A0A3Q0KQI4_SCHMA Loading...

Tetraspanin

AlphaFold DB , UniProt , Accession A0A3Q0KQI4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 339 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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
1M70.9Confident79.7Confident214 Ų214123.4 Ų123.4100%1.05461%0.605SS**  0-33.40-69.6-178.2-176.100113.5R3 T4 S5M1-R3 PolarHBondContact O-N 3.21Å; M1-T4 PolarHBondContact O-N 2.88Å; M1-T4 PolarHBondContact O-OG1 2.86Å; M1-S5 PolarHBondContact O-N 2.76Å
2E81.4Confident79.9Confident132 Ų132123.9 Ų123.962%0.61760%0.602SS**Hα-helixtrans-66.2-39-177.2-159.4-173.3151.400114.3T4 S5 K6E2-T4 VanDerWaalsContact C-N 3.34Å; E2-T4 PolarHBondContact O-N 3.48Å; E2-S5 PolarHBondContact O-N 2.88Å; E2-K6 PolarHBondContact O-N 3.1Å; E2-K6 VanDerWaalsContact O-N 3.14Å; E2-K6 VanDerWaalsContact OE1-CE 3.28Å; E2-K6 WeakPolarHBondContact OE1-CE 3.26Å; E2-K6 IonicContact OE1-NZ 3.38Å; E2-K6 PolarHBondContact OE1-NZ 2.97Å
3R80.5Confident80.1Confident229 Ų229123.8 Ų123.886%0.86460%0.597SS**Hα-helixtrans-63.1-37.3179.7-168.6-179-83178.7-4.7112.7M1 L7M1-R3 PolarHBondContact O-N 3.21Å; R3-L7 PolarHBondContact O-N 3.39Å
4T79.1Confident80.3Confident87 Ų87128.1 Ų128.153%0.53460%0.604SS.*Hα-helixtrans-71.6-37177.648.80000111.7M1 E2 L7 I8M1-T4 PolarHBondContact O-N 2.88Å; M1-T4 PolarHBondContact O-OG1 2.86Å; E2-T4 VanDerWaalsContact C-N 3.34Å; E2-T4 PolarHBondContact O-N 3.48Å; T4-L7 PolarHBondContact O-N 3.27Å; T4-I8 WeakPolarHBondContact O-CD1 3.45Å; T4-I8 VanDerWaalsContact O-CG1 3.26Å; T4-I8 WeakPolarHBondContact O-CG1 3.33Å; T4-I8 PolarHBondContact O-N 2.88Å
5S81.2Confident80.4Confident75 Ų75124.4 Ų124.452%0.52459%0.586SS.*Hα-helixtrans-62.1-48175.8-177.90000112.2M1 E2 L7 I8 H9M1-S5 PolarHBondContact O-N 2.76Å; E2-S5 PolarHBondContact O-N 2.88Å; S5-L7 VanDerWaalsContact C-N 3.32Å; S5-L7 PolarHBondContact O-N 2.96Å; S5-I8 PolarHBondContact O-N 3.5Å; S5-H9 PolarHBondContact O-N 3.35Å
6K82.7Confident80.7Confident121 Ų121126.7 Ų126.753%0.52659%0.593SS.*Hα-helixtrans-61-39.9176.5-72.4179.9-175.3165.80112.2E2 H9 N10E2-K6 PolarHBondContact O-N 3.1Å; E2-K6 VanDerWaalsContact O-N 3.14Å; E2-K6 VanDerWaalsContact OE1-CE 3.28Å; E2-K6 WeakPolarHBondContact OE1-CE 3.26Å; E2-K6 IonicContact OE1-NZ 3.38Å; E2-K6 PolarHBondContact OE1-NZ 2.97Å; K6-H9 PolarHBondContact O-N 3.38Å; K6-N10 PolarHBondContact O-N 3.46Å; K6-N10 VanDerWaalsContact O-N 3.08Å
7L79.3Confident80.8Confident110 Ų110125.2 Ų125.258%0.57659%0.588SS**Hα-helixtrans-62.9-47.9177.4-163.288.4000111.6R3 T4 S5 H9 N10 L11R3-L7 PolarHBondContact O-N 3.39Å; T4-L7 PolarHBondContact O-N 3.27Å; S5-L7 VanDerWaalsContact C-N 3.32Å; S5-L7 PolarHBondContact O-N 2.96Å; L7-H9 VanDerWaalsContact C-N 3.34Å; L7-H9 PolarHBondContact O-N 3.34Å; L7-N10 PolarHBondContact O-N 2.9Å; L7-L11 HydrophobicContact CD2-CD1 4.41Å; L7-L11 HydrophobicContact CG-CD1 4.35Å; L7-L11 WeakPolarHBondContact O-CG 3.49Å; L7-L11 PolarHBondContact O-N 3.03Å
8I80.2Confident80.9Confident91 Ų91121.3 Ų121.347%0.46757%0.569SS.*Hα-helixtrans-62.8-41.5179.6-67.6164.5000111T4 S5 L11 K12T4-I8 WeakPolarHBondContact O-CD1 3.45Å; T4-I8 VanDerWaalsContact O-CG1 3.26Å; T4-I8 WeakPolarHBondContact O-CG1 3.33Å; T4-I8 PolarHBondContact O-N 2.88Å; S5-I8 PolarHBondContact O-N 3.5Å; I8-L11 PolarHBondContact O-N 3.33Å; I8-K12 HydrophobicContact CG2-CD 4.41Å; I8-K12 WeakPolarHBondContact O-CG 3.07Å; I8-K12 PolarHBondContact O-N 3.4Å
9H77.8Confident81Confident126 Ų126119 Ų11958%0.58356%0.558SS**Hα-helixtrans-62-45.5177.3-173.9-87.9000111.8S5 K6 L7 L11 K12 F13S5-H9 PolarHBondContact O-N 3.35Å; K6-H9 PolarHBondContact O-N 3.38Å; L7-H9 VanDerWaalsContact C-N 3.34Å; L7-H9 PolarHBondContact O-N 3.34Å; H9-L11 PolarHBondContact O-N 2.95Å; H9-K12 PolarHBondContact O-N 3.38Å; H9-F13 WeakPolarHBondContact O-CB 3.4Å; H9-F13 PolarHBondContact O-N 3.06Å
