A0A087YS75_POEFO Loading...

Immediate early response 2b

AlphaFold DB , UniProt , Accession A0A087YS75, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 159 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
1M61.2Low89.4Confident208 Ų208127.5 Ų127.5100%1.02563%0.627SS**  03.30-122.9-179.2-132.500113.2V3 N4M1-V3 PolarHBondContact O-N 3.15Å; M1-N4 PolarHBondContact O-N 3.12Å
2E73.1Confident90Very high162 Ų162121.3 Ų121.376%0.75761%0.61SS**Hα-helixtrans-65.9-31.7-176.9-84.8158.2141.200115.1N4 I5 E6E2-N4 PolarHBondContact O-N 3.32Å; E2-I5 PolarHBondContact O-N 3.47Å; E2-E6 PolarHBondContact O-N 3.21Å
3V83.5Confident90.6Very high128 Ų128117.8 Ų117.878%0.77660%0.599SS**Hα-helixtrans-59.9-32.4179-169.30000111.6M1 A7M1-V3 PolarHBondContact O-N 3.15Å; V3-A7 VanDerWaalsContact O-CB 3.25Å; V3-A7 WeakPolarHBondContact O-CB 3.31Å; V3-A7 PolarHBondContact O-N 2.96Å
4N91.1Very high91Very high105 Ų105113.7 Ų113.756%0.56159%0.586SS**Hα-helixtrans-70.5-33.5175.7-106.8-49.2000112.8M1 E2 R8M1-N4 PolarHBondContact O-N 3.12Å; E2-N4 PolarHBondContact O-N 3.32Å; N4-R8 VanDerWaalsContact O-CG 3.3Å; N4-R8 WeakPolarHBondContact O-CG 3Å; N4-R8 PolarHBondContact O-N 3.1Å
5I94.8Very high91.3Very high117 Ų117111.5 Ų111.560%0.658%0.575SS**Hα-helixtrans-74.3-44178.3-61.3171.6000109.5E2 R8 R9E2-I5 PolarHBondContact O-N 3.47Å; I5-R8 PolarHBondContact O-N 3.18Å; I5-R9 PolarHBondContact O-N 3.37Å
6E95.4Very high91.5Very high83 Ų83109.3 Ų109.339%0.38857%0.572SS.*Hα-helixtrans-66.6-38.8178.1-167.958.8-153.300111.5E2 R8 R9 I10E2-E6 PolarHBondContact O-N 3.21Å; E6-R8 PolarHBondContact O-N 2.83Å; E6-R9 WeakPolarHBondContact O-CB 3.41Å; E6-R9 PolarHBondContact O-N 2.95Å; E6-R9 IonicContact OE1-NH1 3.29Å; E6-R9 PolarHBondContact OE1-NH1 3.31Å; E6-R9 IonicContact OE2-NH1 3.37Å; E6-R9 PolarHBondContact OE2-NH1 3.28Å; E6-I10 HydrophobicContact CG-CD1 4.13Å; E6-I10 VanDerWaalsContact O-CG1 3.31Å; E6-I10 WeakPolarHBondContact O-CG1 3.31Å; E6-I10 PolarHBondContact O-N 3.48Å
7A96.7Very high91.5Very high52 Ų52111.5 Ų111.543%0.4358%0.576SS.*Hα-helixtrans-59.7-43.4173.700000112.3V3 R9 I10 L11V3-A7 VanDerWaalsContact O-CB 3.25Å; V3-A7 WeakPolarHBondContact O-CB 3.31Å; V3-A7 PolarHBondContact O-N 2.96Å; A7-R9 VanDerWaalsContact C-N 3.33Å; A7-R9 PolarHBondContact O-N 3.29Å; A7-I10 PolarHBondContact O-N 2.9Å; A7-L11 WeakPolarHBondContact O-CB 3.43Å; A7-L11 PolarHBondContact O-N 3.15Å
8R95.8Very high91.2Very high186 Ų186110.9 Ų110.970%0.70257%0.574SS**Hα-helixtrans-64.3-37.9175.5-72.4174.7-173.1-158.71.7112N4 I5 E6 L11 A12N4-R8 VanDerWaalsContact O-CG 3.3Å; N4-R8 WeakPolarHBondContact O-CG 3Å; N4-R8 PolarHBondContact O-N 3.1Å; I5-R8 PolarHBondContact O-N 3.18Å; E6-R8 PolarHBondContact O-N 2.83Å; R8-L11 PolarHBondContact O-N 3.36Å; R8-A12 WeakPolarHBondContact O-CB 3.26Å; R8-A12 PolarHBondContact O-N 2.97Å
9R97.1Very high91Very high157 Ų157113.2 Ų113.259%0.59258%0.575SS**Hα-helixtrans-65.1-47.6176-175.4-173.1177.8-155.42.4111.7I5 E6 A7 L11 A12 V13I5-R9 PolarHBondContact O-N 3.37Å; E6-R9 WeakPolarHBondContact O-CB 3.41Å; E6-R9 PolarHBondContact O-N 2.95Å; E6-R9 IonicContact OE1-NH1 3.29Å; E6-R9 PolarHBondContact OE1-NH1 3.31Å; E6-R9 IonicContact OE2-NH1 3.37Å; E6-R9 PolarHBondContact OE2-NH1 3.28Å; A7-R9 VanDerWaalsContact C-N 3.33Å; A7-R9 PolarHBondContact O-N 3.29Å; R9-L11 VanDerWaalsContact C-N 3.29Å; R9-L11 PolarHBondContact O-N 3.5Å; R9-A12 PolarHBondContact O-N 3.08Å; R9-V13 WeakPolarHBondContact O-CG2 3.37Å; R9-V13 PolarHBondContact O-N 3.34Å
10I97.1Very high90.5Very high103 Ų103111 Ų11153%0.52858%0.575SS.*Hα-helixtrans-59.1-43.4176.6-68.1167.8000110.2E6 A7 V13 S14E6-I10 HydrophobicContact CG-CD1 4.13Å; E6-I10 VanDerWaalsContact O-CG1 3.31Å; E6-I10 WeakPolarHBondContact O-CG1 3.31Å; E6-I10 PolarHBondContact O-N 3.48Å; A7-I10 PolarHBondContact O-N 2.9Å; I10-V13 PolarHBondContact O-N 3.36Å; I10-S14 WeakPolarHBondContact O-CB 3.39Å; I10-S14 PolarHBondContact O-N 3.15Å; I10-S14 PolarHBondContact O-OG 3.47Å
11L97.6Very high90.1Very high102 Ų102108.3 Ų108.353%0.53457%0.566SS.*Hα-helixtrans-61.8-45.3176.4-175.5152.9000112.2A7 R8 R9 V13 S14 I15A7-L11 WeakPolarHBondContact O-CB 3.43Å; A7-L11 PolarHBondContact O-N 3.15Å; R8-L11 PolarHBondContact O-N 3.36Å; R9-L11 VanDerWaalsContact C-N 3.29Å; R9-L11 PolarHBondContact O-N 3.5Å; L11-V13 VanDerWaalsContact C-N 3.33Å; L11-V13 PolarHBondContact O-N 3.43Å; L11-S14 WeakPolarHBondContact CA-OG 3.48Å; L11-S14 PolarHBondContact O-N 2.88Å; L11-S14 PolarHBondContact O-OG 3.13Å; L11-I15 HydrophobicContact CD2-CD1 3.48Å; L11-I15 VanDerWaalsContact CD2-CD1 3.48Å; L11-I15 HydrophobicContact CD2-CG1 4.36Å; L11-I15 HydrophobicContact CG-CD1 4.28Å; L11-I15 VanDerWaalsContact O-CG1 3.32Å; L11-I15 WeakPolarHBondContact O-CG1 3.36Å; L11-I15 PolarHBondContact O-N 3.41Å
12A97.2Very high90.9Very high52 Ų52107.4 Ų107.443%0.4355%0.551SS.*Hα-helixtrans-62.8-4117800000112.1R8 R9 S16R8-A12 WeakPolarHBondContact O-CB 3.26Å; R8-A12 PolarHBondContact O-N 2.97Å; R9-A12 PolarHBondContact O-N 3.08Å; A12-S16 WeakPolarHBondContact O-CB 3.37Å; A12-S16 PolarHBondContact O-N 2.91Å; A12-S16 VanDerWaalsContact O-N 3.12Å; A12-S16 PolarHBondContact O-OG 3.3Å
