A0A5K4F355_SCHMA Loading...

Kinetochore protein SPC25

AlphaFold DB , UniProt , Accession A0A5K4F355, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 187 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
1M76.6Confident92.8Very high198 Ų198132.5 Ų132.598%0.97564%0.638SS**  0-54.80-161.3177.1-79.100112.7Q3 V4 V5M1-Q3 PolarHBondContact O-N 3.29Å; M1-V4 PolarHBondContact O-N 3.15Å; M1-V4 VanDerWaalsContact O-N 3.15Å; M1-V5 PolarHBondContact O-N 3.3Å
2F91.6Very high93.1Very high191 Ų191137.4 Ų137.484%0.83865%0.645SS**Hα-helixtrans-53.9-43.7-178-74.3-76.8000115.7V4 V5 S6F2-V4 VanDerWaalsContact C-N 3.3Å; F2-V4 PolarHBondContact O-N 3.43Å; F2-V5 PolarHBondContact O-N 3.44Å; F2-S6 PolarHBondContact O-N 3.38Å
3Q91.9Very high93.3Very high153 Ų153132.4 Ų132.472%0.71563%0.629SS**Hα-helixtrans-60.5-38.1178.8-75.7-173.40.400113.1M1 S6 K7M1-Q3 PolarHBondContact O-N 3.29Å; Q3-S6 PolarHBondContact O-N 3Å; Q3-K7 WeakPolarHBondContact O-CG 3.44Å; Q3-K7 PolarHBondContact O-N 3.34Å
4V94.3Very high93.5Very high92 Ų92132.1 Ų132.156%0.55862%0.624SS**Hα-helixtrans-67.1-45.6179178.20000110M1 F2 S6 K7 L8M1-V4 PolarHBondContact O-N 3.15Å; M1-V4 VanDerWaalsContact O-N 3.15Å; F2-V4 VanDerWaalsContact C-N 3.3Å; F2-V4 PolarHBondContact O-N 3.43Å; V4-S6 VanDerWaalsContact C-N 3.32Å; V4-S6 PolarHBondContact O-N 3.31Å; V4-K7 PolarHBondContact O-N 2.94Å; V4-L8 HydrophobicContact CG1-CD1 4.03Å; V4-L8 HydrophobicContact CG1-CG 4.48Å; V4-L8 WeakPolarHBondContact O-CB 3.47Å; V4-L8 WeakPolarHBondContact O-CG 3.42Å; V4-L8 PolarHBondContact O-N 3.03Å
5V95.2Very high93.5Very high72 Ų72129.5 Ų129.544%0.43662%0.615SS.*Hα-helixtrans-61-41.9176.7177.80000111.1M1 F2 L8 R9M1-V5 PolarHBondContact O-N 3.3Å; F2-V5 PolarHBondContact O-N 3.44Å; V5-L8 PolarHBondContact O-N 2.92Å; V5-R9 WeakPolarHBondContact O-CB 3.43Å; V5-R9 PolarHBondContact O-N 2.91Å
6S94.4Very high93.5Very high75 Ų75126.5 Ų126.552%0.52461%0.608SS.*Hα-helixtrans-62.1-47.5176.7-167.60000112F2 Q3 V4 L8 R9 E10F2-S6 PolarHBondContact O-N 3.38Å; Q3-S6 PolarHBondContact O-N 3Å; V4-S6 VanDerWaalsContact C-N 3.32Å; V4-S6 PolarHBondContact O-N 3.31Å; S6-L8 VanDerWaalsContact C-N 3.34Å; S6-L8 PolarHBondContact O-N 2.93Å; S6-R9 PolarHBondContact O-N 2.94Å; S6-E10 PolarHBondContact O-N 3.28Å
7K95.5Very high93.6Very high135 Ų135124.7 Ų124.759%0.58760%0.602SS**Hα-helixtrans-62.2-39.7176.8-74.7-179.1179.1-179.10112.3Q3 V4 E10 K11Q3-K7 WeakPolarHBondContact O-CG 3.44Å; Q3-K7 PolarHBondContact O-N 3.34Å; V4-K7 PolarHBondContact O-N 2.94Å; K7-E10 PolarHBondContact O-N 3.25Å; K7-K11 WeakPolarHBondContact O-CB 3.41Å; K7-K11 WeakPolarHBondContact O-CG 3.44Å; K7-K11 PolarHBondContact O-N 2.96Å
8L95.3Very high93.6Very high111 Ų111121.1 Ų121.158%0.58159%0.592SS**Hα-helixtrans-65.5-42.1175.9-74.9171.4000111.8V4 V5 S6 K11 R12V4-L8 HydrophobicContact CG1-CD1 4.03Å; V4-L8 HydrophobicContact CG1-CG 4.48Å; V4-L8 WeakPolarHBondContact O-CB 3.47Å; V4-L8 WeakPolarHBondContact O-CG 3.42Å; V4-L8 PolarHBondContact O-N 3.03Å; V5-L8 PolarHBondContact O-N 2.92Å; S6-L8 VanDerWaalsContact C-N 3.34Å; S6-L8 PolarHBondContact O-N 2.93Å; L8-K11 PolarHBondContact O-N 3.27Å; L8-R12 WeakPolarHBondContact O-CB 3.36Å; L8-R12 PolarHBondContact O-N 3.26Å
9R95.1Very high93.5Very high178 Ų178122.9 Ų122.967%0.67259%0.593SS**Hα-helixtrans-62-45.9175.6-171-178.1-69171.6-3.1111.1V5 S6 R12 T13V5-R9 WeakPolarHBondContact O-CB 3.43Å; V5-R9 PolarHBondContact O-N 2.91Å; S6-R9 PolarHBondContact O-N 2.94Å; R9-R12 PolarHBondContact O-N 3.43Å; R9-T13 PolarHBondContact O-N 3.44Å; R9-T13 PolarHBondContact O-OG1 2.92Å
10E95.3Very high93.4Very high99 Ų99124.4 Ų124.446%0.46360%0.596SS.*Hα-helixtrans-61.5-46.4177.1-169.5-170.816500112S6 K7 R12 T13 K14S6-E10 PolarHBondContact O-N 3.28Å; K7-E10 PolarHBondContact O-N 3.25Å; E10-R12 VanDerWaalsContact C-N 3.32Å; E10-R12 PolarHBondContact O-N 2.93Å; E10-T13 PolarHBondContact O-N 3.49Å; E10-K14 HydrophobicContact CG-CD 4.45Å; E10-K14 WeakPolarHBondContact O-CG 3.47Å; E10-K14 PolarHBondContact O-N 3.42Å; E10-K14 WeakPolarHBondContact OE1-CE 3.49Å; E10-K14 IonicContact OE1-NZ 2.66Å; E10-K14 PolarHBondContact OE1-NZ 3.49Å
11K96.1Very high93.3Very high154 Ų154124.4 Ų124.467%0.6760%0.599SS**Hα-helixtrans-58-44.2174.8-79.8-174.1177.9-173.30111.8K7 L8 K14 L15K7-K11 WeakPolarHBondContact O-CB 3.41Å; K7-K11 WeakPolarHBondContact O-CG 3.44Å; K7-K11 PolarHBondContact O-N 2.96Å; L8-K11 PolarHBondContact O-N 3.27Å; K11-K14 PolarHBondContact O-N 2.66Å; K11-L15 WeakPolarHBondContact O-CB 3.36Å; K11-L15 PolarHBondContact O-N 2.94Å
12R96.4Very high93.9Very high191 Ų191118.5 Ų118.572%0.72157%0.571SS**Hα-helixtrans-61.2-46.2176.7-176.3179.4177.8179.5-0.5111.4L8 R9 E10 L15 V16L8-R12 WeakPolarHBondContact O-CB 3.36Å; L8-R12 PolarHBondContact O-N 3.26Å; R9-R12 PolarHBondContact O-N 3.43Å; E10-R12 VanDerWaalsContact C-N 3.32Å; E10-R12 PolarHBondContact O-N 2.93Å; R12-L15 PolarHBondContact O-N 2.96Å; R12-V16 HydrophobicContact CG-CG2 4.43Å; R12-V16 WeakPolarHBondContact O-CG2 3.39Å; R12-V16 PolarHBondContact O-N 3.41Å
13T95.1Very high93.8Very high72 Ų72112.5 Ų112.544%0.44255%0.553SS.*Hα-helixtrans-63-43.6178.9-54.40000111.6R9 E10 L15 V16 N17R9-T13 PolarHBondContact O-N 3.44Å; R9-T13 PolarHBondContact O-OG1 2.92Å; E10-T13 PolarHBondContact O-N 3.49Å; T13-L15 VanDerWaalsContact C-N 3.33Å; T13-L15 PolarHBondContact O-N 3.36Å; T13-V16 PolarHBondContact O-N 2.92Å; T13-N17 WeakPolarHBondContact O-CB 3.13Å; T13-N17 VanDerWaalsContact O-CG 3.24Å; T13-N17 PolarHBondContact O-N 2.95Å
14K95.4Very high93.8Very high128 Ų128109.2 Ų109.256%0.55754%0.543SS*.Hα-helixtrans-60.1-43.4175.2-73.2179-177.3172.80111.8E10 K11 N17 S18E10-K14 HydrophobicContact CG-CD 4.45Å; E10-K14 WeakPolarHBondContact O-CG 3.47Å; E10-K14 PolarHBondContact O-N 3.42Å; E10-K14 WeakPolarHBondContact OE1-CE 3.49Å; E10-K14 IonicContact OE1-NZ 2.66Å; E10-K14 PolarHBondContact OE1-NZ 3.49Å; K11-K14 PolarHBondContact O-N 2.66Å; K14-N17 PolarHBondContact O-N 3.42Å; K14-S18 WeakPolarHBondContact O-CB 3.32Å; K14-S18 PolarHBondContact O-N 3.44Å
15L94.1Very high93.5Very high93 Ų93113.6 Ų113.649%0.48755%0.55SS.*Hα-helixtrans-63.2-49.4178.4-173.668000111.5K11 R12 T13 N17 S18 Y19K11-L15 WeakPolarHBondContact O-CB 3.36Å; K11-L15 PolarHBondContact O-N 2.94Å; R12-L15 PolarHBondContact O-N 2.96Å; T13-L15 VanDerWaalsContact C-N 3.33Å; T13-L15 PolarHBondContact O-N 3.36Å; L15-N17 VanDerWaalsContact C-N 3.35Å; L15-N17 PolarHBondContact O-N 2.94Å; L15-S18 WeakPolarHBondContact O-CB 3.36Å; L15-S18 PolarHBondContact O-N 3.49Å; L15-Y19 HydrophobicContact CD1-CD2 4.08Å; L15-Y19 HydrophobicContact CD1-CE2 3.46Å; L15-Y19 VanDerWaalsContact CD1-CE2 3.46Å; L15-Y19 HydrophobicContact CD2-CE2 4.06Å; L15-Y19 HydrophobicContact CG-CD2 3.86Å; L15-Y19 HydrophobicContact CG-CE2 3.5Å; L15-Y19 VanDerWaalsContact CG-CE2 3.5Å; L15-Y19 WeakPolarHBondContact O-CD2 3.39Å; L15-Y19 PolarHBondContact O-N 3.37Å
16V94.2Very high93.2Very high82 Ų82114.6 Ų114.650%0.49755%0.553SS.*Hα-helixtrans-60.3-44178.2171.40000111.4R12 T13 S18 Y19 K20R12-V16 HydrophobicContact CG-CG2 4.43Å; R12-V16 WeakPolarHBondContact O-CG2 3.39Å; R12-V16 PolarHBondContact O-N 3.41Å; T13-V16 PolarHBondContact O-N 2.92Å; V16-S18 VanDerWaalsContact C-N 3.35Å; V16-S18 PolarHBondContact O-N 3.44Å; V16-Y19 PolarHBondContact O-N 3.28Å; V16-K20 WeakPolarHBondContact O-CB 3.37Å; V16-K20 PolarHBondContact O-N 2.96Å
17N94.7Very high93Very high96 Ų96116.4 Ų116.451%0.51355%0.553SS.*Hα-helixtrans-64.3-40.1177.8-72.5-10.7000112T13 K14 L15 K20 L21T13-N17 WeakPolarHBondContact O-CB 3.13Å; T13-N17 VanDerWaalsContact O-CG 3.24Å; T13-N17 PolarHBondContact O-N 2.95Å; K14-N17 PolarHBondContact O-N 3.42Å; L15-N17 VanDerWaalsContact C-N 3.35Å; L15-N17 PolarHBondContact O-N 2.94Å; N17-K20 PolarHBondContact O-N 3.24Å; N17-L21 WeakPolarHBondContact O-CB 3.44Å; N17-L21 PolarHBondContact O-N 3.46Å
18S93Very high92.7Very high59 Ų59116.5 Ų116.541%0.41356%0.555SS.*Hα-helixtrans-60.7-47.6175.2-177.50000111.6K14 L15 V16 K20 L21 N22K14-S18 WeakPolarHBondContact O-CB 3.32Å; K14-S18 PolarHBondContact O-N 3.44Å; L15-S18 WeakPolarHBondContact O-CB 3.36Å; L15-S18 PolarHBondContact O-N 3.49Å; V16-S18 VanDerWaalsContact C-N 3.35Å; V16-S18 PolarHBondContact O-N 3.44Å; S18-K20 PolarHBondContact O-N 3.13Å; S18-L21 PolarHBondContact O-N 3.03Å; S18-N22 WeakPolarHBondContact O-CB 3.16Å; S18-N22 VanDerWaalsContact O-CG 3.28Å; S18-N22 PolarHBondContact O-N 2.98Å; S18-N22 PolarHBondContact O-ND2 3.37Å
19Y91.8Very high92.5Very high157 Ų157115.9 Ų115.962%0.61655%0.552SS**Hα-helixtrans-60.9-44175.9-78.8-66.1000112.5L15 V16 N22 S23L15-Y19 HydrophobicContact CD1-CD2 4.08Å; L15-Y19 HydrophobicContact CD1-CE2 3.46Å; L15-Y19 VanDerWaalsContact CD1-CE2 3.46Å; L15-Y19 HydrophobicContact CD2-CE2 4.06Å; L15-Y19 HydrophobicContact CG-CD2 3.86Å; L15-Y19 HydrophobicContact CG-CE2 3.5Å; L15-Y19 VanDerWaalsContact CG-CE2 3.5Å; L15-Y19 WeakPolarHBondContact O-CD2 3.39Å; L15-Y19 PolarHBondContact O-N 3.37Å; V16-Y19 PolarHBondContact O-N 3.28Å; Y19-N22 PolarHBondContact O-N 2.9Å; Y19-S23 WeakPolarHBondContact O-CB 3.46Å; Y19-S23 PolarHBondContact O-N 3Å
20K92Very high92.3Very high151 Ų151113.7 Ų113.766%0.65755%0.547SS*.Hα-helixtrans-62-46178.6-170.2174.1-178.9179.30111.6V16 N17 S18 N22 S23 T24V16-K20 WeakPolarHBondContact O-CB 3.37Å; V16-K20 PolarHBondContact O-N 2.96Å; N17-K20 PolarHBondContact O-N 3.24Å; S18-K20 PolarHBondContact O-N 3.13Å; K20-N22 PolarHBondContact O-N 2.96Å; K20-S23 WeakPolarHBondContact O-CB 3.42Å; K20-S23 PolarHBondContact O-N 3.46Å; K20-T24 PolarHBondContact O-N 3.38Å; K20-T24 PolarHBondContact O-OG1 3.01Å; K20-T24 VanDerWaalsContact O-OG1 3.13Å
