A0A077Z3B2_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z3B2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 154 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
1M57.8Low67.1Low226 Ų226137.8 Ų137.8100%1.11366%0.662SS**  0-310-80.5173.1134.300114.1F3 K4M1-F3 VanDerWaalsContact C-N 3.34Å; M1-F3 PolarHBondContact O-N 2.98Å; M1-K4 PolarHBondContact O-N 3.43Å
2I67.8Low66.8Low144 Ų144129.9 Ų129.974%0.73864%0.644SS**Hα-helixtrans-58.2-37.4-177.3-67.1153.6000114.1K4 F5 T6I2-K4 VanDerWaalsContact C-N 3.33Å; I2-K4 PolarHBondContact O-N 3Å; I2-F5 PolarHBondContact O-N 2.95Å; I2-T6 PolarHBondContact O-N 3.27Å
3F61.9Low66.5Low186 Ų186132.5 Ų132.582%0.81664%0.644SS**Hα-helixtrans-64.9-29-175.3-124.5-88.1000115.1M1 T6M1-F3 VanDerWaalsContact C-N 3.34Å; M1-F3 PolarHBondContact O-N 2.98Å; F3-T6 PolarHBondContact O-OG1 3.45Å; F3-T6 VanDerWaalsContact O-OG1 3.06Å
4K63.7Low66.6Low177 Ų177127.6 Ų127.677%0.7763%0.626SS**Hα-helixtrans-74.5-33.1178.1-76-176.1175.41790111.6M1 I2 V8M1-K4 PolarHBondContact O-N 3.43Å; I2-K4 VanDerWaalsContact C-N 3.33Å; I2-K4 PolarHBondContact O-N 3Å; K4-V8 WeakPolarHBondContact O-CG2 3.17Å; K4-V8 PolarHBondContact O-N 2.92Å
5F64Low66.4Low143 Ų143125 Ų12563%0.62762%0.62SS**Hα-helixtrans-71.5-41.9-178.1-172.5-105.9000111.9I2 Y7 V8 L9I2-F5 PolarHBondContact O-N 2.95Å; F5-Y7 VanDerWaalsContact C-N 3.3Å; F5-Y7 PolarHBondContact O-N 2.96Å; F5-V8 PolarHBondContact O-N 3.22Å; F5-L9 HydrophobicContact CD1-CD1 3.74Å; F5-L9 HydrophobicContact CD1-CG 4.44Å; F5-L9 HydrophobicContact CE1-CD1 3.33Å; F5-L9 HydrophobicContact CE1-CG 4.13Å; F5-L9 HydrophobicContact CZ-CD1 3.9Å; F5-L9 HydrophobicContact CZ-CG 4.31Å; F5-L9 PolarHBondContact O-N 2.85Å; F5-L9 VanDerWaalsContact O-N 3.12Å
6T72Confident65.8Low73 Ų73121 Ų12145%0.44861%0.613SS.*Hα-helixtrans-62.8-37.217754.30000112.2I2 F3 L9 L10I2-T6 PolarHBondContact O-N 3.27Å; F3-T6 PolarHBondContact O-OG1 3.45Å; F3-T6 VanDerWaalsContact O-OG1 3.06Å; T6-L9 PolarHBondContact O-N 3.31Å; T6-L10 WeakPolarHBondContact O-CB 3.45Å; T6-L10 PolarHBondContact O-N 3Å
7Y67.1Low65.7Low134 Ų134119.6 Ų119.653%0.52561%0.607SS.*Hα-helixtrans-66.1-40.8177.8-173-102.3000113.2F5 L10 K11F5-Y7 VanDerWaalsContact C-N 3.3Å; F5-Y7 PolarHBondContact O-N 2.96Å; Y7-L10 PolarHBondContact O-N 3.06Å; Y7-K11 HydrophobicContact CD1-CD 4.27Å; Y7-K11 HydrophobicContact CE1-CD 3.6Å; Y7-K11 HydrophobicContact CE1-CG 4.32Å; Y7-K11 VanDerWaalsContact CZ-CE 3.44Å; Y7-K11 PolarHBondContact O-N 3.33Å; Y7-K11 WeakPolarHBondContact OH-CE 3.05Å; Y7-K11 PolarHBondContact OH-NZ 3.4Å
8V69.8Low65.4Low101 Ų101117.6 Ų117.661%0.61260%0.597SS**Hα-helixtrans-66.6-43.2177.41750000110.8K4 F5 K11 G12K4-V8 WeakPolarHBondContact O-CG2 3.17Å; K4-V8 PolarHBondContact O-N 2.92Å; F5-V8 PolarHBondContact O-N 3.22Å; V8-K11 PolarHBondContact O-N 3.44Å; V8-G12 PolarHBondContact O-N 3.34Å
9L71.8Confident64.9Low102 Ų102116.8 Ų116.853%0.53459%0.59SS.*Hα-helixtrans-62.3-42.5175.7-74.1176.5000112F5 T6 G12 Y13F5-L9 HydrophobicContact CD1-CD1 3.74Å; F5-L9 HydrophobicContact CD1-CG 4.44Å; F5-L9 HydrophobicContact CE1-CD1 3.33Å; F5-L9 HydrophobicContact CE1-CG 4.13Å; F5-L9 HydrophobicContact CZ-CD1 3.9Å; F5-L9 HydrophobicContact CZ-CG 4.31Å; F5-L9 PolarHBondContact O-N 2.85Å; F5-L9 VanDerWaalsContact O-N 3.12Å; T6-L9 PolarHBondContact O-N 3.31Å; L9-G12 PolarHBondContact O-N 3.29Å; L9-Y13 WeakPolarHBondContact O-CB 3.49Å; L9-Y13 PolarHBondContact O-N 3.09Å
10L76.9Confident64.5Low114 Ų114113.9 Ų113.960%0.59759%0.585SS**Hα-helixtrans-64.4-44.4178.8-169.564.4000111.4T6 Y7 Y13 T14T6-L10 WeakPolarHBondContact O-CB 3.45Å; T6-L10 PolarHBondContact O-N 3Å; Y7-L10 PolarHBondContact O-N 3.06Å; L10-Y13 PolarHBondContact O-N 3.43Å; L10-T14 WeakPolarHBondContact O-CG2 3.38Å; L10-T14 PolarHBondContact O-N 2.93Å; L10-T14 PolarHBondContact O-OG1 3.01Å
11K65.7Low64.2Low116 Ų116112.3 Ų112.350%0.50458%0.581SS.*Hα-helixtrans-61.2-46.7174.4-88.1-172.4164174.50112Y7 V8 Y13 T14 V15Y7-K11 HydrophobicContact CD1-CD 4.27Å; Y7-K11 HydrophobicContact CE1-CD 3.6Å; Y7-K11 HydrophobicContact CE1-CG 4.32Å; Y7-K11 VanDerWaalsContact CZ-CE 3.44Å; Y7-K11 PolarHBondContact O-N 3.33Å; Y7-K11 WeakPolarHBondContact OH-CE 3.05Å; Y7-K11 PolarHBondContact OH-NZ 3.4Å; V8-K11 PolarHBondContact O-N 3.44Å; K11-Y13 VanDerWaalsContact C-N 3.32Å; K11-Y13 PolarHBondContact O-N 2.95Å; K11-T14 WeakPolarHBondContact CA-OG1 3.46Å; K11-T14 PolarHBondContact O-N 2.98Å; K11-T14 PolarHBondContact O-OG1 3.11Å; K11-V15 WeakPolarHBondContact O-CG2 3.37Å; K11-V15 PolarHBondContact O-N 3.39Å; K11-V15 VanDerWaalsContact O-N 3.1Å
12G63.3Low64Low43 Ų43108.8 Ų108.844%0.44356%0.555SS.*Hα-helixtrans-58.4-44.1177.300000112.5V8 L9 V15 A16V8-G12 PolarHBondContact O-N 3.34Å; L9-G12 PolarHBondContact O-N 3.29Å; G12-V15 PolarHBondContact O-N 2.72Å; G12-A16 PolarHBondContact O-N 3.48Å
13Y63.4Low63.3Low163 Ų163103.2 Ų103.264%0.63953%0.534SS*.Hα-helixtrans-64.4-41177.9-165.4-94.4000112.3L9 L10 K11 V15 A16 L17L9-Y13 WeakPolarHBondContact O-CB 3.49Å; L9-Y13 PolarHBondContact O-N 3.09Å; L10-Y13 PolarHBondContact O-N 3.43Å; K11-Y13 VanDerWaalsContact C-N 3.32Å; K11-Y13 PolarHBondContact O-N 2.95Å; Y13-V15 PolarHBondContact O-N 3.36Å; Y13-A16 PolarHBondContact O-N 3.12Å; Y13-L17 WeakPolarHBondContact O-CB 3.4Å; Y13-L17 PolarHBondContact O-N 3Å
14T68Low62.6Low64 Ų64103.8 Ų103.839%0.39353%0.53SS..Hα-helixtrans-63.7-39.8176.656.10000112.8L10 K11 L17 I18L10-T14 WeakPolarHBondContact O-CG2 3.38Å; L10-T14 PolarHBondContact O-N 2.93Å; L10-T14 PolarHBondContact O-OG1 3.01Å; K11-T14 WeakPolarHBondContact CA-OG1 3.46Å; K11-T14 PolarHBondContact O-N 2.98Å; K11-T14 PolarHBondContact O-OG1 3.11Å; T14-L17 PolarHBondContact O-N 2.79Å; T14-I18 WeakPolarHBondContact O-CD1 3.39Å; T14-I18 VanDerWaalsContact O-CG1 3.22Å; T14-I18 WeakPolarHBondContact O-CG1 3.22Å; T14-I18 PolarHBondContact O-N 3.38Å
