F158 HydrophobicContact CZ2-CB 3.91Å; W50-F158 AromaticContact CZ2-CD1 3.63Å; W50-F158 HydrophobicContact CZ2-CD1 3.63Å; W50-F158 HydrophobicContact CZ2-CD2 4.32Å; W50-F158 HydrophobicContact CZ2-CE1 4.2Å; W50-F158 AromaticContact CZ2-CG 3.7Å; W50-F158 HydrophobicContact CZ2-CG 3.7Å; K84-F158 HydrophobicContact CB-CE2 4.2Å; K84-F158 HydrophobicContact CB-CZ 4.12Å; K84-F158 HydrophobicContact CD-CE1 4.23Å; K84-F158 HydrophobicContact CD-CE2 4.48Å; K84-F158 HydrophobicContact CD-CZ 4.11Å; K84-F158 HydrophobicContact CG-CE1 4.27Å; K84-F158 HydrophobicContact CG-CE2 4.31Å; K84-F158 HydrophobicContact CG-CZ 3.79Å; K84-F158 WeakPolarHBondContact O-CZ 3.43Å; V85-F158 HydrophobicContact CG2-CE1 4.35Å; V85-F158 HydrophobicContact CG2-CZ 4.29Å; M88-F158 HydrophobicContact CB-CE2 3.95Å; M88-F158 HydrophobicContact CB-CZ 4.13Å; M88-F158 HydrophobicContact CE-CD2 3.49Å; M88-F158 VanDerWaalsContact CE-CD2 3.49Å; M88-F158 HydrophobicContact CE-CE2 3.47Å; M88-F158 VanDerWaalsContact CE-CE2 3.47Å; M88-F158 HydrophobicContact CE-CZ 4.46Å; M88-F158 HydrophobicContact CG-CE2 4.28Å; L122-F158 HydrophobicContact CD2-CE1 3.87Å; L122-F158 HydrophobicContact CD2-CZ 4.07Å; I154-F158 HydrophobicContact CD1-CE2 4.41Å; I154-F158 HydrophobicContact CG1-CD2 4.4Å; I154-F158 HydrophobicContact CG1-CE2 4.04Å; I154-F158 VanDerWaalsContact O-CD2 3.31Å; I154-F158 WeakPolarHBondContact O-CD2 3.28Å; I154-F158 PolarHBondContact O-N 3.39Å; V155-F158 WeakPolarHBondContact O-CB 3.34Å; V155-F158 PolarHBondContact O-N 3Å; V155-F158 VanDerWaalsContact O-N 3.1Å; Q156-F158 VanDerWaalsContact C-N 3.25Å; Q156-F158 PolarHBondContact O-N 3.3Å; F158-N160 PolarHBondContact O-N 3.48Å; F158-T161 PolarHBondContact O-N 3.04Å; F158-T161 PolarHBondContact O-OG1 3.13Å; F158-S162 WeakPolarHBondContact O-CB 3.49Å; F158-S162 PolarHBondContact O-N 3.18Å; F158-S162 VanDerWaalsContact O-N 3.12Å; F158-S162 PolarHBondContact O-OG 3.09Å
159I89.3Confident89.6Confident53 Ų5356.6 Ų56.627%0.27231%0.31SS..Hα-helixtrans-60-45.8175.5-66.9169.9000111.2W50 I54 V155 Q156 T161 S162W50-I159 HydrophobicContact CB-CD1 3.93Å; W50-I159 HydrophobicContact CB-CG1 3.4Å; W50-I159 HydrophobicContact CG-CG1 4.18Å; I54-I159 HydrophobicContact CD1-CD1 3.5Å; I54-I159 VanDerWaalsContact CD1-CD1 3.5Å; I54-I159 HydrophobicContact CG1-CD1 4.49Å; V155-I159 HydrophobicContact CG1-CD1 4.33Å; V155-I159 PolarHBondContact O-N 3.47Å; Q156-I159 PolarHBondContact O-N 3.38Å; I159-T161 PolarHBondContact O-N 2.83Å; I159-S162 PolarHBondContact O-N 3.07Å
160N83.3Confident89.1Confident135 Ų13552.8 Ų52.872%0.72230%0.295SS*.Hα-helixtrans-73.5-13.7-175.9-66.2-22.3000113.7Q156 F158Q156-N160 VanDerWaalsContact O-CG 3.29Å; Q156-N160 PolarHBondContact O-N 3.06Å; Q156-N160 PolarHBondContact O-ND2 3.47Å; F158-N160 PolarHBondContact O-N 3.48Å
161T71.5Confident88.4Confident92 Ų9256.1 Ų56.156%0.56431%0.312SS*.Hα-helixtrans-107.9-3.2179.353.70000113.8K84 M157 F158 I159K84-T161 PolarHBondContact NZ-OG1 2.97Å; M157-T161 WeakPolarHBondContact O-CG2 3.4Å; M157-T161 PolarHBondContact O-N 3.41Å; M157-T161 PolarHBondContact O-OG1 3.43Å; F158-T161 PolarHBondContact O-N 3.04Å; F158-T161 PolarHBondContact O-OG1 3.13Å; I159-T161 PolarHBondContact O-N 2.83Å
162S56.8Low87.5Confident129 Ų12961.2 Ų61.290%0.90234%0.34SS*.  trans-90.80174.6-56.50000110.8F158 I159F158-S162 WeakPolarHBondContact O-CB 3.49Å; F158-S162 PolarHBondContact O-N 3.18Å; F158-S162 VanDerWaalsContact O-N 3.12Å; F158-S162 PolarHBondContact O-OG 3.09Å; I159-S162 PolarHBondContact O-N 3.07Å

Retrieved 162 of 162 residues in 355.2 ms (Link to these results)