21L91.2Very high92.1Very high125 Ų125113.6 Ų113.665%0.65455%0.55SS*.Hα-helixtrans-61.2-43.9177.7-165.4102.1000111.7N17 S18 T24 R25N17-L21 WeakPolarHBondContact O-CB 3.44Å; N17-L21 PolarHBondContact O-N 3.46Å; S18-L21 PolarHBondContact O-N 3.03Å; L21-T24 PolarHBondContact O-N 3.3Å; L21-R25 WeakPolarHBondContact O-CB 3.43Å; L21-R25 PolarHBondContact O-N 3.48Å
22N89.5Confident92Very high75 Ų75108.9 Ų108.940%0.40154%0.537SS..Hα-helixtrans-65.4-39.7177.7-72.6-24.5000111.9S18 Y19 K20 R25 N26S18-N22 WeakPolarHBondContact O-CB 3.16Å; S18-N22 VanDerWaalsContact O-CG 3.28Å; S18-N22 PolarHBondContact O-N 2.98Å; S18-N22 PolarHBondContact O-ND2 3.37Å; Y19-N22 PolarHBondContact O-N 2.9Å; K20-N22 PolarHBondContact O-N 2.96Å; N22-R25 PolarHBondContact O-N 3.4Å; N22-N26 WeakPolarHBondContact O-CB 3.5Å; N22-N26 VanDerWaalsContact O-CG 3.26Å; N22-N26 PolarHBondContact O-N 3.21Å; N22-N26 PolarHBondContact O-ND2 3.27Å
23S89.4Confident91.8Very high65 Ų65104.9 Ų104.946%0.45553%0.526SS..Hα-helixtrans-59.9-52.1175.4-163.10000111.2Y19 K20 R25 N26 E27Y19-S23 WeakPolarHBondContact O-CB 3.46Å; Y19-S23 PolarHBondContact O-N 3Å; K20-S23 WeakPolarHBondContact O-CB 3.42Å; K20-S23 PolarHBondContact O-N 3.46Å; S23-R25 VanDerWaalsContact C-N 3.33Å; S23-R25 PolarHBondContact O-N 3.44Å; S23-N26 PolarHBondContact O-N 2.98Å; S23-E27 PolarHBondContact O-N 3.38Å
24T90.9Very high91.7Very high83 Ų83105.2 Ų105.251%0.50952%0.524SS..Hα-helixtrans-61.9-39.7179.4-55.50000112K20 L21 E27 H28K20-T24 PolarHBondContact O-N 3.38Å; K20-T24 PolarHBondContact O-OG1 3.01Å; K20-T24 VanDerWaalsContact O-OG1 3.13Å; L21-T24 PolarHBondContact O-N 3.3Å; T24-E27 PolarHBondContact O-N 2.97Å; T24-H28 PolarHBondContact O-N 3.03Å
25R88.3Confident91.6Very high185 Ų185103 Ų10370%0.69852%0.517SS*.Hα-helixtrans-63.7-42176.4-174.8-179.4173.7105.3-0.1111.9L21 N22 S23 H28 L29L21-R25 WeakPolarHBondContact O-CB 3.43Å; L21-R25 PolarHBondContact O-N 3.48Å; N22-R25 PolarHBondContact O-N 3.4Å; S23-R25 VanDerWaalsContact C-N 3.33Å; S23-R25 PolarHBondContact O-N 3.44Å; R25-H28 PolarHBondContact O-N 3.4Å; R25-L29 WeakPolarHBondContact O-CB 3.49Å; R25-L29 PolarHBondContact O-N 3.02Å
26N89.3Confident91.6Very high92 Ų92102.1 Ų102.149%0.49251%0.511SS..Hα-helixtrans-66.1-40.4178.6-75.8-18.9000112N22 S23 L29 K30N22-N26 WeakPolarHBondContact O-CB 3.5Å; N22-N26 VanDerWaalsContact O-CG 3.26Å; N22-N26 PolarHBondContact O-N 3.21Å; N22-N26 PolarHBondContact O-ND2 3.27Å; S23-N26 PolarHBondContact O-N 2.98Å; N26-L29 PolarHBondContact O-N 3.39Å; N26-K30 WeakPolarHBondContact O-CG 3.26Å; N26-K30 PolarHBondContact O-N 3.44Å
27E90Very high91.4Very high113 Ų113103.5 Ų103.553%0.52851%0.512SS..Hα-helixtrans-62.4-45.7173.9-73.2179.1174.100111.7S23 T24 L29 K30 N31S23-E27 PolarHBondContact O-N 3.38Å; T24-E27 PolarHBondContact O-N 2.97Å; E27-L29 VanDerWaalsContact C-N 3.32Å; E27-L29 PolarHBondContact O-N 3.3Å; E27-K30 PolarHBondContact O-N 3.4Å; E27-N31 WeakPolarHBondContact O-CB 3.38Å; E27-N31 PolarHBondContact O-N 2.89Å
28H90.3Very high91.2Very high137 Ų137104 Ų10463%0.63451%0.511SS*.Hα-helixtrans-60.8-41.2176.8-174.7-82.1000112.1T24 R25 N31 S32T24-H28 PolarHBondContact O-N 3.03Å; R25-H28 PolarHBondContact O-N 3.4Å; H28-N31 PolarHBondContact O-N 3.02Å; H28-S32 WeakPolarHBondContact O-CB 3.38Å; H28-S32 PolarHBondContact O-N 2.94Å
29L90Very high91.3Very high98 Ų98106.2 Ų106.251%0.51351%0.514SS..Hα-helixtrans-63.6-45.4177.6-168.574.7000111.6R25 N26 E27 S32 Q33R25-L29 WeakPolarHBondContact O-CB 3.49Å; R25-L29 PolarHBondContact O-N 3.02Å; N26-L29 PolarHBondContact O-N 3.39Å; E27-L29 VanDerWaalsContact C-N 3.32Å; E27-L29 PolarHBondContact O-N 3.3Å; L29-S32 PolarHBondContact O-N 2.96Å; L29-Q33 WeakPolarHBondContact O-CG 3.44Å; L29-Q33 PolarHBondContact O-N 2.95Å
30K91Very high91.4Very high132 Ų132105.4 Ų105.457%0.57451%0.509SS*.Hα-helixtrans-61.4-46.4176.1-73.5178.2-178.7-176.40111.5N26 E27 S32 Q33 I34N26-K30 WeakPolarHBondContact O-CG 3.26Å; N26-K30 PolarHBondContact O-N 3.44Å; E27-K30 PolarHBondContact O-N 3.4Å; K30-S32 VanDerWaalsContact C-N 3.32Å; K30-S32 PolarHBondContact O-N 3.33Å; K30-Q33 PolarHBondContact O-N 2.75Å; K30-I34 VanDerWaalsContact O-CG1 3.28Å; K30-I34 WeakPolarHBondContact O-CG1 3.28Å; K30-I34 PolarHBondContact O-N 3.24Å
31N91.9Very high91.5Very high97 Ų97102.8 Ų102.852%0.51950%0.502SS..Hα-helixtrans-61.2-42.2178.3-73.5-7.3000111.6E27 H28 I34 I35E27-N31 WeakPolarHBondContact O-CB 3.38Å; E27-N31 PolarHBondContact O-N 2.89Å; H28-N31 PolarHBondContact O-N 3.02Å; N31-I34 PolarHBondContact O-N 3.42Å; N31-I35 VanDerWaalsContact O-CG1 3.26Å; N31-I35 WeakPolarHBondContact O-CG1 3.33Å; N31-I35 PolarHBondContact O-N 3.36Å
32S92.7Very high91.6Very high56 Ų56101.2 Ų101.239%0.39249%0.493SS..Hα-helixtrans-60.8-45.1175.6-1760000112.1H28 L29 K30 I34 I35 E36H28-S32 WeakPolarHBondContact O-CB 3.38Å; H28-S32 PolarHBondContact O-N 2.94Å; L29-S32 PolarHBondContact O-N 2.96Å; K30-S32 VanDerWaalsContact C-N 3.32Å; K30-S32 PolarHBondContact O-N 3.33Å; S32-I34 PolarHBondContact O-N 3.33Å; S32-I35 PolarHBondContact O-N 3.31Å; S32-E36 PolarHBondContact O-N 3.45Å
33Q92.8Very high91.6Very high107 Ų107102 Ų10250%0.550%0.497SS..Hα-helixtrans-61.9-42.5176.4-73.3176.6-16.600112.5L29 K30 E36 Q37L29-Q33 WeakPolarHBondContact O-CG 3.44Å; L29-Q33 PolarHBondContact O-N 2.95Å; K30-Q33 PolarHBondContact O-N 2.75Å; Q33-E36 PolarHBondContact O-N 3.05Å; Q33-Q37 WeakPolarHBondContact O-CG 3.42Å; Q33-Q37 PolarHBondContact O-N 2.87Å
34I92.7Very high91.5Very high78 Ų78104.5 Ų104.540%0.450%0.501SS..Hα-helixtrans-62.1-44.7177.3-69.3164.6000110.5K30 N31 S32 E36 Q37 Q38K30-I34 VanDerWaalsContact O-CG1 3.28Å; K30-I34 WeakPolarHBondContact O-CG1 3.28Å; K30-I34 PolarHBondContact O-N 3.24Å; N31-I34 PolarHBondContact O-N 3.42Å; S32-I34 PolarHBondContact O-N 3.33Å; I34-E36 VanDerWaalsContact C-N 3.34Å; I34-E36 PolarHBondContact O-N 3.27Å; I34-Q37 PolarHBondContact O-N 3.44Å; I34-Q38 HydrophobicContact CG2-CG 4.38Å; I34-Q38 WeakPolarHBondContact O-CB 3.48Å; I34-Q38 WeakPolarHBondContact O-CG 3.37Å; I34-Q38 PolarHBondContact O-N 3.15Å
35I93.4Very high91.3Very high81 Ų81105 Ų10542%0.41550%0.5SS..Hα-helixtrans-60.6-44.2178.3-70.9165000110.8N31 S32 Q38 K39N31-I35 VanDerWaalsContact O-CG1 3.26Å; N31-I35 WeakPolarHBondContact O-CG1 3.33Å; N31-I35 PolarHBondContact O-N 3.36Å; S32-I35 PolarHBondContact O-N 3.31Å; I35-Q38 PolarHBondContact O-N 2.97Å; I35-K39 HydrophobicContact CG2-CD 4.46Å; I35-K39 WeakPolarHBondContact O-CG 3.24Å; I35-K39 PolarHBondContact O-N 3.25Å
36E94.1Very high91.5Very high75 Ų75102.7 Ų102.735%0.3550%0.495SS..Hα-helixtrans-67.4-36.5178.4-70.5-54.8126.400112.8S32 Q33 I34 K39 R40S32-E36 PolarHBondContact O-N 3.45Å; Q33-E36 PolarHBondContact O-N 3.05Å; I34-E36 VanDerWaalsContact C-N 3.34Å; I34-E36 PolarHBondContact O-N 3.27Å; E36-K39 IonicContact OE1-NZ 2.75Å; E36-K39 PolarHBondContact OE1-NZ 3.46Å; E36-R40 PolarHBondContact O-N 3.46Å; E36-R40 VanDerWaalsContact O-N 3.15Å
37Q91.1Very high91.6Very high111 Ų111103.7 Ų103.752%0.51950%0.497SS..Hα-helixtrans-64.2-44.5171.9-74.4176.5-12.100111.9Q33 I34 K39 R40 L41Q33-Q37 WeakPolarHBondContact O-CG 3.42Å; Q33-Q37 PolarHBondContact O-N 2.87Å; I34-Q37 PolarHBondContact O-N 3.44Å; Q37-K39 VanDerWaalsContact C-N 3.35Å; Q37-K39 PolarHBondContact O-N 2.96Å; Q37-R40 PolarHBondContact O-N 3.36Å; Q37-L41 WeakPolarHBondContact O-CG 3.44Å; Q37-L41 PolarHBondContact O-N 2.96Å
38Q91.2Very high91.5Very high107 Ų107100.5 Ų100.550%0.549%0.489SS..Hα-helixtrans-60.7-43177-75.1175.4-18.200111.8I34 I35 R40 L41 I42I34-Q38 HydrophobicContact CG2-CG 4.38Å; I34-Q38 WeakPolarHBondContact O-CB 3.48Å; I34-Q38 WeakPolarHBondContact O-CG 3.37Å; I34-Q38 PolarHBondContact O-N 3.15Å; I35-Q38 PolarHBondContact O-N 2.97Å; Q38-R40 PolarHBondContact O-N 3.39Å; Q38-L41 PolarHBondContact O-N 3.16Å; Q38-I42 WeakPolarHBondContact O-CD1 3.49Å; Q38-I42 VanDerWaalsContact O-CG1 3.24Å; Q38-I42 WeakPolarHBondContact O-CG1 3.38Å; Q38-I42 PolarHBondContact O-N 3.36Å
39K95Very high91.4Very high106 Ų10699.4 Ų99.446%0.46148%0.484SS..Hα-helixtrans-58.4-46.7175-73.8175.4-174.91700112I35 E36 Q37 I42 I43I35-K39 HydrophobicContact CG2-CD 4.46Å; I35-K39 WeakPolarHBondContact O-CG 3.24Å; I35-K39 PolarHBondContact O-N 3.25Å; E36-K39 IonicContact OE1-NZ 2.75Å; E36-K39 PolarHBondContact OE1-NZ 3.46Å; Q37-K39 VanDerWaalsContact C-N 3.35Å; Q37-K39 PolarHBondContact O-N 2.96Å; K39-I42 PolarHBondContact O-N 2.93Å; K39-I43 WeakPolarHBondContact O-CG1 3.49Å; K39-I43 PolarHBondContact O-N 3.31Å; K39-I43 VanDerWaalsContact O-N 3.16Å
40R92.9Very high91.5Very high139 Ų13999.6 Ų99.653%0.52549%0.486SS..Hα-helixtrans-60.1-45.9176.7-77.9-172.1-75.2-101.9-2.7112.1E36 Q37 Q38 I42 I43 Q44E36-R40 PolarHBondContact O-N 3.46Å; E36-R40 VanDerWaalsContact O-N 3.15Å; Q37-R40 PolarHBondContact O-N 3.36Å; Q38-R40 PolarHBondContact O-N 3.39Å; R40-I42 PolarHBondContact O-N 2.92Å; R40-I43 PolarHBondContact O-N 3.11Å; R40-Q44 PolarHBondContact O-N 3.26Å; R40-Q44 VanDerWaalsContact O-N 3.11Å
41L93.9Very high91.6Very high96 Ų9697.2 Ų97.250%0.50348%0.478SS..Hα-helixtrans-62.4-41.6178.1-73.6170.2000112.3Q37 Q38 I43 Q44 I45Q37-L41 WeakPolarHBondContact O-CG 3.44Å; Q37-L41 PolarHBondContact O-N 2.96Å; Q38-L41 PolarHBondContact O-N 3.16Å; L41-I43 VanDerWaalsContact C-N 3.29Å; L41-I43 PolarHBondContact O-N 3.47Å; L41-Q44 PolarHBondContact O-N 3.12Å; L41-I45 WeakPolarHBondContact O-CB 3.39Å; L41-I45 VanDerWaalsContact O-CG1 3.25Å; L41-I45 WeakPolarHBondContact O-CG1 3.42Å; L41-I45 PolarHBondContact O-N 3.47Å