13V97Very high90.7Very high77 Ų77103.9 Ų103.947%0.46754%0.54SS..Hα-helixtrans-67.9-42.5177.51730000111.1R9 I10 L11 S16 K17R9-V13 WeakPolarHBondContact O-CG2 3.37Å; R9-V13 PolarHBondContact O-N 3.34Å; I10-V13 PolarHBondContact O-N 3.36Å; L11-V13 VanDerWaalsContact C-N 3.33Å; L11-V13 PolarHBondContact O-N 3.43Å; V13-S16 PolarHBondContact O-N 3.11Å; V13-K17 HydrophobicContact CG1-CD 4.04Å; V13-K17 HydrophobicContact CG1-CG 4.39Å; V13-K17 WeakPolarHBondContact O-CG 3.23Å; V13-K17 PolarHBondContact O-N 3Å
14S96.6Very high90.1Very high60 Ų60105.5 Ų105.542%0.4254%0.54SS..Hα-helixtrans-65.7-41.8-179.365.60000112I10 L11 S16 K17 L18I10-S14 WeakPolarHBondContact O-CB 3.39Å; I10-S14 PolarHBondContact O-N 3.15Å; I10-S14 PolarHBondContact O-OG 3.47Å; L11-S14 WeakPolarHBondContact CA-OG 3.48Å; L11-S14 PolarHBondContact O-N 2.88Å; L11-S14 PolarHBondContact O-OG 3.13Å; S14-S16 PolarHBondContact O-N 3.5Å; S14-K17 PolarHBondContact O-N 3.33Å; S14-L18 WeakPolarHBondContact O-CB 3.36Å; S14-L18 PolarHBondContact O-N 3.39Å
15I95.7Very high89Confident80 Ų80111.7 Ų111.741%0.4156%0.555SS.*Hα-helixtrans-58.9-48.8172.7-69.2176000110.2L11 K17 L18 Y19L11-I15 HydrophobicContact CD2-CD1 3.48Å; L11-I15 VanDerWaalsContact CD2-CD1 3.48Å; L11-I15 HydrophobicContact CD2-CG1 4.36Å; L11-I15 HydrophobicContact CG-CD1 4.28Å; L11-I15 VanDerWaalsContact O-CG1 3.32Å; L11-I15 WeakPolarHBondContact O-CG1 3.36Å; L11-I15 PolarHBondContact O-N 3.41Å; I15-K17 VanDerWaalsContact C-N 3.32Å; I15-K17 PolarHBondContact O-N 2.89Å; I15-L18 WeakPolarHBondContact O-CB 3.38Å; I15-L18 PolarHBondContact O-N 2.9Å; I15-L18 VanDerWaalsContact O-N 3.12Å; I15-Y19 HydrophobicContact CG2-CD2 3.67Å; I15-Y19 HydrophobicContact CG2-CE2 3.66Å; I15-Y19 VanDerWaalsContact O-CD2 3.32Å; I15-Y19 WeakPolarHBondContact O-CD2 3.25Å; I15-Y19 PolarHBondContact O-N 2.92Å
16S93.8Very high88.2Confident77 Ų77108.4 Ų108.454%0.53855%0.55SS..Hα-helixtrans-59.5-42.4179.6-58.70000112.1A12 V13 S14 L18 Y19 A20A12-S16 WeakPolarHBondContact O-CB 3.37Å; A12-S16 PolarHBondContact O-N 2.91Å; A12-S16 VanDerWaalsContact O-N 3.12Å; A12-S16 PolarHBondContact O-OG 3.3Å; V13-S16 PolarHBondContact O-N 3.11Å; S14-S16 PolarHBondContact O-N 3.5Å; S16-L18 VanDerWaalsContact C-N 3.34Å; S16-L18 PolarHBondContact O-N 3.11Å; S16-Y19 PolarHBondContact O-N 2.98Å; S16-A20 WeakPolarHBondContact O-CB 2.88Å; S16-A20 PolarHBondContact O-N 3.37Å
17K92.6Very high87.7Confident146 Ų146105.1 Ų105.164%0.63554%0.539SS*.Hα-helixtrans-65.2-36.6176.1-72.3-179.572.9173.10112.3V13 S14 I15 A20 S21V13-K17 HydrophobicContact CG1-CD 4.04Å; V13-K17 HydrophobicContact CG1-CG 4.39Å; V13-K17 WeakPolarHBondContact O-CG 3.23Å; V13-K17 PolarHBondContact O-N 3Å; S14-K17 PolarHBondContact O-N 3.33Å; I15-K17 VanDerWaalsContact C-N 3.32Å; I15-K17 PolarHBondContact O-N 2.89Å; K17-A20 PolarHBondContact O-N 3.09Å; K17-S21 VanDerWaalsContact O-CB 3.3Å; K17-S21 WeakPolarHBondContact O-CB 3.19Å; K17-S21 PolarHBondContact O-N 2.96Å; K17-S21 PolarHBondContact O-OG 3.19Å; K17-S21 VanDerWaalsContact O-OG 3.08Å
18L86.1Confident87Confident102 Ų102108.8 Ų108.853%0.53455%0.55SS.*Hα-helixtrans-66-44.4176.1-176.7148.3000111.5S14 I15 S16 S21 R22S14-L18 WeakPolarHBondContact O-CB 3.36Å; S14-L18 PolarHBondContact O-N 3.39Å; I15-L18 WeakPolarHBondContact O-CB 3.38Å; I15-L18 PolarHBondContact O-N 2.9Å; I15-L18 VanDerWaalsContact O-N 3.12Å; S16-L18 VanDerWaalsContact C-N 3.34Å; S16-L18 PolarHBondContact O-N 3.11Å; L18-S21 PolarHBondContact O-N 2.92Å; L18-S21 PolarHBondContact O-OG 3.18Å; L18-R22 WeakPolarHBondContact O-CB 3.36Å; L18-R22 PolarHBondContact O-N 3.13Å; L18-R22 VanDerWaalsContact O-N 3.11Å
19Y86.9Confident86.4Confident154 Ų154110.6 Ų110.660%0.60456%0.557SS**Hα-helixtrans-66.3-38.3176.2-84-80.4000112.4I15 S16I15-Y19 HydrophobicContact CG2-CD2 3.67Å; I15-Y19 HydrophobicContact CG2-CE2 3.66Å; I15-Y19 VanDerWaalsContact O-CD2 3.32Å; I15-Y19 WeakPolarHBondContact O-CD2 3.25Å; I15-Y19 PolarHBondContact O-N 2.92Å; S16-Y19 PolarHBondContact O-N 2.98Å
20A81.4Confident86Confident68 Ų68106.9 Ų106.956%0.56255%0.549SS*.Hα-helixtrans-69.9-35.1177.500000113.2S16 K17 T23S16-A20 WeakPolarHBondContact O-CB 2.88Å; S16-A20 PolarHBondContact O-N 3.37Å; K17-A20 PolarHBondContact O-N 3.09Å; A20-T23 PolarHBondContact O-OG1 3.1Å
21S81Confident85.6Confident56 Ų56107.1 Ų107.139%0.39255%0.547SS..Hα-helixtrans-83.7-18.6-178.569.80000113.6K17 L18 T23 Q24K17-S21 VanDerWaalsContact O-CB 3.3Å; K17-S21 WeakPolarHBondContact O-CB 3.19Å; K17-S21 PolarHBondContact O-N 2.96Å; K17-S21 PolarHBondContact O-OG 3.19Å; K17-S21 VanDerWaalsContact O-OG 3.08Å; L18-S21 PolarHBondContact O-N 2.92Å; L18-S21 PolarHBondContact O-OG 3.18Å; S21-T23 PolarHBondContact O-N 3.05Å; S21-Q24 WeakPolarHBondContact O-CB 3.33Å; S21-Q24 PolarHBondContact O-N 3.49Å
22R77.6Confident85.3Confident189 Ų189111.6 Ų111.671%0.71356%0.557SS**THydrogen-bonded Turntrans-55.9-24.1177-166172.9-173.9164.71.9112.7L18L18-R22 WeakPolarHBondContact O-CB 3.36Å; L18-R22 PolarHBondContact O-N 3.13Å; L18-R22 VanDerWaalsContact O-N 3.11Å