15V62.4Low61.8Low89 Ų8998.2 Ų98.254%0.53952%0.517SS..Hα-helixtrans-67.4-43.4177.8175.10000110.5K11 G12 Y13 L17 I18 E19K11-V15 WeakPolarHBondContact O-CG2 3.37Å; K11-V15 PolarHBondContact O-N 3.39Å; K11-V15 VanDerWaalsContact O-N 3.1Å; G12-V15 PolarHBondContact O-N 2.72Å; Y13-V15 PolarHBondContact O-N 3.36Å; V15-L17 VanDerWaalsContact C-N 3.3Å; V15-L17 PolarHBondContact O-N 3.4Å; V15-I18 PolarHBondContact O-N 2.92Å; V15-E19 PolarHBondContact O-N 3.26Å
16A57.1Low60.9Low61 Ų6195.8 Ų95.850%0.50451%0.514SS..Hα-helixtrans-60.9-39.5175.700000112.1G12 Y13 A20G12-A16 PolarHBondContact O-N 3.48Å; Y13-A16 PolarHBondContact O-N 3.12Å; A16-A20 VanDerWaalsContact O-CB 3.24Å; A16-A20 WeakPolarHBondContact O-CB 3.31Å; A16-A20 PolarHBondContact O-N 3.04Å
17L63.7Low59.2Low98 Ų98100.8 Ų100.851%0.51353%0.525SS..Hα-helixtrans-69.3-39177.6-164.673.6000112.2Y13 T14 V15 A20 T21Y13-L17 WeakPolarHBondContact O-CB 3.4Å; Y13-L17 PolarHBondContact O-N 3Å; T14-L17 PolarHBondContact O-N 2.79Å; V15-L17 VanDerWaalsContact C-N 3.3Å; V15-L17 PolarHBondContact O-N 3.4Å; L17-A20 PolarHBondContact O-N 3.1Å; L17-T21 WeakPolarHBondContact O-CB 3.37Å; L17-T21 VanDerWaalsContact O-CG2 3.3Å; L17-T21 WeakPolarHBondContact O-CG2 3.3Å; L17-T21 PolarHBondContact O-N 3.02Å; L17-T21 PolarHBondContact O-OG1 3.28Å
18I61.8Low58Low83 Ų83104.3 Ų104.343%0.42654%0.537SS..Hα-helixtrans-65.8-43.9176.1-68.5163.6000110.7T14 V15 T21 R22T14-I18 WeakPolarHBondContact O-CD1 3.39Å; T14-I18 VanDerWaalsContact O-CG1 3.22Å; T14-I18 WeakPolarHBondContact O-CG1 3.22Å; T14-I18 PolarHBondContact O-N 3.38Å; V15-I18 PolarHBondContact O-N 2.92Å; I18-T21 WeakPolarHBondContact CA-OG1 3.46Å; I18-T21 PolarHBondContact O-N 3.44Å; I18-T21 PolarHBondContact O-OG1 3.36Å; I18-R22 WeakPolarHBondContact O-CB 3.45Å; I18-R22 VanDerWaalsContact O-CG 3.31Å; I18-R22 WeakPolarHBondContact O-CG 3.42Å; I18-R22 PolarHBondContact O-N 3.47Å
19E55.9Low56.5Low102 Ų102107 Ų10748%0.47754%0.543SS..Hα-helixtrans-69-36.7177.3-72.2-58.8136.400112V15 T21 R22 G23V15-E19 PolarHBondContact O-N 3.26Å; E19-T21 VanDerWaalsContact C-N 3.35Å; E19-T21 PolarHBondContact O-N 2.78Å; E19-R22 PolarHBondContact O-N 3.37Å; E19-R22 IonicContact OE1-NH1 3.05Å; E19-R22 PolarHBondContact OE1-NH1 2.94Å; E19-G23 PolarHBondContact O-N 3.37Å
20A56.7Low55Low58 Ų58106.9 Ų106.948%0.47954%0.542SS..Hα-helixtrans-65.1-37.8173.900000112.4A16 L17 R24A16-A20 VanDerWaalsContact O-CB 3.24Å; A16-A20 WeakPolarHBondContact O-CB 3.31Å; A16-A20 PolarHBondContact O-N 3.04Å; L17-A20 PolarHBondContact O-N 3.1Å; A20-R24 WeakPolarHBondContact O-CB 3.24Å; A20-R24 PolarHBondContact O-N 3.39Å
21T58.1Low53.3Low82 Ų82106.4 Ų106.450%0.50355%0.548SS..Hα-helixtrans-73.6-37.1176.250.90000112.1L17 I18 E19 R24 A25L17-T21 WeakPolarHBondContact O-CB 3.37Å; L17-T21 VanDerWaalsContact O-CG2 3.3Å; L17-T21 WeakPolarHBondContact O-CG2 3.3Å; L17-T21 PolarHBondContact O-N 3.02Å; L17-T21 PolarHBondContact O-OG1 3.28Å; I18-T21 WeakPolarHBondContact CA-OG1 3.46Å; I18-T21 PolarHBondContact O-N 3.44Å; I18-T21 PolarHBondContact O-OG1 3.36Å; E19-T21 VanDerWaalsContact C-N 3.35Å; E19-T21 PolarHBondContact O-N 2.78Å; T21-R24 PolarHBondContact O-N 2.96Å; T21-A25 VanDerWaalsContact O-CB 3.3Å; T21-A25 WeakPolarHBondContact O-CB 3.25Å; T21-A25 PolarHBondContact O-N 3.05Å
22R53.9Low51.9Low151 Ų151104.6 Ų104.657%0.5756%0.555SS**Hα-helixtrans-62.8-46.1170.6-76.4175.3171.9177.3-4.4111.7I18 E19 A25 V26I18-R22 WeakPolarHBondContact O-CB 3.45Å; I18-R22 VanDerWaalsContact O-CG 3.31Å; I18-R22 WeakPolarHBondContact O-CG 3.42Å; I18-R22 PolarHBondContact O-N 3.47Å; E19-R22 PolarHBondContact O-N 3.37Å; E19-R22 IonicContact OE1-NH1 3.05Å; E19-R22 PolarHBondContact OE1-NH1 2.94Å; R22-A25 PolarHBondContact O-N 2.95Å; R22-V26 VanDerWaalsContact O-CG2 3.29Å; R22-V26 WeakPolarHBondContact O-CG2 3.29Å; R22-V26 PolarHBondContact O-N 3.41Å
23G51.4Low50.7Low28 Ų28111.9 Ų111.929%0.28957%0.569SS.*Hα-helixtrans-54.5-54.617200000110.8E19 A25 V26 W27E19-G23 PolarHBondContact O-N 3.37Å; G23-A25 VanDerWaalsContact C-N 3.33Å; G23-A25 PolarHBondContact O-N 2.8Å; G23-V26 WeakPolarHBondContact O-CB 3.33Å; G23-V26 PolarHBondContact O-N 2.88Å; G23-V26 VanDerWaalsContact O-N 3.12Å; G23-W27 VanDerWaalsContact C-CD1 3.48Å; G23-W27 PolarHBondContact O-N 3.4Å
24R47.3Very low49.4Very low198 Ų198109.5 Ų109.575%0.74757%0.573SS**Hα-helixtrans-61.3-34.9178.2-94.6-178.1178.8162.31.1114.2A20 T21 V26 W27 R28A20-R24 WeakPolarHBondContact O-CB 3.24Å; A20-R24 PolarHBondContact O-N 3.39Å; T21-R24 PolarHBondContact O-N 2.96Å; R24-V26 VanDerWaalsContact C-N 3.34Å; R24-W27 PolarHBondContact O-N 3.36Å; R24-R28 PolarHBondContact O-N 2.94Å
25A47.3Very low48Very low60 Ų60117.6 Ų117.650%0.49660%0.597SS.*Hα-helixtrans-67-38.2175.200000111.3T21 R22 G23 W27 R28 H29T21-A25 VanDerWaalsContact O-CB 3.3Å; T21-A25 WeakPolarHBondContact O-CB 3.25Å; T21-A25 PolarHBondContact O-N 3.05Å; R22-A25 PolarHBondContact O-N 2.95Å; G23-A25 VanDerWaalsContact C-N 3.33Å; G23-A25 PolarHBondContact O-N 2.8Å; A25-W27 VanDerWaalsContact C-N 3.31Å; A25-W27 PolarHBondContact O-N 3.42Å; A25-R28 PolarHBondContact O-N 2.94Å; A25-H29 PolarHBondContact O-N 2.87Å
26V45Very low47Very low91 Ų91118.2 Ų118.255%0.55260%0.596SS**Hα-helixtrans-63.9-38172174.20000110.8R22 G23 R24 H29 L30R22-V26 VanDerWaalsContact O-CG2 3.29Å; R22-V26 WeakPolarHBondContact O-CG2 3.29Å; R22-V26 PolarHBondContact O-N 3.41Å; G23-V26 WeakPolarHBondContact O-CB 3.33Å; G23-V26 PolarHBondContact O-N 2.88Å; G23-V26 VanDerWaalsContact O-N 3.12Å; R24-V26 VanDerWaalsContact C-N 3.34Å; V26-H29 PolarHBondContact O-N 2.92Å; V26-L30 HydrophobicContact CG1-CD1 4.21Å; V26-L30 WeakPolarHBondContact O-CG 3.3Å; V26-L30 PolarHBondContact O-N 2.9Å
