A0A077Z1C9_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z1C9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 158 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
1M66.3Low85.3Confident200 Ų200130 Ų13099%0.98564%0.637SS**  0-45.80-60-45.6-140.700114.5L3 W4M1-L3 PolarHBondContact O-N 3.45Å; M1-W4 PolarHBondContact O-N 3.15Å
2R78.2Confident85.8Confident222 Ų222128.6 Ų128.684%0.83863%0.633SS**Hα-helixtrans-66.4-34-172.9-65.2-179.8-178.5152.10.2115.5W4 L5 F6R2-W4 PolarHBondContact O-N 3.32Å; R2-L5 PolarHBondContact O-N 3.4Å; R2-F6 PolarHBondContact O-N 3.11Å; R2-F6 VanDerWaalsContact O-N 3.1Å
3L83Confident86.1Confident149 Ų149123.2 Ų123.278%0.7862%0.622SS**Hα-helixtrans-59.8-34.6178.8-71.6168.3000112.7M1 F6 A7M1-L3 PolarHBondContact O-N 3.45Å; L3-F6 PolarHBondContact O-N 3.39Å; L3-A7 WeakPolarHBondContact O-CB 3.44Å; L3-A7 PolarHBondContact O-N 3.44Å
4W86.1Confident86.4Confident197 Ų197121.4 Ų121.475%0.74661%0.614SS**Hα-helixtrans-67.5-41.2177.8-71.386.1000112M1 R2 F6 A7 L8M1-W4 PolarHBondContact O-N 3.15Å; R2-W4 PolarHBondContact O-N 3.32Å; W4-F6 VanDerWaalsContact C-N 3.34Å; W4-A7 PolarHBondContact O-N 3.35Å; W4-L8 WeakPolarHBondContact O-CG 3.43Å; W4-L8 PolarHBondContact O-N 3.4Å
5L87.4Confident86.7Confident114 Ų114119 Ų11960%0.59761%0.607SS**Hα-helixtrans-64.6-40.3175.2-66.2175.9000111.4R2 L8 L9R2-L5 PolarHBondContact O-N 3.4Å; L5-L8 PolarHBondContact O-N 3.05Å; L5-L9 WeakPolarHBondContact O-CG 3.45Å; L5-L9 PolarHBondContact O-N 3.17Å
6F85.7Confident86.8Confident141 Ų141116.5 Ų116.562%0.61860%0.599SS**Hα-helixtrans-64.6-43.9176.2-171.1-98.4000111.7R2 L3 W4 L8 L9 V10R2-F6 PolarHBondContact O-N 3.11Å; R2-F6 VanDerWaalsContact O-N 3.1Å; L3-F6 PolarHBondContact O-N 3.39Å; W4-F6 VanDerWaalsContact C-N 3.34Å; F6-L8 VanDerWaalsContact C-N 3.34Å; F6-L8 PolarHBondContact O-N 2.99Å; F6-L9 PolarHBondContact O-N 3.22Å; F6-V10 HydrophobicContact CD1-CG2 4.05Å; F6-V10 HydrophobicContact CE1-CG2 3.69Å; F6-V10 HydrophobicContact CZ-CG2 4.01Å; F6-V10 WeakPolarHBondContact O-CG2 3.43Å; F6-V10 PolarHBondContact O-N 3.07Å
7A89Confident86.8Confident49 Ų49117.6 Ų117.641%0.40560%0.599SS.*Hα-helixtrans-59.8-43.4175.500000111.9L3 W4 L9 V10 C11L3-A7 WeakPolarHBondContact O-CB 3.44Å; L3-A7 PolarHBondContact O-N 3.44Å; W4-A7 PolarHBondContact O-N 3.35Å; A7-L9 PolarHBondContact O-N 3.2Å; A7-V10 PolarHBondContact O-N 3.17Å; A7-C11 WeakPolarHBondContact O-CB 3.41Å; A7-C11 PolarHBondContact O-N 3.38Å; A7-C11 PolarHBondContact O-SG 3.42Å
8L89.6Confident86.7Confident108 Ų108115.1 Ų115.157%0.56559%0.59SS**Hα-helixtrans-62.3-41.2176-73.6173.9000112.6W4 L5 F6 C11 L12W4-L8 WeakPolarHBondContact O-CG 3.43Å; W4-L8 PolarHBondContact O-N 3.4Å; L5-L8 PolarHBondContact O-N 3.05Å; F6-L8 VanDerWaalsContact C-N 3.34Å; F6-L8 PolarHBondContact O-N 2.99Å; L8-C11 PolarHBondContact O-N 3.07Å; L8-L12 WeakPolarHBondContact O-CG 3.45Å; L8-L12 PolarHBondContact O-N 3.49Å
9L89.7Confident86.4Confident114 Ų114112.9 Ų112.960%0.59758%0.583SS**Hα-helixtrans-64.9-41.9176.4-73.8173.8000112.1L5 F6 A7 L12 A13L5-L9 WeakPolarHBondContact O-CG 3.45Å; L5-L9 PolarHBondContact O-N 3.17Å; F6-L9 PolarHBondContact O-N 3.22Å; A7-L9 PolarHBondContact O-N 3.2Å; L9-L12 PolarHBondContact O-N 3.16Å; L9-A13 WeakPolarHBondContact O-CB 3.38Å; L9-A13 PolarHBondContact O-N 3.29Å
10V92.1Very high86Confident61 Ų61113.1 Ų113.137%0.3758%0.581SS.*Hα-helixtrans-64.5-42.3176.2173.60000110.7F6 A7 L12 A13 I14F6-V10 HydrophobicContact CD1-CG2 4.05Å; F6-V10 HydrophobicContact CE1-CG2 3.69Å; F6-V10 HydrophobicContact CZ-CG2 4.01Å; F6-V10 WeakPolarHBondContact O-CG2 3.43Å; F6-V10 PolarHBondContact O-N 3.07Å; A7-V10 PolarHBondContact O-N 3.17Å; V10-L12 PolarHBondContact O-N 3.28Å; V10-A13 PolarHBondContact O-N 3.35Å; V10-I14 HydrophobicContact CG1-CD1 3.79Å; V10-I14 HydrophobicContact CG1-CG1 4.41Å; V10-I14 VanDerWaalsContact O-CG1 3.26Å; V10-I14 WeakPolarHBondContact O-CG1 3.46Å; V10-I14 PolarHBondContact O-N 3.4Å
11C91.7Very high85.3Confident75 Ų75110.9 Ų110.951%0.50757%0.57SS.*Hα-helixtrans-59.5-46.1174.4-72.10000111.9A7 L8 A13 I14 V15A7-C11 WeakPolarHBondContact O-CB 3.41Å; A7-C11 PolarHBondContact O-N 3.38Å; A7-C11 PolarHBondContact O-SG 3.42Å; L8-C11 PolarHBondContact O-N 3.07Å; C11-A13 PolarHBondContact O-N 3.38Å; C11-I14 PolarHBondContact O-N 3.43Å; C11-V15 WeakPolarHBondContact O-CG2 3.49Å; C11-V15 PolarHBondContact O-N 3.18Å
12L90.5Very high85.4Confident113 Ų113104.9 Ų104.959%0.59254%0.544SS*.Hα-helixtrans-60.9-44.2176.2-77.5170.5000111.9L8 L9 V10 I14 V15 V16L8-L12 WeakPolarHBondContact O-CG 3.45Å; L8-L12 PolarHBondContact O-N 3.49Å; L9-L12 PolarHBondContact O-N 3.16Å; V10-L12 PolarHBondContact O-N 3.28Å; L12-I14 PolarHBondContact O-N 3.1Å; L12-V15 PolarHBondContact O-N 3.36Å; L12-V16 WeakPolarHBondContact O-CG2 3.18Å; L12-V16 PolarHBondContact O-N 3.33Å
13A90.1Very high84.7Confident59 Ų59100.2 Ų100.249%0.48853%0.532SS..Hα-helixtrans-61.7-42.3177.900000112.2L9 V10 C11 V16 F17L9-A13 WeakPolarHBondContact O-CB 3.38Å; L9-A13 PolarHBondContact O-N 3.29Å; V10-A13 PolarHBondContact O-N 3.35Å; C11-A13 PolarHBondContact O-N 3.38Å; A13-V16 PolarHBondContact O-N 3.43Å; A13-F17 VanDerWaalsContact O-CB 3.29Å; A13-F17 WeakPolarHBondContact O-CB 3.4Å; A13-F17 PolarHBondContact O-N 3.44Å