42I92.7Very high91.5Very high92 Ų92100.9 Ų100.947%0.47249%0.485SS..Hα-helixtrans-60.8-40177.5-71.2164.3000111.2Q38 K39 R40 K46Q38-I42 WeakPolarHBondContact O-CD1 3.49Å; Q38-I42 VanDerWaalsContact O-CG1 3.24Å; Q38-I42 WeakPolarHBondContact O-CG1 3.38Å; Q38-I42 PolarHBondContact O-N 3.36Å; K39-I42 PolarHBondContact O-N 2.93Å; R40-I42 PolarHBondContact O-N 2.92Å; I42-K46 HydrophobicContact CG2-CD 4.43Å; I42-K46 WeakPolarHBondContact O-CG 3.24Å; I42-K46 PolarHBondContact O-N 3.31Å; I42-K46 VanDerWaalsContact O-N 3.12Å
43I90.8Very high91.3Very high92 Ų92101 Ų10147%0.47249%0.489SS..Hα-helixtrans-62.7-51.5176.8-67.6165.5000110.1K39 R40 L41 I45 K46 E47K39-I43 WeakPolarHBondContact O-CG1 3.49Å; K39-I43 PolarHBondContact O-N 3.31Å; K39-I43 VanDerWaalsContact O-N 3.16Å; R40-I43 PolarHBondContact O-N 3.11Å; L41-I43 VanDerWaalsContact C-N 3.29Å; L41-I43 PolarHBondContact O-N 3.47Å; I43-I45 VanDerWaalsContact C-N 3.31Å; I43-I45 PolarHBondContact O-N 3.31Å; I43-K46 WeakPolarHBondContact O-CB 3.25Å; I43-K46 PolarHBondContact O-N 3.47Å; I43-E47 HydrophobicContact CG2-CG 4.47Å; I43-E47 WeakPolarHBondContact CG2-OE1 3.39Å; I43-E47 WeakPolarHBondContact O-CG 3.44Å; I43-E47 PolarHBondContact O-N 3.32Å
44Q86.6Confident91.2Very high117 Ų117101.2 Ų101.255%0.54749%0.49SS..Hα-helixtrans-59.2-40.1179.2-69.8177.6-6.300112.7R40 L41 K46 E47 A48R40-Q44 PolarHBondContact O-N 3.26Å; R40-Q44 VanDerWaalsContact O-N 3.11Å; L41-Q44 PolarHBondContact O-N 3.12Å; Q44-K46 VanDerWaalsContact C-N 3.33Å; Q44-K46 PolarHBondContact O-N 3.47Å; Q44-E47 PolarHBondContact O-N 2.96Å; Q44-A48 WeakPolarHBondContact O-CB 3.46Å; Q44-A48 PolarHBondContact O-N 3.38Å
45I87.8Confident91.2Very high95 Ų95100.8 Ų100.849%0.48749%0.489SS..Hα-helixtrans-62.1-43.1176.4-71.1165.6000110.7L41 I43 A48 Q49L41-I45 WeakPolarHBondContact O-CB 3.39Å; L41-I45 VanDerWaalsContact O-CG1 3.25Å; L41-I45 WeakPolarHBondContact O-CG1 3.42Å; L41-I45 PolarHBondContact O-N 3.47Å; I43-I45 VanDerWaalsContact C-N 3.31Å; I43-I45 PolarHBondContact O-N 3.31Å; I45-A48 PolarHBondContact O-N 3.07Å; I45-Q49 HydrophobicContact CG2-CG 4.48Å; I45-Q49 WeakPolarHBondContact O-CB 3.37Å; I45-Q49 VanDerWaalsContact O-CG 3.24Å; I45-Q49 WeakPolarHBondContact O-CG 3.49Å; I45-Q49 PolarHBondContact O-N 2.93Å
46K92.2Very high91Very high136 Ų136100.5 Ų100.559%0.59149%0.485SS*.Hα-helixtrans-65.3-43178.3-74.7179.1177-173.70112I42 I43 Q44 Q49 L50I42-K46 HydrophobicContact CG2-CD 4.43Å; I42-K46 WeakPolarHBondContact O-CG 3.24Å; I42-K46 PolarHBondContact O-N 3.31Å; I42-K46 VanDerWaalsContact O-N 3.12Å; I43-K46 WeakPolarHBondContact O-CB 3.25Å; I43-K46 PolarHBondContact O-N 3.47Å; Q44-K46 VanDerWaalsContact C-N 3.33Å; Q44-K46 PolarHBondContact O-N 3.47Å; K46-Q49 PolarHBondContact O-N 3.4Å; K46-L50 PolarHBondContact O-N 2.97Å
47E91.2Very high90.7Very high113 Ų113100.8 Ų100.853%0.52849%0.493SS..Hα-helixtrans-61.1-46.9176.2-71.2169.1172.300111.1I43 Q44 Q49 L50 L51I43-E47 HydrophobicContact CG2-CG 4.47Å; I43-E47 WeakPolarHBondContact CG2-OE1 3.39Å; I43-E47 WeakPolarHBondContact O-CG 3.44Å; I43-E47 PolarHBondContact O-N 3.32Å; Q44-E47 PolarHBondContact O-N 2.96Å; E47-Q49 VanDerWaalsContact C-N 3.32Å; E47-Q49 PolarHBondContact O-N 3.2Å; E47-L50 PolarHBondContact O-N 3.39Å; E47-L51 WeakPolarHBondContact O-CG 3.31Å; E47-L51 PolarHBondContact O-N 3.31Å
48A86.9Confident90.7Very high45 Ų4598.4 Ų98.437%0.37249%0.487SS..Hα-helixtrans-63.4-35.917700000112.9Q44 I45 R52Q44-A48 WeakPolarHBondContact O-CB 3.46Å; Q44-A48 PolarHBondContact O-N 3.38Å; I45-A48 PolarHBondContact O-N 3.07Å; A48-R52 VanDerWaalsContact O-CB 3.31Å; A48-R52 WeakPolarHBondContact O-CB 3.48Å; A48-R52 PolarHBondContact O-N 3.02Å
49Q88.9Confident90.5Very high114 Ų11499.2 Ų99.253%0.53349%0.486SS..Hα-helixtrans-66.1-41.5174.6-77172.6-1800111.9I45 K46 E47 R52 A53I45-Q49 HydrophobicContact CG2-CG 4.48Å; I45-Q49 WeakPolarHBondContact O-CB 3.37Å; I45-Q49 VanDerWaalsContact O-CG 3.24Å; I45-Q49 WeakPolarHBondContact O-CG 3.49Å; I45-Q49 PolarHBondContact O-N 2.93Å; K46-Q49 PolarHBondContact O-N 3.4Å; E47-Q49 VanDerWaalsContact C-N 3.32Å; E47-Q49 PolarHBondContact O-N 3.2Å; Q49-R52 PolarHBondContact O-N 3.05Å; Q49-A53 PolarHBondContact O-N 2.99Å
50L91.9Very high90.2Very high103 Ų10398.2 Ų98.254%0.53948%0.483SS..Hα-helixtrans-63.6-49.1176.7-175.9130000111.1K46 E47 R52 A53 E54K46-L50 PolarHBondContact O-N 2.97Å; E47-L50 PolarHBondContact O-N 3.39Å; L50-R52 VanDerWaalsContact C-N 3.28Å; L50-R52 PolarHBondContact O-N 2.87Å; L50-A53 WeakPolarHBondContact O-CB 3.45Å; L50-A53 PolarHBondContact O-N 3.43Å; L50-A53 VanDerWaalsContact O-N 3.1Å; L50-E54 WeakPolarHBondContact CD2-OE1 3.39Å; L50-E54 PolarHBondContact O-N 3.47Å
51L93.6Very high89.9Confident81 Ų8199 Ų9942%0.42449%0.485SS..Hα-helixtrans-57.6-41.2175.6-72.4171.5000112.1E47 A53 E54 L55E47-L51 WeakPolarHBondContact O-CG 3.31Å; E47-L51 PolarHBondContact O-N 3.31Å; L51-A53 VanDerWaalsContact C-N 3.34Å; L51-A53 PolarHBondContact O-N 2.96Å; L51-E54 PolarHBondContact O-N 2.95Å; L51-L55 WeakPolarHBondContact O-CB 3.13Å; L51-L55 WeakPolarHBondContact O-CG 3.49Å; L51-L55 PolarHBondContact O-N 3.07Å
52R88.5Confident89.4Confident175 Ų17599.8 Ų99.866%0.6649%0.49SS*.Hα-helixtrans-65.4-37.4178.2-162.2-179.7-83.4121.9-9111.8A48 Q49 L50 E56A48-R52 VanDerWaalsContact O-CB 3.31Å; A48-R52 WeakPolarHBondContact O-CB 3.48Å; A48-R52 PolarHBondContact O-N 3.02Å; Q49-R52 PolarHBondContact O-N 3.05Å; L50-R52 VanDerWaalsContact C-N 3.28Å; L50-R52 PolarHBondContact O-N 2.87Å; R52-E56 WeakPolarHBondContact O-CB 3.42Å; R52-E56 PolarHBondContact O-N 2.95Å
53A88.7Confident88.8Confident58 Ų5899.6 Ų99.648%0.47949%0.489SS..Hα-helixtrans-68.8-39.1175.400000112.5Q49 L50 L51 E56 T57Q49-A53 PolarHBondContact O-N 2.99Å; L50-A53 WeakPolarHBondContact O-CB 3.45Å; L50-A53 PolarHBondContact O-N 3.43Å; L50-A53 VanDerWaalsContact O-N 3.1Å; L51-A53 VanDerWaalsContact C-N 3.34Å; L51-A53 PolarHBondContact O-N 2.96Å; A53-E56 PolarHBondContact O-N 3.34Å; A53-T57 PolarHBondContact O-N 3.1Å; A53-T57 PolarHBondContact O-OG1 3.35Å
54E91.7Very high88.4Confident112 Ų112102.7 Ų102.752%0.52350%0.502SS..Hα-helixtrans-66.2-43.7175.4-72.9-179.1177.200112L50 L51 E56 T57 C58L50-E54 WeakPolarHBondContact CD2-OE1 3.39Å; L50-E54 PolarHBondContact O-N 3.47Å; L51-E54 PolarHBondContact O-N 2.95Å; E54-E56 VanDerWaalsContact C-N 3.33Å; E54-E56 PolarHBondContact O-N 2.63Å; E54-T57 WeakPolarHBondContact O-CB 3.38Å; E54-T57 PolarHBondContact O-N 2.95Å; E54-C58 WeakPolarHBondContact O-CB 3.42Å; E54-C58 PolarHBondContact O-N 3.47Å
55L91.8Very high88.2Confident69 Ų69101.4 Ų101.436%0.36151%0.506SS..Hα-helixtrans-61.4-41.7174.3-76.4174000111.7L51 T57 C58 R59 W156L51-L55 WeakPolarHBondContact O-CB 3.13Å; L51-L55 WeakPolarHBondContact O-CG 3.49Å; L51-L55 PolarHBondContact O-N 3.07Å; L55-T57 VanDerWaalsContact C-N 3.32Å; L55-T57 PolarHBondContact O-N 3.22Å; L55-C58 WeakPolarHBondContact O-CB 3.15Å; L55-C58 PolarHBondContact O-N 3.22Å; L55-R59 WeakPolarHBondContact O-CB 3.36Å; L55-R59 PolarHBondContact O-N 2.75Å; L55-W156 HydrophobicContact CD2-CH2 4.09Å; L55-W156 HydrophobicContact CD2-CZ3 4.26Å
56E89.5Confident87.5Confident74 Ų74100.3 Ų100.335%0.34650%0.5SS..Hα-helixtrans-64.4-39.7176.1-173.864.6-17700111.3R52 A53 E54 C58 R59 H60R52-E56 WeakPolarHBondContact O-CB 3.42Å; R52-E56 PolarHBondContact O-N 2.95Å; A53-E56 PolarHBondContact O-N 3.34Å; E54-E56 VanDerWaalsContact C-N 3.33Å; E54-E56 PolarHBondContact O-N 2.63Å; E56-C58 VanDerWaalsContact C-N 3.34Å; E56-R59 VanDerWaalsContact CD-CZ 3.49Å; E56-R59 WeakPolarHBondContact O-CB 3.43Å; E56-R59 PolarHBondContact O-N 3.19Å; E56-R59 IonicContact OE1-CZ 3.25Å; E56-R59 IonicContact OE1-NE 3.96Å; E56-R59 IonicContact OE1-NH1 3.01Å; E56-R59 PolarHBondContact OE1-NH1 3.01Å; E56-R59 IonicContact OE1-NH2 2.63Å; E56-R59 PolarHBondContact OE1-NH2 3.01Å; E56-R59 IonicContact OE2-CZ 3.71Å; E56-R59 VanDerWaalsContact OE2-CZ 3.27Å; E56-R59 IonicContact OE2-NE 3.33Å; E56-R59 IonicContact OE2-NH1 3.27Å; E56-R59 PolarHBondContact OE2-NH1 2.69Å; E56-R59 IonicContact OE2-NH2 3.75Å; E56-H60 PolarHBondContact O-N 3.33Å; E56-H60 PolarHBondContact O-ND1 2.91Å; E56-H60 IonicContact OE1-CE1 3.07Å; E56-H60 PolarHBondContact OE1-CE1 2.55Å; E56-H60 IonicContact OE1-ND1 3.76Å
57T88.6Confident86.7Confident82 Ų8296.7 Ų96.750%0.50349%0.491SS..Hα-helixtrans-62.9-42.4173.4-57.60000111.3A53 E54 L55 H60 R61A53-T57 PolarHBondContact O-N 3.1Å; A53-T57 PolarHBondContact O-OG1 3.35Å; E54-T57 WeakPolarHBondContact O-CB 3.38Å; E54-T57 PolarHBondContact O-N 2.95Å; L55-T57 VanDerWaalsContact C-N 3.32Å; L55-T57 PolarHBondContact O-N 3.22Å; T57-H60 PolarHBondContact O-N 2.83Å; T57-R61 WeakPolarHBondContact O-CG 3.46Å; T57-R61 PolarHBondContact O-N 3.07Å
58C89.9Confident85.8Confident60 Ų6094.4 Ų94.441%0.40550%0.497SS..Hα-helixtrans-60.1-47.1175.1-168.80000111.4E54 L55 E56 H60 R61 L62E54-C58 WeakPolarHBondContact O-CB 3.42Å; E54-C58 PolarHBondContact O-N 3.47Å; L55-C58 WeakPolarHBondContact O-CB 3.15Å; L55-C58 PolarHBondContact O-N 3.22Å; E56-C58 VanDerWaalsContact C-N 3.34Å; C58-H60 VanDerWaalsContact C-N 3.33Å; C58-H60 PolarHBondContact O-N 3.47Å; C58-R61 PolarHBondContact O-N 2.77Å; C58-L62 PolarHBondContact O-N 3.37Å
59R88.3Confident85.1Confident124 Ų124100.1 Ų100.147%0.46852%0.516SS..Hα-helixtrans-56.2-46.4176.2-167.3-165.279.9-1740111.5L55 E56 L62 L63L55-R59 WeakPolarHBondContact O-CB 3.36Å; L55-R59 PolarHBondContact O-N 2.75Å; E56-R59 VanDerWaalsContact CD-CZ 3.49Å; E56-R59 WeakPolarHBondContact O-CB 3.43Å; E56-R59 PolarHBondContact O-N 3.19Å; E56-R59 IonicContact OE1-CZ 3.25Å; E56-R59 IonicContact OE1-NE 3.96Å; E56-R59 IonicContact OE1-NH1 3.01Å; E56-R59 PolarHBondContact OE1-NH1 3.01Å; E56-R59 IonicContact OE1-NH2 2.63Å; E56-R59 PolarHBondContact OE1-NH2 3.01Å; E56-R59 IonicContact OE2-CZ 3.71Å; E56-R59 VanDerWaalsContact OE2-CZ 3.27Å; E56-R59 IonicContact OE2-NE 3.33Å; E56-R59 IonicContact OE2-NH1 3.27Å; E56-R59 PolarHBondContact OE2-NH1 2.69Å; E56-R59 IonicContact OE2-NH2 3.75Å; R59-L62 PolarHBondContact O-N 3.33Å; R59-L63 HydrophobicContact CG-CD1 4.23Å; R59-L63 VanDerWaalsContact O-CG 3.31Å; R59-L63 WeakPolarHBondContact O-CG 3.31Å; R59-L63 PolarHBondContact O-N 3.34Å