27W36.7Very low46.4Very low178 Ų178121.3 Ų121.367%0.67460%0.604SS**Hα-helixtrans-67.6-38.5175.3-67.9106.8000113G23 R24 A25 H29 L30 S31G23-W27 VanDerWaalsContact C-CD1 3.48Å; G23-W27 PolarHBondContact O-N 3.4Å; R24-W27 PolarHBondContact O-N 3.36Å; A25-W27 VanDerWaalsContact C-N 3.31Å; A25-W27 PolarHBondContact O-N 3.42Å; W27-H29 VanDerWaalsContact C-N 3.29Å; W27-H29 PolarHBondContact O-N 2.82Å; W27-L30 HydrophobicContact CE3-CD1 4.46Å; W27-L30 PolarHBondContact O-N 2.84Å; W27-L30 VanDerWaalsContact O-N 3.11Å; W27-S31 PolarHBondContact O-N 3.29Å; W27-S31 VanDerWaalsContact O-N 3.16Å; W27-S31 PolarHBondContact O-OG 3.21Å
28R41.1Very low45.7Very low208 Ų208121 Ų12179%0.78562%0.615SS**Hα-helixtrans-63.7-34.9175.4-81.5-164172.7-176.1-0.5112.6R24 A25 L30 S31R24-R28 PolarHBondContact O-N 2.94Å; A25-R28 PolarHBondContact O-N 2.94Å; R28-L30 PolarHBondContact O-N 3.48Å; R28-S31 PolarHBondContact O-N 3.47Å
29H39.1Very low44.7Very low158 Ų158126.7 Ų126.773%0.73163%0.632SS**Hα-helixtrans-74.5-16.2176.7-125.7-59.8000113.7A25 V26 W27A25-H29 PolarHBondContact O-N 2.87Å; V26-H29 PolarHBondContact O-N 2.92Å; W27-H29 VanDerWaalsContact C-N 3.29Å; W27-H29 PolarHBondContact O-N 2.82Å
30L39.4Very low44.1Very low100 Ų100128.5 Ų128.552%0.52464%0.638SS.*Hα-helixtrans-87.6-19.1172.3-71.4162.7000112.7V26 W27 R28 A32V26-L30 HydrophobicContact CG1-CD1 4.21Å; V26-L30 WeakPolarHBondContact O-CG 3.3Å; V26-L30 PolarHBondContact O-N 2.9Å; W27-L30 HydrophobicContact CE3-CD1 4.46Å; W27-L30 PolarHBondContact O-N 2.84Å; W27-L30 VanDerWaalsContact O-N 3.11Å; R28-L30 PolarHBondContact O-N 3.48Å; L30-A32 VanDerWaalsContact C-N 3.28Å; L30-A32 PolarHBondContact O-N 2.73Å
31S41Very low43.4Very low103 Ų103135 Ų13572%0.7265%0.65SS**THydrogen-bonded Turntrans-76.5-10.6176.5-42.10000114.1W27 R28W27-S31 PolarHBondContact O-N 3.29Å; W27-S31 VanDerWaalsContact O-N 3.16Å; W27-S31 PolarHBondContact O-OG 3.21Å; R28-S31 PolarHBondContact O-N 3.47Å
32A37.6Very low42.9Very low78 Ų78133.8 Ų133.865%0.64565%0.649SS**THydrogen-bonded Turntrans-106.729.5-176.900000113.7L30 P34L30-A32 VanDerWaalsContact C-N 3.28Å; L30-A32 PolarHBondContact O-N 2.73Å; A32-P34 WeakPolarHBondContact O-CD 3.41Å
33R37.7Very low42.6Very low197 Ų197131.8 Ų131.874%0.74365%0.649SS**  trans-94.1112168.5-72.2-164.1177.7-149.30.6110.1
34P35.2Very low42.4Very low112 Ų112137.7 Ų137.773%0.72767%0.669SS**  trans-76.8147-17231.6-33.2000111.9A32A32-P34 WeakPolarHBondContact O-CD 3.41Å
35R40.3Very low42.6Very low234 Ų234136.5 Ų136.588%0.88367%0.669SS**  trans59.457.4159.2-68.6-179.4165.7146.9-3.2117.2D37R35-D37 VanDerWaalsContact C-N 3.28Å
36I40.9Very low42.7Very low102 Ų102138.4 Ų138.452%0.52367%0.671SS.*  trans-9544.1156.9-43.8-177.7000109.8R39 F40I36-R39 HydrophobicContact CG2-CB 4.15Å; I36-F40 HydrophobicContact CG2-CD2 4.18Å
37D44.1Very low42.6Very low127 Ų127135.8 Ų135.868%0.67966%0.662SS**Hα-helixtrans-79.2-30.6178.3-88.7-44.7000113R35R35-D37 VanDerWaalsContact C-N 3.28Å
38A48.5Very low42.9Very low91 Ų91129.3 Ų129.375%0.75265%0.65SS**Hα-helixtrans-82.2-31.8-174.200000113.8
39R42.3Very low43.2Very low203 Ų203126.7 Ų126.777%0.76665%0.647SS**Hα-helixtrans-84.4-30.3-176-73.6-174.1158-174.8-4.6113.3I36 A42 L43I36-R39 HydrophobicContact CG2-CB 4.15Å; R39-A42 PolarHBondContact O-N 3.38Å; R39-L43 PolarHBondContact O-N 3.03Å
40F41.6Very low43.7Very low139 Ų139124.3 Ų124.361%0.6164%0.639SS**Hα-helixtrans-72.6-35.6179.6-115.8-86.3000112.3I36 A42 L43 E44I36-F40 HydrophobicContact CG2-CD2 4.18Å; F40-A42 PolarHBondContact O-N 3.42Å; F40-L43 PolarHBondContact O-N 2.81Å; F40-L43 VanDerWaalsContact O-N 3.12Å; F40-E44 PolarHBondContact O-N 3.39Å
41R42.4Very low44.1Very low195 Ų195122.3 Ų122.374%0.73664%0.637SS**Hα-helixtrans-63.2-24.7174.2-75.8-165.2177.8-152.60.5114.1
42A47.5Very low44.2Very low57 Ų57125.1 Ų125.147%0.47164%0.636SS.*Hα-helixtrans-76.8-40.4173.300000111.6R39 F40 E44 K45 D46R39-A42 PolarHBondContact O-N 3.38Å; F40-A42 PolarHBondContact O-N 3.42Å; A42-E44 VanDerWaalsContact C-N 3.34Å; A42-E44 PolarHBondContact O-N 2.96Å; A42-K45 PolarHBondContact O-N 3.12Å; A42-D46 PolarHBondContact O-N 2.92Å
43L47.5Very low44.4Very low109 Ų109123.8 Ų123.857%0.57163%0.625SS**Hα-helixtrans-72-26.1178.8-86163.2000113.6R39 F40 K45 D46 G47R39-L43 PolarHBondContact O-N 3.03Å; F40-L43 PolarHBondContact O-N 2.81Å; F40-L43 VanDerWaalsContact O-N 3.12Å; L43-K45 VanDerWaalsContact C-N 3.3Å; L43-K45 PolarHBondContact O-N 3.35Å; L43-D46 PolarHBondContact O-N 3.28Å; L43-G47 PolarHBondContact O-N 2.83Å
44E48.8Very low44.6Very low151 Ų151121.1 Ų121.171%0.70662%0.621SS**Hα-helixtrans-70.7-28.2176.8-143172.1-162.200112.3F40 A42F40-E44 PolarHBondContact O-N 3.39Å; A42-E44 VanDerWaalsContact C-N 3.34Å; A42-E44 PolarHBondContact O-N 2.96Å
45K50Low44.8Very low174 Ų174123.4 Ų123.476%0.75762%0.622SS**Hα-helixtrans-71.6-39.8172-73.8-171.5175.9-174.10112.1A42 L43A42-K45 PolarHBondContact O-N 3.12Å; L43-K45 VanDerWaalsContact C-N 3.3Å; L43-K45 PolarHBondContact O-N 3.35Å
46D51.1Low44.7Very low100 Ų100120 Ų12054%0.53562%0.616SS.*Hα-helixtrans-77.8-28.7179.8-63.7-11.7000112.2A42 L43 G48 E49 I50A42-D46 PolarHBondContact O-N 2.92Å; L43-D46 PolarHBondContact O-N 3.28Å; D46-G48 VanDerWaalsContact C-N 3.3Å; D46-G48 PolarHBondContact O-N 2.82Å; D46-E49 PolarHBondContact O-N 2.98Å; D46-I50 WeakPolarHBondContact O-CG1 3.43Å