14I91.1Very high83.7Confident98 Ų9894.8 Ų94.850%0.50351%0.509SS..Hα-helixtrans-64.1-42.3176.5-66.3165.3000110.8V10 C11 L12 F17 T18V10-I14 HydrophobicContact CG1-CD1 3.79Å; V10-I14 HydrophobicContact CG1-CG1 4.41Å; V10-I14 VanDerWaalsContact O-CG1 3.26Å; V10-I14 WeakPolarHBondContact O-CG1 3.46Å; V10-I14 PolarHBondContact O-N 3.4Å; C11-I14 PolarHBondContact O-N 3.43Å; L12-I14 PolarHBondContact O-N 3.1Å; I14-F17 PolarHBondContact O-N 3.41Å; I14-T18 HydrophobicContact CG2-CG2 4.24Å; I14-T18 WeakPolarHBondContact O-CB 3.38Å; I14-T18 VanDerWaalsContact O-CG2 3.25Å; I14-T18 WeakPolarHBondContact O-CG2 3.45Å; I14-T18 PolarHBondContact O-N 3.39Å; I14-T18 PolarHBondContact O-OG1 3.44Å
15V90.4Very high82.5Confident85 Ų8592.7 Ų92.752%0.51551%0.505SS..Hα-helixtrans-62.6-46.6177.5172.60000110.9C11 L12 F17 T18 V19C11-V15 WeakPolarHBondContact O-CG2 3.49Å; C11-V15 PolarHBondContact O-N 3.18Å; L12-V15 PolarHBondContact O-N 3.36Å; V15-F17 PolarHBondContact O-N 3.23Å; V15-T18 WeakPolarHBondContact CA-OG1 3.33Å; V15-T18 PolarHBondContact O-N 3.22Å; V15-T18 PolarHBondContact O-OG1 3.46Å; V15-V19 VanDerWaalsContact O-CG2 3.32Å; V15-V19 WeakPolarHBondContact O-CG2 3.25Å; V15-V19 PolarHBondContact O-N 3.24Å
16V88.8Confident81.2Confident79 Ų7993.8 Ų93.848%0.47951%0.505SS..Hα-helixtrans-61-47.1176.1174.70000110.9L12 A13 T18 V19 E20L12-V16 WeakPolarHBondContact O-CG2 3.18Å; L12-V16 PolarHBondContact O-N 3.33Å; A13-V16 PolarHBondContact O-N 3.43Å; V16-T18 VanDerWaalsContact C-N 3.32Å; V16-T18 PolarHBondContact O-N 3.47Å; V16-V19 PolarHBondContact O-N 3.1Å; V16-E20 HydrophobicContact CG1-CG 4.36Å; V16-E20 WeakPolarHBondContact O-CB 3.18Å; V16-E20 WeakPolarHBondContact O-CG 2.89Å; V16-E20 PolarHBondContact O-N 3.35Å
17F85.4Confident79.7Confident136 Ų13690 Ų9060%0.59650%0.499SS*.Hα-helixtrans-65.7-33.2-178.4-152.1-102.2000112.7A13 I14 V15 N21A13-F17 VanDerWaalsContact O-CB 3.29Å; A13-F17 WeakPolarHBondContact O-CB 3.4Å; A13-F17 PolarHBondContact O-N 3.44Å; I14-F17 PolarHBondContact O-N 3.41Å; V15-F17 PolarHBondContact O-N 3.23Å; F17-N21 WeakPolarHBondContact CD1-ND2 3.22Å; F17-N21 WeakPolarHBondContact CE1-ND2 3.38Å; F17-N21 VanDerWaalsContact O-CB 3.23Å; F17-N21 WeakPolarHBondContact O-CB 3.04Å; F17-N21 PolarHBondContact O-N 3Å; F17-N21 PolarHBondContact O-ND2 3.42Å
18T85.6Confident77.9Confident72 Ų7294.9 Ų94.944%0.44251%0.511SS..Hα-helixtrans-73-41175.5530000111.9I14 V15 V16 N21 V22I14-T18 HydrophobicContact CG2-CG2 4.24Å; I14-T18 WeakPolarHBondContact O-CB 3.38Å; I14-T18 VanDerWaalsContact O-CG2 3.25Å; I14-T18 WeakPolarHBondContact O-CG2 3.45Å; I14-T18 PolarHBondContact O-N 3.39Å; I14-T18 PolarHBondContact O-OG1 3.44Å; V15-T18 WeakPolarHBondContact CA-OG1 3.33Å; V15-T18 PolarHBondContact O-N 3.22Å; V15-T18 PolarHBondContact O-OG1 3.46Å; V16-T18 VanDerWaalsContact C-N 3.32Å; V16-T18 PolarHBondContact O-N 3.47Å; T18-N21 PolarHBondContact O-N 3.29Å; T18-V22 WeakPolarHBondContact O-CB 3.09Å; T18-V22 WeakPolarHBondContact O-CG2 3.21Å; T18-V22 PolarHBondContact O-N 3.35Å
19V81.9Confident76.1Confident74 Ų7493.4 Ų93.445%0.44851%0.51SS..Hα-helixtrans-62.6-49.8174.5173.90000110.3V15 V16 N21 V22 E23V15-V19 VanDerWaalsContact O-CG2 3.32Å; V15-V19 WeakPolarHBondContact O-CG2 3.25Å; V15-V19 PolarHBondContact O-N 3.24Å; V16-V19 PolarHBondContact O-N 3.1Å; V19-N21 PolarHBondContact O-N 3.42Å; V19-V22 PolarHBondContact O-N 3.49Å; V19-E23 WeakPolarHBondContact O-CB 3.49Å; V19-E23 WeakPolarHBondContact O-CG 3.25Å; V19-E23 PolarHBondContact O-N 3.46Å
20E77.1Confident74.2Confident116 Ų11696.6 Ų96.654%0.54252%0.519SS..Hα-helixtrans-63.3-38.5178-72.9-175169.100112.4V16 E23 A24V16-E20 HydrophobicContact CG1-CG 4.36Å; V16-E20 WeakPolarHBondContact O-CB 3.18Å; V16-E20 WeakPolarHBondContact O-CG 2.89Å; V16-E20 PolarHBondContact O-N 3.35Å; E20-E23 PolarHBondContact O-N 2.96Å; E20-A24 WeakPolarHBondContact O-CA 3.41Å; E20-A24 WeakPolarHBondContact O-CB 3.34Å; E20-A24 PolarHBondContact O-N 3.17Å
21N71.9Confident72.2Confident66 Ų66101.7 Ų101.735%0.35354%0.536SS..Hα-helixtrans-70.5-34.3175.4-87.1-65.3000112.9F17 T18 V19 K25F17-N21 WeakPolarHBondContact CD1-ND2 3.22Å; F17-N21 WeakPolarHBondContact CE1-ND2 3.38Å; F17-N21 VanDerWaalsContact O-CB 3.23Å; F17-N21 WeakPolarHBondContact O-CB 3.04Å; F17-N21 PolarHBondContact O-N 3Å; F17-N21 PolarHBondContact O-ND2 3.42Å; T18-N21 PolarHBondContact O-N 3.29Å; V19-N21 PolarHBondContact O-N 3.42Å; N21-K25 VanDerWaalsContact O-CB 3.24Å; N21-K25 WeakPolarHBondContact O-CB 3.41Å; N21-K25 WeakPolarHBondContact O-CG 3.3Å; N21-K25 PolarHBondContact O-N 3.31Å
22V68.9Low70Confident74 Ų74101 Ų10145%0.44853%0.532SS..Hα-helixtrans-69-41.7175.3169.80000110T18 V19 K25 K26T18-V22 WeakPolarHBondContact O-CB 3.09Å; T18-V22 WeakPolarHBondContact O-CG2 3.21Å; T18-V22 PolarHBondContact O-N 3.35Å; V19-V22 PolarHBondContact O-N 3.49Å; V22-K25 PolarHBondContact O-N 3.18Å; V22-K26 HydrophobicContact CG1-CD 4.3Å; V22-K26 VanDerWaalsContact O-CG 3.3Å; V22-K26 WeakPolarHBondContact O-CG 3.29Å; V22-K26 PolarHBondContact O-N 3.37Å
23E63.7Low67.9Low125 Ų125103.4 Ų103.458%0.58453%0.533SS*.Hα-helixtrans-68.6-41.2174.5-72.4-168.8166.300112.2V19 E20 K25 K26 A27V19-E23 WeakPolarHBondContact O-CB 3.49Å; V19-E23 WeakPolarHBondContact O-CG 3.25Å; V19-E23 PolarHBondContact O-N 3.46Å; E20-E23 PolarHBondContact O-N 2.96Å; E23-K25 VanDerWaalsContact C-N 3.34Å; E23-K25 PolarHBondContact O-N 3.04Å; E23-K26 CarbonylContact O-C 3.55Å; E23-K26 PolarHBondContact O-N 3.39Å; E23-A27 VanDerWaalsContact O-CB 3.25Å; E23-A27 WeakPolarHBondContact O-CB 2.91Å; E23-A27 PolarHBondContact O-N 3.39Å