23T69.4Low85.1Confident87 Ų87111.7 Ų111.753%0.53456%0.555SS.*THydrogen-bonded Turntrans-101.68.6176.553.20000114.2A20 S21 G27A20-T23 PolarHBondContact O-OG1 3.1Å; S21-T23 PolarHBondContact O-N 3.05Å; T23-G27 VanDerWaalsContact C-CA 3.46Å; T23-G27 WeakPolarHBondContact O-CA 3.35Å
24Q70.6Confident84.8Confident162 Ų162113 Ų11376%0.75756%0.559SS**THydrogen-bonded Turntrans-98.5-30.9-173.3-152.5170.718.400113.2S21S21-Q24 WeakPolarHBondContact O-CB 3.33Å; S21-Q24 PolarHBondContact O-N 3.49Å
25R68.3Low84.7Confident236 Ų236114.1 Ų114.189%0.89156%0.559SS**SBendtrans-98.298.9170.5-160.8168.1179.5136.5-2.2109.2G27R25-G27 PolarHBondContact O-N 2.78Å
26G78.5Confident84.8Confident47 Ų47115.3 Ų115.349%0.48557%0.566SS.*SBendtrans83.1-26.7-176.800000115.6L30G26-L30 WeakPolarHBondContact O-CB 3.47Å; G26-L30 PolarHBondContact O-N 3.04Å
27G84.9Confident85Confident15 Ų15115.3 Ų115.316%0.15557%0.566CS.*Hα-helixtrans59.4-162.4167.700000117.8T23 R25 R29 L30 H31T23-G27 VanDerWaalsContact C-CA 3.46Å; T23-G27 WeakPolarHBondContact O-CA 3.35Å; R25-G27 PolarHBondContact O-N 2.78Å; G27-R29 PolarHBondContact O-N 2.95Å; G27-R29 VanDerWaalsContact O-N 3.16Å; G27-L30 PolarHBondContact O-N 2.88Å; G27-L30 VanDerWaalsContact O-N 3.14Å; G27-H31 PolarHBondContact O-N 2.87Å
28L82.4Confident85.2Confident128 Ų128113.9 Ų113.967%0.6757%0.565SS**Hα-helixtrans-57.4-29.3179.7-172.865.9000111.7R32L28-R32 VanDerWaalsContact O-CB 3.31Å; L28-R32 WeakPolarHBondContact O-CB 3.34Å; L28-R32 PolarHBondContact O-N 3.32Å
29R81.8Confident85.8Confident224 Ų224112.9 Ų112.985%0.84556%0.562SS**Hα-helixtrans-65.4-49.8175.9-68.7179.663.9-160.7-1.3111.8G27 H31 R32 S33G27-R29 PolarHBondContact O-N 2.95Å; G27-R29 VanDerWaalsContact O-N 3.16Å; R29-H31 VanDerWaalsContact C-N 3.35Å; R29-R32 PolarHBondContact O-N 2.98Å; R29-S33 PolarHBondContact O-N 3.14Å; R29-S33 PolarHBondContact O-OG 3.16Å
30L89.1Confident86.3Confident80 Ų80109.9 Ų109.942%0.41956%0.555SS.*Hα-helixtrans-64.5-40.9175.8-178.864.4000111.1G26 G27 R32 S33 L34G26-L30 WeakPolarHBondContact O-CB 3.47Å; G26-L30 PolarHBondContact O-N 3.04Å; G27-L30 PolarHBondContact O-N 2.88Å; G27-L30 VanDerWaalsContact O-N 3.14Å; L30-R32 PolarHBondContact O-N 3.37Å; L30-S33 WeakPolarHBondContact CA-OG 3.39Å; L30-S33 PolarHBondContact O-N 3.49Å; L30-S33 PolarHBondContact O-OG 2.95Å; L30-L34 HydrophobicContact CD1-CD1 3.4Å; L30-L34 HydrophobicContact CG-CD1 3.83Å; L30-L34 WeakPolarHBondContact O-CB 3.35Å; L30-L34 WeakPolarHBondContact O-CD1 3.28Å; L30-L34 PolarHBondContact O-N 2.98Å
31H89.1Confident87.1Confident108 Ų108112.3 Ų112.350%0.555%0.553SS.*Hα-helixtrans-58.5-47.3175.6179.957000111.6G27 R29 S33 L34 L35G27-H31 PolarHBondContact O-N 2.87Å; R29-H31 VanDerWaalsContact C-N 3.35Å; H31-S33 PolarHBondContact O-N 2.95Å; H31-L34 PolarHBondContact O-N 3.26Å; H31-L35 WeakPolarHBondContact NE2-CD1 3.35Å; H31-L35 WeakPolarHBondContact O-CB 3.25Å; H31-L35 WeakPolarHBondContact O-CG 3.44Å; H31-L35 PolarHBondContact O-N 2.97Å
32R92Very high87.9Confident196 Ų196112.2 Ų112.274%0.7455%0.552SS**Hα-helixtrans-63.3-41.3177-172.3176.2-175.9-177.51.3112.1L28 R29 L30 L35 L36L28-R32 VanDerWaalsContact O-CB 3.31Å; L28-R32 WeakPolarHBondContact O-CB 3.34Å; L28-R32 PolarHBondContact O-N 3.32Å; R29-R32 PolarHBondContact O-N 2.98Å; L30-R32 PolarHBondContact O-N 3.37Å; R32-L35 PolarHBondContact O-N 3.45Å; R32-L36 WeakPolarHBondContact O-CB 3.49Å; R32-L36 PolarHBondContact O-N 2.94Å
33S91.7Very high88.8Confident54 Ų54105.6 Ų105.638%0.37854%0.538SS..Hα-helixtrans-65.9-42.2177.461.90000111.8R29 L30 H31 L36 S37R29-S33 PolarHBondContact O-N 3.14Å; R29-S33 PolarHBondContact O-OG 3.16Å; L30-S33 WeakPolarHBondContact CA-OG 3.39Å; L30-S33 PolarHBondContact O-N 3.49Å; L30-S33 PolarHBondContact O-OG 2.95Å; H31-S33 PolarHBondContact O-N 2.95Å; S33-L36 PolarHBondContact O-N 2.9Å; S33-S37 PolarHBondContact O-N 2.98Å; S33-S37 PolarHBondContact O-OG 3.02Å; S33-S37 VanDerWaalsContact O-OG 3.08Å
34L92.2Very high90.2Very high105 Ų105108.4 Ų108.455%0.5554%0.539SS..Hα-helixtrans-62.6-44.4175.6-97.767.4000111.9L30 H31 L36 S37 L38L30-L34 HydrophobicContact CD1-CD1 3.4Å; L30-L34 HydrophobicContact CG-CD1 3.83Å; L30-L34 WeakPolarHBondContact O-CB 3.35Å; L30-L34 WeakPolarHBondContact O-CD1 3.28Å; L30-L34 PolarHBondContact O-N 2.98Å; H31-L34 PolarHBondContact O-N 3.26Å; L34-L36 VanDerWaalsContact C-N 3.34Å; L34-L36 PolarHBondContact O-N 2.95Å; L34-S37 PolarHBondContact O-N 3.21Å; L34-L38 PolarHBondContact O-N 3.4Å
35L94.4Very high91.4Very high83 Ų83104.9 Ų104.944%0.43553%0.525SS..Hα-helixtrans-59.2-45.9175.5-75.6175.9000111.3H31 R32 S37 L38 V39H31-L35 WeakPolarHBondContact NE2-CD1 3.35Å; H31-L35 WeakPolarHBondContact O-CB 3.25Å; H31-L35 WeakPolarHBondContact O-CG 3.44Å; H31-L35 PolarHBondContact O-N 2.97Å; R32-L35 PolarHBondContact O-N 3.45Å; L35-S37 PolarHBondContact O-N 3.26Å; L35-L38 PolarHBondContact O-N 2.93Å; L35-V39 WeakPolarHBondContact O-CG2 3.42Å; L35-V39 PolarHBondContact O-N 3.08Å