10N81.5Confident81.4Confident99 Ų99116 Ų11653%0.52955%0.55SS.*Hα-helixtrans-64.2-38.4178-75-13.1000112.7K6 L7 F13 R14K6-N10 PolarHBondContact O-N 3.46Å; K6-N10 VanDerWaalsContact O-N 3.08Å; L7-N10 PolarHBondContact O-N 2.9Å; N10-F13 PolarHBondContact O-N 3.36Å; N10-R14 WeakPolarHBondContact O-CG 3.31Å; N10-R14 PolarHBondContact O-N 2.96Å
11L81.6Confident81.7Confident73 Ų73115.6 Ų115.638%0.38255%0.548SS..Hα-helixtrans-64.4-47.3175.4-72169.1000111.6L7 I8 H9 F13 R14 Q15L7-L11 HydrophobicContact CD2-CD1 4.41Å; L7-L11 HydrophobicContact CG-CD1 4.35Å; L7-L11 WeakPolarHBondContact O-CG 3.49Å; L7-L11 PolarHBondContact O-N 3.03Å; I8-L11 PolarHBondContact O-N 3.33Å; H9-L11 PolarHBondContact O-N 2.95Å; L11-F13 VanDerWaalsContact C-N 3.29Å; L11-F13 PolarHBondContact O-N 3.39Å; L11-R14 PolarHBondContact O-N 3.26Å; L11-Q15 WeakPolarHBondContact O-CB 3.22Å; L11-Q15 PolarHBondContact O-N 3.22Å
12K82.2Confident82.5Confident130 Ų130106 Ų10657%0.56550%0.501SS*.Hα-helixtrans-60.2-39.3175.9-76.3-175.6178.9-176.80112.3I8 H9 Q15 K16I8-K12 HydrophobicContact CG2-CD 4.41Å; I8-K12 WeakPolarHBondContact O-CG 3.07Å; I8-K12 PolarHBondContact O-N 3.4Å; H9-K12 PolarHBondContact O-N 3.38Å; K12-Q15 PolarHBondContact O-N 3.11Å; K12-K16 WeakPolarHBondContact O-CG 3.34Å; K12-K16 PolarHBondContact O-N 2.94Å
13F83.1Confident83Confident122 Ų122102.2 Ų102.254%0.53549%0.492SS..Hα-helixtrans-65.3-45.9177.2-175.2-100.1000111.8H9 N10 L11 Q15 K16 M17H9-F13 WeakPolarHBondContact O-CB 3.4Å; H9-F13 PolarHBondContact O-N 3.06Å; N10-F13 PolarHBondContact O-N 3.36Å; L11-F13 VanDerWaalsContact C-N 3.29Å; L11-F13 PolarHBondContact O-N 3.39Å; F13-Q15 VanDerWaalsContact C-N 3.35Å; F13-Q15 PolarHBondContact O-N 2.96Å; F13-K16 PolarHBondContact O-N 3.4Å; F13-M17 HydrophobicContact CD1-CE 4.3Å; F13-M17 HydrophobicContact CE1-CE 3.43Å; F13-M17 VanDerWaalsContact CE1-CE 3.43Å; F13-M17 HydrophobicContact CZ-CE 3.86Å; F13-M17 PolarHBondContact O-N 3.48Å
14R83.3Confident83.6Confident184 Ų18496.7 Ų96.769%0.69447%0.474SS*.Hα-helixtrans-59.9-42.9174.6-75.4-177.7178.8-166-0.5112N10 L11 M17 F18N10-R14 WeakPolarHBondContact O-CG 3.31Å; N10-R14 PolarHBondContact O-N 2.96Å; L11-R14 PolarHBondContact O-N 3.26Å; R14-M17 PolarHBondContact O-N 3.42Å; R14-F18 VanDerWaalsContact O-CB 3.32Å; R14-F18 WeakPolarHBondContact O-CB 3.41Å; R14-F18 PolarHBondContact O-N 3.42Å
15Q82Confident84.2Confident73 Ų7394 Ų9434%0.34146%0.457SS..Hα-helixtrans-61.6-44.9177.2-173.7-178.3-1.700112.3L11 K12 F13 M17 F18 H19 Y279L11-Q15 WeakPolarHBondContact O-CB 3.22Å; L11-Q15 PolarHBondContact O-N 3.22Å; K12-Q15 PolarHBondContact O-N 3.11Å; F13-Q15 VanDerWaalsContact C-N 3.35Å; F13-Q15 PolarHBondContact O-N 2.96Å; Q15-M17 PolarHBondContact O-N 2.79Å; Q15-F18 PolarHBondContact O-N 3.34Å; Q15-H19 PolarHBondContact O-CD2 3.07Å; Q15-H19 PolarHBondContact O-N 3.35Å; Q15-Y279 HydrophobicContact CG-CE1 4.48Å
16K84.1Confident84.8Confident161 Ų16193.6 Ų93.670%0.745%0.445SS*.Hα-helixtrans-61.7-43.4175.8-76.4-176.6179.5-175.90112.2K12 F13 F18 S20K12-K16 WeakPolarHBondContact O-CG 3.34Å; K12-K16 PolarHBondContact O-N 2.94Å; F13-K16 PolarHBondContact O-N 3.4Å; K16-F18 VanDerWaalsContact C-N 3.33Å; K16-S20 WeakPolarHBondContact O-CB 3.38Å; K16-S20 PolarHBondContact O-N 2.92Å
17M82.5Confident85.5Confident102 Ų10292.6 Ų92.650%0.50244%0.444SS..Hα-helixtrans-62.8-42.9177.2-172-177.3-67.500111F13 R14 Q15 S20 Q21F13-M17 HydrophobicContact CD1-CE 4.3Å; F13-M17 HydrophobicContact CE1-CE 3.43Å; F13-M17 VanDerWaalsContact CE1-CE 3.43Å; F13-M17 HydrophobicContact CZ-CE 3.86Å; F13-M17 PolarHBondContact O-N 3.48Å; R14-M17 PolarHBondContact O-N 3.42Å; Q15-M17 PolarHBondContact O-N 2.79Å; M17-S20 PolarHBondContact O-N 3.15Å; M17-Q21 WeakPolarHBondContact O-CG 3.45Å; M17-Q21 PolarHBondContact O-N 3.47Å; M17-Q21 VanDerWaalsContact O-N 3.1Å