24A62.1Low65.7Low35 Ų35104.1 Ų104.129%0.28954%0.535SS..Hα-helixtrans-66-35.4174.900000111.7E20 A27 K28E20-A24 WeakPolarHBondContact O-CA 3.41Å; E20-A24 WeakPolarHBondContact O-CB 3.34Å; E20-A24 PolarHBondContact O-N 3.17Å; A24-A27 PolarHBondContact O-N 2.78Å; A24-K28 WeakPolarHBondContact O-CB 3.14Å; A24-K28 WeakPolarHBondContact O-CG 3.34Å; A24-K28 PolarHBondContact O-N 2.97Å
25K60.6Low63.6Low152 Ų152105.7 Ų105.766%0.66154%0.54SS*.Hα-helixtrans-67.6-38.3172.2-78.3175.9-179.6-178.90111.4N21 V22 E23 S29N21-K25 VanDerWaalsContact O-CB 3.24Å; N21-K25 WeakPolarHBondContact O-CB 3.41Å; N21-K25 WeakPolarHBondContact O-CG 3.3Å; N21-K25 PolarHBondContact O-N 3.31Å; V22-K25 PolarHBondContact O-N 3.18Å; E23-K25 VanDerWaalsContact C-N 3.34Å; E23-K25 PolarHBondContact O-N 3.04Å; K25-S29 WeakPolarHBondContact O-CB 3.19Å; K25-S29 PolarHBondContact O-N 3.01Å
26K58.8Low61.4Low138 Ų138108.7 Ų108.760%0.655%0.548SS*.Hα-helixtrans-71.3-34.5174.4-71.6174.3-177.6178.80112.8V22 E23 K30V22-K26 HydrophobicContact CG1-CD 4.3Å; V22-K26 VanDerWaalsContact O-CG 3.3Å; V22-K26 WeakPolarHBondContact O-CG 3.29Å; V22-K26 PolarHBondContact O-N 3.37Å; E23-K26 CarbonylContact O-C 3.55Å; E23-K26 PolarHBondContact O-N 3.39Å; K26-K30 PolarHBondContact O-N 3.26Å
27A54.2Low59.3Low60 Ų60111.6 Ų111.650%0.49655%0.551SS.*Hα-helixtrans-75.7-38.717700000111.7E23 A24 K31E23-A27 VanDerWaalsContact O-CB 3.25Å; E23-A27 WeakPolarHBondContact O-CB 2.91Å; E23-A27 PolarHBondContact O-N 3.39Å; A24-A27 PolarHBondContact O-N 2.78Å; A27-K31 VanDerWaalsContact O-CB 3.29Å; A27-K31 WeakPolarHBondContact O-CB 3.28Å; A27-K31 PolarHBondContact O-N 3.13Å
28K51.8Low57.5Low153 Ų153109 Ų10967%0.66555%0.546SS*.Hα-helixtrans-73.8-32.7173.8-68.9178-177.9-178.20111.9A24 K30 K31 S32A24-K28 WeakPolarHBondContact O-CB 3.14Å; A24-K28 WeakPolarHBondContact O-CG 3.34Å; A24-K28 PolarHBondContact O-N 2.97Å; K28-K30 VanDerWaalsContact C-N 3.3Å; K28-K30 PolarHBondContact O-N 2.97Å; K28-K31 PolarHBondContact O-N 3.14Å; K28-S32 PolarHBondContact O-N 3.45Å; K28-S32 PolarHBondContact O-OG 3.03Å
29S51.2Low55.6Low76 Ų76109.7 Ų109.753%0.53155%0.55SS.*Hα-helixtrans-73.6-19.1176.6940000114K25K25-S29 WeakPolarHBondContact O-CB 3.19Å; K25-S29 PolarHBondContact O-N 3.01Å
30K50.2Low54Low181 Ų181109.8 Ų109.879%0.78755%0.554SS**Hα-helixtrans-95.2-10.4171.2-70.7-170.3177.5-177.80113.8K26 K28K26-K30 PolarHBondContact O-N 3.26Å; K28-K30 VanDerWaalsContact C-N 3.3Å; K28-K30 PolarHBondContact O-N 2.97Å
31K49.4Very low52.4Low168 Ų168107 Ų10773%0.7354%0.543SS*.Hα-helixtrans-109.7-13.3-177.9-143.3154.8-176.1174.20114.9A27 K28A27-K31 VanDerWaalsContact O-CB 3.29Å; A27-K31 WeakPolarHBondContact O-CB 3.28Å; A27-K31 PolarHBondContact O-N 3.13Å; K28-K31 PolarHBondContact O-N 3.14Å
32S45.9Very low51.2Low60 Ų60113.3 Ų113.342%0.4256%0.562SS.*SBendtrans-97.5-22.817467.90000115K28 S34 Q35 E36K28-S32 PolarHBondContact O-N 3.45Å; K28-S32 PolarHBondContact O-OG 3.03Å; S32-S34 VanDerWaalsContact C-N 3.3Å; S32-S34 PolarHBondContact O-N 3.45Å; S32-Q35 PolarHBondContact O-N 3.08Å; S32-E36 PolarHBondContact O-N 3.14Å
33R46.1Very low50.2Low165 Ų165117.8 Ų117.862%0.62358%0.575SS**THydrogen-bonded Turntrans-74.9-16.8179.7-155173.4-165.7172.65.1113.9R37R33-R37 VanDerWaalsContact O-CB 3.25Å; R33-R37 WeakPolarHBondContact O-CB 3.24Å; R33-R37 WeakPolarHBondContact O-CD 3.49Å; R33-R37 VanDerWaalsContact O-CG 3.25Å; R33-R37 WeakPolarHBondContact O-CG 3.32Å
34S44.9Very low49.4Very low74 Ų74115.9 Ų115.952%0.51757%0.566SS.*THydrogen-bonded Turntrans-91.9-18.3171.383.30000112.9S32 T38S32-S34 VanDerWaalsContact C-N 3.3Å; S32-S34 PolarHBondContact O-N 3.45Å; S34-T38 WeakPolarHBondContact O-CB 3.49Å; S34-T38 WeakPolarHBondContact O-CG2 3.32Å; S34-T38 PolarHBondContact O-N 2.91Å; S34-T38 PolarHBondContact O-OG1 2.84Å
35Q47.3Very low48.6Very low131 Ų131119.6 Ų119.661%0.61258%0.577SS**Hα-helixtrans-87.8-39.6179.7-158.4171.89.700112.3S32 T38 V39S32-Q35 PolarHBondContact O-N 3.08Å; Q35-T38 VanDerWaalsContact CA-OG1 3.28Å; Q35-T38 WeakPolarHBondContact CA-OG1 3.47Å; Q35-T38 PolarHBondContact O-N 3.43Å; Q35-T38 PolarHBondContact O-OG1 2.99Å; Q35-V39 WeakPolarHBondContact O-CB 3.45Å; Q35-V39 VanDerWaalsContact O-CG2 3.32Å; Q35-V39 WeakPolarHBondContact O-CG2 3.25Å; Q35-V39 PolarHBondContact O-N 3.19Å
36E43.6Very low48.1Very low147 Ų147120.1 Ų120.169%0.68758%0.58SS**Hα-helixtrans-72.2-31.5170-73.4-176145.700111.7S32 S40S32-E36 PolarHBondContact O-N 3.14Å; E36-S40 WeakPolarHBondContact O-CA 3.32Å; E36-S40 WeakPolarHBondContact O-CB 3.43Å; E36-S40 PolarHBondContact O-N 3.34Å
37R45.6Very low47.7Very low140 Ų140121.3 Ų121.353%0.52859%0.585SS.*Hα-helixtrans-75-24.2169.3-73.9-177.4174.7175.5-3.7113.5R33 N41R33-R37 VanDerWaalsContact O-CB 3.25Å; R33-R37 WeakPolarHBondContact O-CB 3.24Å; R33-R37 WeakPolarHBondContact O-CD 3.49Å; R33-R37 VanDerWaalsContact O-CG 3.25Å; R33-R37 WeakPolarHBondContact O-CG 3.32Å; R37-N41 WeakPolarHBondContact O-CA 3.45Å; R37-N41 WeakPolarHBondContact O-CB 3.48Å; R37-N41 PolarHBondContact O-N 3.28Å; R37-N41 PolarHBondContact O-ND2 3.3Å; R37-N41 VanDerWaalsContact O-ND2 3.14Å