36L96.9Very high92.7Very high105 Ų10599 Ų9955%0.5551%0.51SS..Hα-helixtrans-62-43.3177.1-178.161.9000111.5R32 S33 L34 L38 V39 M40R32-L36 WeakPolarHBondContact O-CB 3.49Å; R32-L36 PolarHBondContact O-N 2.94Å; S33-L36 PolarHBondContact O-N 2.9Å; L34-L36 VanDerWaalsContact C-N 3.34Å; L34-L36 PolarHBondContact O-N 2.95Å; L36-L38 VanDerWaalsContact C-N 3.32Å; L36-L38 PolarHBondContact O-N 3.32Å; L36-V39 PolarHBondContact O-N 2.94Å; L36-M40 HydrophobicContact CD1-CE 4.43Å; L36-M40 HydrophobicContact CD1-CG 4.11Å; L36-M40 HydrophobicContact CG-CG 4.32Å; L36-M40 WeakPolarHBondContact O-CB 3.3Å; L36-M40 VanDerWaalsContact O-CG 3.26Å; L36-M40 WeakPolarHBondContact O-CG 3.49Å; L36-M40 PolarHBondContact O-N 2.76Å
37S97.1Very high93.6Very high76 Ų76104 Ų10453%0.53152%0.516SS..Hα-helixtrans-60.3-40.9175.8-640000112.3S33 L34 L35 K41S33-S37 PolarHBondContact O-N 2.98Å; S33-S37 PolarHBondContact O-OG 3.02Å; S33-S37 VanDerWaalsContact O-OG 3.08Å; L34-S37 PolarHBondContact O-N 3.21Å; L35-S37 PolarHBondContact O-N 3.26Å; S37-K41 WeakPolarHBondContact O-CB 3.44Å; S37-K41 PolarHBondContact O-N 2.85Å
38L97.7Very high94Very high117 Ų117107.5 Ų107.561%0.61353%0.528SS*.Hα-helixtrans-64.9-45.8177.2-175.263.9000111.6L34 L35 L36 K41 S42L34-L38 PolarHBondContact O-N 3.4Å; L35-L38 PolarHBondContact O-N 2.93Å; L36-L38 VanDerWaalsContact C-N 3.32Å; L36-L38 PolarHBondContact O-N 3.32Å; L38-K41 PolarHBondContact O-N 3.49Å; L38-S42 PolarHBondContact O-N 3.11Å; L38-S42 PolarHBondContact O-OG 2.71Å
39V98Very high94.5Very high81 Ų81104.6 Ų104.649%0.49152%0.518SS..Hα-helixtrans-64.6-42.5178.1172.80000111.6L35 L36 K41 S42 A43L35-V39 WeakPolarHBondContact O-CG2 3.42Å; L35-V39 PolarHBondContact O-N 3.08Å; L36-V39 PolarHBondContact O-N 2.94Å; V39-K41 VanDerWaalsContact C-N 3.33Å; V39-K41 PolarHBondContact O-N 3.08Å; V39-S42 PolarHBondContact O-N 3.03Å; V39-S42 PolarHBondContact O-OG 3.47Å; V39-A43 VanDerWaalsContact O-CB 3.31Å; V39-A43 WeakPolarHBondContact O-CB 3.38Å; V39-A43 PolarHBondContact O-N 2.94Å
40M98.3Very high94.8Very high91 Ų9196.9 Ų96.945%0.44850%0.499SS..Hα-helixtrans-66.5-36.4176.7-70.3-63.998.100112.1L36 R44L36-M40 HydrophobicContact CD1-CE 4.43Å; L36-M40 HydrophobicContact CD1-CG 4.11Å; L36-M40 HydrophobicContact CG-CG 4.32Å; L36-M40 WeakPolarHBondContact O-CB 3.3Å; L36-M40 VanDerWaalsContact O-CG 3.26Å; L36-M40 WeakPolarHBondContact O-CG 3.49Å; L36-M40 PolarHBondContact O-N 2.76Å; M40-R44 WeakPolarHBondContact O-CG 3.35Å; M40-R44 PolarHBondContact O-N 3.47Å; M40-R44 VanDerWaalsContact O-N 3.13Å; M40-R44 PolarHBondContact O-NE 2.96Å
41K97.8Very high94.7Very high118 Ų118101.2 Ų101.251%0.51351%0.509SS..Hα-helixtrans-62.2-53.6172.1175.6170.9168.9166.40110.9S37 L38 V39 A43 R44 D45S37-K41 WeakPolarHBondContact O-CB 3.44Å; S37-K41 PolarHBondContact O-N 2.85Å; L38-K41 PolarHBondContact O-N 3.49Å; V39-K41 VanDerWaalsContact C-N 3.33Å; V39-K41 PolarHBondContact O-N 3.08Å; K41-A43 VanDerWaalsContact C-N 3.29Å; K41-A43 PolarHBondContact O-N 3.26Å; K41-R44 PolarHBondContact O-N 3.2Å; K41-R44 VanDerWaalsContact O-N 3.11Å; K41-D45 PolarHBondContact O-N 3.26Å
42S97.7Very high94Very high55 Ų55103 Ų10339%0.38552%0.518SS..Hα-helixtrans-60.9-37.8-179.662.20000112.8L38 V39 D45 I46L38-S42 PolarHBondContact O-N 3.11Å; L38-S42 PolarHBondContact O-OG 2.71Å; V39-S42 PolarHBondContact O-N 3.03Å; V39-S42 PolarHBondContact O-OG 3.47Å; S42-D45 PolarHBondContact O-N 2.94Å; S42-I46 VanDerWaalsContact O-CG1 3.28Å; S42-I46 WeakPolarHBondContact O-CG1 3.44Å; S42-I46 PolarHBondContact O-N 3.12Å
43A97.7Very high92.8Very high50 Ų5098 Ų9841%0.41351%0.513SS..Hα-helixtrans-62.6-42.2176.400000111.9V39 K41 Y47V39-A43 VanDerWaalsContact O-CB 3.31Å; V39-A43 WeakPolarHBondContact O-CB 3.38Å; V39-A43 PolarHBondContact O-N 2.94Å; K41-A43 VanDerWaalsContact C-N 3.29Å; K41-A43 PolarHBondContact O-N 3.26Å; A43-Y47 WeakPolarHBondContact O-CB 3.48Å; A43-Y47 PolarHBondContact O-N 2.98Å
44R97.2Very high91.4Very high146 Ų146102.5 Ų102.555%0.55153%0.528SS*.Hα-helixtrans-64.1-44.3173.7-74.3-177.8-66.5-148.41.5111.8M40 K41 I46 Y47 H48M40-R44 WeakPolarHBondContact O-CG 3.35Å; M40-R44 PolarHBondContact O-N 3.47Å; M40-R44 VanDerWaalsContact O-N 3.13Å; M40-R44 PolarHBondContact O-NE 2.96Å; K41-R44 PolarHBondContact O-N 3.2Å; K41-R44 VanDerWaalsContact O-N 3.11Å; R44-I46 VanDerWaalsContact C-N 3.3Å; R44-I46 PolarHBondContact O-N 3.34Å; R44-Y47 PolarHBondContact O-N 2.79Å; R44-H48 PolarHBondContact O-CD2 3.29Å; R44-H48 PolarHBondContact O-N 2.92Å
45D95.7Very high89.5Confident87 Ų87100.7 Ų100.747%0.46553%0.529SS..Hα-helixtrans-60.7-40.4179.8-61.8-15.4000111.2K41 S42 S49K41-D45 PolarHBondContact O-N 3.26Å; S42-D45 PolarHBondContact O-N 2.94Å; D45-S49 VanDerWaalsContact O-CB 3.25Å; D45-S49 WeakPolarHBondContact O-CB 3.39Å; D45-S49 PolarHBondContact O-N 3.12Å; D45-S49 PolarHBondContact O-OG 3.5Å
46I96.8Very high87.3Confident114 Ų114102.1 Ų102.159%0.58554%0.543SS*.Hα-helixtrans-68.9-43.3175.2-65.7164.9000111.2S42 R44 S49 S50S42-I46 VanDerWaalsContact O-CG1 3.28Å; S42-I46 WeakPolarHBondContact O-CG1 3.44Å; S42-I46 PolarHBondContact O-N 3.12Å; R44-I46 VanDerWaalsContact C-N 3.3Å; R44-I46 PolarHBondContact O-N 3.34Å; I46-S49 WeakPolarHBondContact CA-OG 3.45Å; I46-S49 PolarHBondContact O-OG 3.32Å; I46-S49 VanDerWaalsContact O-OG 3.1Å; I46-S50 VanDerWaalsContact O-CB 3.25Å; I46-S50 WeakPolarHBondContact O-CB 3.35Å; I46-S50 PolarHBondContact O-N 3.49Å