18F82.2Confident86.2Confident55 Ų5591.2 Ų91.224%0.24144%0.437CS..Hα-helixtrans-62.4-51178.3-171.5-88.5000112R14 Q15 K16 S20 Q21 M22 K272 D275 E276R14-F18 VanDerWaalsContact O-CB 3.32Å; R14-F18 WeakPolarHBondContact O-CB 3.41Å; R14-F18 PolarHBondContact O-N 3.42Å; Q15-F18 PolarHBondContact O-N 3.34Å; K16-F18 VanDerWaalsContact C-N 3.33Å; F18-S20 VanDerWaalsContact C-N 3.27Å; F18-S20 PolarHBondContact O-N 2.89Å; F18-Q21 PolarHBondContact O-N 3.02Å; F18-Q21 VanDerWaalsContact O-N 3.14Å; F18-M22 WeakPolarHBondContact O-CB 3.35Å; F18-M22 PolarHBondContact O-N 3.48Å; F18-K272 HydrophobicContact CE2-CD 3.93Å; F18-K272 HydrophobicContact CZ-CD 4.29Å; F18-K272 VanDerWaalsContact CZ-O 3.27Å; F18-K272 WeakPolarHBondContact CZ-O 3.21Å; F18-D275 HydrophobicContact CE2-CB 4.04Å; F18-D275 HydrophobicContact CZ-CB 3.81Å; F18-E276 HydrophobicContact CD1-CG 4.46Å; F18-E276 HydrophobicContact CE1-CB 3.64Å; F18-E276 HydrophobicContact CE1-CG 3.78Å; F18-E276 HydrophobicContact CZ-CB 4.15Å
19H84.1Confident87Confident77 Ų7786.9 Ų86.936%0.35642%0.415SS..Hα-helixtrans-59.5-36.4175.4-79.1-56.4000112.8Q15 M22 A23 E276Q15-H19 PolarHBondContact O-CD2 3.07Å; Q15-H19 PolarHBondContact O-N 3.35Å; H19-M22 PolarHBondContact O-N 3.21Å; H19-A23 WeakPolarHBondContact O-CB 3.48Å; H19-A23 PolarHBondContact O-N 3.46Å; H19-E276 IonicContact CE1-OE1 2.76Å; H19-E276 PolarHBondContact CE1-OE1 2.93Å; H19-E276 IonicContact ND1-OE1 3.86Å; H19-E276 PolarHBondContact ND1-OE1 3.44Å
20S87.7Confident87.9Confident59 Ų5983 Ų8341%0.41340%0.398SS..Hα-helixtrans-63.6-42.4176.5-174.60000112.1K16 M17 F18 K24K16-S20 WeakPolarHBondContact O-CB 3.38Å; K16-S20 PolarHBondContact O-N 2.92Å; M17-S20 PolarHBondContact O-N 3.15Å; F18-S20 VanDerWaalsContact C-N 3.27Å; F18-S20 PolarHBondContact O-N 2.89Å; S20-K24 WeakPolarHBondContact O-CG 3.31Å; S20-K24 PolarHBondContact O-N 3.13Å
21Q88.8Confident88.6Confident107 Ų10782.5 Ų82.550%0.539%0.394SS..Hα-helixtrans-67.9-43176.6-66.1-64.4-15.200111.3M17 F18 A23 K24 L25M17-Q21 WeakPolarHBondContact O-CG 3.45Å; M17-Q21 PolarHBondContact O-N 3.47Å; M17-Q21 VanDerWaalsContact O-N 3.1Å; F18-Q21 PolarHBondContact O-N 3.02Å; F18-Q21 VanDerWaalsContact O-N 3.14Å; Q21-A23 VanDerWaalsContact C-N 3.32Å; Q21-A23 PolarHBondContact O-N 3.24Å; Q21-K24 PolarHBondContact O-N 2.94Å; Q21-L25 WeakPolarHBondContact O-CB 3.35Å; Q21-L25 PolarHBondContact O-N 3.02Å
22M87.8Confident89.3Confident13 Ų1379.8 Ų79.86%0.06438%0.38CS..Hα-helixtrans-57.2-45176.7-16471.9-168.600111.8F18 H19 K24 L25 K26 Y269 K272 A273F18-M22 WeakPolarHBondContact O-CB 3.35Å; F18-M22 PolarHBondContact O-N 3.48Å; H19-M22 PolarHBondContact O-N 3.21Å; M22-K24 PolarHBondContact O-N 3.15Å; M22-L25 PolarHBondContact O-N 3.35Å; M22-K26 WeakPolarHBondContact O-CB 3.35Å; M22-K26 PolarHBondContact O-N 2.94Å; M22-Y269 HydrophobicContact CE-CD2 4.08Å; M22-Y269 HydrophobicContact CE-CE2 3.54Å; M22-K272 HydrophobicContact CE-CB 4.49Å; M22-K272 HydrophobicContact SD-CB 3.66Å; M22-A273 HydrophobicContact CE-CB 3.49Å; M22-A273 VanDerWaalsContact CE-CB 3.49Å
23A90.8Very high90Very high52 Ų5273.6 Ų73.643%0.4335%0.353SS..Hα-helixtrans-62.7-42.517800000112.4H19 Q21 I27H19-A23 WeakPolarHBondContact O-CB 3.48Å; H19-A23 PolarHBondContact O-N 3.46Å; Q21-A23 VanDerWaalsContact C-N 3.32Å; Q21-A23 PolarHBondContact O-N 3.24Å; A23-I27 WeakPolarHBondContact O-CG1 3.48Å; A23-I27 PolarHBondContact O-N 3.28Å