38T47.1Very low47.5Very low83 Ų83123.8 Ų123.851%0.50958%0.584SS.*Hα-helixtrans-85.6-23.1174.242.60000112.9S34 Q35 R42S34-T38 WeakPolarHBondContact O-CB 3.49Å; S34-T38 WeakPolarHBondContact O-CG2 3.32Å; S34-T38 PolarHBondContact O-N 2.91Å; S34-T38 PolarHBondContact O-OG1 2.84Å; Q35-T38 VanDerWaalsContact CA-OG1 3.28Å; Q35-T38 WeakPolarHBondContact CA-OG1 3.47Å; Q35-T38 PolarHBondContact O-N 3.43Å; Q35-T38 PolarHBondContact O-OG1 2.99Å; T38-R42 WeakPolarHBondContact O-CB 3.25Å; T38-R42 WeakPolarHBondContact O-CG 3.08Å; T38-R42 PolarHBondContact O-N 3.41Å
39V46.4Very low47.4Very low86 Ų86122.3 Ų122.352%0.52158%0.579SS.*Hα-helixtrans-88.9-34.9172.9-178.50000111.7Q35 R42 K43Q35-V39 WeakPolarHBondContact O-CB 3.45Å; Q35-V39 VanDerWaalsContact O-CG2 3.32Å; Q35-V39 WeakPolarHBondContact O-CG2 3.25Å; Q35-V39 PolarHBondContact O-N 3.19Å; V39-R42 PolarHBondContact O-N 2.83Å; V39-K43 PolarHBondContact O-N 2.7Å; V39-K43 VanDerWaalsContact O-N 3.16Å
40S47.2Very low47.4Very low75 Ų75125.4 Ų125.452%0.52459%0.585SS.*Hα-helixtrans-72.6-44.4168.5-179.60000111.6E36 R42 K43 E44E36-S40 WeakPolarHBondContact O-CA 3.32Å; E36-S40 WeakPolarHBondContact O-CB 3.43Å; E36-S40 PolarHBondContact O-N 3.34Å; S40-R42 VanDerWaalsContact C-N 3.3Å; S40-R42 PolarHBondContact O-N 2.57Å; S40-K43 PolarHBondContact O-N 2.95Å; S40-E44 WeakPolarHBondContact O-CB 3.05Å; S40-E44 PolarHBondContact O-N 3.37Å
41N43.5Very low47.3Very low58 Ų58122.5 Ų122.531%0.3157%0.574SS.*Hα-helixtrans-68.5-23168.2-84.1-52.5000112.5R37 H45R37-N41 WeakPolarHBondContact O-CA 3.45Å; R37-N41 WeakPolarHBondContact O-CB 3.48Å; R37-N41 PolarHBondContact O-N 3.28Å; R37-N41 PolarHBondContact O-ND2 3.3Å; R37-N41 VanDerWaalsContact O-ND2 3.14Å; N41-H45 WeakPolarHBondContact O-CA 3.23Å; N41-H45 WeakPolarHBondContact O-CB 3.2Å; N41-H45 PolarHBondContact O-CD2 3.16Å; N41-H45 VanDerWaalsContact O-CG 3.28Å; N41-H45 PolarHBondContact O-N 2.92Å
42R46.7Very low47.3Very low199 Ų199123.6 Ų123.675%0.75157%0.574SS**Hα-helixtrans-68.2-36.6171.4-108.2178.6163.7177.6-4.4112.1T38 V39 S40 K46T38-R42 WeakPolarHBondContact O-CB 3.25Å; T38-R42 WeakPolarHBondContact O-CG 3.08Å; T38-R42 PolarHBondContact O-N 3.41Å; V39-R42 PolarHBondContact O-N 2.83Å; S40-R42 VanDerWaalsContact C-N 3.3Å; S40-R42 PolarHBondContact O-N 2.57Å; R42-K46 PolarHBondContact O-N 3.4Å
43K47.5Very low47.7Very low167 Ų167126 Ų12673%0.72658%0.579SS**Hα-helixtrans-77.6-32.2174-78.1-174.2174.4-179.80112.3V39 S40 K47V39-K43 PolarHBondContact O-N 2.7Å; V39-K43 VanDerWaalsContact O-N 3.16Å; S40-K43 PolarHBondContact O-N 2.95Å; K43-K47 PolarHBondContact O-N 3.42Å
44E46.7Very low48Very low86 Ų86123.2 Ų123.240%0.40258%0.576SS.*Hα-helixtrans-80.3-32.4176.6-145.3-170.8145.400112.8S40 K47 K48S40-E44 WeakPolarHBondContact O-CB 3.05Å; S40-E44 PolarHBondContact O-N 3.37Å; E44-K47 PolarHBondContact O-N 2.82Å; E44-K48 WeakPolarHBondContact O-CB 3.47Å; E44-K48 WeakPolarHBondContact O-CG 3.38Å; E44-K48 PolarHBondContact O-N 3.22Å; E44-K48 WeakPolarHBondContact OE1-CE 3.01Å; E44-K48 IonicContact OE1-NZ 3.85Å; E44-K48 PolarHBondContact OE1-NZ 3.4Å
45H45.9Very low48.2Very low113 Ų113128.3 Ų128.352%0.52358%0.584SS.*Hα-helixtrans-72.9-28170.9-79-66.1000112.3N41 K48 H49N41-H45 WeakPolarHBondContact O-CA 3.23Å; N41-H45 WeakPolarHBondContact O-CB 3.2Å; N41-H45 PolarHBondContact O-CD2 3.16Å; N41-H45 VanDerWaalsContact O-CG 3.28Å; N41-H45 PolarHBondContact O-N 2.92Å; H45-K48 PolarHBondContact O-N 2.81Å; H45-H49 WeakPolarHBondContact O-CB 3.18Å; H45-H49 PolarHBondContact O-N 3.24Å
46K50Low48.4Very low163 Ų163128.6 Ų128.671%0.70959%0.585SS**Hα-helixtrans-64.5-44.5169.3-103.5-174.7171.2-170.90111.4R42 H49 E50R42-K46 PolarHBondContact O-N 3.4Å; K46-H49 PolarHBondContact O-N 3.45Å; K46-E50 PolarHBondContact O-N 3.47Å; K46-E50 VanDerWaalsContact O-N 3.08Å
47K50.4Low48.8Very low162 Ų162131 Ų13170%0.70459%0.588SS**Hα-helixtrans-65.1-37.4173.3-88.4-172.9171.3-176.40113.4K43 E44 H51K43-K47 PolarHBondContact O-N 3.42Å; E44-K47 PolarHBondContact O-N 2.82Å; K47-H51 WeakPolarHBondContact O-CB 3.47Å; K47-H51 PolarHBondContact O-N 2.98Å; K47-H51 VanDerWaalsContact O-N 3.13Å
48K50.1Low49.1Very low112 Ų112130.2 Ų130.249%0.48759%0.59SS.*Hα-helixtrans-74.7-23.5175.9-71.9175.1-174.4161.10112.9E44 H45 R52E44-K48 WeakPolarHBondContact O-CB 3.47Å; E44-K48 WeakPolarHBondContact O-CG 3.38Å; E44-K48 PolarHBondContact O-N 3.22Å; E44-K48 WeakPolarHBondContact OE1-CE 3.01Å; E44-K48 IonicContact OE1-NZ 3.85Å; E44-K48 PolarHBondContact OE1-NZ 3.4Å; H45-K48 PolarHBondContact O-N 2.81Å; K48-R52 WeakPolarHBondContact O-CB 3.5Å; K48-R52 PolarHBondContact O-N 3.18Å; K48-R52 VanDerWaalsContact O-N 3.17Å
49H50.1Low49.1Very low122 Ų122131.7 Ų131.757%0.56560%0.595SS**Hα-helixtrans-82.1-30.8176.3-149-69.6000112.4H45 K46 Q53H45-H49 WeakPolarHBondContact O-CB 3.18Å; H45-H49 PolarHBondContact O-N 3.24Å; K46-H49 PolarHBondContact O-N 3.45Å; H49-Q53 PolarHBondContact CE1-NE2 3.47Å; H49-Q53 PolarHBondContact ND1-NE2 3.26Å; H49-Q53 WeakPolarHBondContact O-CG 3.45Å; H49-Q53 PolarHBondContact O-N 2.79Å
50E50.7Low49.4Very low141 Ų141137.8 Ų137.866%0.65961%0.609SS**Hα-helixtrans-69.3-42.2167.9-81.7176.2151.300111.3K46 R52 Q53 D54K46-E50 PolarHBondContact O-N 3.47Å; K46-E50 VanDerWaalsContact O-N 3.08Å; E50-R52 VanDerWaalsContact C-N 3.27Å; E50-R52 PolarHBondContact O-N 3.46Å; E50-Q53 PolarHBondContact O-N 3.22Å; E50-D54 PolarHBondContact O-N 2.74Å
51H49.1Very low49.4Very low120 Ų120140.6 Ų140.656%0.55661%0.611SS**Hα-helixtrans-72.5-18.2179.5-158.251.6000114.1K47K47-H51 WeakPolarHBondContact O-CB 3.47Å; K47-H51 PolarHBondContact O-N 2.98Å; K47-H51 VanDerWaalsContact O-N 3.13Å