47Y96.3Very high85.3Confident152 Ų152103.6 Ų103.660%0.59656%0.562SS**Hα-helixtrans-62.2-45.9-180177-100.9000112.1A43 R44 R51A43-Y47 WeakPolarHBondContact O-CB 3.48Å; A43-Y47 PolarHBondContact O-N 2.98Å; R44-Y47 PolarHBondContact O-N 2.79Å; Y47-R51 WeakPolarHBondContact O-CB 3.32Å; Y47-R51 PolarHBondContact O-N 3.36Å; Y47-R51 VanDerWaalsContact O-N 3.09Å
48H94.8Very high82.6Confident87 Ų87103.4 Ų103.440%0.40357%0.572SS.*Hα-helixtrans-70.6-43.9178.9-72.9-66.1000112.1R44 S50 R51 E52R44-H48 PolarHBondContact O-CD2 3.29Å; R44-H48 PolarHBondContact O-N 2.92Å; H48-S50 VanDerWaalsContact C-N 3.31Å; H48-S50 PolarHBondContact O-N 2.84Å; H48-R51 PolarHBondContact O-N 3.41Å; H48-R51 VanDerWaalsContact O-N 3.11Å; H48-E52 WeakPolarHBondContact O-CB 3.46Å; H48-E52 WeakPolarHBondContact O-CG 3.21Å; H48-E52 PolarHBondContact O-N 2.79Å
49S92.3Very high80Confident67 Ų67101.1 Ų101.147%0.46958%0.577SS.*Hα-helixtrans-62.1-38.3177.358.90000112.6D45 I46 S53D45-S49 VanDerWaalsContact O-CB 3.25Å; D45-S49 WeakPolarHBondContact O-CB 3.39Å; D45-S49 PolarHBondContact O-N 3.12Å; D45-S49 PolarHBondContact O-OG 3.5Å; I46-S49 WeakPolarHBondContact CA-OG 3.45Å; I46-S49 PolarHBondContact O-OG 3.32Å; I46-S49 VanDerWaalsContact O-OG 3.1Å; S49-S53 WeakPolarHBondContact O-CB 3.36Å; S49-S53 PolarHBondContact O-N 3.44Å; S49-S53 PolarHBondContact O-OG 3.26Å
50S88.7Confident77.4Confident63 Ų63105.2 Ų105.244%0.44160%0.595SS.*Hα-helixtrans-67-34.9173.8179.70000113.1I46 H48 S53 E54I46-S50 VanDerWaalsContact O-CB 3.25Å; I46-S50 WeakPolarHBondContact O-CB 3.35Å; I46-S50 PolarHBondContact O-N 3.49Å; H48-S50 VanDerWaalsContact C-N 3.31Å; H48-S50 PolarHBondContact O-N 2.84Å; S50-S53 WeakPolarHBondContact CA-OG 3.45Å; S50-S53 PolarHBondContact O-OG 3.28Å; S50-E54 WeakPolarHBondContact O-CB 3.32Å; S50-E54 VanDerWaalsContact O-CG 3.23Å; S50-E54 WeakPolarHBondContact O-CG 3.44Å; S50-E54 PolarHBondContact O-N 2.97Å; S50-E54 VanDerWaalsContact O-N 3.13Å
51R86.8Confident75Confident170 Ų170107 Ų10764%0.64262%0.616SS**Hα-helixtrans-77.3-32.9-179.7-167.4-178.3169-135.2-5.5112.2Y47 H48Y47-R51 WeakPolarHBondContact O-CB 3.32Å; Y47-R51 PolarHBondContact O-N 3.36Å; Y47-R51 VanDerWaalsContact O-N 3.09Å; H48-R51 PolarHBondContact O-N 3.41Å; H48-R51 VanDerWaalsContact O-N 3.11Å
52E75.1Confident72.3Confident145 Ų145105.1 Ų105.168%0.67862%0.623SS**Hα-helixtrans-71.9-32172.9-71166-161.700111.6H48H48-E52 WeakPolarHBondContact O-CB 3.46Å; H48-E52 WeakPolarHBondContact O-CG 3.21Å; H48-E52 PolarHBondContact O-N 2.79Å
53S66Low70.4Confident91 Ų91108 Ų10864%0.63664%0.64SS**Hα-helixtrans-77.7-26.8175.464.20000114.5S49 S50 A55S49-S53 WeakPolarHBondContact O-CB 3.36Å; S49-S53 PolarHBondContact O-N 3.44Å; S49-S53 PolarHBondContact O-OG 3.26Å; S50-S53 WeakPolarHBondContact CA-OG 3.45Å; S50-S53 PolarHBondContact O-OG 3.28Å; S53-A55 VanDerWaalsContact C-N 3.3Å
54E61Low68Low149 Ų149114 Ų11470%0.69666%0.66SS**THydrogen-bonded Turntrans-88.18.3177.4-72.2-74.6147.300113S50 P56S50-E54 WeakPolarHBondContact O-CB 3.32Å; S50-E54 VanDerWaalsContact O-CG 3.23Å; S50-E54 WeakPolarHBondContact O-CG 3.44Å; S50-E54 PolarHBondContact O-N 2.97Å; S50-E54 VanDerWaalsContact O-N 3.13Å; E54-P56 WeakPolarHBondContact O-CD 3.49Å
55A53.3Low65.4Low68 Ų68115.2 Ų115.256%0.56267%0.672SS**  trans-87.2101.8169.800000109.8S53 S57S53-A55 VanDerWaalsContact C-N 3.3Å; A55-S57 PolarHBondContact O-N 3.37Å
56P48.5Very low63.7Low113 Ų113116.1 Ų116.173%0.73468%0.682SS**  trans-65.2135.6158.329.5-31.4000107.6E54 G58E54-P56 WeakPolarHBondContact O-CD 3.49Å; P56-G58 PolarHBondContact O-N 3.23Å
57S53.7Low61.1Low136 Ų136118.9 Ų118.995%0.95169%0.694SS**SBendtrans-31.3109164.5-179.90000111.2A55A55-S57 PolarHBondContact O-N 3.37Å
58G40.6Very low58.5Low71 Ų71119.1 Ų119.173%0.73271%0.706SS**  trans-175.570.1-16900000113P56P56-G58 PolarHBondContact O-N 3.23Å
59G43.2Very low55.9Low70 Ų70121.3 Ų121.372%0.72273%0.726SS**  trans59.6113.9142.300000120.1
60L44.1Very low53.3Low167 Ų167123.3 Ų123.387%0.87474%0.74SS**  trans66.992143.6-50176.9000118.1
61S47.3Very low50.9Low128 Ų128126.2 Ų126.290%0.89576%0.76SS**  trans-100.983.7130.866.30000108.2
62A41.4Very low48.9Very low79 Ų79123 Ų12365%0.65376%0.763SS**  trans-72.2154.616600000110
63P57.3Low47.6Very low115 Ų115121.4 Ų121.475%0.74777%0.766SS**  trans-87.8164-168.737.5-33.9000112.7
64E47Very low46Very low177 Ų177123.3 Ų123.383%0.82777%0.773SS**  trans63.7124.2165.4-65.3-158.6126.900118.8
65E44.5Very low45.2Very low171 Ų171122.5 Ų122.580%0.79977%0.773SS**  -170.8143.590.8-96-162.6151.200112.5
66P58.3Low44.6Very low105 Ų105124.8 Ų124.868%0.68278%0.782SS**  trans-79.1119167.631.6-29.6000110.3D68P66-D68 PolarHBondContact O-N 2.87Å
67M43.7Very low44Very low172 Ų172126.6 Ų126.685%0.84778%0.781SS**  trans-88.993.4174.5-73.8-128.7-81.900111.1
68D40.4Very low43.4Very low157 Ų157124.7 Ų124.784%0.8477%0.765SS**  trans-99.497.6156.6-79.8-50.9000108.8P66 S70P66-D68 PolarHBondContact O-N 2.87Å; D68-S70 PolarHBondContact O-N 2.92Å; D68-S70 VanDerWaalsContact O-N 3.12Å
69T39.9Very low43.2Very low133 Ų133129.8 Ų129.882%0.81677%0.77SS**  trans-79.292.4169.9230000110.4