47G41.2Very low44.8Very low35 Ų35119 Ų11936%0.36162%0.618SS.*Hα-helixtrans-66.9-29.2176.500000113.7L43 E49 I50 A51L43-G47 PolarHBondContact O-N 2.83Å; G47-E49 VanDerWaalsContact C-N 3.34Å; G47-E49 PolarHBondContact O-N 2.76Å; G47-I50 PolarHBondContact O-N 2.8Å; G47-A51 PolarHBondContact O-N 2.87Å; G47-A51 VanDerWaalsContact O-N 3.1Å
48G43.7Very low44.4Very low42 Ų42116.6 Ų116.643%0.43362%0.616SS.*Hα-helixtrans-65.2-33.7177.300000113.6D46D46-G48 VanDerWaalsContact C-N 3.3Å; D46-G48 PolarHBondContact O-N 2.82Å
49E48Very low43.8Very low153 Ų153117.6 Ų117.672%0.71562%0.618SS**Hα-helixtrans-74.6-34.8174.5-81.2-169.3151.100112.2D46 G47 A51 K52 A53D46-E49 PolarHBondContact O-N 2.98Å; G47-E49 VanDerWaalsContact C-N 3.34Å; G47-E49 PolarHBondContact O-N 2.76Å; E49-A51 VanDerWaalsContact C-N 3.32Å; E49-A51 PolarHBondContact O-N 2.89Å; E49-K52 PolarHBondContact O-N 3.36Å; E49-A53 PolarHBondContact O-N 3.48Å; E49-A53 VanDerWaalsContact O-N 3.12Å
50I48.5Very low43.6Very low108 Ų108113 Ų11355%0.55462%0.616SS**Hα-helixtrans-68.7-33.8178.5-55.7169.2000110.8D46 G47 A53 Q54D46-I50 WeakPolarHBondContact O-CG1 3.43Å; G47-I50 PolarHBondContact O-N 2.8Å; I50-A53 PolarHBondContact O-N 2.85Å; I50-Q54 PolarHBondContact O-N 3.5Å
51A47.5Very low43.4Very low59 Ų59109.8 Ų109.849%0.48862%0.615SS.*Hα-helixtrans-65.4-37175.500000112.7G47 E49 Q54 Q55G47-A51 PolarHBondContact O-N 2.87Å; G47-A51 VanDerWaalsContact O-N 3.1Å; E49-A51 VanDerWaalsContact C-N 3.32Å; E49-A51 PolarHBondContact O-N 2.89Å; A51-Q54 PolarHBondContact O-N 3.28Å; A51-Q55 PolarHBondContact O-N 3.47Å; A51-Q55 VanDerWaalsContact O-N 3.16Å
52K43.1Very low42.8Very low161 Ų161110.2 Ų110.270%0.762%0.619SS**Hα-helixtrans-69.6-41174.7-74.9-173.1177.1-178.80112.2E49 Q54 Q55 E56E49-K52 PolarHBondContact O-N 3.36Å; K52-Q54 VanDerWaalsContact C-N 3.26Å; K52-Q54 PolarHBondContact O-N 3.24Å; K52-Q55 PolarHBondContact O-N 3Å; K52-Q55 VanDerWaalsContact O-N 3.13Å; K52-E56 PolarHBondContact O-N 3.14Å; K52-E56 VanDerWaalsContact O-N 3.15Å
53A43.5Very low42.2Very low51 Ų51114.3 Ų114.342%0.42163%0.631SS.*Hα-helixtrans-63.6-32.6175.300000112.6E49 I50 S57E49-A53 PolarHBondContact O-N 3.48Å; E49-A53 VanDerWaalsContact O-N 3.12Å; I50-A53 PolarHBondContact O-N 2.85Å; A53-S57 WeakPolarHBondContact O-CB 3.28Å; A53-S57 PolarHBondContact O-N 3.46Å; A53-S57 PolarHBondContact O-OG 3.46Å
54Q40.2Very low41.7Very low140 Ų140113.8 Ų113.865%0.65463%0.634SS**Hα-helixtrans-71.6-31.5173.8-78.5-158.4-26.200113.2I50 A51 K52 S57 A58I50-Q54 PolarHBondContact O-N 3.5Å; A51-Q54 PolarHBondContact O-N 3.28Å; K52-Q54 VanDerWaalsContact C-N 3.26Å; K52-Q54 PolarHBondContact O-N 3.24Å; Q54-S57 PolarHBondContact O-N 2.93Å; Q54-A58 WeakPolarHBondContact O-CB 3.09Å; Q54-A58 PolarHBondContact O-N 3.11Å
55Q40.4Very low41Very low160 Ų160115.4 Ų115.475%0.74864%0.639SS**Hα-helixtrans-74.7-33.6177.6-159.4155.6300112.4A51 K52A51-Q55 PolarHBondContact O-N 3.47Å; A51-Q55 VanDerWaalsContact O-N 3.16Å; K52-Q55 PolarHBondContact O-N 3Å; K52-Q55 VanDerWaalsContact O-N 3.13Å
56E37Very low39.9Very low163 Ų163115.9 Ų115.976%0.76265%0.646SS**Hα-helixtrans-69.6-37.2168.8-85.5-178.816100112.3K52 A58 S59K52-E56 PolarHBondContact O-N 3.14Å; K52-E56 VanDerWaalsContact O-N 3.15Å; E56-A58 VanDerWaalsContact C-N 3.29Å; E56-A58 PolarHBondContact O-N 3.18Å; E56-S59 PolarHBondContact O-N 3.32Å
57S43.4Very low38.8Very low81 Ų81114.3 Ų114.357%0.56665%0.654SS**Hα-helixtrans-70.4-24.4177.6-58.60000113.2A53 Q54 S59A53-S57 WeakPolarHBondContact O-CB 3.28Å; A53-S57 PolarHBondContact O-N 3.46Å; A53-S57 PolarHBondContact O-OG 3.46Å; Q54-S57 PolarHBondContact O-N 2.93Å; S57-S59 VanDerWaalsContact C-N 3.33Å
58A35.9Very low38.4Very low76 Ų76117 Ų11763%0.62867%0.667SS**Hα-helixtrans-76.1-18.6177.200000113.4Q54 E56 S60Q54-A58 WeakPolarHBondContact O-CB 3.09Å; Q54-A58 PolarHBondContact O-N 3.11Å; E56-A58 VanDerWaalsContact C-N 3.29Å; E56-A58 PolarHBondContact O-N 3.18Å; A58-S60 VanDerWaalsContact C-N 3.31Å; A58-S60 PolarHBondContact O-N 3.48Å
59S36.3Very low38.5Very low113 Ų113120.4 Ų120.479%0.7968%0.681SS**THydrogen-bonded Turntrans-76.8-14.2178.4-179.20000113.9E56 S57E56-S59 PolarHBondContact O-N 3.32Å; S57-S59 VanDerWaalsContact C-N 3.33Å
60S37.8Very low37.7Very low105 Ų105123.3 Ų123.373%0.73469%0.686SS**THydrogen-bonded Turntrans-118.8-8.1-172.4-165.30000114.1A58 Y62A58-S60 VanDerWaalsContact C-N 3.31Å; A58-S60 PolarHBondContact O-N 3.48Å; S60-Y62 PolarHBondContact O-N 3.38Å
61A38.3Very low37.3Very low72 Ų72128.3 Ų128.360%0.59570%0.698SS**  trans-83.883.3179.600000111.3I63A61-I63 PolarHBondContact O-N 3.39Å; A61-I63 VanDerWaalsContact O-N 3.11Å
62Y29.4Very low36.7Very low205 Ų205132.6 Ų132.680%0.80471%0.707SS**  trans-24.7111.5148.8177.6-97.3000111.2S60 P64S60-Y62 PolarHBondContact O-N 3.38Å; Y62-P64 WeakPolarHBondContact O-CD 3.3Å
63I34.5Very low36.9Very low142 Ų142127.6 Ų127.673%0.72869%0.69SS**  trans-73106.2179.1-58.4169.3000107.2A61 K65A61-I63 PolarHBondContact O-N 3.39Å; A61-I63 VanDerWaalsContact O-N 3.11Å; I63-K65 PolarHBondContact O-N 3.26Å
64P36.6Very low37.2Very low98 Ų98128.4 Ų128.464%0.63669%0.693SS**  trans-76104.517310.57.6000106.6Y62Y62-P64 WeakPolarHBondContact O-CD 3.3Å
65K33.6Very low37.5Very low185 Ų185124 Ų12480%0.80468%0.68SS**  trans-61.3138.4163.7-71.7175.9175.3175.10108.2I63I63-K65 PolarHBondContact O-N 3.26Å
66M27.1Very low37.8Very low185 Ų185118.8 Ų118.891%0.91166%0.664SS**  trans87.6115.2164.4-47.7-62.5-92.600117.6
67G29.5Very low38.5Very low67 Ų67116 Ų11669%0.69165%0.654SS**  trans110.893.1135.200000117.5
68S31.6Very low38.8Very low92 Ų92121.1 Ų121.164%0.64366%0.661SS**  trans84.6111.4156.3-53.20000117.8W70S68-W70 PolarHBondContact O-N 3.29Å
69P45.7Very low39.5Very low113 Ų113123.7 Ų123.773%0.73466%0.663SS**THydrogen-bonded Turntrans-65.4-0.9-176.4-19.931000116.9