52R49.3Very low49.6Very low191 Ų191142.7 Ų142.772%0.72162%0.623SS**Hα-helixtrans-84.7-24.9174.1-140.8174.4-171167.11.8112.6K48 E50K48-R52 WeakPolarHBondContact O-CB 3.5Å; K48-R52 PolarHBondContact O-N 3.18Å; K48-R52 VanDerWaalsContact O-N 3.17Å; E50-R52 VanDerWaalsContact C-N 3.27Å; E50-R52 PolarHBondContact O-N 3.46Å
53Q54.4Low49.8Very low112 Ų112140.9 Ų140.952%0.52362%0.62SS.*Hα-helixtrans-80.5-25176.4-73.8-177.18.900113.2H49 E50 R57H49-Q53 PolarHBondContact CE1-NE2 3.47Å; H49-Q53 PolarHBondContact ND1-NE2 3.26Å; H49-Q53 WeakPolarHBondContact O-CG 3.45Å; H49-Q53 PolarHBondContact O-N 2.79Å; E50-Q53 PolarHBondContact O-N 3.22Å; Q53-R57 PolarHBondContact O-N 3.49Å
54D50.8Low49.8Very low106 Ų106134.5 Ų134.557%0.56760%0.602SS**Hα-helixtrans-77.5-24.8171.3-100.4-16.5000113.5E50E50-D54 PolarHBondContact O-N 2.74Å
55R50Low49.8Very low181 Ų181137 Ų13768%0.68361%0.611SS**Hα-helixtrans-76-30.7174.5-93.4-179.6170.5162.3-1.4113.4
56E52.4Low49.9Very low136 Ų136138.7 Ų138.764%0.63662%0.62SS**Hα-helixtrans-83-19175.7-75.3-177.317400113.8
57R51.8Low49.9Very low197 Ų197138.3 Ų138.374%0.74362%0.618SS**Hα-helixtrans-77.3-19.3170.1-82-173.3-178.7-146.10.7113.6Q53Q53-R57 PolarHBondContact O-N 3.49Å
58H50.6Low49.7Very low124 Ų124136.1 Ų136.157%0.57461%0.614SS**Hα-helixtrans-84.3-33.7175.7-103.6-87.1000113.2R60 K61H58-R60 VanDerWaalsContact C-N 3.32Å; H58-R60 PolarHBondContact O-N 3.31Å; H58-K61 PolarHBondContact O-N 3.06Å
59D47.9Very low49.6Very low115 Ų115135.8 Ų135.862%0.61562%0.618SS**Hα-helixtrans-72.5-21.1-179.1-114.6-23.7000114.3
60R51.9Low49.4Very low214 Ų214136.9 Ų136.981%0.80862%0.623SS**Hα-helixtrans-85.4-17173.3-70.2-174.8-178.5170.82.7113.3H58 G64H58-R60 VanDerWaalsContact C-N 3.32Å; H58-R60 PolarHBondContact O-N 3.31Å; R60-G64 PolarHBondContact O-N 3.28Å
61K47.3Very low49.3Very low133 Ų133137.4 Ų137.458%0.57862%0.623SS**Hα-helixtrans-82.1-27.6178.7-142.8174.9-174.5179.10111.7H58 K65H58-K61 PolarHBondContact O-N 3.06Å; K61-K65 PolarHBondContact O-N 3.17Å
62D49.1Very low49.3Very low103 Ų103136.8 Ų136.855%0.55162%0.624SS**Hα-helixtrans-86-35177.3-69.8-26.1000112.9G64 K65 E66D62-G64 VanDerWaalsContact C-N 3.3Å; D62-G64 PolarHBondContact O-N 3.22Å; D62-K65 PolarHBondContact O-N 3.27Å; D62-E66 PolarHBondContact O-N 3.41Å
63K49.7Very low49.4Very low161 Ų161135.3 Ų135.370%0.762%0.623SS**Hα-helixtrans-74-14.9171.7-75-168.6176.9179.80115.1
64G46.7Very low49.2Very low33 Ų33135.7 Ų135.734%0.3463%0.625SS.*Hα-helixtrans-84.6-35.517300000113.1R60 D62 K67 D68R60-G64 PolarHBondContact O-N 3.28Å; D62-G64 VanDerWaalsContact C-N 3.3Å; D62-G64 PolarHBondContact O-N 3.22Å; G64-K67 PolarHBondContact O-N 2.94Å; G64-D68 PolarHBondContact O-N 2.88Å
65K48.3Very low49.3Very low137 Ų137137.2 Ų137.260%0.59663%0.628SS**Hα-helixtrans-76.6-21.5179.4-78.6-176.7173.6-174.40114.2K61 D62 N69K61-K65 PolarHBondContact O-N 3.17Å; D62-K65 PolarHBondContact O-N 3.27Å; K65-N69 PolarHBondContact O-ND2 3.17Å
66E48.1Very low49.4Very low150 Ų150136 Ų13670%0.70163%0.628SS**Hα-helixtrans-78.9-28.9172.1-106.8-179.9168.300113.2D62D62-E66 PolarHBondContact O-N 3.41Å
67K49.1Very low49.5Very low155 Ų155132.7 Ų132.767%0.67462%0.62SS**Hα-helixtrans-84.3-24.5179.6-77.4-171.8174.4-175.90114.6G64G64-K67 PolarHBondContact O-N 2.94Å
68D47.4Very low49.7Very low115 Ų115130.1 Ų130.162%0.61561%0.614SS**Hα-helixtrans-81.8-25.3173.9-77.1-23000112.5G64 E70 D72G64-D68 PolarHBondContact O-N 2.88Å; D68-E70 VanDerWaalsContact C-N 3.33Å; D68-E70 PolarHBondContact O-N 3.33Å; D68-D72 PolarHBondContact O-N 2.69Å
69N46.8Very low49.9Very low106 Ų106130.2 Ų130.257%0.56762%0.615SS**Hα-helixtrans-77.3-13.8176.2-87.4-25.9000114.5K65 K73K65-N69 PolarHBondContact O-ND2 3.17Å; N69-K73 WeakPolarHBondContact O-CG 3.26Å
70E46.1Very low50.3Low145 Ų145131.1 Ų131.168%0.67862%0.615SS**Hα-helixtrans-90.5-30.2176.9-155.2164.3-157.400111.9D68 E74D68-E70 VanDerWaalsContact C-N 3.33Å; D68-E70 PolarHBondContact O-N 3.33Å; E70-E74 PolarHBondContact O-N 3.33Å
71K48.9Very low50.6Low151 Ų151126.5 Ų126.566%0.65760%0.603SS**Hα-helixtrans-76.4-30175.1-73.7-174176.8179.80113.8Q75K71-Q75 PolarHBondContact O-N 2.75Å
72D49.3Very low51.1Low108 Ų108126.5 Ų126.558%0.57860%0.599SS**Hα-helixtrans-75.9-23.8174.6-103.8-6.2000113.2D68 K76D68-D72 PolarHBondContact O-N 2.69Å; D72-K76 PolarHBondContact O-N 3.48Å
73K51.4Low51.6Low160 Ų160126.2 Ų126.270%0.69659%0.594SS**Hα-helixtrans-80-29.5173.1-73-178.8-178.7178.50112.5N69 S77N69-K73 WeakPolarHBondContact O-CG 3.26Å; K73-S77 PolarHBondContact O-N 3.42Å
74E50.5Low52.1Low120 Ų120126 Ų12656%0.56159%0.593SS**Hα-helixtrans-78.4-29177.2-138.9-176.7174.500113E70E70-E74 PolarHBondContact O-N 3.33Å
75Q52.7Low52.7Low138 Ų138133.1 Ų133.165%0.64561%0.61SS**Hα-helixtrans-76.5-37.8172.2-82.1-169-36.300113.2K71 S77 K78 E79K71-Q75 PolarHBondContact O-N 2.75Å; Q75-S77 VanDerWaalsContact C-N 3.35Å; Q75-S77 PolarHBondContact O-N 2.89Å; Q75-K78 PolarHBondContact O-N 3.41Å; Q75-E79 PolarHBondContact O-N 2.88Å
76K51.9Low53.1Low155 Ų155133.9 Ų133.967%0.67461%0.609SS**Hα-helixtrans-64.7-34.4175.2-100.2179.2173.4173.70113.5D72 E79 E80D72-K76 PolarHBondContact O-N 3.48Å; K76-E79 PolarHBondContact O-N 3.01Å; K76-E80 PolarHBondContact O-N 3.36Å; K76-E80 VanDerWaalsContact O-N 3.1Å
77S55Low53.5Low67 Ų67133.8 Ų133.847%0.46961%0.606SS.*Hα-helixtrans-70.8-32.5178.888.90000112.9K73 Q75 E81K73-S77 PolarHBondContact O-N 3.42Å; Q75-S77 VanDerWaalsContact C-N 3.35Å; Q75-S77 PolarHBondContact O-N 2.89Å; S77-E81 PolarHBondContact O-N 3.2Å; S77-E81 VanDerWaalsContact O-N 3.17Å