60H87.8Confident84Confident86 Ų8697.8 Ų97.840%0.39851%0.506SS..Hα-helixtrans-60.7-47.9177.7-76.292.4000112E56 T57 C58 L62 L63 E64E56-H60 PolarHBondContact O-N 3.33Å; E56-H60 PolarHBondContact O-ND1 2.91Å; E56-H60 IonicContact OE1-CE1 3.07Å; E56-H60 PolarHBondContact OE1-CE1 2.55Å; E56-H60 IonicContact OE1-ND1 3.76Å; T57-H60 PolarHBondContact O-N 2.83Å; C58-H60 VanDerWaalsContact C-N 3.33Å; C58-H60 PolarHBondContact O-N 3.47Å; H60-L62 VanDerWaalsContact C-N 3.3Å; H60-L62 PolarHBondContact O-N 2.91Å; H60-L63 PolarHBondContact O-N 2.84Å; H60-E64 WeakPolarHBondContact O-CG 3.48Å; H60-E64 PolarHBondContact O-N 3.2Å
61R86.9Confident82.5Confident154 Ų15499.2 Ų99.258%0.58151%0.508SS*.Hα-helixtrans-60.1-40.4176.9-70-172.8-61-1771.2112.5T57 C58 E64 S65T57-R61 WeakPolarHBondContact O-CG 3.46Å; T57-R61 PolarHBondContact O-N 3.07Å; C58-R61 PolarHBondContact O-N 2.77Å; R61-E64 PolarHBondContact O-N 3.39Å; R61-S65 WeakPolarHBondContact O-CB 3.42Å; R61-S65 PolarHBondContact O-N 2.88Å; R61-S65 PolarHBondContact O-OG 3.41Å
62L83.4Confident80.7Confident113 Ų113100.2 Ų100.259%0.59252%0.521SS*.Hα-helixtrans-63.6-45.2177.6-174.465.7000110.8C58 R59 H60 S65 I66C58-L62 PolarHBondContact O-N 3.37Å; R59-L62 PolarHBondContact O-N 3.33Å; H60-L62 VanDerWaalsContact C-N 3.3Å; H60-L62 PolarHBondContact O-N 2.91Å; L62-S65 WeakPolarHBondContact O-CB 3.39Å; L62-S65 PolarHBondContact O-N 3.22Å; L62-I66 PolarHBondContact O-N 2.97Å
63L79.6Confident79.2Confident89 Ų8996.1 Ų96.147%0.46651%0.512SS..Hα-helixtrans-65.3-37177.1-70173.7000112.8R59 H60 S65 I66R59-L63 HydrophobicContact CG-CD1 4.23Å; R59-L63 VanDerWaalsContact O-CG 3.31Å; R59-L63 WeakPolarHBondContact O-CG 3.31Å; R59-L63 PolarHBondContact O-N 3.34Å; H60-L63 PolarHBondContact O-N 2.84Å; L63-S65 VanDerWaalsContact C-N 3.28Å; L63-I66 HydrophobicContact CD2-CD1 3.96Å; L63-I66 WeakPolarHBondContact O-CB 3.38Å; L63-I66 PolarHBondContact O-N 2.86Å
64E83.8Confident77.5Confident156 Ų156101.7 Ų101.773%0.72953%0.532SS*.Hα-helixtrans-68.7-27.8174.3-74.4175.8178.400112.7H60 R61 I66H60-E64 WeakPolarHBondContact O-CG 3.48Å; H60-E64 PolarHBondContact O-N 3.2Å; R61-E64 PolarHBondContact O-N 3.39Å; E64-I66 PolarHBondContact O-N 3.48Å
65S81.2Confident75.6Confident91 Ų91101.8 Ų101.864%0.63654%0.54SS*.THydrogen-bonded Turntrans-75-13.4176.2-57.40000112.8R61 L62 L63 P67R61-S65 WeakPolarHBondContact O-CB 3.42Å; R61-S65 PolarHBondContact O-N 2.88Å; R61-S65 PolarHBondContact O-OG 3.41Å; L62-S65 WeakPolarHBondContact O-CB 3.39Å; L62-S65 PolarHBondContact O-N 3.22Å; L63-S65 VanDerWaalsContact C-N 3.28Å; S65-P67 VanDerWaalsContact O-CD 3.26Å; S65-P67 WeakPolarHBondContact O-CD 3.5Å
66I73.4Confident73.3Confident71 Ų71104.1 Ų104.136%0.36455%0.549SS..SBendtrans-72.8118.5176.5-59.8174.9000108.8L62 L63 E64 G68 I70L62-I66 PolarHBondContact O-N 2.97Å; L63-I66 HydrophobicContact CD2-CD1 3.96Å; L63-I66 WeakPolarHBondContact O-CB 3.38Å; L63-I66 PolarHBondContact O-N 2.86Å; E64-I66 PolarHBondContact O-N 3.48Å; I66-G68 PolarHBondContact O-N 2.85Å; I66-I70 HydrophobicContact CG2-CB 4.27Å; I66-I70 HydrophobicContact CG2-CG2 4.49Å
67P75.9Confident71.3Confident61 Ų61105.8 Ų105.840%0.39656%0.56SS.*  trans-57.3136175.9-24.234.4000111.7S65 H69 I70 K71S65-P67 VanDerWaalsContact O-CD 3.26Å; S65-P67 WeakPolarHBondContact O-CD 3.5Å; P67-H69 WeakPolarHBondContact CB-CE1 3.46Å; P67-H69 PolarHBondContact O-N 3.22Å; P67-I70 HydrophobicContact CB-CD1 4.26Å; P67-I70 HydrophobicContact CG-CD1 4.1Å; P67-I70 PolarHBondContact O-N 2.73Å; P67-K71 PolarHBondContact O-N 2.98Å
68G71.7Confident69.4Low64 Ų64105.3 Ų105.366%0.6656%0.557SS**THydrogen-bonded Turntrans-56.6-26.3-174.100000115.3I66 I70 K71I66-G68 PolarHBondContact O-N 2.85Å; G68-I70 VanDerWaalsContact C-N 3.28Å; G68-I70 PolarHBondContact O-N 2.89Å; G68-K71 PolarHBondContact O-N 3.39Å
69H71.9Confident67.3Low165 Ų165109.1 Ų109.176%0.76457%0.572SS**THydrogen-bonded Turntrans-75.2-12.6177.462.9-90.3000114.2P67P67-H69 WeakPolarHBondContact CB-CE1 3.46Å; P67-H69 PolarHBondContact O-N 3.22Å
70I66.4Low65.3Low65 Ų65107.8 Ų107.833%0.33357%0.574SS.*THydrogen-bonded Turntrans-103.3-17.7175.8-55.7167.6000110.5I66 P67 G68 C72 L142I66-I70 HydrophobicContact CG2-CB 4.27Å; I66-I70 HydrophobicContact CG2-CG2 4.49Å; P67-I70 HydrophobicContact CB-CD1 4.26Å; P67-I70 HydrophobicContact CG-CD1 4.1Å; P67-I70 PolarHBondContact O-N 2.73Å; G68-I70 VanDerWaalsContact C-N 3.28Å; G68-I70 PolarHBondContact O-N 2.89Å; I70-C72 PolarHBondContact O-N 3.19Å; I70-L142 HydrophobicContact CD1-CD2 4.03Å; I70-L142 HydrophobicContact CG1-CD2 4.41Å; I70-L142 HydrophobicContact CG2-CD1 3.91Å; I70-L142 HydrophobicContact CG2-CD2 3.61Å; I70-L142 HydrophobicContact CG2-CG 4.43Å
71K59.9Low63.4Low133 Ų133110.3 Ų110.358%0.57858%0.584SS**  trans-60.6106.5-178-166.6170.3-177.8174.60108.6P67 G68 D73P67-K71 PolarHBondContact O-N 2.98Å; G68-K71 PolarHBondContact O-N 3.39Å; K71-D73 VanDerWaalsContact C-N 3.35Å; K71-D73 PolarHBondContact O-N 2.92Å
72C56.5Low61.6Low102 Ų102106.4 Ų106.469%0.68957%0.574SS**  trans-64.398.7172.1-100.90000107.6I70 I74I70-C72 PolarHBondContact O-N 3.19Å; C72-I74 PolarHBondContact O-N 3.13Å
73D55.7Low59.9Low90 Ų90103.1 Ų103.148%0.48157%0.568SS.*  trans-58.6128.4161.5-72.5-32.4000107K71 T75 H76K71-D73 VanDerWaalsContact C-N 3.35Å; K71-D73 PolarHBondContact O-N 2.92Å; D73-T75 PolarHBondContact O-N 3.41Å; D73-H76 WeakPolarHBondContact O-CB 3.25Å; D73-H76 PolarHBondContact O-N 3.42Å
74I53.3Low58.4Low175 Ų175107.3 Ų107.390%0.89758%0.578SS**THydrogen-bonded Turntrans-54.1-19.1-177.7-65168.5000111.4C72C72-I74 PolarHBondContact O-N 3.13Å
75T51.9Low56.8Low114 Ų114105.7 Ų105.770%0.69957%0.574SS**THydrogen-bonded Turntrans-76.3-12.5174.648.90000115.2D73 N77D73-T75 PolarHBondContact O-N 3.41Å; T75-N77 PolarHBondContact O-N 3.28Å
76H44.9Very low55.2Low118 Ų118109 Ų10955%0.54658%0.577SS.*  trans-74.196.8172.8-83.5-61.5000108.7D73 V78D73-H76 WeakPolarHBondContact O-CB 3.25Å; D73-H76 PolarHBondContact O-N 3.42Å; H76-V78 HydrophobicContact CB-CG2 4.2Å; H76-V78 PolarHBondContact O-N 3.3Å
77N47.5Very low53.9Low108 Ų108113 Ų11358%0.57860%0.597SS**THydrogen-bonded Turntrans-54.734.4169.7-73.7-8.5000114.4T75 D80 K81T75-N77 PolarHBondContact O-N 3.28Å; N77-D80 HydrophobicContact CB-CB 4.33Å; N77-D80 PolarHBondContact O-N 3.33Å; N77-K81 PolarHBondContact O-N 2.89Å
78V48.2Very low52.2Low73 Ų73116.3 Ų116.344%0.44261%0.611SS.*Hα-helixtrans-70.4-27173.1-178.10000109.8H76 D80 K81 L82H76-V78 HydrophobicContact CB-CG2 4.2Å; H76-V78 PolarHBondContact O-N 3.3Å; V78-D80 VanDerWaalsContact C-N 3.29Å; V78-D80 PolarHBondContact O-N 3.33Å; V78-K81 PolarHBondContact O-N 3.39Å; V78-K81 VanDerWaalsContact O-N 3.09Å; V78-L82 HydrophobicContact CG1-CD1 3.91Å; V78-L82 HydrophobicContact CG1-CG 4.15Å; V78-L82 WeakPolarHBondContact O-CG 3.31Å; V78-L82 PolarHBondContact O-N 3.43Å
79I45.9Very low50.8Low139 Ų139120.4 Ų120.471%0.71362%0.618SS**Hα-helixtrans-60.6-40169.8-63.2177.6000110.8K81 L82 G83I79-K81 PolarHBondContact O-N 3.42Å; I79-L82 PolarHBondContact O-N 3.2Å; I79-G83 PolarHBondContact O-N 2.78Å
80D46.1Very low49.3Very low97 Ų97120.1 Ų120.152%0.51962%0.621SS.*Hα-helixtrans-65.9-24.3176.5-74.1-12.6000113.1N77 V78N77-D80 HydrophobicContact CB-CB 4.33Å; N77-D80 PolarHBondContact O-N 3.33Å; V78-D80 VanDerWaalsContact C-N 3.29Å; V78-D80 PolarHBondContact O-N 3.33Å
81K47Very low47.9Very low138 Ų138124.6 Ų124.660%0.664%0.641SS**Hα-helixtrans-84.7-45.1174.7-69.5-171.8178.7-175.70111.7N77 V78 I79 G83 R84N77-K81 PolarHBondContact O-N 2.89Å; V78-K81 PolarHBondContact O-N 3.39Å; V78-K81 VanDerWaalsContact O-N 3.09Å; I79-K81 PolarHBondContact O-N 3.42Å; K81-G83 VanDerWaalsContact C-N 3.3Å; K81-G83 PolarHBondContact O-N 2.84Å; K81-R84 PolarHBondContact O-N 3.48Å; K81-R84 VanDerWaalsContact O-N 3.12Å
82L50.5Low46.5Very low72 Ų72126 Ų12638%0.37765%0.654SS.*Hα-helixtrans-60.7-39.2178.2-73166.1000111.6V78 I79 R84 D85 F86V78-L82 HydrophobicContact CG1-CD1 3.91Å; V78-L82 HydrophobicContact CG1-CG 4.15Å; V78-L82 WeakPolarHBondContact O-CG 3.31Å; V78-L82 PolarHBondContact O-N 3.43Å; I79-L82 PolarHBondContact O-N 3.2Å; L82-R84 PolarHBondContact O-N 3.21Å; L82-R84 VanDerWaalsContact O-N 3.14Å; L82-D85 PolarHBondContact O-N 2.91Å; L82-F86 HydrophobicContact CD2-CE2 4.47Å; L82-F86 WeakPolarHBondContact O-CD2 3.14Å
83G46.6Very low45.4Very low45 Ų45126.4 Ų126.446%0.46465%0.654SS.*Hα-helixtrans-63.1-18.9177.800000115I79 K81I79-G83 PolarHBondContact O-N 2.78Å; K81-G83 VanDerWaalsContact C-N 3.3Å; K81-G83 PolarHBondContact O-N 2.84Å
84R49.3Very low44.3Very low176 Ų176128 Ų12866%0.66467%0.667SS**Hα-helixtrans-90.2-26.1179.2-69.2-158.9-62.6-124.91.2113.9K81 L82K81-R84 PolarHBondContact O-N 3.48Å; K81-R84 VanDerWaalsContact O-N 3.12Å; L82-R84 PolarHBondContact O-N 3.21Å; L82-R84 VanDerWaalsContact O-N 3.14Å
85D49.4Very low43.1Very low122 Ų122125.9 Ų125.965%0.65266%0.662SS**Hα-helixtrans-81.9-24.3-176.4-59-19000111.7L82 M87L82-D85 PolarHBondContact O-N 2.91Å; D85-M87 PolarHBondContact O-N 2.87Å
86F47.4Very low42.1Very low161 Ų161126.8 Ų126.871%0.70667%0.668SS**THydrogen-bonded Turntrans-81.9-6.8178.1-71.4-72.9000115.2L82L82-F86 HydrophobicContact CD2-CE2 4.47Å; L82-F86 WeakPolarHBondContact O-CD2 3.14Å
87M45.6Very low41.3Very low156 Ų156126 Ų12677%0.76868%0.675SS**THydrogen-bonded Turntrans-97.17.4-175.1-72.5-69.2147.900114.6D85D85-M87 PolarHBondContact O-N 2.87Å
88N40.9Very low40.5Very low130 Ų130127.8 Ų127.870%0.69569%0.685SS**  trans-116.27.7-171.7-114.718.6000117.4N90N88-N90 VanDerWaalsContact C-N 3.32Å; N88-N90 PolarHBondContact O-N 3.4Å