24K93.1Very high90.6Very high113 Ų11369.6 Ų69.649%0.49134%0.34SS..Hα-helixtrans-62.5-47.8175.8-70.1175-176.9-178.40111.3S20 Q21 M22 K26 I27 I28S20-K24 WeakPolarHBondContact O-CG 3.31Å; S20-K24 PolarHBondContact O-N 3.13Å; Q21-K24 PolarHBondContact O-N 2.94Å; M22-K24 PolarHBondContact O-N 3.15Å; K24-K26 VanDerWaalsContact C-N 3.32Å; K24-K26 PolarHBondContact O-N 3.02Å; K24-I27 PolarHBondContact O-N 3.33Å; K24-I28 VanDerWaalsContact O-CG1 3.3Å; K24-I28 WeakPolarHBondContact O-CG1 3.43Å; K24-I28 PolarHBondContact O-N 3.4Å
25L92.7Very high91.3Very high32 Ų3263.9 Ų63.917%0.16832%0.323CS..Hα-helixtrans-65.7-36.8-177.8-167.958.1000112Q21 M22 I28 S29 V265 F268 Y269 K272Q21-L25 WeakPolarHBondContact O-CB 3.35Å; Q21-L25 PolarHBondContact O-N 3.02Å; M22-L25 PolarHBondContact O-N 3.35Å; L25-I28 PolarHBondContact O-N 3.3Å; L25-S29 VanDerWaalsContact O-CB 3.26Å; L25-S29 WeakPolarHBondContact O-CB 3.46Å; L25-S29 PolarHBondContact O-N 2.91Å; L25-V265 HydrophobicContact CD1-CG1 4.04Å; L25-F268 HydrophobicContact CD1-CB 4.28Å; L25-F268 HydrophobicContact CD2-CB 4.03Å; L25-Y269 HydrophobicContact CB-CD2 4.29Å; L25-Y269 VanDerWaalsContact CD2-CA 3.48Å; L25-Y269 HydrophobicContact CD2-CD2 4.42Å; L25-Y269 HydrophobicContact CG-CD2 4.06Å; L25-K272 HydrophobicContact CD2-CB 4.26Å; L25-K272 HydrophobicContact CD2-CG 4.09Å
26K94.3Very high92Very high65 Ų6560.4 Ų60.428%0.28331%0.307SS..Hα-helixtrans-56.3-49.8170.8-171.7178.8-179.5174.50111.7M22 K24 S29 I30 I94 Y269M22-K26 WeakPolarHBondContact O-CB 3.35Å; M22-K26 PolarHBondContact O-N 2.94Å; K24-K26 VanDerWaalsContact C-N 3.32Å; K24-K26 PolarHBondContact O-N 3.02Å; K26-S29 PolarHBondContact O-N 3.37Å; K26-I30 HydrophobicContact CG-CD1 4.11Å; K26-I30 WeakPolarHBondContact O-CG1 3.4Å; K26-I30 PolarHBondContact O-N 3.49Å; K26-I94 HydrophobicContact CD-CG2 4.42Å; K26-I94 HydrophobicContact CG-CG2 3.6Å; K26-Y269 HydrophobicContact CB-CD2 4.4Å; K26-Y269 HydrophobicContact CB-CE2 3.7Å; K26-Y269 HydrophobicContact CG-CE2 4.11Å
27I95.8Very high92.7Very high100 Ų10054.4 Ų54.451%0.51328%0.282SS..Hα-helixtrans-63.1-46.9-179.5-68.1166.2000110.3A23 K24 S29 I30 I31A23-I27 WeakPolarHBondContact O-CG1 3.48Å; A23-I27 PolarHBondContact O-N 3.28Å; K24-I27 PolarHBondContact O-N 3.33Å; I27-S29 VanDerWaalsContact C-N 3.34Å; I27-S29 PolarHBondContact O-N 2.82Å; I27-I30 PolarHBondContact O-N 3.14Å; I27-I31 HydrophobicContact CG2-CD1 3.7Å; I27-I31 HydrophobicContact CG2-CG1 4.39Å; I27-I31 VanDerWaalsContact O-CG1 3.29Å; I27-I31 WeakPolarHBondContact O-CG1 3.41Å; I27-I31 PolarHBondContact O-N 3.4Å
28I95.5Very high93.4Very high82 Ų8254.1 Ų54.142%0.42128%0.281SS..Hα-helixtrans-59.6-46.4178.7-63.6166.2000110.4K24 L25 I30 I31 L32 V265K24-I28 VanDerWaalsContact O-CG1 3.3Å; K24-I28 WeakPolarHBondContact O-CG1 3.43Å; K24-I28 PolarHBondContact O-N 3.4Å; L25-I28 PolarHBondContact O-N 3.3Å; I28-I30 PolarHBondContact O-N 3.48Å; I28-I31 PolarHBondContact O-N 3.39Å; I28-L32 HydrophobicContact CG2-CD1 3.94Å; I28-L32 HydrophobicContact CG2-CG 4.34Å; I28-L32 WeakPolarHBondContact O-CG 3.26Å; I28-L32 PolarHBondContact O-N 3.25Å; I28-V265 HydrophobicContact CG2-CG1 3.92Å
29S95.5Very high94.1Very high0 Ų054 Ų540%028%0.283CS..Hα-helixtrans-61.4-42.9178.8176.60000112L25 K26 I27 I31 L32 N33 I94 N266L25-S29 VanDerWaalsContact O-CB 3.26Å; L25-S29 WeakPolarHBondContact O-CB 3.46Å; L25-S29 PolarHBondContact O-N 2.91Å; K26-S29 PolarHBondContact O-N 3.37Å; I27-S29 VanDerWaalsContact C-N 3.34Å; I27-S29 PolarHBondContact O-N 2.82Å; S29-I31 PolarHBondContact O-N 3.35Å; S29-L32 PolarHBondContact O-N 3.48Å; S29-N33 PolarHBondContact O-N 3.46Å; S29-N33 PolarHBondContact O-ND2 2.97Å; S29-I94 WeakPolarHBondContact OG-CD1 3.45Å; S29-N266 PolarHBondContact OG-OD1 3.2Å