70W32.8Very low40.2Very low213 Ų213123.1 Ų123.181%0.80766%0.655SS**THydrogen-bonded Turntrans-109.1-4.2-163.9-62.892.7000114.9S68 T73S68-W70 PolarHBondContact O-N 3.29Å; W70-T73 PolarHBondContact O-OG1 2.93Å
71R39Very low40.8Very low214 Ų214120.6 Ų120.681%0.80864%0.64SS**SBendtrans-82.5-29.2176.3-76.5-171.3176.8-94.30.7113.4T73 S74R71-T73 VanDerWaalsContact C-N 3.3Å; R71-T73 PolarHBondContact O-N 2.95Å; R71-S74 PolarHBondContact O-OG 3.44Å
72H35.5Very low41.4Very low149 Ų149120.1 Ų120.169%0.6963%0.632SS**Hα-helixtrans-78.2-11.1178.6-76.8-79.7000114.4S74 A75 A76H72-S74 VanDerWaalsContact C-N 3.28Å; H72-S74 PolarHBondContact O-N 3.23Å; H72-A75 PolarHBondContact O-N 2.89Å; H72-A76 PolarHBondContact O-N 2.88Å; H72-A76 VanDerWaalsContact O-N 3.14Å
73T47.3Very low42.4Very low56 Ų56113.5 Ų113.534%0.34462%0.62SS.*Hα-helixtrans-64.6-34.6177.4-26.60000111.4W70 R71 A76 I77W70-T73 PolarHBondContact O-OG1 2.93Å; R71-T73 VanDerWaalsContact C-N 3.3Å; R71-T73 PolarHBondContact O-N 2.95Å; T73-A76 PolarHBondContact O-N 3.08Å; T73-I77 HydrophobicContact CG2-CD1 3.9Å; T73-I77 HydrophobicContact CG2-CG1 4.4Å; T73-I77 VanDerWaalsContact O-CB 3.3Å; T73-I77 WeakPolarHBondContact O-CB 3.47Å; T73-I77 WeakPolarHBondContact O-CD1 3.46Å; T73-I77 WeakPolarHBondContact O-CG1 3.14Å; T73-I77 PolarHBondContact O-N 3.41Å
74S50Low43.1Very low67 Ų67112.7 Ų112.747%0.46962%0.617SS.*Hα-helixtrans-68.9-38.5-178.765.70000113.1R71 H72 R78R71-S74 PolarHBondContact O-OG 3.44Å; H72-S74 VanDerWaalsContact C-N 3.28Å; H72-S74 PolarHBondContact O-N 3.23Å; S74-R78 WeakPolarHBondContact O-CB 3.31Å; S74-R78 VanDerWaalsContact O-CG 3.31Å; S74-R78 WeakPolarHBondContact O-CG 3.42Å; S74-R78 PolarHBondContact O-N 3.16Å
75A45.4Very low43.8Very low48 Ų48114.4 Ų114.440%0.39762%0.616SS.*Hα-helixtrans-70.4-43175.600000111.4H72 I77 R78 L79H72-A75 PolarHBondContact O-N 2.89Å; A75-I77 PolarHBondContact O-N 2.86Å; A75-R78 PolarHBondContact O-N 3.43Å; A75-L79 WeakPolarHBondContact O-CG 3.28Å; A75-L79 PolarHBondContact O-N 3.43Å
76A47.2Very low44.7Very low50 Ų50110.3 Ų110.341%0.41360%0.603SS.*Hα-helixtrans-62.3-43.2175.700000111.7H72 T73 R78 L79 V80H72-A76 PolarHBondContact O-N 2.88Å; H72-A76 VanDerWaalsContact O-N 3.14Å; T73-A76 PolarHBondContact O-N 3.08Å; A76-R78 VanDerWaalsContact C-N 3.35Å; A76-R78 PolarHBondContact O-N 3.39Å; A76-L79 PolarHBondContact O-N 3.15Å; A76-V80 WeakPolarHBondContact O-CB 3.48Å; A76-V80 VanDerWaalsContact O-CG2 3.28Å; A76-V80 WeakPolarHBondContact O-CG2 3.31Å; A76-V80 PolarHBondContact O-N 2.93Å
77I52.5Low45.7Very low106 Ų106103.1 Ų103.154%0.54458%0.577SS.*Hα-helixtrans-61.7-43.1175-70163.8000110.6T73 A75 L79 V80 A81T73-I77 HydrophobicContact CG2-CD1 3.9Å; T73-I77 HydrophobicContact CG2-CG1 4.4Å; T73-I77 VanDerWaalsContact O-CB 3.3Å; T73-I77 WeakPolarHBondContact O-CB 3.47Å; T73-I77 WeakPolarHBondContact O-CD1 3.46Å; T73-I77 WeakPolarHBondContact O-CG1 3.14Å; T73-I77 PolarHBondContact O-N 3.41Å; A75-I77 PolarHBondContact O-N 2.86Å; I77-L79 PolarHBondContact O-N 2.98Å; I77-V80 PolarHBondContact O-N 3.28Å; I77-A81 VanDerWaalsContact O-CB 3.28Å; I77-A81 WeakPolarHBondContact O-CB 3.47Å; I77-A81 PolarHBondContact O-N 3.4Å
78R48.4Very low46.4Very low188 Ų188105.2 Ų105.271%0.70957%0.572SS**Hα-helixtrans-62-41.7176.4-78176.4177.3175.2-0.4112.2S74 A75 A76 A81 S82S74-R78 WeakPolarHBondContact O-CB 3.31Å; S74-R78 VanDerWaalsContact O-CG 3.31Å; S74-R78 WeakPolarHBondContact O-CG 3.42Å; S74-R78 PolarHBondContact O-N 3.16Å; A75-R78 PolarHBondContact O-N 3.43Å; A76-R78 VanDerWaalsContact C-N 3.35Å; A76-R78 PolarHBondContact O-N 3.39Å; R78-A81 PolarHBondContact O-N 3.3Å; R78-S82 WeakPolarHBondContact O-CB 3.49Å; R78-S82 PolarHBondContact O-N 2.89Å; R78-S82 PolarHBondContact O-OG 3.02Å
79L50.3Low47.2Very low129 Ų129107.9 Ų107.968%0.67557%0.572SS**Hα-helixtrans-66.4-42.7176.7-73.3173.6000112A75 A76 I77 A81 S82 A83A75-L79 WeakPolarHBondContact O-CG 3.28Å; A75-L79 PolarHBondContact O-N 3.43Å; A76-L79 PolarHBondContact O-N 3.15Å; I77-L79 PolarHBondContact O-N 2.98Å; L79-A81 VanDerWaalsContact C-N 3.35Å; L79-S82 PolarHBondContact O-N 3.08Å; L79-A83 VanDerWaalsContact O-CB 3.27Å; L79-A83 WeakPolarHBondContact O-CB 3.27Å; L79-A83 PolarHBondContact O-N 3.11Å
80V52.5Low47.1Very low101 Ų101110.2 Ų110.261%0.61257%0.571SS**Hα-helixtrans-64.4-41.1176.2172.60000110.8A76 I77 A83 L84A76-V80 WeakPolarHBondContact O-CB 3.48Å; A76-V80 VanDerWaalsContact O-CG2 3.28Å; A76-V80 WeakPolarHBondContact O-CG2 3.31Å; A76-V80 PolarHBondContact O-N 2.93Å; I77-V80 PolarHBondContact O-N 3.28Å; V80-A83 PolarHBondContact O-N 2.97Å; V80-L84 VanDerWaalsContact O-CB 3.31Å; V80-L84 WeakPolarHBondContact O-CB 3.32Å; V80-L84 PolarHBondContact O-N 3.41Å
81A49.7Very low47.8Very low52 Ų52109.4 Ų109.443%0.4357%0.567SS.*Hα-helixtrans-62.4-48175.700000111.6I77 R78 L79 A83 L84 E85I77-A81 VanDerWaalsContact O-CB 3.28Å; I77-A81 WeakPolarHBondContact O-CB 3.47Å; I77-A81 PolarHBondContact O-N 3.4Å; R78-A81 PolarHBondContact O-N 3.3Å; L79-A81 VanDerWaalsContact C-N 3.35Å; A81-A83 VanDerWaalsContact C-N 3.35Å; A81-A83 PolarHBondContact O-N 2.92Å; A81-L84 PolarHBondContact O-N 3.45Å; A81-E85 WeakPolarHBondContact O-CB 3.46Å; A81-E85 PolarHBondContact O-N 3.36Å
82S50.5Low48Very low62 Ų62100.9 Ų100.943%0.43455%0.547SS..Hα-helixtrans-63-38.9176.5-670000112.6R78 L79 N86R78-S82 WeakPolarHBondContact O-CB 3.49Å; R78-S82 PolarHBondContact O-N 2.89Å; R78-S82 PolarHBondContact O-OG 3.02Å; L79-S82 PolarHBondContact O-N 3.08Å; S82-N86 VanDerWaalsContact O-CB 3.32Å; S82-N86 WeakPolarHBondContact O-CB 3.35Å; S82-N86 VanDerWaalsContact O-CG 3.29Å; S82-N86 PolarHBondContact O-N 2.98Å; S82-N86 PolarHBondContact O-ND2 3.38Å