89D42.1Very low39.4Very low150 Ų150131.4 Ų131.480%0.80270%0.702SS**  trans-90.613.7178.8-75.1-18000114.9
90N39.9Very low38.4Very low158 Ų158131.1 Ų131.185%0.84571%0.707SS**  trans-109.555.5171.3-77-14.5000112.2N88N88-N90 VanDerWaalsContact C-N 3.32Å; N88-N90 PolarHBondContact O-N 3.4Å
91Q36.8Very low37.5Very low159 Ų159132 Ų13274%0.74372%0.716SS**  trans-133.284.9154.9-75.2-162.460.200111.1T93Q91-T93 PolarHBondContact O-N 2.81Å
92L32Very low36.7Very low163 Ų163132.4 Ų132.485%0.85373%0.725SS**  trans-51.493.8153.1-177.973.6000110
93T32.6Very low35.6Very low111 Ų111138.8 Ų138.868%0.68175%0.749SS**  trans-133.788.4159.846.60000110.4Q91 T95Q91-T93 PolarHBondContact O-N 2.81Å; T93-T95 PolarHBondContact O-N 2.98Å
94T31.9Very low34.7Very low123 Ų123142.6 Ų142.676%0.75576%0.763SS**  trans-43.4109.4148.5-470000110.3
95T29.6Very low33.7Very low131 Ų131139.5 Ų139.580%0.80477%0.765SS**  trans-167.3108.6138.9-0.20000112.8T93T93-T95 PolarHBondContact O-N 2.98Å
96T29.4Very low32.8Very low132 Ų132144.1 Ų144.181%0.8177%0.774SS**  trans-36.9126.5145.3-49.90000112.3
97S28.1Very low31.9Very low101 Ų101145.5 Ų145.571%0.70678%0.78SS**  trans173.5108.1143.7172.30000112.8
98N30.6Very low31.2Very low146 Ų146146.4 Ų146.478%0.78178%0.782SS**  trans21.4115.8135.4-58.7-14.2000119.8
99N25.8Very low30.7Very low149 Ų149148.1 Ų148.180%0.79779%0.792SS**  trans23.6135.4136.7-67.5-9.9000120.7
100T25.6Very low30.3Very low133 Ų133148.6 Ų148.682%0.81679%0.792SS**  trans86.2112.4148.341.60000119.7
101T26.8Very low30Very low116 Ų116147.4 Ų147.471%0.71279%0.791SS**  trans103.3107.4136.3-47.30000117.6
102D29.1Very low29.5Very low147 Ų147148.7 Ų148.779%0.78680%0.797SS**  trans49.8105.5144.5-56.6-26.2000119.8
103K28.2Very low29.5Very low206 Ų206148 Ų14890%0.89679%0.793SS**  trans-159.8112.2132.8-117.5168.6-177.7174.60113.6
104T28.6Very low29.2Very low124 Ų124150.8 Ų150.876%0.76180%0.796SS**  trans-24.6144.2158.854.70000118.3
105T27.2Very low29.1Very low112 Ų112152.1 Ų152.169%0.68780%0.798SS**  trans111.792142.8-43.70000115.8
106Y31Very low29Very low218 Ų218151.2 Ų151.286%0.85579%0.792SS**  trans-132.7102.8138.9-116.2-90.9000108.8
107K28.8Very low29Very low191 Ų191149 Ų14983%0.8378%0.782SS**  trans-74.4121.9164.5-80.3180172.5179.30107.4
108Q31Very low29.2Very low174 Ų174147.6 Ų147.681%0.81377%0.772SS**  trans-148.6130.1150.2-110.8173.21.700109.9I110Q108-I110 PolarHBondContact O-N 2.87Å
109N29.8Very low29.3Very low167 Ų167150.9 Ų150.989%0.89378%0.775SS**  trans-66.1112.6-170.8-66.1-52.8000110.9
110I33.8Very low29.9Very low159 Ų159147.9 Ų147.982%0.81576%0.763SS**  trans-116.9110.1153-61.3-179.9000105.9Q108 Q112Q108-I110 PolarHBondContact O-N 2.87Å; I110-Q112 PolarHBondContact O-N 3.29Å
111T33.2Very low30.4Very low133 Ų133146.3 Ų146.382%0.81675%0.753SS**  trans-31.9119.2175.1-17.50000110.7L113T111-L113 PolarHBondContact O-N 2.91Å
112Q27.5Very low31.5Very low186 Ų186145.1 Ų145.187%0.86975%0.749SS**  trans-49.792.5179.5-73.4172.7-17.600111.3I110 K114I110-Q112 PolarHBondContact O-N 3.29Å; Q112-K114 PolarHBondContact O-N 2.98Å
113L31Very low32.2Very low149 Ų149145.7 Ų145.778%0.7875%0.745SS**  trans-72.989.1153.3-140.190.7000105.4T111 L115T111-L113 PolarHBondContact O-N 2.91Å; L113-L115 HydrophobicContact CD2-CD1 4.21Å; L113-L115 HydrophobicContact CD2-CG 4.26Å; L113-L115 PolarHBondContact O-N 3.42Å
114K27.4Very low33Very low170 Ų170141.7 Ų141.774%0.73973%0.729SS**  trans-66.278176.5-175.4-178.1178.9-177.50108.8Q112 T116Q112-K114 PolarHBondContact O-N 2.98Å; K114-T116 HydrophobicContact CG-CG2 4.06Å; K114-T116 PolarHBondContact O-N 3Å; K114-T116 VanDerWaalsContact O-N 3.1Å
115L29.5Very low33.7Very low150 Ų150142.2 Ų142.279%0.78573%0.727SS**  trans-80.279.1164.7-72169.8000107.6L113 S117L113-L115 HydrophobicContact CD2-CD1 4.21Å; L113-L115 HydrophobicContact CD2-CG 4.26Å; L113-L115 PolarHBondContact O-N 3.42Å; L115-S117 PolarHBondContact O-N 3.46Å; L115-S117 VanDerWaalsContact O-N 3.17Å
116T27.1Very low34.5Very low112 Ų112143 Ų14369%0.68772%0.722SS**  trans-6899.5158.438.50000107.9K114K114-T116 HydrophobicContact CG-CG2 4.06Å; K114-T116 PolarHBondContact O-N 3Å; K114-T116 VanDerWaalsContact O-N 3.1Å
117S28.7Very low35.2Very low86 Ų86137.7 Ų137.760%0.60171%0.705SS**  trans-150.482.4155.3-1660000110L115L115-S117 PolarHBondContact O-N 3.46Å; L115-S117 VanDerWaalsContact O-N 3.17Å
118S32Very low36Very low71 Ų71131.1 Ų131.150%0.49768%0.684SS.*  trans9.5114.4131.7-2.70000116.6
119Y33.8Very low36.9Very low216 Ų216128.7 Ų128.785%0.84767%0.67SS**  trans54.656.8157.26.4-90000116.7T121Y119-T121 PolarHBondContact O-N 3.3Å
120T37.2Very low37.9Very low86 Ų86125.3 Ų125.353%0.52865%0.652SS.*  trans-79.5101.3158.453.90000108.4E124T120-E124 WeakPolarHBondContact CB-OE2 3.44Å; T120-E124 WeakPolarHBondContact CG2-OE2 3.43Å
121T37Very low38.6Very low100 Ų100121.3 Ų121.361%0.61363%0.633SS**  trans-50.5143.6174.923.80000109.5Y119 K123 E124Y119-T121 PolarHBondContact O-N 3.3Å; T121-K123 PolarHBondContact O-N 3.43Å; T121-E124 PolarHBondContact O-N 2.99Å
122S48.8Very low39.4Very low91 Ų91121.2 Ų121.264%0.63662%0.623SS**THydrogen-bonded Turntrans-39.8-22.6178.549.10000116.2E124 L125 E126S122-E124 PolarHBondContact O-N 3.2Å; S122-L125 PolarHBondContact O-N 3.44Å; S122-E126 PolarHBondContact O-N 2.89Å; S122-E126 VanDerWaalsContact O-N 3.15Å
123K44.3Very low40.4Very low159 Ų159116.1 Ų116.169%0.69160%0.599SS**Hα-helixtrans-60.6-34.9173.9-64.3-171175.8-1750114.7T121 Q127T121-K123 PolarHBondContact O-N 3.43Å; K123-Q127 WeakPolarHBondContact O-CB 3.38Å; K123-Q127 PolarHBondContact O-N 3.4Å
124E45.1Very low41.4Very low121 Ų121112.1 Ų112.157%0.56558%0.584SS**Hα-helixtrans-72.6-31.2176.7-84.1-173.8177.100112.2T120 T121 S122 S128T120-E124 WeakPolarHBondContact CB-OE2 3.44Å; T120-E124 WeakPolarHBondContact CG2-OE2 3.43Å; T121-E124 PolarHBondContact O-N 2.99Å; S122-E124 PolarHBondContact O-N 3.2Å; E124-S128 WeakPolarHBondContact O-CB 3.5Å; E124-S128 PolarHBondContact O-N 3.45Å
125L42.7Very low42.7Very low136 Ų136109 Ų10971%0.71257%0.574SS**Hα-helixtrans-68.4-43.7174.5-153.790.4000110.6S122 S128 F129S122-L125 PolarHBondContact O-N 3.44Å; L125-S128 PolarHBondContact O-N 3.02Å; L125-S128 PolarHBondContact O-OG 3.41Å; L125-F129 PolarHBondContact O-N 2.92Å
126E44.5Very low43.8Very low127 Ų127105.9 Ų105.959%0.59356%0.557SS**Hα-helixtrans-63.4-39.9174.7-74-178.2171.800112.3S122 F129 N130S122-E126 PolarHBondContact O-N 2.89Å; S122-E126 VanDerWaalsContact O-N 3.15Å; E126-F129 PolarHBondContact O-N 3.45Å; E126-N130 WeakPolarHBondContact O-CB 3.44Å; E126-N130 PolarHBondContact O-N 2.82Å; E126-N130 PolarHBondContact O-ND2 3.34Å
127Q46.1Very low45.3Very low107 Ų107104.6 Ų104.650%0.555%0.545SS..Hα-helixtrans-64.6-43.4174.9-169.365.737.800111.3K123 F129 N130 D131K123-Q127 WeakPolarHBondContact O-CB 3.38Å; K123-Q127 PolarHBondContact O-N 3.4Å; Q127-F129 VanDerWaalsContact C-N 3.28Å; Q127-F129 PolarHBondContact O-N 3.41Å; Q127-N130 PolarHBondContact O-N 2.96Å; Q127-D131 PolarHBondContact NE2-OD1 3.38Å; Q127-D131 WeakPolarHBondContact O-CB 3.48Å; Q127-D131 PolarHBondContact O-N 3.01Å
128S46.1Very low46.8Very low53 Ų53103.7 Ų103.737%0.37154%0.537SS..Hα-helixtrans-62.4-35.5176.779.60000112.7E124 L125 Q132E124-S128 WeakPolarHBondContact O-CB 3.5Å; E124-S128 PolarHBondContact O-N 3.45Å; L125-S128 PolarHBondContact O-N 3.02Å; L125-S128 PolarHBondContact O-OG 3.41Å; S128-Q132 WeakPolarHBondContact O-CB 3.26Å; S128-Q132 VanDerWaalsContact O-CG 3.26Å; S128-Q132 WeakPolarHBondContact O-CG 3.34Å; S128-Q132 PolarHBondContact O-N 3.08Å
129F49.4Very low48.5Very low123 Ų123102.7 Ų102.754%0.53953%0.528SS..Hα-helixtrans-71-41.9176.3-169-95000111.4L125 E126 Q127 Q132 Q133L125-F129 PolarHBondContact O-N 2.92Å; E126-F129 PolarHBondContact O-N 3.45Å; Q127-F129 VanDerWaalsContact C-N 3.28Å; Q127-F129 PolarHBondContact O-N 3.41Å; F129-Q132 PolarHBondContact O-N 2.93Å; F129-Q133 WeakPolarHBondContact O-CB 3.27Å; F129-Q133 PolarHBondContact O-N 3.25Å
130N51.4Low50.1Low96 Ų9697.3 Ų97.351%0.51351%0.51SS..Hα-helixtrans-65.1-39.8174.7-76.6-27.6000112.2E126 Q127 Q133 S134E126-N130 WeakPolarHBondContact O-CB 3.44Å; E126-N130 PolarHBondContact O-N 2.82Å; E126-N130 PolarHBondContact O-ND2 3.34Å; Q127-N130 PolarHBondContact O-N 2.96Å; N130-Q133 PolarHBondContact O-N 3.32Å; N130-S134 VanDerWaalsContact O-CB 3.24Å; N130-S134 WeakPolarHBondContact O-CB 3.4Å; N130-S134 PolarHBondContact O-N 2.88Å
131D48.2Very low51.6Low76 Ų7698.7 Ų98.741%0.40651%0.509SS..Hα-helixtrans-66.3-41.6175.8-66.7-16.6000110.3Q127 S134 I135Q127-D131 PolarHBondContact NE2-OD1 3.38Å; Q127-D131 WeakPolarHBondContact O-CB 3.48Å; Q127-D131 PolarHBondContact O-N 3.01Å; D131-S134 PolarHBondContact O-N 3.48Å; D131-I135 WeakPolarHBondContact O-CB 3.43Å; D131-I135 WeakPolarHBondContact O-CD1 3.35Å; D131-I135 WeakPolarHBondContact O-CG1 3.28Å; D131-I135 PolarHBondContact O-N 3.48Å
132Q49.2Very low53.1Low130 Ų13096.7 Ų96.761%0.60749%0.494SS*.Hα-helixtrans-63-43.2173.2-78.9179.9-18.700112.6S128 F129 I135 M136S128-Q132 WeakPolarHBondContact O-CB 3.26Å; S128-Q132 VanDerWaalsContact O-CG 3.26Å; S128-Q132 WeakPolarHBondContact O-CG 3.34Å; S128-Q132 PolarHBondContact O-N 3.08Å; F129-Q132 PolarHBondContact O-N 2.93Å; Q132-I135 PolarHBondContact O-N 3.39Å; Q132-M136 WeakPolarHBondContact O-CB 3.25Å; Q132-M136 PolarHBondContact O-N 3.42Å
133Q49.2Very low54.1Low80 Ų8098.6 Ų98.637%0.37449%0.487SS..Hα-helixtrans-64-41.8175.9-164.392.737.800110.9F129 N130 M136 N137F129-Q133 WeakPolarHBondContact O-CB 3.27Å; F129-Q133 PolarHBondContact O-N 3.25Å; N130-Q133 PolarHBondContact O-N 3.32Å; Q133-M136 PolarHBondContact O-N 3.27Å; Q133-N137 WeakPolarHBondContact O-CB 3.43Å; Q133-N137 PolarHBondContact O-N 2.96Å; Q133-N137 PolarHBondContact O-ND2 3.37Å; Q133-N137 PolarHBondContact O-OD1 2.88Å