30I96.9Very high94.7Very high45 Ų4550.3 Ų50.323%0.23127%0.266CS..Hα-helixtrans-61.6-45.2174.3-69.7167.9000111.2K26 I27 I28 L32 N33 S34 I94K26-I30 HydrophobicContact CG-CD1 4.11Å; K26-I30 WeakPolarHBondContact O-CG1 3.4Å; K26-I30 PolarHBondContact O-N 3.49Å; I27-I30 PolarHBondContact O-N 3.14Å; I28-I30 PolarHBondContact O-N 3.48Å; I30-L32 PolarHBondContact O-N 2.96Å; I30-N33 PolarHBondContact O-N 3.28Å; I30-S34 WeakPolarHBondContact O-CB 3.36Å; I30-S34 PolarHBondContact O-N 3.31Å; I30-S34 PolarHBondContact O-OG 3.23Å; I30-I94 HydrophobicContact CD1-CG2 4.08Å; I30-I94 HydrophobicContact CG1-CB 4.41Å; I30-I94 HydrophobicContact CG1-CD1 4.36Å; I30-I94 HydrophobicContact CG1-CG2 3.82Å
31I96.8Very high95.2Very high87 Ų8749.4 Ų49.445%0.44626%0.259SS..Hα-helixtrans-59.8-47.2178.2-70.5168.3000110.1I27 I28 S29 S34 I35I27-I31 HydrophobicContact CG2-CD1 3.7Å; I27-I31 HydrophobicContact CG2-CG1 4.39Å; I27-I31 VanDerWaalsContact O-CG1 3.29Å; I27-I31 WeakPolarHBondContact O-CG1 3.41Å; I27-I31 PolarHBondContact O-N 3.4Å; I28-I31 PolarHBondContact O-N 3.39Å; S29-I31 PolarHBondContact O-N 3.35Å; I31-S34 CarbonylContact O-C 3.57Å; I31-S34 WeakPolarHBondContact O-CA 3.48Å; I31-S34 WeakPolarHBondContact O-CB 3.48Å; I31-S34 PolarHBondContact O-N 3.4Å; I31-S34 VanDerWaalsContact O-N 3.11Å; I31-I35 HydrophobicContact CG2-CD1 3.75Å; I31-I35 HydrophobicContact CG2-CG1 4.26Å; I31-I35 VanDerWaalsContact O-CG1 3.31Å; I31-I35 WeakPolarHBondContact O-CG1 3.33Å; I31-I35 PolarHBondContact O-N 3.26Å
32L95.5Very high95.6Very high16 Ų1649.1 Ų49.18%0.08426%0.26CS..Hα-helixtrans-65-42.7-178.4-70.1175.2000113.2I28 S29 I30 S34 I35 L36 F261 V265I28-L32 HydrophobicContact CG2-CD1 3.94Å; I28-L32 HydrophobicContact CG2-CG 4.34Å; I28-L32 WeakPolarHBondContact O-CG 3.26Å; I28-L32 PolarHBondContact O-N 3.25Å; S29-L32 PolarHBondContact O-N 3.48Å; I30-L32 PolarHBondContact O-N 2.96Å; L32-S34 PolarHBondContact O-N 2.9Å; L32-I35 HydrophobicContact CD2-CD1 4.44Å; L32-I35 PolarHBondContact O-N 3.37Å; L32-L36 WeakPolarHBondContact O-CB 3.28Å; L32-L36 PolarHBondContact O-N 3.4Å; L32-F261 HydrophobicContact CD1-CD1 4.31Å; L32-F261 HydrophobicContact CD1-CE1 4.08Å; L32-F261 HydrophobicContact CD2-CD1 3.64Å; L32-F261 HydrophobicContact CD2-CE1 3.35Å; L32-F261 HydrophobicContact CD2-CZ 4.4Å; L32-F261 HydrophobicContact CG-CE1 4.38Å; L32-V265 HydrophobicContact CD1-CB 3.49Å; L32-V265 VanDerWaalsContact CD1-CB 3.49Å; L32-V265 HydrophobicContact CD1-CG1 3.72Å; L32-V265 HydrophobicContact CD1-CG2 3.37Å
33N97Very high96Very high0 Ų049 Ų490%026%0.26CS..Hα-helixtrans-64-33.2173.4-72.6-83.1000111.4S29 I30 L36 I37 I91 Q105 N266S29-N33 PolarHBondContact O-N 3.46Å; S29-N33 PolarHBondContact O-ND2 2.97Å; I30-N33 PolarHBondContact O-N 3.28Å; N33-L36 WeakPolarHBondContact O-CB 3.33Å; N33-L36 PolarHBondContact O-N 3.16Å; N33-I37 VanDerWaalsContact O-CG1 3.29Å; N33-I37 WeakPolarHBondContact O-CG1 3.31Å; N33-I37 PolarHBondContact O-N 2.79Å; N33-I37 VanDerWaalsContact O-N 3.1Å; N33-I91 HydrophobicContact CB-CD1 4.27Å; N33-I91 HydrophobicContact CB-CG1 3.69Å; N33-Q105 PolarHBondContact OD1-NE2 2.96Å; N33-N266 PolarHBondContact ND2-ND2 2.02Å; N33-N266 PolarHBondContact ND2-OD1 3.3Å
34S97.4Very high96.3Very high39 Ų3949.5 Ų49.527%0.27325%0.252SS..Hα-helixtrans-68-42.1174-54.60000112.1I30 I31 L32 L36 I37 I38I30-S34 WeakPolarHBondContact O-CB 3.36Å; I30-S34 PolarHBondContact O-N 3.31Å; I30-S34 PolarHBondContact O-OG 3.23Å; I31-S34 CarbonylContact O-C 3.57Å; I31-S34 WeakPolarHBondContact O-CA 3.48Å; I31-S34 WeakPolarHBondContact O-CB 3.48Å; I31-S34 PolarHBondContact O-N 3.4Å; I31-S34 VanDerWaalsContact O-N 3.11Å; L32-S34 PolarHBondContact O-N 2.9Å; S34-L36 VanDerWaalsContact C-N 3.34Å; S34-I37 PolarHBondContact O-N 2.91Å; S34-I38 VanDerWaalsContact O-CG1 3.28Å; S34-I38 WeakPolarHBondContact O-CG1 3.49Å; S34-I38 PolarHBondContact O-N 3.48Å