83A50.5Low48.3Very low66 Ų66102.6 Ų102.655%0.54555%0.547SS..Hα-helixtrans-66.5-39.2175.900000111.7L79 V80 A81 G87L79-A83 VanDerWaalsContact O-CB 3.27Å; L79-A83 WeakPolarHBondContact O-CB 3.27Å; L79-A83 PolarHBondContact O-N 3.11Å; V80-A83 PolarHBondContact O-N 2.97Å; A81-A83 VanDerWaalsContact C-N 3.35Å; A81-A83 PolarHBondContact O-N 2.92Å; A83-G87 PolarHBondContact O-N 3.32Å
84L48.9Very low48Very low125 Ų125105.8 Ų105.865%0.65456%0.562SS**Hα-helixtrans-68.7-42.7177.6-159.380.5000111.4V80 A81 G87 N88V80-L84 VanDerWaalsContact O-CB 3.31Å; V80-L84 WeakPolarHBondContact O-CB 3.32Å; V80-L84 PolarHBondContact O-N 3.41Å; A81-L84 PolarHBondContact O-N 3.45Å; L84-G87 PolarHBondContact O-N 3.47Å; L84-N88 WeakPolarHBondContact O-CB 3.39Å; L84-N88 PolarHBondContact O-N 2.71Å
85E51.9Low47.7Very low134 Ų134106.2 Ų106.263%0.62657%0.565SS**Hα-helixtrans-65.9-42.5179-166.2173.6-178.600111.6A81 N88 K89A81-E85 WeakPolarHBondContact O-CB 3.46Å; A81-E85 PolarHBondContact O-N 3.36Å; E85-N88 PolarHBondContact O-N 2.72Å; E85-K89 PolarHBondContact O-N 3.2Å; E85-K89 VanDerWaalsContact O-N 3.08Å
86N52.4Low47.4Very low99 Ų99106.7 Ų106.753%0.52957%0.569SS.*Hα-helixtrans-68.9-37.3174.9-73.1-28.7000112.6S82 N88 K89 K90S82-N86 VanDerWaalsContact O-CB 3.32Å; S82-N86 WeakPolarHBondContact O-CB 3.35Å; S82-N86 VanDerWaalsContact O-CG 3.29Å; S82-N86 PolarHBondContact O-N 2.98Å; S82-N86 PolarHBondContact O-ND2 3.38Å; N86-N88 VanDerWaalsContact C-N 3.28Å; N86-N88 PolarHBondContact O-N 3.46Å; N86-K89 PolarHBondContact O-N 3.1Å; N86-K90 PolarHBondContact O-N 3.35Å
87G47.3Very low46.7Very low35 Ų35108.7 Ų108.736%0.36158%0.579SS.*Hα-helixtrans-61.6-37.8172.900000112.2A83 L84 K90 R91A83-G87 PolarHBondContact O-N 3.32Å; L84-G87 PolarHBondContact O-N 3.47Å; G87-K90 PolarHBondContact O-N 3.13Å; G87-R91 PolarHBondContact O-N 2.84Å
88N45.6Very low46.1Very low111 Ų111106.5 Ų106.559%0.59458%0.576SS**Hα-helixtrans-71.1-36.8176.9-111.5-11.9000112.8L84 E85 N86 K90 R91 G92L84-N88 WeakPolarHBondContact O-CB 3.39Å; L84-N88 PolarHBondContact O-N 2.71Å; E85-N88 PolarHBondContact O-N 2.72Å; N86-N88 VanDerWaalsContact C-N 3.28Å; N86-N88 PolarHBondContact O-N 3.46Å; N88-K90 VanDerWaalsContact C-N 3.27Å; N88-K90 PolarHBondContact O-N 3.39Å; N88-R91 PolarHBondContact O-N 3.07Å; N88-G92 PolarHBondContact O-N 2.94Å
89K48.2Very low45.4Very low148 Ų148100.1 Ų100.164%0.64356%0.564SS**Hα-helixtrans-61.6-34.4171.4-100.7176.6-178.71680112.8E85 N86E85-K89 PolarHBondContact O-N 3.2Å; E85-K89 VanDerWaalsContact O-N 3.08Å; N86-K89 PolarHBondContact O-N 3.1Å
90K43.8Very low44.8Very low161 Ų16198 Ų9870%0.756%0.56SS**Hα-helixtrans-78.5-33.1176.1-71.6-172179.3-178.70112.9N86 G87 N88N86-K90 PolarHBondContact O-N 3.35Å; G87-K90 PolarHBondContact O-N 3.13Å; N88-K90 VanDerWaalsContact C-N 3.27Å; N88-K90 PolarHBondContact O-N 3.39Å
91R46.1Very low44.4Very low196 Ų19697 Ų9774%0.7456%0.558SS**Hα-helixtrans-76.2-31.9174.2-82.2-174.3-179.4-179.92.1113.8G87 N88 R93 N94 S95G87-R91 PolarHBondContact O-N 2.84Å; N88-R91 PolarHBondContact O-N 3.07Å; R91-R93 VanDerWaalsContact C-N 3.3Å; R91-R93 PolarHBondContact O-N 3.35Å; R91-N94 PolarHBondContact O-N 3.3Å; R91-N94 VanDerWaalsContact O-N 3.1Å; R91-S95 PolarHBondContact O-N 3.37Å; R91-S95 VanDerWaalsContact O-N 3.07Å; R91-S95 PolarHBondContact O-OG 3.33Å
92G44.1Very low44Very low36 Ų3697.5 Ų97.537%0.37156%0.561SS.*Hα-helixtrans-63.2-31.4179.700000114N88 N94 S95 A96N88-G92 PolarHBondContact O-N 2.94Å; G92-N94 VanDerWaalsContact C-N 3.34Å; G92-S95 PolarHBondContact O-OG 3.18Å; G92-A96 PolarHBondContact O-N 3.4Å
93R41.4Very low43.6Very low185 Ų185100.4 Ų100.470%0.69857%0.571SS**Hα-helixtrans-69.3-32.4173.8-81-172.3-108.4172.9-7.6112.8R91R91-R93 VanDerWaalsContact C-N 3.3Å; R91-R93 PolarHBondContact O-N 3.35Å
94N41.4Very low42.9Very low122 Ų122107.8 Ų107.865%0.65259%0.585SS**Hα-helixtrans-86.7-27.2-176.3-66.5-2.5000112.7R91 G92 A98R91-N94 PolarHBondContact O-N 3.3Å; R91-N94 VanDerWaalsContact O-N 3.1Å; G92-N94 VanDerWaalsContact C-N 3.34Å; N94-A98 VanDerWaalsContact O-CB 3.29Å; N94-A98 WeakPolarHBondContact O-CB 3.49Å; N94-A98 PolarHBondContact O-N 2.99Å
95S43.2Very low42.5Very low76 Ų76108.5 Ų108.553%0.53159%0.589SS.*Hα-helixtrans-78.2-32.1175.457.50000113.1R91 G92 A98 A99R91-S95 PolarHBondContact O-N 3.37Å; R91-S95 VanDerWaalsContact O-N 3.07Å; R91-S95 PolarHBondContact O-OG 3.33Å; G92-S95 PolarHBondContact O-OG 3.18Å; S95-A98 PolarHBondContact O-N 3.16Å; S95-A99 PolarHBondContact O-N 2.79Å; S95-A99 VanDerWaalsContact O-N 3.09Å
96A39.1Very low41.9Very low58 Ų58112 Ų11248%0.47960%0.596SS.*Hα-helixtrans-68.4-41176.200000112.2G92 S100G92-A96 PolarHBondContact O-N 3.4Å; A96-S100 PolarHBondContact O-N 3.42Å; A96-S100 PolarHBondContact O-OG 3.13Å
97C34Very low40.8Very low92 Ų92110.9 Ų110.962%0.62261%0.609SS**Hα-helixtrans-73.6-30.7175.5-74.90000113.1S100 S101C97-S100 PolarHBondContact O-N 3.15Å; C97-S101 PolarHBondContact O-N 3.23Å
98A38.1Very low40.4Very low60 Ų60116.7 Ų116.750%0.49663%0.631SS.*Hα-helixtrans-68.6-37.7175.600000112.2N94 S95 A102N94-A98 VanDerWaalsContact O-CB 3.29Å; N94-A98 WeakPolarHBondContact O-CB 3.49Å; N94-A98 PolarHBondContact O-N 2.99Å; S95-A98 PolarHBondContact O-N 3.16Å; A98-A102 WeakPolarHBondContact O-CB 3.49Å; A98-A102 PolarHBondContact O-N 3.42Å
99A35.4Very low40Very low55 Ų55116.4 Ų116.446%0.45564%0.637SS.*Hα-helixtrans-66.8-40.917500000111.9S95 A102 I103S95-A99 PolarHBondContact O-N 2.79Å; S95-A99 VanDerWaalsContact O-N 3.09Å; A99-A102 PolarHBondContact O-N 3.35Å; A99-I103 WeakPolarHBondContact O-CG1 3.41Å; A99-I103 PolarHBondContact O-N 3.03Å