78K54.7Low53.9Low143 Ų143129 Ų12962%0.62260%0.596SS**Hα-helixtrans-71.7-32.3174.9-73.7-179.5180170.50112.8Q75 W82Q75-K78 PolarHBondContact O-N 3.41Å; K78-W82 PolarHBondContact O-N 2.9Å
79E54.6Low54.2Low125 Ų125131.6 Ų131.658%0.58460%0.602SS**Hα-helixtrans-74.3-38.4177.2-151.7171.2-161.100111.5Q75 K76 W82 H83Q75-E79 PolarHBondContact O-N 2.88Å; K76-E79 PolarHBondContact O-N 3.01Å; E79-W82 PolarHBondContact O-N 2.83Å; E79-H83 PolarHBondContact O-CD2 2.85Å; E79-H83 PolarHBondContact O-N 3.45Å
80E56.3Low54.6Low135 Ų135130.2 Ų130.263%0.63160%0.6SS**Hα-helixtrans-70.7-35.3178.7-154.7174.7-176.900113K76 H83 K84K76-E80 PolarHBondContact O-N 3.36Å; K76-E80 VanDerWaalsContact O-N 3.1Å; E80-H83 PolarHBondContact O-N 2.73Å; E80-K84 PolarHBondContact O-N 3.46Å
81E58.2Low55Low116 Ų116130 Ų13054%0.54260%0.599SS.*Hα-helixtrans-69.1-33.4175-157-174.2166.700112.4S77 K84 R85S77-E81 PolarHBondContact O-N 3.2Å; S77-E81 VanDerWaalsContact O-N 3.17Å; E81-K84 PolarHBondContact O-N 3.49Å; E81-R85 PolarHBondContact O-N 2.96Å; E81-R85 VanDerWaalsContact O-N 3.07Å
82W59.4Low55.2Low134 Ų134129.6 Ų129.651%0.50860%0.604SS.*Hα-helixtrans-66.2-38.3175.5-170.577.2000112.3K78 E79 R86K78-W82 PolarHBondContact O-N 2.9Å; E79-W82 PolarHBondContact O-N 2.83Å; W82-R86 PolarHBondContact O-N 3.16Å; W82-R86 VanDerWaalsContact O-N 3.16Å
83H58.5Low55.4Low97 Ų97129.5 Ų129.545%0.44961%0.608SS.*Hα-helixtrans-70.7-35.4176-79.4-69.6000113.2E79 E80 R86 K87E79-H83 PolarHBondContact O-CD2 2.85Å; E79-H83 PolarHBondContact O-N 3.45Å; E80-H83 PolarHBondContact O-N 2.73Å; H83-R86 PolarHBondContact O-N 3.27Å; H83-K87 PolarHBondContact O-N 2.96Å
84K60.9Low55.4Low156 Ų156126.9 Ų126.968%0.67861%0.609SS**Hα-helixtrans-66.2-43.9173.1-91.9178.9177.1172.30112.5E80 E81 R86 K87 A88E80-K84 PolarHBondContact O-N 3.46Å; E81-K84 PolarHBondContact O-N 3.49Å; K84-R86 VanDerWaalsContact C-N 3.31Å; K84-R86 PolarHBondContact O-N 2.95Å; K84-K87 PolarHBondContact O-N 2.87Å; K84-A88 PolarHBondContact O-N 2.85Å; K84-A88 VanDerWaalsContact O-N 3.11Å
85R58.9Low55.2Low182 Ų182124.3 Ų124.369%0.68762%0.615SS**Hα-helixtrans-65.3-30.7176.8-81.7-175.4174.6-136.5-1.4113.2E81 K89E81-R85 PolarHBondContact O-N 2.96Å; E81-R85 VanDerWaalsContact O-N 3.07Å; R85-K89 PolarHBondContact O-N 3.43Å
86R56.5Low54.7Low154 Ų154124 Ų12458%0.58162%0.623SS**Hα-helixtrans-72-41175.2-90.5-174.2162.9-166.3-2.2113.2W82 H83 K84 K89 S90W82-R86 PolarHBondContact O-N 3.16Å; W82-R86 VanDerWaalsContact O-N 3.16Å; H83-R86 PolarHBondContact O-N 3.27Å; K84-R86 VanDerWaalsContact C-N 3.31Å; K84-R86 PolarHBondContact O-N 2.95Å; R86-K89 PolarHBondContact O-N 2.96Å; R86-S90 PolarHBondContact O-N 3.49Å
87K57.2Low54.4Low148 Ų148125.1 Ų125.164%0.64363%0.63SS**Hα-helixtrans-69-40.6177.8-72.6-172.3175.6-174.50112.5H83 K84 K89 S90 E91H83-K87 PolarHBondContact O-N 2.96Å; K84-K87 PolarHBondContact O-N 2.87Å; K87-K89 VanDerWaalsContact C-N 3.28Å; K87-K89 PolarHBondContact O-N 3.27Å; K87-S90 PolarHBondContact O-N 3.29Å; K87-S90 VanDerWaalsContact O-N 3.17Å; K87-S90 PolarHBondContact O-OG 2.93Å; K87-E91 WeakPolarHBondContact O-CB 3.29Å; K87-E91 PolarHBondContact O-N 3.49Å
88A56.5Low53.8Low54 Ų54127.9 Ų127.945%0.44665%0.65SS.*Hα-helixtrans-64.9-28.7175.900000113.6K84 N92K84-A88 PolarHBondContact O-N 2.85Å; K84-A88 VanDerWaalsContact O-N 3.11Å; A88-N92 PolarHBondContact O-N 3.35Å
89K54.6Low53.5Low170 Ų170124.2 Ų124.274%0.73965%0.653SS**Hα-helixtrans-79.1-25.9173.8-94.9-176.3173.3-175.60114R85 R86 K87 T93R85-K89 PolarHBondContact O-N 3.43Å; R86-K89 PolarHBondContact O-N 2.96Å; K87-K89 VanDerWaalsContact C-N 3.28Å; K87-K89 PolarHBondContact O-N 3.27Å; K89-T93 PolarHBondContact O-OG1 3.35Å
90S54.1Low53.1Low76 Ų76129.6 Ų129.653%0.53167%0.668SS.*Hα-helixtrans-82.9-24.8174.8630000113.1R86 K87 T93R86-S90 PolarHBondContact O-N 3.49Å; K87-S90 PolarHBondContact O-N 3.29Å; K87-S90 VanDerWaalsContact O-N 3.17Å; K87-S90 PolarHBondContact O-OG 2.93Å; S90-T93 PolarHBondContact O-OG1 2.96Å; S90-T93 VanDerWaalsContact O-OG1 3.07Å
91E54.4Low52.8Low142 Ų142131.6 Ų131.666%0.66468%0.677SS**Hα-helixtrans-85.4-21.7-178.8-153.2162.6-179.800112.8K87 T93 S94K87-E91 WeakPolarHBondContact O-CB 3.29Å; K87-E91 PolarHBondContact O-N 3.49Å; E91-T93 VanDerWaalsContact C-N 3.32Å; E91-S94 PolarHBondContact O-OG 3Å
92N54.5Low52.2Low142 Ų142131.7 Ų131.776%0.75969%0.69SS**THydrogen-bonded Turntrans-87.26.6172.6-74.6-12.1000114.2A88A88-N92 PolarHBondContact O-N 3.35Å
93T53.6Low51.8Low106 Ų106128.9 Ų128.965%0.6570%0.703SS**THydrogen-bonded Turntrans-113.97.5177.547.40000113.7K89 S90 E91K89-T93 PolarHBondContact O-OG1 3.35Å; S90-T93 PolarHBondContact O-OG1 2.96Å; S90-T93 VanDerWaalsContact O-OG1 3.07Å; E91-T93 VanDerWaalsContact C-N 3.32Å
94S50.4Low51.5Low104 Ų104134.1 Ų134.173%0.72773%0.725SS**SBendtrans-93.912.817956.40000114.4E91E91-S94 PolarHBondContact O-OG 3Å
95G47Very low51.5Low67 Ų67135 Ų13569%0.69174%0.736SS**  trans-130.721.6-173.500000115.9
96T42.3Very low51.5Low132 Ų132132.2 Ų132.281%0.8174%0.741SS**  trans-110.693.9174.7-39.90000109.5
97E44.4Very low51.8Low177 Ų177134.4 Ų134.483%0.82776%0.755SS**  trans-50.3157.9165.5-61.7179.8114.900111.8
98S43.5Very low51.6Low126 Ų126139.4 Ų139.488%0.88177%0.77SS**  trans77.4105.5147.1-176.10000117.2
99G47.7Very low51.6Low66 Ų66143.3 Ų143.368%0.6879%0.788SS**  trans129.1116.4134.800000116.9