134S51.9Low55.2Low65 Ų6596.5 Ų96.546%0.45548%0.48SS..Hα-helixtrans-63.8-42.6175.5-178.50000112N130 D131 N137 T138N130-S134 VanDerWaalsContact O-CB 3.24Å; N130-S134 WeakPolarHBondContact O-CB 3.4Å; N130-S134 PolarHBondContact O-N 2.88Å; D131-S134 PolarHBondContact O-N 3.48Å; S134-N137 PolarHBondContact O-N 3.46Å; S134-T138 WeakPolarHBondContact O-CB 3.36Å; S134-T138 WeakPolarHBondContact O-CG2 3.32Å; S134-T138 PolarHBondContact O-N 3.25Å; S134-T138 PolarHBondContact O-OG1 2.68Å
135I54.4Low56.5Low104 Ų10496.8 Ų96.853%0.53348%0.476SS..Hα-helixtrans-65.3-40.8174.7-68.3162.9000110.7D131 Q132 T138 T139D131-I135 WeakPolarHBondContact O-CB 3.43Å; D131-I135 WeakPolarHBondContact O-CD1 3.35Å; D131-I135 WeakPolarHBondContact O-CG1 3.28Å; D131-I135 PolarHBondContact O-N 3.48Å; Q132-I135 PolarHBondContact O-N 3.39Å; I135-T138 VanDerWaalsContact CA-OG1 3.24Å; I135-T138 WeakPolarHBondContact CA-OG1 3.48Å; I135-T138 PolarHBondContact O-N 3.4Å; I135-T138 PolarHBondContact O-OG1 2.89Å; I135-T139 HydrophobicContact CG2-CG2 4.36Å; I135-T139 WeakPolarHBondContact O-CB 3.38Å; I135-T139 VanDerWaalsContact O-CG2 3.29Å; I135-T139 WeakPolarHBondContact O-CG2 3.33Å; I135-T139 PolarHBondContact O-N 3.06Å; I135-T139 PolarHBondContact O-OG1 3.25Å
136M52.4Low57.9Low85 Ų8594.9 Ų94.942%0.41947%0.47SS..Hα-helixtrans-63.2-44.7175.5-171.1175.967.900111.2Q132 Q133 T139 Q140Q132-M136 WeakPolarHBondContact O-CB 3.25Å; Q132-M136 PolarHBondContact O-N 3.42Å; Q133-M136 PolarHBondContact O-N 3.27Å; M136-T139 WeakPolarHBondContact CA-OG1 3.26Å; M136-T139 PolarHBondContact O-N 3.34Å; M136-T139 PolarHBondContact O-OG1 2.97Å; M136-Q140 WeakPolarHBondContact O-CB 3.36Å; M136-Q140 WeakPolarHBondContact O-CG 3.49Å; M136-Q140 PolarHBondContact O-N 3.28Å
137N59.6Low59.3Low84 Ų8491.2 Ų91.245%0.44946%0.456SS..Hα-helixtrans-65.2-42.6177.5-67.8-16.9000111.8Q133 S134 Q140 F141Q133-N137 WeakPolarHBondContact O-CB 3.43Å; Q133-N137 PolarHBondContact O-N 2.96Å; Q133-N137 PolarHBondContact O-ND2 3.37Å; Q133-N137 PolarHBondContact O-OD1 2.88Å; S134-N137 PolarHBondContact O-N 3.46Å; N137-Q140 PolarHBondContact O-N 3.36Å; N137-F141 WeakPolarHBondContact O-CB 3.47Å; N137-F141 PolarHBondContact O-N 2.89Å
138T59.6Low60.6Low68 Ų6890.5 Ų90.542%0.41745%0.453SS..Hα-helixtrans-67.9-39.1177.8480000112S134 I135 F141 L142S134-T138 WeakPolarHBondContact O-CB 3.36Å; S134-T138 WeakPolarHBondContact O-CG2 3.32Å; S134-T138 PolarHBondContact O-N 3.25Å; S134-T138 PolarHBondContact O-OG1 2.68Å; I135-T138 VanDerWaalsContact CA-OG1 3.24Å; I135-T138 WeakPolarHBondContact CA-OG1 3.48Å; I135-T138 PolarHBondContact O-N 3.4Å; I135-T138 PolarHBondContact O-OG1 2.89Å; T138-F141 PolarHBondContact O-N 3.45Å; T138-L142 WeakPolarHBondContact O-CB 3.46Å; T138-L142 VanDerWaalsContact O-CG 3.22Å; T138-L142 WeakPolarHBondContact O-CG 3.39Å; T138-L142 PolarHBondContact O-N 3.25Å
139T68.1Low61.9Low50 Ų5092.6 Ų92.631%0.30746%0.456SS..Hα-helixtrans-67.4-36.9174.5530000112.4I135 M136 R143I135-T139 HydrophobicContact CG2-CG2 4.36Å; I135-T139 WeakPolarHBondContact O-CB 3.38Å; I135-T139 VanDerWaalsContact O-CG2 3.29Å; I135-T139 WeakPolarHBondContact O-CG2 3.33Å; I135-T139 PolarHBondContact O-N 3.06Å; I135-T139 PolarHBondContact O-OG1 3.25Å; M136-T139 WeakPolarHBondContact CA-OG1 3.26Å; M136-T139 PolarHBondContact O-N 3.34Å; M136-T139 PolarHBondContact O-OG1 2.97Å; T139-R143 WeakPolarHBondContact O-CB 3.27Å; T139-R143 WeakPolarHBondContact O-CG 3.22Å; T139-R143 PolarHBondContact O-N 2.96Å; T139-R143 PolarHBondContact O-NE 3Å; T139-R143 PolarHBondContact OG1-NH2 3.31Å
140Q66.8Low63.1Low103 Ų10391.3 Ų91.348%0.48146%0.455SS..Hα-helixtrans-64.5-45.7171.4-75.4179.1-6.800111.7M136 N137 L142 R143 Q144M136-Q140 WeakPolarHBondContact O-CB 3.36Å; M136-Q140 WeakPolarHBondContact O-CG 3.49Å; M136-Q140 PolarHBondContact O-N 3.28Å; N137-Q140 PolarHBondContact O-N 3.36Å; Q140-L142 PolarHBondContact O-N 3.32Å; Q140-R143 PolarHBondContact O-N 2.84Å; Q140-Q144 WeakPolarHBondContact O-CB 3.28Å; Q140-Q144 PolarHBondContact O-N 2.89Å
141F68.4Low64.4Low115 Ų11589.9 Ų89.950%0.50445%0.446SS..Hα-helixtrans-61.2-44.2176.3178.7-98.5000112.1N137 T138 Q144 R145N137-F141 WeakPolarHBondContact O-CB 3.47Å; N137-F141 PolarHBondContact O-N 2.89Å; T138-F141 PolarHBondContact O-N 3.45Å; F141-Q144 PolarHBondContact O-N 2.84Å; F141-R145 VanDerWaalsContact O-CB 3.26Å; F141-R145 WeakPolarHBondContact O-CB 3.4Å; F141-R145 PolarHBondContact O-N 3.32Å
142L69.1Low65.8Low57 Ų5792 Ų9230%0.29845%0.454SS..Hα-helixtrans-64.1-44.2176.5-74.4172.1000111.4I70 T138 Q140 R145 V146I70-L142 HydrophobicContact CD1-CD2 4.03Å; I70-L142 HydrophobicContact CG1-CD2 4.41Å; I70-L142 HydrophobicContact CG2-CD1 3.91Å; I70-L142 HydrophobicContact CG2-CD2 3.61Å; I70-L142 HydrophobicContact CG2-CG 4.43Å; T138-L142 WeakPolarHBondContact O-CB 3.46Å; T138-L142 VanDerWaalsContact O-CG 3.22Å; T138-L142 WeakPolarHBondContact O-CG 3.39Å; T138-L142 PolarHBondContact O-N 3.25Å; Q140-L142 PolarHBondContact O-N 3.32Å; L142-R145 PolarHBondContact O-N 3.09Å; L142-V146 WeakPolarHBondContact O-CB 3.33Å; L142-V146 VanDerWaalsContact O-CG2 3.24Å; L142-V146 WeakPolarHBondContact O-CG2 3.44Å; L142-V146 PolarHBondContact O-N 3.14Å
143R70.6Confident67.1Low131 Ų13190.6 Ų90.649%0.49445%0.446SS..Hα-helixtrans-57.9-51.3173.9-85.1-174.8-78.8-110.3-3.1110.9T139 Q140 R145 V146 T147T139-R143 WeakPolarHBondContact O-CB 3.27Å; T139-R143 WeakPolarHBondContact O-CG 3.22Å; T139-R143 PolarHBondContact O-N 2.96Å; T139-R143 PolarHBondContact O-NE 3Å; T139-R143 PolarHBondContact OG1-NH2 3.31Å; Q140-R143 PolarHBondContact O-N 2.84Å; R143-R145 VanDerWaalsContact C-N 3.29Å; R143-R145 PolarHBondContact O-N 3.03Å; R143-V146 PolarHBondContact O-N 3.04Å; R143-T147 WeakPolarHBondContact O-CB 3.29Å; R143-T147 PolarHBondContact O-N 2.84Å; R143-T147 PolarHBondContact O-OG1 3.48Å
144Q65.7Low68.3Low115 Ų11589.2 Ų89.254%0.53744%0.441SS..Hα-helixtrans-56.2-45.5178.3-177.2177-6.700111.3Q140 F141 T147 E148Q140-Q144 WeakPolarHBondContact O-CB 3.28Å; Q140-Q144 PolarHBondContact O-N 2.89Å; F141-Q144 PolarHBondContact O-N 2.84Å; Q144-T147 WeakPolarHBondContact O-CB 3.42Å; Q144-T147 PolarHBondContact O-N 3.12Å; Q144-E148 WeakPolarHBondContact CG-OE1 3.24Å; Q144-E148 PolarHBondContact NE2-OE1 3.21Å; Q144-E148 WeakPolarHBondContact O-CB 3.46Å; Q144-E148 WeakPolarHBondContact O-CG 3.27Å; Q144-E148 PolarHBondContact O-N 3.36Å
145R72.5Confident69.4Low128 Ų12889.8 Ų89.848%0.48344%0.439SS..Hα-helixtrans-70-36.4-178.7-164172.1171.6101.40113.2F141 L142 R143 H149F141-R145 VanDerWaalsContact O-CB 3.26Å; F141-R145 WeakPolarHBondContact O-CB 3.4Å; F141-R145 PolarHBondContact O-N 3.32Å; L142-R145 PolarHBondContact O-N 3.09Å; R143-R145 VanDerWaalsContact C-N 3.29Å; R143-R145 PolarHBondContact O-N 3.03Å; R145-H149 PolarHBondContact O-CD2 3.48Å; R145-H149 PolarHBondContact O-N 3.3Å; R145-H149 VanDerWaalsContact O-N 3.08Å
146V72.6Confident70.7Confident96 Ų9690.8 Ų90.858%0.58244%0.436SS*.Hα-helixtrans-65.6-44.4172.2168.80000110L142 R143 H149 L150L142-V146 WeakPolarHBondContact O-CB 3.33Å; L142-V146 VanDerWaalsContact O-CG2 3.24Å; L142-V146 WeakPolarHBondContact O-CG2 3.44Å; L142-V146 PolarHBondContact O-N 3.14Å; R143-V146 PolarHBondContact O-N 3.04Å; V146-H149 PolarHBondContact O-N 3.16Å; V146-L150 VanDerWaalsContact O-CB 3.27Å; V146-L150 WeakPolarHBondContact O-CB 3.22Å; V146-L150 PolarHBondContact O-N 3.44Å
147T73.9Confident71.6Confident50 Ų5090.8 Ų90.831%0.30743%0.434SS..Hα-helixtrans-59.8-47.8176.1-68.10000111.6R143 Q144 H149 L150 I151 L185R143-T147 WeakPolarHBondContact O-CB 3.29Å; R143-T147 PolarHBondContact O-N 2.84Å; R143-T147 PolarHBondContact O-OG1 3.48Å; Q144-T147 WeakPolarHBondContact O-CB 3.42Å; Q144-T147 PolarHBondContact O-N 3.12Å; T147-H149 PolarHBondContact O-N 2.95Å; T147-L150 PolarHBondContact O-N 2.87Å; T147-I151 HydrophobicContact CG2-CD1 3.7Å; T147-I151 HydrophobicContact CG2-CG1 4.43Å; T147-I151 WeakPolarHBondContact O-CB 3.18Å; T147-I151 WeakPolarHBondContact O-CD1 3.43Å; T147-I151 WeakPolarHBondContact O-CG1 3.4Å; T147-I151 PolarHBondContact O-N 2.76Å; T147-L185 HydrophobicContact CG2-CD2 3.36Å
148E73.8Confident72.1Confident91 Ų9188 Ų8843%0.42542%0.42SS..Hα-helixtrans-57.7-49.4176.6-76.5168.7-170.100111.1Q144 L150 I151 E152Q144-E148 WeakPolarHBondContact CG-OE1 3.24Å; Q144-E148 PolarHBondContact NE2-OE1 3.21Å; Q144-E148 WeakPolarHBondContact O-CB 3.46Å; Q144-E148 WeakPolarHBondContact O-CG 3.27Å; Q144-E148 PolarHBondContact O-N 3.36Å; E148-L150 PolarHBondContact O-N 3.31Å; E148-I151 PolarHBondContact O-N 2.85Å; E148-E152 WeakPolarHBondContact O-CG 3.43Å; E148-E152 PolarHBondContact O-N 3.17Å
149H72.5Confident72.6Confident97 Ų9789.6 Ų89.645%0.44943%0.425SS..Hα-helixtrans-65.8-35.7177.3-80.9-38.7000113.6R145 V146 T147 E152 F153R145-H149 PolarHBondContact O-CD2 3.48Å; R145-H149 PolarHBondContact O-N 3.3Å; R145-H149 VanDerWaalsContact O-N 3.08Å; V146-H149 PolarHBondContact O-N 3.16Å; T147-H149 PolarHBondContact O-N 2.95Å; H149-E152 IonicContact CE1-OE2 3.19Å; H149-E152 IonicContact ND1-OE2 3.56Å; H149-E152 PolarHBondContact ND1-OE2 2.9Å; H149-E152 PolarHBondContact O-N 3.41Å; H149-F153 VanDerWaalsContact O-CB 3.26Å; H149-F153 WeakPolarHBondContact O-CB 3.48Å; H149-F153 PolarHBondContact O-N 3.45Å
150L76.1Confident72.5Confident97 Ų9788.3 Ų88.351%0.50842%0.418SS..Hα-helixtrans-66.2-42.4176.8-167.872.9000110.4V146 T147 E148 F153 L154V146-L150 VanDerWaalsContact O-CB 3.27Å; V146-L150 WeakPolarHBondContact O-CB 3.22Å; V146-L150 PolarHBondContact O-N 3.44Å; T147-L150 PolarHBondContact O-N 2.87Å; E148-L150 PolarHBondContact O-N 3.31Å; L150-F153 PolarHBondContact O-N 3.48Å; L150-L154 HydrophobicContact CG-CD1 4.1Å; L150-L154 HydrophobicContact CG-CG 4.5Å; L150-L154 WeakPolarHBondContact O-CB 3.22Å; L150-L154 VanDerWaalsContact O-CG 3.22Å; L150-L154 WeakPolarHBondContact O-CG 3.47Å; L150-L154 PolarHBondContact O-N 2.87Å