100S37.7Very low39.6Very low85 Ų85114.3 Ų114.359%0.59465%0.648SS**Hα-helixtrans-67.3-36.2177.4-66.10000113.2A96 C97A96-S100 PolarHBondContact O-N 3.42Å; A96-S100 PolarHBondContact O-OG 3.13Å; C97-S100 PolarHBondContact O-N 3.15Å
101S42.5Very low39.3Very low80 Ų80115.6 Ų115.656%0.55965%0.653SS**Hα-helixtrans-73.4-30.8174.5-950000113.4C97 I103 R104C97-S101 PolarHBondContact O-N 3.23Å; S101-I103 VanDerWaalsContact C-N 3.32Å; S101-I103 PolarHBondContact O-N 3.31Å; S101-R104 PolarHBondContact O-N 3.36Å
102A41.7Very low38.7Very low61 Ų61115.6 Ų115.650%0.50466%0.662SS.*Hα-helixtrans-69.7-29.9178.400000112.8A98 A99A98-A102 WeakPolarHBondContact O-CB 3.49Å; A98-A102 PolarHBondContact O-N 3.42Å; A99-A102 PolarHBondContact O-N 3.35Å
103I42.7Very low38.2Very low123 Ų123121.3 Ų121.363%0.63169%0.69SS**Hα-helixtrans-72.6-34.2177-64.7167.6000111A99 S101 N105 R106A99-I103 WeakPolarHBondContact O-CG1 3.41Å; A99-I103 PolarHBondContact O-N 3.03Å; S101-I103 VanDerWaalsContact C-N 3.32Å; S101-I103 PolarHBondContact O-N 3.31Å; I103-N105 VanDerWaalsContact C-N 3.27Å; I103-N105 PolarHBondContact O-N 3.09Å; I103-R106 PolarHBondContact O-N 3.06Å
104R35.9Very low37.6Very low221 Ų221115.1 Ų115.183%0.83468%0.683SS**Hα-helixtrans-67.5-25.7-179.9-170.1176.1-97.4174.9-7113.4S101S101-R104 PolarHBondContact O-N 3.36Å
105N40.9Very low37.2Very low141 Ų141114.8 Ų114.875%0.75469%0.688SS**THydrogen-bonded Turntrans-91.7-10.3-178-72.7-16.9000114.8I103 G107I103-N105 VanDerWaalsContact C-N 3.27Å; I103-N105 PolarHBondContact O-N 3.09Å; N105-G107 PolarHBondContact O-N 3.41Å
106R37.6Very low37.1Very low206 Ų206117.2 Ų117.278%0.77770%0.702SS**SBendtrans-93.791.6166.8-72.8-172.9-178.6171.50.6106.7I103 L108I103-R106 PolarHBondContact O-N 3.06Å; R106-L108 PolarHBondContact O-N 3.41Å
107G29.7Very low37Very low77 Ų77120.3 Ų120.379%0.79472%0.715SS**  trans-52.269.9179.200000114.2N105 S109N105-G107 PolarHBondContact O-N 3.41Å; G107-S109 PolarHBondContact O-N 3.12Å
108L39.7Very low37.3Very low157 Ų157119.9 Ų119.982%0.82272%0.718SS**  trans-71.189160.9-75.1164.2000105.4R106 A110R106-L108 PolarHBondContact O-N 3.41Å; L108-A110 PolarHBondContact O-N 2.99Å
109S37.2Very low37.2Very low104 Ų104124.8 Ų124.873%0.72773%0.73SS**  trans-23.7120.2162.7176.10000111.2G107 K111G107-S109 PolarHBondContact O-N 3.12Å; S109-K111 PolarHBondContact O-N 3.48Å
110A40Very low37.2Very low105 Ų105129.3 Ų129.387%0.86875%0.746SS**SBendtrans-66.177.8179.200000111L108L108-A110 PolarHBondContact O-N 2.99Å
111K37.9Very low37.2Very low187 Ų187136.5 Ų136.581%0.81376%0.76SS**  trans-157.781.4165.4-104.8-174.3-178.6-176.20108.2S109S109-K111 PolarHBondContact O-N 3.48Å
112E32.6Very low36.9Very low197 Ų197137.2 Ų137.292%0.92177%0.765SS**  trans-178.579.8145.5-99.3167.3-155.200107.2G114E112-G114 PolarHBondContact O-N 3.23Å
113T33Very low36.7Very low155 Ų155142.7 Ų142.795%0.95178%0.778SS**  trans-63.3105.316839.40000109.9
114G30Very low36.2Very low55 Ų55147.7 Ų147.757%0.56779%0.789SS**  trans-147127.8158.200000107.8E112E112-G114 PolarHBondContact O-N 3.23Å
115P33.4Very low36.2Very low116 Ų116143.1 Ų143.175%0.75379%0.789SS**  trans-57.7131.2-177.223.8-32000108.5T117P115-T117 VanDerWaalsContact C-N 3.26Å; P115-T117 PolarHBondContact O-N 3.33Å
116P39.9Very low36Very low126 Ų126140.4 Ų140.482%0.81879%0.786SS**  trans-62.696.1176.525.5-32.3000107.5A118P116-A118 PolarHBondContact O-N 3.48Å; P116-A118 VanDerWaalsContact O-N 3.13Å
117T36.4Very low36Very low124 Ų124134.2 Ų134.276%0.76178%0.779SS**  trans-50.8122.3168.230.20000106.1P115 H119P115-T117 VanDerWaalsContact C-N 3.26Å; P115-T117 PolarHBondContact O-N 3.33Å; T117-H119 PolarHBondContact O-N 3.24Å
118A41.1Very low36.2Very low82 Ų82136.3 Ų136.368%0.67877%0.772SS**SBendtrans-67.333.1-173.700000113.4P116P116-A118 PolarHBondContact O-N 3.48Å; P116-A118 VanDerWaalsContact O-N 3.13Å
119H35.5Very low36.3Very low164 Ų164136 Ų13676%0.75977%0.77SS**THydrogen-bonded Turntrans-99.14.2-170.1-137.9-46.5000114.9T117T117-H119 PolarHBondContact O-N 3.24Å
120L37.1Very low36Very low150 Ų150140.7 Ų140.779%0.78577%0.772SS**THydrogen-bonded Turntrans-102.418.4168.3-67.6176.4000113.3S122L120-S122 VanDerWaalsContact C-N 3.33Å; L120-S122 PolarHBondContact O-N 3.49Å
121R37.7Very low36Very low235 Ų235138.8 Ų138.889%0.88775%0.752SS**THydrogen-bonded Turntrans-83.96.5-178.1-115.9-179.4174.9160.1-0.6116
122S35.4Very low36.6Very low95 Ų95135.3 Ų135.366%0.66475%0.748SS**THydrogen-bonded Turntrans-143.837.7178.2790000114.8L120 R124L120-S122 VanDerWaalsContact C-N 3.33Å; L120-S122 PolarHBondContact O-N 3.49Å; S122-R124 PolarHBondContact O-N 3.37Å; S122-R124 VanDerWaalsContact O-N 3.08Å
123K37.1Very low36.9Very low176 Ų176136.9 Ų136.977%0.76575%0.746SS**  trans-8286.3156.1-69.8-161.4179.5-176.20107.2C125K123-C125 PolarHBondContact O-N 3.19Å
124R33.2Very low37.1Very low229 Ų229135.6 Ų135.686%0.86473%0.733SS**  trans-37.4106.3167.7-68.2175.7-175.6-1740.5107.7S122 A126S122-R124 PolarHBondContact O-N 3.37Å; S122-R124 VanDerWaalsContact O-N 3.08Å; R124-A126 PolarHBondContact O-N 2.87Å
125C35.2Very low37.4Very low125 Ų125138.4 Ų138.485%0.84574%0.741SS**  trans-69.368.5154.7-68.60000106.5K123 A127K123-C125 PolarHBondContact O-N 3.19Å; C125-A127 PolarHBondContact O-N 3.5Å
126A36Very low38Very low84 Ų84140.9 Ų140.969%0.69475%0.747SS**  trans-67.769.1146.100000105R124 D128R124-A126 PolarHBondContact O-N 2.87Å; A126-D128 PolarHBondContact O-N 3.38Å
127A38.6Very low38Very low75 Ų75144.7 Ų144.762%0.6275%0.75SS**  trans-6491.6157.100000102.8C125 I129C125-A127 PolarHBondContact O-N 3.5Å; A127-I129 PolarHBondContact O-N 3.43Å
128D33.8Very low38Very low122 Ų122141.8 Ų141.865%0.65275%0.745SS**  trans-5288.2167.4-149.618.8000104.9A126 R130A126-D128 PolarHBondContact O-N 3.38Å; D128-R130 HydrophobicContact CB-CG 4.43Å; D128-R130 PolarHBondContact O-N 3.1Å; D128-R130 IonicContact OD2-NE 3.55Å