35I96.7Very high96.4Very high63 Ų6347 Ų4732%0.32325%0.249SC..Hα-helixtrans-64.8-40.5175.3-60.3167.1000110.1I31 L32 I37 I38 I39 M258I31-I35 HydrophobicContact CG2-CD1 3.75Å; I31-I35 HydrophobicContact CG2-CG1 4.26Å; I31-I35 VanDerWaalsContact O-CG1 3.31Å; I31-I35 WeakPolarHBondContact O-CG1 3.33Å; I31-I35 PolarHBondContact O-N 3.26Å; L32-I35 HydrophobicContact CD2-CD1 4.44Å; L32-I35 PolarHBondContact O-N 3.37Å; I35-I37 VanDerWaalsContact C-N 3.3Å; I35-I37 PolarHBondContact O-N 3.47Å; I35-I38 PolarHBondContact O-N 3.01Å; I35-I39 HydrophobicContact CG2-CG1 3.95Å; I35-I39 WeakPolarHBondContact O-CB 3.49Å; I35-I39 WeakPolarHBondContact O-CG1 3.48Å; I35-I39 PolarHBondContact O-N 2.92Å; I35-M258 HydrophobicContact CB-CE 3.99Å; I35-M258 HydrophobicContact CG2-CE 3.22Å
36L96.9Very high96.4Very high1 Ų147.9 Ų47.91%0.00526%0.258CS..Hα-helixtrans-54.9-46.4173.917864.9000111.4L32 N33 S34 S40 L109 M258 N259 A262L32-L36 WeakPolarHBondContact O-CB 3.28Å; L32-L36 PolarHBondContact O-N 3.4Å; N33-L36 WeakPolarHBondContact O-CB 3.33Å; N33-L36 PolarHBondContact O-N 3.16Å; S34-L36 VanDerWaalsContact C-N 3.34Å; L36-S40 WeakPolarHBondContact O-CB 3.31Å; L36-S40 PolarHBondContact O-N 3.31Å; L36-S40 PolarHBondContact O-OG 3.21Å; L36-L109 HydrophobicContact CD2-CD2 3.94Å; L36-M258 HydrophobicContact CD1-CB 3.87Å; L36-N259 WeakPolarHBondContact CD1-OD1 3.23Å; L36-A262 HydrophobicContact CD2-CB 4.47Å
37I98Very high96.4Very high34 Ų3445.3 Ų45.317%0.17425%0.247CC..Hα-helixtrans-62.2-48176.1-66162.5000111N33 S34 I35 S40 S41 I84 I88 I91N33-I37 VanDerWaalsContact O-CG1 3.29Å; N33-I37 WeakPolarHBondContact O-CG1 3.31Å; N33-I37 PolarHBondContact O-N 2.79Å; N33-I37 VanDerWaalsContact O-N 3.1Å; S34-I37 PolarHBondContact O-N 2.91Å; I35-I37 VanDerWaalsContact C-N 3.3Å; I35-I37 PolarHBondContact O-N 3.47Å; I37-S40 PolarHBondContact O-N 3.45Å; I37-S41 VanDerWaalsContact O-CB 3.28Å; I37-S41 WeakPolarHBondContact O-CB 3.37Å; I37-S41 PolarHBondContact O-N 3.08Å; I37-S41 PolarHBondContact O-OG 2.97Å; I37-I84 HydrophobicContact CG2-CG2 4.38Å; I37-I88 HydrophobicContact CD1-CG1 3.85Å; I37-I88 HydrophobicContact CG1-CG1 4.46Å; I37-I91 HydrophobicContact CD1-CD1 3.67Å
38I97.6Very high96.2Very high96 Ų9644.6 Ų44.649%0.49225%0.245SC..Hα-helixtrans-61.7-50.5-177.3-69.4164.3000110.7S34 I35 S41 I42S34-I38 VanDerWaalsContact O-CG1 3.28Å; S34-I38 WeakPolarHBondContact O-CG1 3.49Å; S34-I38 PolarHBondContact O-N 3.48Å; I35-I38 PolarHBondContact O-N 3.01Å; I38-S41 PolarHBondContact O-N 3.49Å; I38-I42 HydrophobicContact CG2-CD1 3.84Å; I38-I42 WeakPolarHBondContact O-CG1 3.45Å; I38-I42 PolarHBondContact O-N 3.43Å
39I96.5Very high96.1Very high52 Ų5246.8 Ų46.827%0.26726%0.256SS..Hα-helixtrans-63.2-45.3180-65.7-62.2000110.9I35 S41 I42 I43 M258I35-I39 HydrophobicContact CG2-CG1 3.95Å; I35-I39 WeakPolarHBondContact O-CB 3.49Å; I35-I39 WeakPolarHBondContact O-CG1 3.48Å; I35-I39 PolarHBondContact O-N 2.92Å; I39-S41 VanDerWaalsContact C-N 3.25Å; I39-S41 PolarHBondContact O-N 3.43Å; I39-I42 PolarHBondContact O-N 3.01Å; I39-I43 HydrophobicContact CG2-CD1 3.95Å; I39-I43 WeakPolarHBondContact O-CG1 3.45Å; I39-I43 PolarHBondContact O-N 3.32Å; I39-M258 HydrophobicContact CG1-CE 4.28Å
40S97.6Very high95.8Very high0 Ų048.6 Ų48.60%027%0.267CS..Hα-helixtrans-61-36.7176.5-57.70000111.7L36 I37 F44 S83L36-S40 WeakPolarHBondContact O-CB 3.31Å; L36-S40 PolarHBondContact O-N 3.31Å; L36-S40 PolarHBondContact O-OG 3.21Å; I37-S40 PolarHBondContact O-N 3.45Å; S40-F44 WeakPolarHBondContact O-CB 3.33Å; S40-F44 PolarHBondContact O-N 3.4Å; S40-S83 VanDerWaalsContact OG-CB 3.32Å; S40-S83 WeakPolarHBondContact OG-CB 3.29Å