70S38.2Very low43.1Very low109 Ų109131.2 Ų131.276%0.76277%0.767SS**  trans24.9104.9135.6-171.10000117.7D68D68-S70 PolarHBondContact O-N 2.92Å; D68-S70 VanDerWaalsContact O-N 3.12Å
71S39.4Very low42.8Very low125 Ų125131.4 Ų131.487%0.87476%0.763SS**  trans-14597.3132.4-164.40000109.1
72S44Very low42.5Very low101 Ų101131.3 Ų131.371%0.70676%0.759SS**  trans-117.9154.6153.771.10000106.6
73P47.3Very low42.5Very low113 Ų113134.4 Ų134.473%0.73476%0.764SS**  -141.7152.481.536.8-18.8000110.5
74V32.2Very low41.3Very low130 Ų130133.8 Ų133.879%0.78876%0.763SS**  -177.6133.170.9164.20000105.8
75L45.8Very low40.5Very low132 Ų132132.1 Ų132.169%0.69176%0.759SS**  trans-113.6147.2162.8-167.181.6000107.5E77L75-E77 HydrophobicContact CD2-CB 3.75Å; L75-E77 HydrophobicContact CG-CB 4.16Å
76P39.9Very low39.9Very low116 Ų116134 Ų13475%0.75376%0.759SS**  -137.6118.6104.222.9-3.7000110.7
77E35.8Very low38.7Very low151 Ų151136.4 Ų136.471%0.70677%0.766SS**  53.8146.779.1-158.9154.8178.400115L75L75-E77 HydrophobicContact CD2-CB 3.75Å; L75-E77 HydrophobicContact CG-CB 4.16Å
78P42Very low38.2Very low96 Ų96132.7 Ų132.762%0.62376%0.757SS**  cis-132.2166.8-25.929.7-10.6000116.3
79Q35.5Very low38Very low178 Ų178131.1 Ų131.183%0.83276%0.759SS**  trans71.8163.4145.1-66.3-97.2-43.900120.8
80P41.6Very low37.6Very low101 Ų101132.7 Ų132.766%0.65676%0.757SS**  cis-127.1171.1-29.326.9-6.4000113.1
81E38.2Very low37.4Very low171 Ų171134.4 Ų134.480%0.79976%0.763SS**  trans-57154.2163.2-60.9-170.416800112
82P39.7Very low37.1Very low125 Ų125134 Ų13481%0.81276%0.755SS**  -130.5138.2129.433.9-22.8000112.6
83L41.2Very low36.5Very low144 Ų144134.9 Ų134.975%0.75476%0.756SS**  trans-58.9164.9163.3-67.8167.4000111.8
84S33.5Very low36.1Very low103 Ų103138.1 Ų138.172%0.7276%0.761SS**  trans87.1139.2147.255.80000120.2
85D28.7Very low36.4Very low141 Ų141140.7 Ų140.775%0.75477%0.765SS**  trans94.796.7153.8-59.8-25.9000119.6
86R32.7Very low36.1Very low212 Ų212140.1 Ų140.180%0.877%0.772SS**  69.2112.7108.8-173.9173.2151.4-163.9-5116.7
87N32.1Very low35.9Very low155 Ų155141 Ų14183%0.82977%0.77SS**  trans-154.3103.9136.1-101.45000107.6
88S33.4Very low36.1Very low94 Ų94139 Ų13966%0.65777%0.773SS**  55.896.296.6-84.70000113.4
89S35.9Very low36Very low124 Ų124143.3 Ų143.387%0.86778%0.782SS**  trans-108.611413549.20000106.5
90E32.7Very low36.4Very low166 Ų166141.5 Ų141.578%0.77678%0.783SS**  trans-68.7130.9175.3-66.9170.213200109.6
91T32.8Very low36.6Very low145 Ų145143.6 Ų143.689%0.8978%0.784SS**  trans-132.5103.9141.350.80000107.2
92V34.5Very low36.8Very low116 Ų116142.4 Ų142.470%0.70378%0.783SS**  trans-61.8162.1169.7175.10000110.1
93T31.2Very low36.8Very low119 Ų119144.7 Ų144.773%0.7378%0.776SS**  trans103.3109.8154.4-32.90000113.1
94E38.4Very low37.1Very low181 Ų181145.1 Ų145.185%0.84678%0.779SS**  cis-152164.5-1.2-63.1-153.113500109.7
95E39.6Very low37.5Very low184 Ų184148.8 Ų148.886%0.8678%0.783SS**  trans-62.2152.7168.2-72.6-159.5142.500114
96S38.9Very low38.1Very low121 Ų121147.8 Ų147.885%0.84678%0.777SS**  -157.4121.9120.8-167.70000111
97D34.9Very low38.8Very low133 Ų133141.8 Ų141.871%0.71177%0.765SS**  trans-50.9137.4167.9176.135.4000114.2
98S39.4Very low39.5Very low109 Ų109139.6 Ų139.676%0.76276%0.757SS**  179.8115.8126.3630000112.3
99K40.3Very low40.4Very low187 Ų187144 Ų14481%0.81377%0.767SS**  trans-42.2132.5159.7176.7-177-175.21780115
100V44.3Very low41.2Very low140 Ų140145 Ų14585%0.84876%0.758SS**  -166.2128.2129.4-100.10000110.8
101E45.4Very low42.5Very low145 Ų145147.1 Ų147.168%0.67877%0.765SS**  trans-62132.7165-62.7-79.9153.200110.2Y103E101-Y103 HydrophobicContact CB-CE1 4.09Å
102D43.2Very low43.7Very low146 Ų146147.2 Ų147.278%0.78176%0.755SS**  trans-145.6138.2146.8-16629.3000109.6
103Y39.1Very low44.9Very low173 Ų173148.8 Ų148.868%0.67876%0.759SS**  trans-98.4116.4-163.6-31.9-93.9000106.9E101E101-Y103 HydrophobicContact CB-CE1 4.09Å
104D47.7Very low46Very low153 Ų153150.8 Ų150.882%0.81877%0.765SS**  trans-133.193.2161.2-161.931.7000109.1D106D104-D106 PolarHBondContact O-N 3.37Å
105F41.5Very low47.1Very low181 Ų181146.7 Ų146.779%0.79476%0.756SS**  trans-78.1106.9163.1171.3-91.2000106.4
106D42.4Very low47.7Very low119 Ų119144.3 Ų144.364%0.63676%0.757SS**  trans-149.7109.2143.5-117.3-25.9000111.2D104D104-D106 PolarHBondContact O-N 3.37Å
107T47Very low48.3Very low87 Ų87142.5 Ų142.553%0.53475%0.749SS.*  63.9112.3126.852.30000120.7
108T46.1Very low49.4Very low109 Ų109147.5 Ų147.567%0.66976%0.758SS**  68.7103.712752.30000119.3
109E52.7Low50.3Low185 Ų185151.8 Ų151.886%0.86477%0.766SS**  66.7146.1111.2-65.2-179.5-165.500120.6
110E53.3Low51Low145 Ų145148.3 Ų148.368%0.67877%0.765SS**  trans90.165.7160.1-143.4-178.2167.300118.1E112E110-E112 HydrophobicContact CG-CB 3.81Å; E110-E112 PolarHBondContact O-N 3Å
111K59.8Low52Low212 Ų212152.4 Ų152.492%0.92277%0.766SS**THydrogen-bonded Turntrans-72.652.7155.8-75.4-163171.8179.30112.7
112E57.7Low52.5Low147 Ų147155.4 Ų155.469%0.68778%0.776SS**THydrogen-bonded Turntrans-88.2-17.4176.5-178.8163146.800113.4E110 L114E110-E112 HydrophobicContact CG-CB 3.81Å; E110-E112 PolarHBondContact O-N 3Å; E112-L114 PolarHBondContact O-N 3.44Å; E112-L114 VanDerWaalsContact O-N 3.1Å