129I40.8Very low37.8Very low151 Ų151144.8 Ų144.877%0.77475%0.745SS**  trans-69.180.9171.3-63174.6000103.6A127 S131A127-I129 PolarHBondContact O-N 3.43Å; I129-S131 PolarHBondContact O-N 3.3Å
130R32Very low38Very low202 Ų202144.5 Ų144.576%0.76275%0.748SS**  trans-63.590.6172.2-73.5179.5175.2-173.6-4.1106.5D128 P132D128-R130 HydrophobicContact CB-CG 4.43Å; D128-R130 PolarHBondContact O-N 3.1Å; D128-R130 IonicContact OD2-NE 3.55Å; R130-P132 VanDerWaalsContact O-CD 3.25Å; R130-P132 WeakPolarHBondContact O-CD 3.43Å
131S38.6Very low38Very low65 Ų65144.9 Ų144.946%0.45574%0.743SS.*  trans-60.5115.8159.1-680000106.6I129 W133 L134I129-S131 PolarHBondContact O-N 3.3Å; S131-W133 PolarHBondContact O-N 3.47Å; S131-L134 PolarHBondContact O-N 3.43Å
132P50.6Low38Very low113 Ų113138.5 Ų138.573%0.73474%0.735SS**THydrogen-bonded Turntrans-64.22.3-169.4-21.932.4000115.7R130R130-P132 VanDerWaalsContact O-CD 3.25Å; R130-P132 WeakPolarHBondContact O-CD 3.43Å
133W40Very low38Very low230 Ų230138 Ų13887%0.87174%0.736SS**THydrogen-bonded Turntrans-125.98.1-167.5-51.998.1000113.7S131S131-W133 PolarHBondContact O-N 3.47Å
134L37.6Very low38Very low129 Ų129136.9 Ų136.968%0.67574%0.738SS**SBendtrans-102.4110.9171.3-85.2132.9000109.1S131 L136S131-L134 PolarHBondContact O-N 3.43Å; L134-L136 PolarHBondContact O-N 3.12Å
135P35.8Very low38.3Very low113 Ų113131.3 Ų131.373%0.73473%0.734SS**  trans-59.7137.8170.323.1-29.9000109.1K137P135-K137 PolarHBondContact O-N 3.45Å
136L44.8Very low38.4Very low169 Ų169131.5 Ų131.589%0.88573%0.727SS**  trans-51.291.9-178.6-74133.2000110.7L134 G138L134-L136 PolarHBondContact O-N 3.12Å; L136-G138 VanDerWaalsContact C-N 3.33Å; L136-G138 PolarHBondContact O-N 3.3Å
137K40.9Very low38.5Very low205 Ų205133.3 Ų133.389%0.89173%0.73SS**THydrogen-bonded Turntrans-71.393.1165.2-80.1-176.2175-177.20106.9P135P135-K137 PolarHBondContact O-N 3.45Å
138G36.4Very low38.5Very low64 Ų64136.6 Ų136.666%0.6674%0.737SS**THydrogen-bonded Turntrans169.6-16.9172.700000118.3L136 I140L136-G138 VanDerWaalsContact C-N 3.33Å; L136-G138 PolarHBondContact O-N 3.3Å; G138-I140 VanDerWaalsContact C-N 3.28Å; G138-I140 PolarHBondContact O-N 2.92Å; G138-I140 VanDerWaalsContact O-N 3.11Å
139E36.6Very low38.5Very low145 Ų145138.9 Ų138.968%0.67875%0.748SS**  trans-87.774.2170.2-73.6-155.3154.900110.1K141E139-K141 PolarHBondContact O-N 2.81Å; E139-K141 IonicContact OE1-NZ 2.98Å; E139-K141 PolarHBondContact OE1-NZ 3.32Å; E139-K141 IonicContact OE2-NZ 2.79Å; E139-K141 PolarHBondContact OE2-NZ 2.64Å
140I39.9Very low38.7Very low158 Ų158137.3 Ų137.381%0.8175%0.748SS**  trans-76.577.1157.7-48.5171.3000105.5G138 S142G138-I140 VanDerWaalsContact C-N 3.28Å; G138-I140 PolarHBondContact O-N 2.92Å; G138-I140 VanDerWaalsContact O-N 3.11Å; I140-S142 VanDerWaalsContact C-N 3.26Å; I140-S142 PolarHBondContact O-N 3.39Å; I140-S142 VanDerWaalsContact O-N 3.09Å
141K38Very low39.1Very low158 Ų158134.3 Ų134.369%0.68775%0.747SS**  trans-75.493.1161.5-77.7175-179142.80106E139E139-K141 PolarHBondContact O-N 2.81Å; E139-K141 IonicContact OE1-NZ 2.98Å; E139-K141 PolarHBondContact OE1-NZ 3.32Å; E139-K141 IonicContact OE2-NZ 2.79Å; E139-K141 PolarHBondContact OE2-NZ 2.64Å
142S36.9Very low39.3Very low101 Ų101135.8 Ų135.871%0.70676%0.763SS**  trans-51.3142166.745.60000111.4I140I140-S142 VanDerWaalsContact C-N 3.26Å; I140-S142 PolarHBondContact O-N 3.39Å; I140-S142 VanDerWaalsContact O-N 3.09Å
143A35.3Very low38.8Very low84 Ų84140.5 Ų140.569%0.69477%0.768SS**  trans69.592.9163.900000116.7
144D37Very low38.8Very low152 Ų152140.8 Ų140.881%0.81378%0.784SS**  -146.279.5125.9-86.5-31.4000107.3N146D144-N146 PolarHBondContact O-N 3.31Å
145S39.9Very low38.9Very low112 Ų112141.4 Ų141.478%0.78379%0.789SS**  trans-69.465.4162550000108.8T147S145-T147 VanDerWaalsContact C-N 3.33Å; S145-T147 PolarHBondContact O-N 3.45Å
146N36.3Very low39Very low130 Ų130142.8 Ų142.870%0.69579%0.792SS**  trans-87.788.6164.2-104.9-30000107.3D144 N148D144-N146 PolarHBondContact O-N 3.31Å; N146-N148 PolarHBondContact O-N 3.4Å
147T38.9Very low38.7Very low121 Ų121141.4 Ų141.474%0.74279%0.787SS**  trans-39.399156.843.20000110.6S145S145-T147 VanDerWaalsContact C-N 3.33Å; S145-T147 PolarHBondContact O-N 3.45Å
148N37.9Very low38.6Very low144 Ų144137.6 Ų137.677%0.7778%0.781SS**  trans-144.269.7159.4-89.1-46.2000107.4N146 P150N146-N148 PolarHBondContact O-N 3.4Å; N148-P150 WeakPolarHBondContact O-CD 3.29Å
149L34.8Very low38.7Very low170 Ų170142.3 Ų142.389%0.8979%0.788SS**  trans-75.3107.2152.4-79.7154.1000105.4N151L149-N151 PolarHBondContact O-N 3.47Å
150P44.2Very low38.9Very low118 Ų118142.1 Ų142.177%0.76680%0.795SS**  trans-65.7110.7166.927.5-30.3000106.5N148 A152N148-P150 WeakPolarHBondContact O-CD 3.29Å; P150-A152 PolarHBondContact O-N 3.05Å
151N39.7Very low38.8Very low140 Ų140140.9 Ų140.975%0.74979%0.794SS**  trans-43105.3162.9-120.5-3.1000107.9L149 Y153L149-N151 PolarHBondContact O-N 3.47Å; N151-Y153 VanDerWaalsContact C-N 3.27Å; N151-Y153 PolarHBondContact O-N 3.5Å
152A43.6Very low38.8Very low95 Ų95139.6 Ų139.679%0.78580%0.803SS**  trans-6997.7163.700000105.3P150 I154P150-A152 PolarHBondContact O-N 3.05Å; A152-I154 PolarHBondContact O-N 3.4Å
153Y39.9Very low39Very low213 Ų213142.8 Ų142.884%0.83581%0.811SS**  trans-53.2133.3172.2-97-101000109.5N151N151-Y153 VanDerWaalsContact C-N 3.27Å; N151-Y153 PolarHBondContact O-N 3.5Å
154I40.7Very low39.3Very low235 Ų235148.2 Ų148.2100%1.20582%0.821SS**  trans-50.50169.1-63.5163.9000110.6A152A152-I154 PolarHBondContact O-N 3.4Å

Retrieved 154 of 154 residues in 55.7 ms (Link to these results)