41S97.6Very high95.5Very high40 Ų4049.2 Ų49.228%0.2827%0.27SS..Hα-helixtrans-70.3-37.5176.8-58.10000112.5I37 I38 I39 S45I37-S41 VanDerWaalsContact O-CB 3.28Å; I37-S41 WeakPolarHBondContact O-CB 3.37Å; I37-S41 PolarHBondContact O-N 3.08Å; I37-S41 PolarHBondContact O-OG 2.97Å; I38-S41 PolarHBondContact O-N 3.49Å; I39-S41 VanDerWaalsContact C-N 3.25Å; I39-S41 PolarHBondContact O-N 3.43Å; S41-S45 VanDerWaalsContact O-CB 3.32Å; S41-S45 WeakPolarHBondContact O-CB 3.45Å; S41-S45 PolarHBondContact O-N 3.08Å; S41-S45 PolarHBondContact O-OG 3.27Å
42I97.1Very high95.2Very high101 Ų10149.1 Ų49.152%0.51828%0.277SS..Hα-helixtrans-64-47.3174.9-70.1166000110.1I38 I39 S45 S46I38-I42 HydrophobicContact CG2-CD1 3.84Å; I38-I42 WeakPolarHBondContact O-CG1 3.45Å; I38-I42 PolarHBondContact O-N 3.43Å; I39-I42 PolarHBondContact O-N 3.01Å; I42-S45 PolarHBondContact O-N 3.12Å; I42-S46 PolarHBondContact O-N 3.05Å; I42-S46 PolarHBondContact O-OG 3.32Å
43I96.2Very high95.1Very high11 Ų1154.5 Ų54.56%0.05630%0.297CS..Hα-helixtrans-65.4-43.3178.1-63.8172000110.7I39 S45 S46 V47 I76 C80 L255I39-I43 HydrophobicContact CG2-CD1 3.95Å; I39-I43 WeakPolarHBondContact O-CG1 3.45Å; I39-I43 PolarHBondContact O-N 3.32Å; I43-S45 VanDerWaalsContact C-N 3.32Å; I43-S45 PolarHBondContact O-N 3.04Å; I43-S46 PolarHBondContact O-N 3.48Å; I43-S46 PolarHBondContact O-OG 3.38Å; I43-V47 HydrophobicContact CG2-CG2 4.47Å; I43-V47 WeakPolarHBondContact O-CG2 3.43Å; I43-V47 PolarHBondContact O-N 3.01Å; I43-I76 HydrophobicContact CG2-CG2 3.85Å; I43-C80 VanDerWaalsContact CG2-SG 3.59Å; I43-L255 HydrophobicContact CD1-CD2 3.91Å; I43-L255 HydrophobicContact CD1-CG 3.92Å
44F96.8Very high94.7Very high62 Ų6258.4 Ų58.427%0.27232%0.323SS..Hα-helixtrans-57.4-46.5175.1176.3-97.7000111.7S40 V47 L48 V77 C80 I81S40-F44 WeakPolarHBondContact O-CB 3.33Å; S40-F44 PolarHBondContact O-N 3.4Å; F44-V47 PolarHBondContact O-N 2.74Å; F44-L48 HydrophobicContact CE1-CD2 4.32Å; F44-L48 WeakPolarHBondContact O-CB 3.5Å; F44-L48 PolarHBondContact O-N 3.12Å; F44-V77 HydrophobicContact CD2-CG1 4.26Å; F44-V77 HydrophobicContact CE2-CG1 3.9Å; F44-C80 HydrophobicContact CB-CB 3.88Å; F44-C80 HydrophobicContact CD2-CB 4.33Å; F44-I81 HydrophobicContact CD2-CG1 4.32Å; F44-I81 HydrophobicContact CE2-CD1 4.2Å; F44-I81 HydrophobicContact CE2-CG1 4.09Å
45S96Very high94.3Very high60 Ų6058.3 Ų58.342%0.4232%0.319SS..Hα-helixtrans-66.1-40.3179.8-57.40000112S41 I42 I43 L48 L49S41-S45 VanDerWaalsContact O-CB 3.32Å; S41-S45 WeakPolarHBondContact O-CB 3.45Å; S41-S45 PolarHBondContact O-N 3.08Å; S41-S45 PolarHBondContact O-OG 3.27Å; I42-S45 PolarHBondContact O-N 3.12Å; I43-S45 VanDerWaalsContact C-N 3.32Å; I43-S45 PolarHBondContact O-N 3.04Å; S45-L48 PolarHBondContact O-N 2.87Å; S45-L49 WeakPolarHBondContact O-CG 3.32Å; S45-L49 PolarHBondContact O-N 3.5Å
46S93.3Very high94Very high51 Ų5159.9 Ų59.936%0.35732%0.321SS..Hα-helixtrans-65.6-40.7177.369.40000111.9I42 I43 L49 V50I42-S46 PolarHBondContact O-N 3.05Å; I42-S46 PolarHBondContact O-OG 3.32Å; I43-S46 PolarHBondContact O-N 3.48Å; I43-S46 PolarHBondContact O-OG 3.38Å; S46-L49 PolarHBondContact O-N 3.22Å; S46-V50 WeakPolarHBondContact O-CG2 3.39Å; S46-V50 PolarHBondContact O-N 2.98Å; S46-V50 VanDerWaalsContact O-N 3.08Å
47V92.8Very high93.6Very high11 Ų1162.8 Ų62.87%0.06734%0.336CS..Hα-helixtrans-65.3-40.3174171.80000111.5I43 F44 L49 V50 I51 L73 I76 V77I43-V47 HydrophobicContact CG2-CG2 4.47Å; I43-V47 WeakPolarHBondContact O-CG2 3.43Å; I43-V47 PolarHBondContact O-N 3.01Å; F44-V47 PolarHBondContact O-N 2.74Å; V47-L49 VanDerWaalsContact C-N 3.33Å; V47-L49 PolarHBondContact O-N 3.13Å; V47-V50 WeakPolarHBondContact O-CB 3.48Å; V47-V50 PolarHBondContact O-N 3.29Å; V47-I51 HydrophobicContact CG1-CD1 3.8Å; V47-I51 HydrophobicContact CG1-CG1 4.38Å; V47-I51 WeakPolarHBondContact O-CG1 3.48Å; V47-I51 PolarHBondContact O-N 3.1Å; V47-L73 HydrophobicContact CG1-CB 4.42Å; V47-L73 HydrophobicContact CG1-CD2 4.06Å; V47-I76 HydrophobicContact CG2-CB 4.48Å; V47-I76 HydrophobicContact CG2-CG2 3.76Å; V47-V77 HydrophobicContact CB-CG2 4.46Å; V47-V77 HydrophobicContact CG1-CG2 3.61Å