151I78.6Confident72.2Confident66 Ų6686.3 Ų86.334%0.33841%0.409SS..Hα-helixtrans-62.5-47.8175.2-68.6164.4000110.5T147 E148 F153 L154 N155 L185T147-I151 HydrophobicContact CG2-CD1 3.7Å; T147-I151 HydrophobicContact CG2-CG1 4.43Å; T147-I151 WeakPolarHBondContact O-CB 3.18Å; T147-I151 WeakPolarHBondContact O-CD1 3.43Å; T147-I151 WeakPolarHBondContact O-CG1 3.4Å; T147-I151 PolarHBondContact O-N 2.76Å; E148-I151 PolarHBondContact O-N 2.85Å; I151-F153 VanDerWaalsContact C-N 3.34Å; I151-F153 PolarHBondContact O-N 3.37Å; I151-L154 PolarHBondContact O-N 3.41Å; I151-N155 VanDerWaalsContact O-CB 3.29Å; I151-N155 WeakPolarHBondContact O-CB 3.33Å; I151-N155 VanDerWaalsContact O-CG 3.31Å; I151-N155 PolarHBondContact O-N 2.84Å; I151-N155 PolarHBondContact O-ND2 2.85Å; I151-L185 HydrophobicContact CD1-CD1 3.8Å; I151-L185 HydrophobicContact CG1-CD1 4.06Å
152E77.2Confident71.6Confident119 Ų11982.8 Ų82.856%0.55640%0.395SS*.Hα-helixtrans-58.4-45.8176.3-74.8176.6169.800111.6E148 H149 N155 W156E148-E152 WeakPolarHBondContact O-CG 3.43Å; E148-E152 PolarHBondContact O-N 3.17Å; H149-E152 IonicContact CE1-OE2 3.19Å; H149-E152 IonicContact ND1-OE2 3.56Å; H149-E152 PolarHBondContact ND1-OE2 2.9Å; H149-E152 PolarHBondContact O-N 3.41Å; E152-N155 PolarHBondContact O-N 2.82Å; E152-W156 WeakPolarHBondContact O-CB 3.26Å; E152-W156 PolarHBondContact O-N 3Å
153F76.8Confident70.8Confident102 Ų10286.8 Ų86.845%0.44741%0.41SS..Hα-helixtrans-64.4-45.7178.2175.1-96.7000112.2H149 L150 I151 W156 F157H149-F153 VanDerWaalsContact O-CB 3.26Å; H149-F153 WeakPolarHBondContact O-CB 3.48Å; H149-F153 PolarHBondContact O-N 3.45Å; L150-F153 PolarHBondContact O-N 3.48Å; I151-F153 VanDerWaalsContact C-N 3.34Å; I151-F153 PolarHBondContact O-N 3.37Å; F153-W156 HydrophobicContact CD2-CE3 4.09Å; F153-W156 HydrophobicContact CD2-CZ3 4.39Å; F153-W156 HydrophobicContact CE2-CE3 4.03Å; F153-W156 AromaticContact CE2-CZ3 3.89Å; F153-W156 HydrophobicContact CE2-CZ3 3.89Å; F153-W156 PolarHBondContact O-N 2.79Å; F153-F157 HydrophobicContact CE1-CB 4.48Å; F153-F157 VanDerWaalsContact O-CB 3.25Å; F153-F157 WeakPolarHBondContact O-CB 3.16Å; F153-F157 PolarHBondContact O-N 3.36Å
154L74.7Confident69.9Low50 Ų5088 Ų8826%0.26242%0.421SS..Hα-helixtrans-63.9-42.7178.2-74.2171.6000111.1L150 I151 F157 V158 L181L150-L154 HydrophobicContact CG-CD1 4.1Å; L150-L154 HydrophobicContact CG-CG 4.5Å; L150-L154 WeakPolarHBondContact O-CB 3.22Å; L150-L154 VanDerWaalsContact O-CG 3.22Å; L150-L154 WeakPolarHBondContact O-CG 3.47Å; L150-L154 PolarHBondContact O-N 2.87Å; I151-L154 PolarHBondContact O-N 3.41Å; L154-F157 PolarHBondContact O-N 2.83Å; L154-V158 WeakPolarHBondContact O-CB 3.29Å; L154-V158 VanDerWaalsContact O-CG2 3.27Å; L154-V158 WeakPolarHBondContact O-CG2 3.42Å; L154-V158 PolarHBondContact O-N 2.83Å; L154-L181 HydrophobicContact CD1-CD1 4.05Å; L154-L181 HydrophobicContact CD1-CD2 3.7Å
155N74.8Confident69.1Low78 Ų7884.7 Ų84.742%0.41741%0.409SS..Hα-helixtrans-61.4-46.2174.6-78.7-22000111.4I151 E152 L159I151-N155 VanDerWaalsContact O-CB 3.29Å; I151-N155 WeakPolarHBondContact O-CB 3.33Å; I151-N155 VanDerWaalsContact O-CG 3.31Å; I151-N155 PolarHBondContact O-N 2.84Å; I151-N155 PolarHBondContact O-ND2 2.85Å; E152-N155 PolarHBondContact O-N 2.82Å; N155-L159 WeakPolarHBondContact O-CB 3.33Å; N155-L159 VanDerWaalsContact O-CG 3.28Å; N155-L159 WeakPolarHBondContact O-CG 3.48Å; N155-L159 PolarHBondContact O-N 3.45Å
156W80.1Confident68Low124 Ų12487.9 Ų87.947%0.4743%0.43SS..Hα-helixtrans-61-44.9175.1172.676.2000111.9L55 E152 F153 L159 S160L55-W156 HydrophobicContact CD2-CH2 4.09Å; L55-W156 HydrophobicContact CD2-CZ3 4.26Å; E152-W156 WeakPolarHBondContact O-CB 3.26Å; E152-W156 PolarHBondContact O-N 3Å; F153-W156 HydrophobicContact CD2-CE3 4.09Å; F153-W156 HydrophobicContact CD2-CZ3 4.39Å; F153-W156 HydrophobicContact CE2-CE3 4.03Å; F153-W156 AromaticContact CE2-CZ3 3.89Å; F153-W156 HydrophobicContact CE2-CZ3 3.89Å; F153-W156 PolarHBondContact O-N 2.79Å; W156-L159 PolarHBondContact O-N 2.99Å; W156-S160 PolarHBondContact NE1-OG 3.5Å; W156-S160 WeakPolarHBondContact O-CB 3.45Å; W156-S160 PolarHBondContact O-N 2.89Å; W156-S160 PolarHBondContact O-OG 3.31Å
157F72.9Confident67.1Low85 Ų8588.5 Ų88.537%0.37343%0.429SS..Hα-helixtrans-63.9-45.6-179.4-179.5-96.6000111.9F153 L154 L159 Q161F153-F157 HydrophobicContact CE1-CB 4.48Å; F153-F157 VanDerWaalsContact O-CB 3.25Å; F153-F157 WeakPolarHBondContact O-CB 3.16Å; F153-F157 PolarHBondContact O-N 3.36Å; L154-F157 PolarHBondContact O-N 2.83Å; F157-L159 VanDerWaalsContact C-N 3.34Å; F157-Q161 HydrophobicContact CD2-CG 3.84Å; F157-Q161 HydrophobicContact CE1-CG 4.34Å; F157-Q161 HydrophobicContact CE2-CG 3.58Å; F157-Q161 HydrophobicContact CG-CG 4.35Å; F157-Q161 HydrophobicContact CZ-CB 4.43Å; F157-Q161 HydrophobicContact CZ-CG 3.85Å; F157-Q161 VanDerWaalsContact O-CB 3.25Å; F157-Q161 WeakPolarHBondContact O-CB 3.44Å; F157-Q161 WeakPolarHBondContact O-CG 3.36Å; F157-Q161 PolarHBondContact O-N 3.19Å
158V68.5Low66Low27 Ų2796 Ų9616%0.16446%0.457CS..Hα-helixtrans-59-48172.7166.40000109.4L154 S160 I162 F163L154-V158 WeakPolarHBondContact O-CB 3.29Å; L154-V158 VanDerWaalsContact O-CG2 3.27Å; L154-V158 WeakPolarHBondContact O-CG2 3.42Å; L154-V158 PolarHBondContact O-N 2.83Å; V158-S160 PolarHBondContact O-N 3.38Å; V158-I162 HydrophobicContact CB-CD1 4.22Å; V158-I162 HydrophobicContact CG1-CD1 3.93Å; V158-I162 HydrophobicContact CG2-CD1 4.1Å; V158-I162 WeakPolarHBondContact O-CA 3.39Å; V158-I162 WeakPolarHBondContact O-CB 3.34Å; V158-I162 PolarHBondContact O-N 3.34Å; V158-F163 HydrophobicContact CG1-CE2 4.4Å
159L70.6Confident65.1Low101 Ų10193.7 Ų93.753%0.52945%0.449SS..Iπ-helixtrans-59-52.6-179.6-76.3172.9000113.1N155 W156 F157 F163N155-L159 WeakPolarHBondContact O-CB 3.33Å; N155-L159 VanDerWaalsContact O-CG 3.28Å; N155-L159 WeakPolarHBondContact O-CG 3.48Å; N155-L159 PolarHBondContact O-N 3.45Å; W156-L159 PolarHBondContact O-N 2.99Å; F157-L159 VanDerWaalsContact C-N 3.34Å; L159-F163 HydrophobicContact CD2-CD2 3.69Å; L159-F163 HydrophobicContact CD2-CE2 3.9Å; L159-F163 WeakPolarHBondContact O-CB 3.38Å; L159-F163 PolarHBondContact O-N 2.91Å
160S66.5Low64.7Low22 Ų2294 Ų9415%0.15445%0.454CS..Iπ-helixtrans-72.6-40.7-176.6-66.70000113.1W156 V158 E164W156-S160 PolarHBondContact NE1-OG 3.5Å; W156-S160 WeakPolarHBondContact O-CB 3.45Å; W156-S160 PolarHBondContact O-N 2.89Å; W156-S160 PolarHBondContact O-OG 3.31Å; V158-S160 PolarHBondContact O-N 3.38Å; S160-E164 VanDerWaalsContact O-CB 3.31Å; S160-E164 WeakPolarHBondContact O-CB 3.34Å
161Q60.2Low64.3Low62 Ų6294.5 Ų94.529%0.2945%0.454SS..Iπ-helixtrans-85.2-34.4-176.6-63.6-64.5-13.100112.8F157 T165F157-Q161 HydrophobicContact CD2-CG 3.84Å; F157-Q161 HydrophobicContact CE1-CG 4.34Å; F157-Q161 HydrophobicContact CE2-CG 3.58Å; F157-Q161 HydrophobicContact CG-CG 4.35Å; F157-Q161 HydrophobicContact CZ-CB 4.43Å; F157-Q161 HydrophobicContact CZ-CG 3.85Å; F157-Q161 VanDerWaalsContact O-CB 3.25Å; F157-Q161 WeakPolarHBondContact O-CB 3.44Å; F157-Q161 WeakPolarHBondContact O-CG 3.36Å; F157-Q161 PolarHBondContact O-N 3.19Å; Q161-T165 WeakPolarHBondContact O-CB 3.37Å; Q161-T165 WeakPolarHBondContact O-CG2 3.5Å; Q161-T165 PolarHBondContact O-OG1 3.05Å
162I55.8Low64Low41 Ų4197 Ų9721%0.2147%0.467CS..Iπ-helixtrans-93.6-35.2-172.1-63.3171.5000112V158 T165 V169V158-I162 HydrophobicContact CB-CD1 4.22Å; V158-I162 HydrophobicContact CG1-CD1 3.93Å; V158-I162 HydrophobicContact CG2-CD1 4.1Å; V158-I162 WeakPolarHBondContact O-CA 3.39Å; V158-I162 WeakPolarHBondContact O-CB 3.34Å; V158-I162 PolarHBondContact O-N 3.34Å; I162-T165 CarbonylContact C-O 3.55Å; I162-V169 HydrophobicContact CB-CG2 3.99Å; I162-V169 HydrophobicContact CD1-CG2 3.8Å; I162-V169 HydrophobicContact CG1-CG2 3.64Å; I162-V169 HydrophobicContact CG2-CB 3.54Å; I162-V169 HydrophobicContact CG2-CG1 4.42Å; I162-V169 HydrophobicContact CG2-CG2 3.29Å
163F53Low63.8Low141 Ų14195.7 Ų95.762%0.61846%0.464SS*.Iπ-helixtrans-95.9-34-179.3-65.3-74.3000113.7V158 L159V158-F163 HydrophobicContact CG1-CE2 4.4Å; L159-F163 HydrophobicContact CD2-CD2 3.69Å; L159-F163 HydrophobicContact CD2-CE2 3.9Å; L159-F163 WeakPolarHBondContact O-CB 3.38Å; L159-F163 PolarHBondContact O-N 2.91Å
164E50.9Low63.3Low155 Ų15595.8 Ų95.872%0.72446%0.461SS*.SBendtrans-80.6-31.3178.2-56.3-177.7174.600112.5S160S160-E164 VanDerWaalsContact O-CB 3.31Å; S160-E164 WeakPolarHBondContact O-CB 3.34Å
165T49.7Very low63.4Low47 Ų4798.7 Ų98.729%0.28847%0.474SS..SBendtrans-88.6127.4165.989.50000106.6Q161 I162 I167Q161-T165 WeakPolarHBondContact O-CB 3.37Å; Q161-T165 WeakPolarHBondContact O-CG2 3.5Å; Q161-T165 PolarHBondContact O-OG1 3.05Å; I162-T165 CarbonylContact C-O 3.55Å; T165-I167 PolarHBondContact O-N 3.37Å; T165-I167 WeakPolarHBondContact OG1-CD1 3.13Å; T165-I167 WeakPolarHBondContact OG1-CG1 3.37Å
166E49.9Very low63.6Low195 Ų19598.2 Ų98.291%0.91148%0.476SS*.  trans-65.729.7178.5-64.8-179.4150.800113.5K168E166-K168 VanDerWaalsContact C-N 3.32Å; E166-K168 PolarHBondContact O-N 2.84Å
167I52.1Low63.4Low109 Ų10995.9 Ų95.956%0.55947%0.472SS*.  trans-69.195168.5-61.4174.7000106.1T165 V169T165-I167 PolarHBondContact O-N 3.37Å; T165-I167 WeakPolarHBondContact OG1-CD1 3.13Å; T165-I167 WeakPolarHBondContact OG1-CG1 3.37Å; I167-V169 VanDerWaalsContact C-N 3.29Å; I167-V169 HydrophobicContact CG2-CG2 4.34Å; I167-V169 PolarHBondContact O-N 2.87Å