100R46Very low51.7Low238 Ų238144.7 Ų144.790%0.89879%0.794SS**  trans8098.1150.4-65.2174.6168.2148.8-2.5116.6
101E50.1Low51.3Low177 Ų177150.9 Ų150.983%0.82781%0.806SS**  60.7116.188.6-97.5-169.7128.200115.1
102S46.5Very low51.4Low117 Ų117151.2 Ų151.282%0.81881%0.808SS**  trans67.1105141.5-63.70000118.7
103G50.2Low51.4Low75 Ų75150.1 Ų150.177%0.77380%0.801SS**  trans166.185.2156.100000117.7
104K52.5Low51.5Low208 Ų208154.3 Ų154.390%0.90481%0.807SS**  trans43.3102.8145.4-67.5177.4178.3-179.50118.6
105L60.7Low51.9Low174 Ų174153.8 Ų153.891%0.91181%0.809SS**PPolyproline II helixtrans-58.8127.6158.7-75.4152.7000111.6
106P59.6Low52.3Low123 Ų123159.2 Ų159.280%0.79982%0.818SS**PPolyproline II helixtrans-80.1130.8164.226.4-22.7000110.7
107K63.3Low52.8Low201 Ų201162.3 Ų162.387%0.87482%0.821SS**PPolyproline II helixtrans-52.2133.6176.1-83.3171.2171.3172.10111.7T109K107-T109 PolarHBondContact O-N 3.35Å; K107-T109 VanDerWaalsContact O-N 3.1Å
108R51.5Low53Low253 Ų253158 Ų15896%0.95581%0.81SS**  trans-49.5111.3165.9-74173.5120.9114.2-3.9110.2
109T57.2Low53.8Low136 Ų136157.1 Ų157.183%0.83480%0.804SS**  trans-82.7133.8162.842.70000108.7K107 R111K107-T109 PolarHBondContact O-N 3.35Å; K107-T109 VanDerWaalsContact O-N 3.1Å; T109-R111 PolarHBondContact O-N 3.39Å
110K55.7Low54.2Low199 Ų199159.9 Ų159.987%0.86580%0.803SS**  trans-58.2132.2178.8-77.6178.5174.2177.90109.5E112K110-E112 PolarHBondContact O-N 2.92Å
111R47.1Very low54.6Low206 Ų206152.3 Ų152.378%0.77779%0.786SS**  trans-66.6109.4170.7-175.9-179.6-171.9169.64.5108.6T109 D113T109-R111 PolarHBondContact O-N 3.39Å; R111-D113 WeakPolarHBondContact CD-OD2 3.4Å; R111-D113 WeakPolarHBondContact CG-OD1 3.36Å; R111-D113 IonicContact CZ-OD1 3Å; R111-D113 IonicContact CZ-OD2 2.96Å; R111-D113 IonicContact NE-OD1 3.94Å; R111-D113 PolarHBondContact NE-OD1 2.96Å; R111-D113 IonicContact NE-OD2 2.69Å; R111-D113 PolarHBondContact NE-OD2 3.26Å; R111-D113 IonicContact NH2-OD1 3.59Å; R111-D113 IonicContact NH2-OD2 2.78Å
112E55.8Low54.7Low149 Ų149148.5 Ų148.570%0.69678%0.775SS**  trans-95.490.7166.6-68.6-173.8170.900107.9K110 Y114K110-E112 PolarHBondContact O-N 2.92Å; E112-Y114 VanDerWaalsContact C-N 3.28Å; E112-Y114 HydrophobicContact CB-CD2 3.89Å; E112-Y114 HydrophobicContact CB-CE2 3.9Å; E112-Y114 HydrophobicContact CG-CE2 4.37Å; E112-Y114 PolarHBondContact O-N 3.38Å
113D54.1Low54.9Low118 Ų118150.7 Ų150.763%0.63177%0.77SS**  trans-75.981.2170.7-70.9-36.5000108.6R111 A115R111-D113 WeakPolarHBondContact CD-OD2 3.4Å; R111-D113 WeakPolarHBondContact CG-OD1 3.36Å; R111-D113 IonicContact CZ-OD1 3Å; R111-D113 IonicContact CZ-OD2 2.96Å; R111-D113 IonicContact NE-OD1 3.94Å; R111-D113 PolarHBondContact NE-OD1 2.96Å; R111-D113 IonicContact NE-OD2 2.69Å; R111-D113 PolarHBondContact NE-OD2 3.26Å; R111-D113 IonicContact NH2-OD1 3.59Å; R111-D113 IonicContact NH2-OD2 2.78Å; D113-A115 PolarHBondContact O-N 3.46Å; D113-A115 VanDerWaalsContact O-N 3.14Å
114Y56.4Low55.1Low194 Ų194154.5 Ų154.576%0.76177%0.765SS**  trans-79.587.6167-80.9-82.1000109.7E112 M116E112-Y114 VanDerWaalsContact C-N 3.28Å; E112-Y114 HydrophobicContact CB-CD2 3.89Å; E112-Y114 HydrophobicContact CB-CE2 3.9Å; E112-Y114 HydrophobicContact CG-CE2 4.37Å; E112-Y114 PolarHBondContact O-N 3.38Å; Y114-M116 VanDerWaalsContact C-N 3.28Å; Y114-M116 PolarHBondContact O-N 3.28Å
115A58.1Low55.1Low93 Ų93149 Ų14977%0.76975%0.749SS**  trans-71.585.9164.600000109.4D113 K117D113-A115 PolarHBondContact O-N 3.46Å; D113-A115 VanDerWaalsContact O-N 3.14Å; A115-K117 PolarHBondContact O-N 2.9Å
116M55.4Low54.8Low182 Ų182148.4 Ų148.490%0.89774%0.739SS**  trans-63.4101.4172.3-164.8164.4163.300108.7Y114 S118Y114-M116 VanDerWaalsContact C-N 3.28Å; Y114-M116 PolarHBondContact O-N 3.28Å; M116-S118 PolarHBondContact O-N 2.93Å
117K53.4Low54.4Low197 Ų197147.7 Ų147.786%0.85773%0.725SS**  trans-61.3101.1174.2-73.5176176.3175.30108.4A115 S119A115-K117 PolarHBondContact O-N 2.9Å; K117-S119 PolarHBondContact O-N 3.13Å
118S48.9Very low53.9Low87 Ų87143.4 Ų143.461%0.60871%0.71SS**  trans-67.5113.4173.967.80000109.4M116 D120M116-S118 PolarHBondContact O-N 2.93Å; S118-D120 PolarHBondContact O-N 3.25Å
119S59.5Low53.8Low106 Ų106138.2 Ų138.274%0.74170%0.697SS**THydrogen-bonded Turntrans-66.97.4178.7-57.90000115K117K117-S119 PolarHBondContact O-N 3.13Å
120D56.8Low53.6Low124 Ų124134.4 Ų134.466%0.66368%0.679SS**THydrogen-bonded Turntrans-90.1-12.9-171.9-90.6-32.4000115.5S118S118-D120 PolarHBondContact O-N 3.25Å
121S53.6Low53.5Low79 Ų79131 Ų13155%0.55267%0.665SS**Hα-helixtrans-82.7-19.7-17953.20000114
122V51.8Low53.6Low98 Ų98126.9 Ų126.959%0.59466%0.658SS**Hα-helixtrans-79.3-24.4-177.4-1760000112.2
123K52.4Low53.5Low162 Ų162124.6 Ų124.670%0.70465%0.654SS**Hα-helixtrans-72.7-33.1178.3-76.5-177178.81760113.1V125K123-V125 PolarHBondContact O-N 3.19Å
124K53.6Low53.4Low156 Ų156126.6 Ų126.668%0.67866%0.66SS**Hα-helixtrans-71.3-28.3-179.3-72.6-174.1177.9-178.30113.7I128K124-I128 WeakPolarHBondContact O-CD1 3.45Å; K124-I128 WeakPolarHBondContact O-CG1 3.46Å
125V53.4Low53.2Low93 Ų93123.3 Ų123.356%0.56466%0.659SS**Hα-helixtrans-73.8-34.2-179.6-178.20000111.7K123 Q129K123-V125 PolarHBondContact O-N 3.19Å; V125-Q129 PolarHBondContact O-N 3.48Å
126K54.3Low52.8Low161 Ų161123.4 Ų123.470%0.765%0.653SS**Hα-helixtrans-71.8-31.1177.3-74.2-172.6175.4-174.60113.1A130K126-A130 PolarHBondContact O-N 3.24Å