113N60.4Low53.6Low148 Ų148159.7 Ų159.779%0.79178%0.781SS**  trans-92.247.7-171.8-71-74.1000115.2S115N113-S115 PolarHBondContact O-N 3.42Å; N113-S115 VanDerWaalsContact O-N 3.15Å
114L54.9Low54.7Low161 Ų161163.8 Ų163.884%0.84380%0.796SS**  trans-81.888.5162.7-68.2179.1000109.4E112E112-L114 PolarHBondContact O-N 3.44Å; E112-L114 VanDerWaalsContact O-N 3.1Å
115S60.1Low55.3Low95 Ų95159.7 Ų159.766%0.66479%0.79SS**  trans-42.9140.1173.560.20000112.8N113 A117N113-S115 PolarHBondContact O-N 3.42Å; N113-S115 VanDerWaalsContact O-N 3.15Å; S115-A117 PolarHBondContact O-N 3.25Å
116P51.7Low56.2Low134 Ų134160.7 Ų160.787%0.8779%0.794SS**  trans-59.9101.9169.4-24.134.5000110.7R118P116-R118 PolarHBondContact O-N 3.04Å; P116-R118 VanDerWaalsContact O-N 3.15Å
117A52.5Low56.9Low83 Ų83159.7 Ų159.769%0.68680%0.802SS**  trans-58.7116.7174.700000109.9S115S115-A117 PolarHBondContact O-N 3.25Å
118R58Low57.3Low238 Ų238161.3 Ų161.390%0.89882%0.817SS**  trans43.593.8148.4-62.5-176.6164.1-161.4-3.6116.7P116P116-R118 PolarHBondContact O-N 3.04Å; P116-R118 VanDerWaalsContact O-N 3.15Å
119Q59.1Low57.9Low199 Ų199160.5 Ų160.593%0.9382%0.821SS**  trans-111.393.6150.3-63.6-166.86.100110.3R121Q119-R121 PolarHBondContact O-N 2.95Å
120S54.8Low58.2Low115 Ų115155.6 Ų155.680%0.80481%0.812SS**  trans-62.5119167.5-177.10000110.5
121R64.8Low58.6Low226 Ų226153.6 Ų153.685%0.85381%0.812SS**  trans-164.6109.9131.7-159.7163.2-77.8171.5-4.9111.6Q119 R123Q119-R121 PolarHBondContact O-N 2.95Å; R121-R123 PolarHBondContact O-N 3.01Å
122K55Low58.9Low207 Ų207150.6 Ų150.690%0.981%0.806SS**  trans-56.6115.1167.5-68.5172177.1175.90109.8
123R66.4Low59Low236 Ų236152.2 Ų152.289%0.89181%0.811SS**  trans-110.199.9154.6-75.2-174.869.5-157.60.7108R121 G125R121-R123 PolarHBondContact O-N 3.01Å; R123-G125 PolarHBondContact O-N 3.48Å
124R62Low59.2Low259 Ų259151.9 Ų151.998%0.97781%0.808SS**  trans-74.2107.2166.2-174.7176.9-166.8-129.92.4107.5
125G60.8Low59.3Low67 Ų67149.6 Ų149.669%0.69180%0.803SS**  trans-151.776.3-179.400000112.1R123R123-G125 PolarHBondContact O-N 3.48Å
126K60.2Low59.3Low203 Ų203150.9 Ų150.988%0.88381%0.812SS**  trans33.4112.6146.8-61.7166.4179.5177.40118.6
127A57.6Low59.6Low97 Ų97153.5 Ų153.580%0.80281%0.81SS**  trans33.3114.4143.900000119.5A129A127-A129 PolarHBondContact O-N 3.46Å
128S56.3Low59.8Low122 Ų122160.9 Ų160.985%0.85382%0.82SS**  22.782.9129.1-1760000116.5
129A58.5Low59.7Low92 Ų92153.5 Ų153.576%0.7681%0.809SS**  trans-97.2114.6139.800000105.3A127A127-A129 PolarHBondContact O-N 3.46Å
130A58.8Low59.6Low81 Ų81154 Ų15467%0.66980%0.803SS**  trans-48.7132.9173.700000108.5D132A130-D132 PolarHBondContact O-N 2.99Å
131P60.3Low59.4Low103 Ų103155.5 Ų155.567%0.66980%0.801SS**  trans-63.5117.718028.3-33.7000107.5F133P131-F133 HydrophobicContact CB-CD2 3.88Å; P131-F133 HydrophobicContact CB-CE2 4.13Å; P131-F133 PolarHBondContact O-N 3.07Å
132D66.9Low58.9Low149 Ų149149.4 Ų149.480%0.79778%0.782SS**  trans-75.464.2-172-157.311.8000110.6A130A130-D132 PolarHBondContact O-N 2.99Å
133F59.9Low58.8Low182 Ų182145.2 Ų145.280%0.79878%0.776SS**  trans-10635.4172.7-69.5-74.5000111P131P131-F133 HydrophobicContact CB-CD2 3.88Å; P131-F133 HydrophobicContact CB-CE2 4.13Å; P131-F133 PolarHBondContact O-N 3.07Å
134L63.9Low58.2Low141 Ų141136.2 Ų136.274%0.73876%0.757SS**SBendtrans-94.7117.1163.6-67.7176.6000107.1S136L134-S136 PolarHBondContact O-N 2.74Å
135P58.7Low57.8Low113 Ų113129.2 Ų129.273%0.73474%0.736SS**  trans-54.5115.3167.9-17.728.9000106.8K137P135-K137 PolarHBondContact O-N 3.47Å
136S58.4Low57.5Low121 Ų121132.5 Ų132.585%0.84673%0.733SS**  trans-72.654-17963.90000110.8L134 R138L134-S136 PolarHBondContact O-N 2.74Å; S136-R138 VanDerWaalsContact C-N 3.27Å; S136-R138 PolarHBondContact O-N 3.22Å; S136-R138 VanDerWaalsContact O-N 3.08Å
137K59.4Low57.2Low189 Ų189131.7 Ų131.782%0.82272%0.724SS**  trans-82.277.4170.3-82-167.9175.6-176.80108.6P135 A139P135-K137 PolarHBondContact O-N 3.47Å; K137-A139 PolarHBondContact O-N 3.24Å
138R55.2Low56.9Low239 Ų239135.1 Ų135.190%0.90272%0.721SS**  trans-79.182147.4-61.8-171-158.7-151.65.9106.7S136 R140S136-R138 VanDerWaalsContact C-N 3.27Å; S136-R138 PolarHBondContact O-N 3.22Å; S136-R138 VanDerWaalsContact O-N 3.08Å; R138-R140 PolarHBondContact O-N 3.02Å
139A56.4Low57Low82 Ų82137.2 Ų137.268%0.67871%0.71SS**  trans-73.288.3159.800000106.3K137 L141K137-A139 PolarHBondContact O-N 3.24Å; A139-L141 PolarHBondContact O-N 3.29Å
140R57.6Low57Low209 Ų209138.6 Ų138.679%0.78970%0.701SS**  trans-70.888169.7-170.6178.4172.4165.73.6106.6R138 E142R138-R140 PolarHBondContact O-N 3.02Å; R140-E142 IonicContact CZ-OE1 3.41Å; R140-E142 IonicContact NE-OE1 2.79Å; R140-E142 PolarHBondContact NE-OE1 2.94Å; R140-E142 IonicContact NH2-OE1 3.34Å; R140-E142 PolarHBondContact NH2-OE1 3.37Å; R140-E142 PolarHBondContact O-N 3.42Å
141L49.5Very low56.8Low147 Ų147139.8 Ų139.877%0.7770%0.696SS**  trans-74.8103.6167.6-82.4166.8000107.1A139A139-L141 PolarHBondContact O-N 3.29Å