168K51.8Low63.6Low207 Ų20794.2 Ų94.290%0.947%0.466SS*.  trans-52.995.8167.4-71.7-176.6175.7-175.10108.7E166 D170E166-K168 VanDerWaalsContact C-N 3.32Å; E166-K168 PolarHBondContact O-N 2.84Å; K168-D170 PolarHBondContact O-N 3.28Å
169V55Low64Low43 Ų43101 Ų10126%0.26149%0.49SS..  trans-74.6122.9168169.20000106.6I162 I167 Q171 L173 W174I162-V169 HydrophobicContact CB-CG2 3.99Å; I162-V169 HydrophobicContact CD1-CG2 3.8Å; I162-V169 HydrophobicContact CG1-CG2 3.64Å; I162-V169 HydrophobicContact CG2-CB 3.54Å; I162-V169 HydrophobicContact CG2-CG1 4.42Å; I162-V169 HydrophobicContact CG2-CG2 3.29Å; I167-V169 VanDerWaalsContact C-N 3.29Å; I167-V169 HydrophobicContact CG2-CG2 4.34Å; I167-V169 PolarHBondContact O-N 2.87Å; V169-Q171 PolarHBondContact O-N 3.1Å; V169-L173 HydrophobicContact CG1-CB 4.34Å; V169-L173 HydrophobicContact CG1-CD2 4.35Å; V169-W174 HydrophobicContact CG1-CB 4.47Å
170D63Low64.5Low102 Ų102101.2 Ų101.255%0.54549%0.488SS..  trans-52.6125.9173.4-158.6-22.9000108.4K168 D172 L173 W174K168-D170 PolarHBondContact O-N 3.28Å; D170-D172 PolarHBondContact O-N 3.3Å; D170-D172 VanDerWaalsContact O-N 3.13Å; D170-L173 HydrophobicContact CB-CB 4.22Å; D170-L173 WeakPolarHBondContact O-CA 3.37Å; D170-L173 WeakPolarHBondContact O-CB 3.39Å; D170-L173 PolarHBondContact O-N 3.01Å; D170-W174 PolarHBondContact O-N 3.43Å
171Q68.2Low64.6Low109 Ų109102.3 Ų102.351%0.50949%0.492SS..Hα-helixtrans-54.4-35-177.7177.565.723.800110.5V169 L173 W174 E175V169-Q171 PolarHBondContact O-N 3.1Å; Q171-L173 VanDerWaalsContact C-N 3.32Å; Q171-L173 PolarHBondContact O-N 2.8Å; Q171-W174 WeakPolarHBondContact O-CB 3.46Å; Q171-W174 PolarHBondContact O-N 2.8Å; Q171-E175 PolarHBondContact NE2-OE1 3.17Å; Q171-E175 PolarHBondContact O-N 3.33Å
172D72.4Confident65.3Low117 Ų117108 Ų10863%0.62651%0.511SS*.Hα-helixtrans-64.4-36.9178-64.7-11.6000111.9D170 S176D170-D172 PolarHBondContact O-N 3.3Å; D170-D172 VanDerWaalsContact O-N 3.13Å; D172-S176 WeakPolarHBondContact O-CB 3.35Å; D172-S176 PolarHBondContact O-N 2.82Å
173L72Confident66Low93 Ų93111.3 Ų111.349%0.48752%0.524SS..Hα-helixtrans-68.8-38.5175.7-176.263.9000111V169 D170 Q171 S176 I177V169-L173 HydrophobicContact CG1-CB 4.34Å; V169-L173 HydrophobicContact CG1-CD2 4.35Å; D170-L173 HydrophobicContact CB-CB 4.22Å; D170-L173 WeakPolarHBondContact O-CA 3.37Å; D170-L173 WeakPolarHBondContact O-CB 3.39Å; D170-L173 PolarHBondContact O-N 3.01Å; Q171-L173 VanDerWaalsContact C-N 3.32Å; Q171-L173 PolarHBondContact O-N 2.8Å; L173-S176 PolarHBondContact O-N 3.25Å; L173-I177 HydrophobicContact CD1-CD1 4.19Å; L173-I177 HydrophobicContact CD1-CG1 4.41Å; L173-I177 HydrophobicContact CG-CD1 3.99Å; L173-I177 WeakPolarHBondContact O-CG1 3.24Å; L173-I177 PolarHBondContact O-N 3.35Å
174W67.3Low66.6Low103 Ų103110.6 Ų110.639%0.3952%0.522SS..Hα-helixtrans-62.1-48.8175177.384.7000111.4V169 D170 Q171 S176 I177 Q178V169-W174 HydrophobicContact CG1-CB 4.47Å; D170-W174 PolarHBondContact O-N 3.43Å; Q171-W174 WeakPolarHBondContact O-CB 3.46Å; Q171-W174 PolarHBondContact O-N 2.8Å; W174-S176 VanDerWaalsContact C-N 3.3Å; W174-S176 PolarHBondContact O-N 3.36Å; W174-I177 PolarHBondContact O-N 2.94Å; W174-Q178 HydrophobicContact CD2-CG 4.02Å; W174-Q178 HydrophobicContact CG-CG 4.47Å; W174-Q178 HydrophobicContact CH2-CG 4.29Å; W174-Q178 HydrophobicContact CZ2-CG 3.75Å; W174-Q178 WeakPolarHBondContact O-CB 3.24Å; W174-Q178 WeakPolarHBondContact O-CG 3.11Å; W174-Q178 PolarHBondContact O-N 3.03Å
175E76.9Confident66.9Low111 Ų111107.2 Ų107.252%0.51951%0.509SS..Hα-helixtrans-61.3-40.6178.4-69.5-167.4-176.900111.5Q171 Q178 Y179Q171-E175 PolarHBondContact NE2-OE1 3.17Å; Q171-E175 PolarHBondContact O-N 3.33Å; E175-Q178 PolarHBondContact O-N 2.95Å; E175-Y179 VanDerWaalsContact O-CB 3.27Å; E175-Y179 WeakPolarHBondContact O-CB 3.46Å; E175-Y179 PolarHBondContact O-N 3.4Å
176S78.7Confident67.5Low68 Ų68109.8 Ų109.848%0.47653%0.529SS..Hα-helixtrans-62.2-46.3176.6-176.30000112.5D172 L173 W174 Y179 E180D172-S176 WeakPolarHBondContact O-CB 3.35Å; D172-S176 PolarHBondContact O-N 2.82Å; L173-S176 PolarHBondContact O-N 3.25Å; W174-S176 VanDerWaalsContact C-N 3.3Å; W174-S176 PolarHBondContact O-N 3.36Å; S176-Y179 PolarHBondContact O-N 2.84Å; S176-E180 PolarHBondContact O-N 2.99Å
177I75.4Confident67.4Low75 Ų75112 Ų11239%0.38553%0.53SS..Hα-helixtrans-66.5-42.3179.8-68.3168.9000110.5L173 W174 Y179 E180 L181L173-I177 HydrophobicContact CD1-CD1 4.19Å; L173-I177 HydrophobicContact CD1-CG1 4.41Å; L173-I177 HydrophobicContact CG-CD1 3.99Å; L173-I177 WeakPolarHBondContact O-CG1 3.24Å; L173-I177 PolarHBondContact O-N 3.35Å; W174-I177 PolarHBondContact O-N 2.94Å; I177-Y179 VanDerWaalsContact C-N 3.31Å; I177-Y179 PolarHBondContact O-N 2.94Å; I177-E180 PolarHBondContact O-N 2.86Å; I177-L181 HydrophobicContact CG2-CD1 3.86Å; I177-L181 HydrophobicContact CG2-CG 4.41Å; I177-L181 WeakPolarHBondContact O-CB 3.46Å; I177-L181 WeakPolarHBondContact O-CG 3.34Å; I177-L181 PolarHBondContact O-N 3.36Å
178Q76.7Confident68.1Low50 Ų50112.2 Ų112.223%0.23453%0.529CS..Hα-helixtrans-64.6-37177.3-72.6-63.2-60.100112.2W174 E175 R182W174-Q178 HydrophobicContact CD2-CG 4.02Å; W174-Q178 HydrophobicContact CG-CG 4.47Å; W174-Q178 HydrophobicContact CH2-CG 4.29Å; W174-Q178 HydrophobicContact CZ2-CG 3.75Å; W174-Q178 WeakPolarHBondContact O-CB 3.24Å; W174-Q178 WeakPolarHBondContact O-CG 3.11Å; W174-Q178 PolarHBondContact O-N 3.03Å; E175-Q178 PolarHBondContact O-N 2.95Å; Q178-R182 WeakPolarHBondContact O-CB 3.4Å; Q178-R182 WeakPolarHBondContact O-CG 2.93Å; Q178-R182 PolarHBondContact O-N 2.96Å
179Y78.3Confident69Low171 Ų171107.2 Ų107.267%0.67151%0.51SS*.Hα-helixtrans-66.2-46.7176.5-166.1-90.8000111.6E175 S176 I177 R182 F183E175-Y179 VanDerWaalsContact O-CB 3.27Å; E175-Y179 WeakPolarHBondContact O-CB 3.46Å; E175-Y179 PolarHBondContact O-N 3.4Å; S176-Y179 PolarHBondContact O-N 2.84Å; I177-Y179 VanDerWaalsContact C-N 3.31Å; I177-Y179 PolarHBondContact O-N 2.94Å; Y179-R182 PolarHBondContact O-N 3.3Å; Y179-F183 PolarHBondContact O-N 3.43Å
180E79.8Confident69.8Low104 Ų104110.8 Ų110.849%0.48652%0.523SS..Hα-helixtrans-60.4-48.5177.6-161.471.6-134.100111.3S176 I177 R182 F183 E184S176-E180 PolarHBondContact O-N 2.99Å; I177-E180 PolarHBondContact O-N 2.86Å; E180-R182 VanDerWaalsContact C-N 3.31Å; E180-R182 PolarHBondContact O-N 3.18Å; E180-F183 WeakPolarHBondContact O-CB 3.26Å; E180-F183 PolarHBondContact O-N 2.96Å; E180-E184 PolarHBondContact O-N 3.48Å
181L70.3Confident70.2Confident46 Ų46111.3 Ų111.324%0.24152%0.522CS..Hα-helixtrans-60.7-39.2177.7-74.8170.4000112.2L154 I177 F183 L185L154-L181 HydrophobicContact CD1-CD1 4.05Å; L154-L181 HydrophobicContact CD1-CD2 3.7Å; I177-L181 HydrophobicContact CG2-CD1 3.86Å; I177-L181 HydrophobicContact CG2-CG 4.41Å; I177-L181 WeakPolarHBondContact O-CB 3.46Å; I177-L181 WeakPolarHBondContact O-CG 3.34Å; I177-L181 PolarHBondContact O-N 3.36Å; L181-F183 VanDerWaalsContact C-N 3.32Å; L181-L185 WeakPolarHBondContact O-CB 3.43Å; L181-L185 WeakPolarHBondContact O-CD1 3.4Å; L181-L185 WeakPolarHBondContact O-CG 3.37Å; L181-L185 PolarHBondContact O-N 3.38Å; L181-L185 VanDerWaalsContact O-N 3.16Å
182R74.4Confident70.3Confident182 Ų182111.4 Ų111.469%0.68752%0.523SS*.Hα-helixtrans-65.9-36.8174.9-84.2-174.7179.9-159.41.4112.5Q178 Y179 E180 S186Q178-R182 WeakPolarHBondContact O-CB 3.4Å; Q178-R182 WeakPolarHBondContact O-CG 2.93Å; Q178-R182 PolarHBondContact O-N 2.96Å; Y179-R182 PolarHBondContact O-N 3.3Å; E180-R182 VanDerWaalsContact C-N 3.31Å; E180-R182 PolarHBondContact O-N 3.18Å; R182-S186 WeakPolarHBondContact O-CB 3.48Å; R182-S186 PolarHBondContact O-N 3.3Å; R182-S186 PolarHBondContact O-OG 2.72Å
183F69.8Low70.2Confident109 Ų109111.1 Ų111.148%0.47852%0.516SS..Hα-helixtrans-67.5-47.3179.5-171.7-97000111Y179 E180 L181 L185 S186 Y187Y179-F183 PolarHBondContact O-N 3.43Å; E180-F183 WeakPolarHBondContact O-CB 3.26Å; E180-F183 PolarHBondContact O-N 2.96Å; L181-F183 VanDerWaalsContact C-N 3.32Å; F183-L185 PolarHBondContact O-N 3.15Å; F183-S186 PolarHBondContact O-N 3.21Å; F183-Y187 HydrophobicContact CE1-CD2 4.25Å; F183-Y187 HydrophobicContact CE1-CE2 4.13Å; F183-Y187 HydrophobicContact CE2-CE2 4.25Å; F183-Y187 HydrophobicContact CZ-CD2 4.21Å; F183-Y187 AromaticContact CZ-CE2 3.7Å; F183-Y187 HydrophobicContact CZ-CE2 3.7Å
184E66.5Low70Confident127 Ų127112.4 Ų112.459%0.59352%0.518SS*.Hα-helixtrans-62.5-31.1177.4-70.7-169.5167.100112.9E180E180-E184 PolarHBondContact O-N 3.48Å
185L56.9Low70.2Confident84 Ų84113.1 Ų113.144%0.4453%0.528SS..Hα-helixtrans-83-13.4178.8-69.8172.7000114.5T147 I151 L181 F183T147-L185 HydrophobicContact CG2-CD2 3.36Å; I151-L185 HydrophobicContact CD1-CD1 3.8Å; I151-L185 HydrophobicContact CG1-CD1 4.06Å; L181-L185 WeakPolarHBondContact O-CB 3.43Å; L181-L185 WeakPolarHBondContact O-CD1 3.4Å; L181-L185 WeakPolarHBondContact O-CG 3.37Å; L181-L185 PolarHBondContact O-N 3.38Å; L181-L185 VanDerWaalsContact O-N 3.16Å; F183-L185 PolarHBondContact O-N 3.15Å
186S63Low69.7Low101 Ų101113.3 Ų113.371%0.70653%0.529SS*.THydrogen-bonded Turntrans-89.8-5.9179.6-59.30000113.3R182 F183R182-S186 WeakPolarHBondContact O-CB 3.48Å; R182-S186 PolarHBondContact O-N 3.3Å; R182-S186 PolarHBondContact O-OG 2.72Å; F183-S186 PolarHBondContact O-N 3.21Å
187Y46.5Very low68.9Low242 Ų242117.4 Ų117.495%0.94953%0.534SS*.  trans-101.40174.1-98.2-85.8000111.2F183F183-Y187 HydrophobicContact CE1-CD2 4.25Å; F183-Y187 HydrophobicContact CE1-CE2 4.13Å; F183-Y187 HydrophobicContact CE2-CE2 4.25Å; F183-Y187 HydrophobicContact CZ-CD2 4.21Å; F183-Y187 AromaticContact CZ-CE2 3.7Å; F183-Y187 HydrophobicContact CZ-CE2 3.7Å

Retrieved 187 of 187 residues in 33.2 ms (Link to these results)

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