127E51.1Low52.5Low108 Ų108117.2 Ų117.251%0.50564%0.636SS.*Hα-helixtrans-73.8-29.7-179.5-156.3-175.615500112.7K131E127-K131 WeakPolarHBondContact O-CG 3.37Å; E127-K131 PolarHBondContact O-N 3.44Å; E127-K131 IonicContact OE1-NZ 3.88Å; E127-K131 PolarHBondContact OE1-NZ 3.33Å
128I51.3Low52.6Low110 Ų110115.3 Ų115.356%0.56464%0.635SS**Hα-helixtrans-74.8-39.3177.4-61.5166.1000110.7K124 A130 K131 D132K124-I128 WeakPolarHBondContact O-CD1 3.45Å; K124-I128 WeakPolarHBondContact O-CG1 3.46Å; I128-A130 PolarHBondContact O-N 3.38Å; I128-K131 PolarHBondContact O-N 2.97Å; I128-D132 PolarHBondContact O-N 3.01Å
129Q50.9Low52.7Low145 Ų145120 Ų12068%0.67865%0.648SS**Hα-helixtrans-66.7-32.8176.3-88.4-170.99.600114V125 T133V125-Q129 PolarHBondContact O-N 3.48Å; Q129-T133 PolarHBondContact O-OG1 2.97Å
130A53Low52.2Low56 Ų56119.6 Ų119.646%0.46364%0.644SS.*Hα-helixtrans-76-26.3179.100000113K126 I128 T133K126-A130 PolarHBondContact O-N 3.24Å; I128-A130 PolarHBondContact O-N 3.38Å; A130-T133 PolarHBondContact O-OG1 3.39Å
131K52.5Low51.9Low128 Ų128122.7 Ų122.756%0.55765%0.654SS**Hα-helixtrans-83.8-33-180-74.2173.9175171.70112.6E127 I128E127-K131 WeakPolarHBondContact O-CG 3.37Å; E127-K131 PolarHBondContact O-N 3.44Å; E127-K131 IonicContact OE1-NZ 3.88Å; E127-K131 PolarHBondContact OE1-NZ 3.33Å; I128-K131 PolarHBondContact O-N 2.97Å
132D50.1Low51.9Low118 Ų118126.5 Ų126.563%0.63167%0.667SS**Hα-helixtrans-77.3-23.8177.2-84.7-12.4000113.8I128I128-D132 PolarHBondContact O-N 3.01Å
133T52.8Low51.8Low102 Ų102131.1 Ų131.163%0.62668%0.68SS**SBendtrans-78.1-20.6179.4350000113.8Q129 A130Q129-T133 PolarHBondContact O-OG1 2.97Å; A130-T133 PolarHBondContact O-OG1 3.39Å
134H52Low51.5Low160 Ų160128.5 Ų128.574%0.74168%0.682SS**SBendtrans-84-19178.9-98.9-78.6000114.3
135V52.6Low51.4Low124 Ų124129.2 Ų129.275%0.75269%0.687SS**THydrogen-bonded Turntrans-85.8-13.8-177.8-176.70000112.2
136C48.8Very low51Low95 Ų95131.7 Ų131.764%0.64270%0.697SS**THydrogen-bonded Turntrans-97.59.3-179.4-150.50000113.8
137G50.4Low51Low53 Ų53130.3 Ų130.355%0.54670%0.703SS.*SBendtrans-85.5-35-178.800000114.6
138D54.5Low50.8Low156 Ų156134.4 Ų134.483%0.83472%0.721SS**SBendtrans-99.90.3-162.3-67-23.7000115
139Q51.6Low50.4Low187 Ų187132.4 Ų132.487%0.87473%0.729SS**SBendtrans-118.20-176.5-127.6-177.580.700115.2Q141Q139-Q141 VanDerWaalsContact C-N 3.34Å; Q139-Q141 PolarHBondContact O-N 2.93Å
140C48.9Very low50.5Low96 Ų96137.2 Ų137.265%0.64974%0.74SS**  trans-92.757.7175.3-78.60000111.7L142C140-L142 PolarHBondContact O-N 3.29Å
141Q50.4Low50.2Low189 Ų189144 Ų14488%0.88376%0.763SS**  trans-76.177.5158.6-72.8-164.331.400108.6Q139 K143Q139-Q141 VanDerWaalsContact C-N 3.34Å; Q139-Q141 PolarHBondContact O-N 2.93Å; Q141-K143 PolarHBondContact O-N 3.41Å; Q141-K143 VanDerWaalsContact O-N 3.16Å
142L52.7Low50.4Low159 Ų159142 Ų14283%0.83277%0.77SS**  trans-65.4110.2166.4-135.588.2000106.9C140 S144C140-L142 PolarHBondContact O-N 3.29Å; L142-S144 PolarHBondContact O-N 3.36Å
143K49.5Very low50.4Low196 Ų196145.5 Ų145.585%0.85278%0.782SS**  trans-52.9104.9167-92.8172.9170.9172.90108.6Q141 H145Q141-K143 PolarHBondContact O-N 3.41Å; Q141-K143 VanDerWaalsContact O-N 3.16Å; K143-H145 PolarHBondContact O-N 3.2Å; K143-H145 VanDerWaalsContact O-N 3.13Å
144S47.6Very low50.9Low107 Ų107147.2 Ų147.275%0.74879%0.786SS**  trans-63.8106.6164.949.50000107.8L142L142-S144 PolarHBondContact O-N 3.36Å
145H50Low50.7Low170 Ų170146 Ų14679%0.78779%0.785SS**  trans-94.8108.7163.4-124.7-77.6000106.1K143 T147K143-H145 PolarHBondContact O-N 3.2Å; K143-H145 VanDerWaalsContact O-N 3.13Å; H145-T147 PolarHBondContact O-N 3.41Å
146D46.4Very low51Low145 Ų145145.8 Ų145.878%0.77578%0.784SS**  trans-52.1120.8171.2-68.1-52000109.9
147T53.4Low51.5Low133 Ų133146.6 Ų146.682%0.81679%0.786SS**  trans-118.486.3162.254.20000107.3H145H145-T147 PolarHBondContact O-N 3.41Å
148E46.4Very low51.9Low193 Ų193153.2 Ų153.290%0.90282%0.819SS**  trans-55133.4155.9-74.4-165.7133.100109.2
149G44.9Very low51.8Low69 Ų69153.1 Ų153.171%0.71182%0.819SS**  trans8388.9156.500000116.1
150R51Low51.8Low246 Ų246151.3 Ų151.393%0.92882%0.816SS**  168.9116.4119.8-92.4175.4-161.9-148.63.5109.1A152R150-A152 PolarHBondContact O-N 3.37Å
151E48.7Very low52Low199 Ų199154.4 Ų154.493%0.9383%0.825SS**  trans-55.3126.6168.9-64.2174.714600109.7
152A55.3Low52.1Low85 Ų85152.4 Ų152.470%0.70282%0.822SS**  trans-95.894.8164.700000107R150 I154R150-A152 PolarHBondContact O-N 3.37Å; A152-I154 HydrophobicContact CB-CG1 4.48Å; A152-I154 PolarHBondContact O-N 3.1Å
153E50.1Low52Low192 Ų192151.9 Ų151.990%0.89782%0.821SS**  trans-65.4107.3161.1-170.4174.9-167.300107.1
154I63.1Low52.2Low138 Ų138149 Ų14971%0.70882%0.819SS**  trans-100.3100.7172.3-56.9172.1000105.9A152 V156A152-I154 HydrophobicContact CB-CG1 4.48Å; A152-I154 PolarHBondContact O-N 3.1Å; I154-V156 HydrophobicContact CG2-CG2 3.83Å; I154-V156 PolarHBondContact O-N 3.38Å
155D49Very low52.5Low134 Ų134152 Ų15272%0.71782%0.824SS**  trans-70115.1169.5-164.7-1.5000108.6
156V57.3Low52.7Low120 Ų120150.6 Ų150.673%0.72783%0.827SS**  trans-119.891.3171.9-174.20000106.3I154I154-V156 HydrophobicContact CG2-CG2 3.83Å; I154-V156 PolarHBondContact O-N 3.38Å
157T61.2Low53.2Low112 Ų112151.1 Ų151.169%0.68783%0.831SS**  trans-79.8141.8165.2-4.30000108.4
158P58.5Low53.2Low192 Ų192152.7 Ų152.7100%1.24783%0.832SS**  trans-70.90-159.329.3-34.8000115.6

Retrieved 158 of 158 residues in 354.6 ms (Link to these results)