142E55.8Low56.9Low99 Ų99137.4 Ų137.446%0.46368%0.682SS.*  trans-64.3129.3166.4-70.2-68.9142.700108.4R140 G144R140-E142 IonicContact CZ-OE1 3.41Å; R140-E142 IonicContact NE-OE1 2.79Å; R140-E142 PolarHBondContact NE-OE1 2.94Å; R140-E142 IonicContact NH2-OE1 3.34Å; R140-E142 PolarHBondContact NH2-OE1 3.37Å; R140-E142 PolarHBondContact O-N 3.42Å; E142-G144 PolarHBondContact O-N 3.43Å
143P52.7Low56.6Low118 Ų118135.6 Ų135.677%0.76667%0.672SS**THydrogen-bonded Turntrans-63.711.1-176.9-22.332.7000116.4
144G52.8Low56.8Low48 Ų48132.4 Ų132.450%0.49566%0.662SS.*THydrogen-bonded Turntrans-102-18.7-174.600000115.7E142E142-G144 PolarHBondContact O-N 3.43Å
145E55.2Low56.9Low112 Ų112131.3 Ų131.352%0.52366%0.657SS.*SBendtrans-92.1-15.9-172.6-69.2-174.1141.100114.2R147 K148 R149E145-R147 PolarHBondContact O-N 2.87Å; E145-K148 PolarHBondContact O-N 3.48Å; E145-R149 PolarHBondContact O-N 3.17Å
146E53.6Low57.1Low136 Ų136131.3 Ų131.364%0.63665%0.651SS**Hα-helixtrans-68.1-35.8-174.4-154.3167-150.800112.3K148 R149 Q150E146-K148 PolarHBondContact O-N 2.99Å; E146-R149 PolarHBondContact O-N 3.42Å; E146-Q150 WeakPolarHBondContact O-CB 3.31Å; E146-Q150 WeakPolarHBondContact O-CG 3.42Å; E146-Q150 PolarHBondContact O-N 3.15Å
147R54.6Low56.8Low185 Ų185130.7 Ų130.770%0.69865%0.645SS**Hα-helixtrans-66.5-34.6175.1-93-175.2-79.4151.5-5.1113.1E145 N151E145-R147 PolarHBondContact O-N 2.87Å; R147-N151 WeakPolarHBondContact O-CB 3.47Å; R147-N151 PolarHBondContact O-N 3.46Å; R147-N151 PolarHBondContact O-ND2 2.98Å
148K51.3Low56.9Low170 Ų170128.3 Ų128.374%0.73964%0.64SS**Hα-helixtrans-73.8-37.5-179.8-69.8-177.2-179.5178.60111.5E145 E146 S152E145-K148 PolarHBondContact O-N 3.48Å; E146-K148 PolarHBondContact O-N 2.99Å; K148-S152 PolarHBondContact O-N 2.96Å
149R57.8Low56.6Low166 Ų166128.3 Ų128.363%0.62665%0.647SS**Hα-helixtrans-74.2-36.4177.7-64.5-166.8-174.6-165.23.8113.2E145 E146 S152 L153E145-R149 PolarHBondContact O-N 3.17Å; E146-R149 PolarHBondContact O-N 3.42Å; R149-S152 PolarHBondContact O-N 3.1Å; R149-S152 PolarHBondContact O-OG 2.98Å; R149-S152 VanDerWaalsContact O-OG 3.07Å; R149-L153 WeakPolarHBondContact O-CB 3.25Å; R149-L153 WeakPolarHBondContact O-CG 3.3Å; R149-L153 PolarHBondContact O-N 3.42Å
150Q57.7Low56.6Low120 Ų120130.7 Ų130.756%0.56165%0.645SS**Hα-helixtrans-65.8-41174-77.4175.9-7.300111.7E146 L154E146-Q150 WeakPolarHBondContact O-CB 3.31Å; E146-Q150 WeakPolarHBondContact O-CG 3.42Å; E146-Q150 PolarHBondContact O-N 3.15Å; Q150-L154 VanDerWaalsContact O-CB 3.22Å; Q150-L154 WeakPolarHBondContact O-CB 3.37Å; Q150-L154 PolarHBondContact O-N 3.41Å
151N55.7Low56.6Low107 Ų107126.5 Ų126.557%0.57264%0.638SS**Hα-helixtrans-70-34.7176.7-75.1-57.7000112.8R147 L155R147-N151 WeakPolarHBondContact O-CB 3.47Å; R147-N151 PolarHBondContact O-N 3.46Å; R147-N151 PolarHBondContact O-ND2 2.98Å; N151-L155 WeakPolarHBondContact O-CB 3.36Å; N151-L155 PolarHBondContact O-N 3.19Å; N151-L155 VanDerWaalsContact O-N 3.1Å
152S61.8Low57Low53 Ų53125.4 Ų125.437%0.37163%0.631SS.*Hα-helixtrans-68.5-45.4175.272.50000111.6K148 R149 L154 L155 D156K148-S152 PolarHBondContact O-N 2.96Å; R149-S152 PolarHBondContact O-N 3.1Å; R149-S152 PolarHBondContact O-OG 2.98Å; R149-S152 VanDerWaalsContact O-OG 3.07Å; S152-L154 VanDerWaalsContact C-N 3.31Å; S152-L154 PolarHBondContact O-N 2.98Å; S152-L155 PolarHBondContact O-N 3.29Å; S152-D156 WeakPolarHBondContact O-CB 3.22Å; S152-D156 PolarHBondContact O-N 3.27Å
153L60.8Low57Low111 Ų111126.9 Ų126.958%0.58164%0.64SS**Hα-helixtrans-66.4-33.8178.9-68.8171.5000112.2R149 C157R149-L153 WeakPolarHBondContact O-CB 3.25Å; R149-L153 WeakPolarHBondContact O-CG 3.3Å; R149-L153 PolarHBondContact O-N 3.42Å; L153-C157 PolarHBondContact O-N 2.96Å; L153-C157 VanDerWaalsContact O-N 3.15Å; L153-C157 PolarHBondContact O-SG 3.42Å
154L65.1Low57.3Low114 Ų114127.5 Ų127.560%0.59763%0.633SS**Hα-helixtrans-72.2-31.8176.2-163.5142.2000112.2Q150 S152Q150-L154 VanDerWaalsContact O-CB 3.22Å; Q150-L154 WeakPolarHBondContact O-CB 3.37Å; Q150-L154 PolarHBondContact O-N 3.41Å; S152-L154 VanDerWaalsContact C-N 3.31Å; S152-L154 PolarHBondContact O-N 2.98Å
155L65.6Low57.6Low119 Ų119132.8 Ų132.862%0.62364%0.642SS**Hα-helixtrans-76.7-32.2175.4-161.667.6000112.5N151 S152 L158N151-L155 WeakPolarHBondContact O-CB 3.36Å; N151-L155 PolarHBondContact O-N 3.19Å; N151-L155 VanDerWaalsContact O-N 3.1Å; S152-L155 PolarHBondContact O-N 3.29Å; L155-L158 PolarHBondContact O-N 3.35Å
156D62.6Low57.8Low113 Ų113134.3 Ų134.360%0.60465%0.65SS**Hα-helixtrans-74.2-25.6175.6-72.4-21.7000112.6S152 L158S152-D156 WeakPolarHBondContact O-CB 3.22Å; S152-D156 PolarHBondContact O-N 3.27Å; D156-L158 VanDerWaalsContact C-N 3.33Å
157C52.5Low58.1Low108 Ų108134.2 Ų134.273%0.7365%0.651SS**THydrogen-bonded Turntrans-82.1-5.3173-74.70000114.5L153L153-C157 PolarHBondContact O-N 2.96Å; L153-C157 VanDerWaalsContact O-N 3.15Å; L153-C157 PolarHBondContact O-SG 3.42Å
158L60.6Low58.4Low138 Ų138129.9 Ų129.972%0.72365%0.648SS**THydrogen-bonded Turntrans-105.410.8-179.5-108.588.7000114.1L155 D156L155-L158 PolarHBondContact O-N 3.35Å; D156-L158 VanDerWaalsContact C-N 3.33Å
159K49.4Very low59Low240 Ų240126.3 Ų126.3100%1.04364%0.639SS**  trans-111.20166.5-83.1174.8177.3158.40110.1

Retrieved 159 of 159 residues in 247.4 ms (Link to these results)