48L93.4Very high93.2Very high86 Ų8666.3 Ų66.345%0.4535%0.35SS..Hα-helixtrans-64.7-37.9177.4-171.861.5000112F44 S45 I51 S52F44-L48 HydrophobicContact CE1-CD2 4.32Å; F44-L48 WeakPolarHBondContact O-CB 3.5Å; F44-L48 PolarHBondContact O-N 3.12Å; S45-L48 PolarHBondContact O-N 2.87Å; L48-I51 PolarHBondContact O-N 3.07Å; L48-S52 VanDerWaalsContact O-CB 3.31Å; L48-S52 WeakPolarHBondContact O-CB 3.27Å; L48-S52 PolarHBondContact O-N 2.9Å; L48-S52 PolarHBondContact O-OG 3.36Å
49L92.2Very high92.9Very high127 Ų12761.7 Ų61.767%0.66533%0.327SS*.Hα-helixtrans-61.8-43.1172.6-74.3169.9000111.7S45 S46 V47 S52 Y53S45-L49 WeakPolarHBondContact O-CG 3.32Å; S45-L49 PolarHBondContact O-N 3.5Å; S46-L49 PolarHBondContact O-N 3.22Å; V47-L49 VanDerWaalsContact C-N 3.33Å; V47-L49 PolarHBondContact O-N 3.13Å; L49-S52 PolarHBondContact O-N 3.03Å; L49-Y53 PolarHBondContact O-N 3.47Å; L49-Y53 VanDerWaalsContact O-N 3.14Å
50V89.7Confident92.5Very high39 Ų3960 Ų6024%0.23632%0.318CS..Hα-helixtrans-61.1-43.5175.3165.80000111.7S46 V47 S52 W56 F60 L73S46-V50 WeakPolarHBondContact O-CG2 3.39Å; S46-V50 PolarHBondContact O-N 2.98Å; S46-V50 VanDerWaalsContact O-N 3.08Å; V47-V50 WeakPolarHBondContact O-CB 3.48Å; V47-V50 PolarHBondContact O-N 3.29Å; V50-S52 VanDerWaalsContact C-N 3.34Å; V50-W56 HydrophobicContact CG1-CB 4.09Å; V50-W56 WeakPolarHBondContact O-CB 3.47Å; V50-F60 HydrophobicContact CG1-CD2 3.7Å; V50-F60 HydrophobicContact CG1-CE2 3.19Å; V50-F60 HydrophobicContact CG1-CZ 3.9Å; V50-L73 HydrophobicContact CG1-CD1 4.37Å
51I89.5Confident92.1Very high57 Ų5763.6 Ų63.629%0.29234%0.336SS..Hα-helixtrans-67.6-37177.5-68.1167.7000111.2V47 L48 Y53 L57 L73V47-I51 HydrophobicContact CG1-CD1 3.8Å; V47-I51 HydrophobicContact CG1-CG1 4.38Å; V47-I51 WeakPolarHBondContact O-CG1 3.48Å; V47-I51 PolarHBondContact O-N 3.1Å; L48-I51 PolarHBondContact O-N 3.07Å; I51-Y53 VanDerWaalsContact C-N 3.3Å; I51-Y53 PolarHBondContact O-N 3.33Å; I51-L57 HydrophobicContact CG2-CD1 4.37Å; I51-L73 HydrophobicContact CD1-CB 4.48Å; I51-L73 HydrophobicContact CD1-CD1 4.49Å; I51-L73 HydrophobicContact CG1-CD1 3.89Å
52S91.7Very high91.7Very high85 Ų8561.9 Ų61.959%0.59432%0.324SS*.Hα-helixtrans-72-23.9-177.7-58.80000112.9L48 L49 V50 P54L48-S52 VanDerWaalsContact O-CB 3.31Å; L48-S52 WeakPolarHBondContact O-CB 3.27Å; L48-S52 PolarHBondContact O-N 2.9Å; L48-S52 PolarHBondContact O-OG 3.36Å; L49-S52 PolarHBondContact O-N 3.03Å; V50-S52 VanDerWaalsContact C-N 3.34Å; S52-P54 WeakPolarHBondContact O-CD 3.33Å
53Y92.2Very high91.2Very high129 Ų12957.2 Ų57.251%0.50630%0.3SS..SBendtrans-89.1115.5178.4-164.7-106.5000111.4L49 I51 L55 W56 L57L49-Y53 PolarHBondContact O-N 3.47Å; L49-Y53 VanDerWaalsContact O-N 3.14Å; I51-Y53 VanDerWaalsContact C-N 3.3Å; I51-Y53 PolarHBondContact O-N 3.33Å; Y53-L55 VanDerWaalsContact C-N 3.33Å; Y53-L55 HydrophobicContact CD1-CB 3.67Å; Y53-L55 HydrophobicContact CE1-CB 3.42Å; Y53-L55 VanDerWaalsContact CE1-CB 3.42Å; Y53-L55 HydrophobicContact CE1-CD2 3.95Å; Y53-L55 HydrophobicContact CE1-CG 4.28Å; Y53-L55 PolarHBondContact O-N 3.39Å; Y53-W56 HydrophobicContact CD1-CB 4.44Å; Y53-W56 AromaticContact CD1-CD1 3.35Å; Y53-W56 HydrophobicContact CD1-CG 4.18Å; Y53-W56 PolarHBondContact O-N 2.98Å; Y53-L57 PolarHBondContact O-N 2.93Å
54P89.8Confident90.8Very high82 Ų8259.4 Ų59.453%0.53231%0.31SS..Hα-helixtrans-58.1-36.8-171-27.735000115.3S52 L57 K58S52-P54 WeakPolarHBondContact O-CD 3.33Å; P54-L57 PolarHBondContact O-N 3.01Å; P54-K58 WeakPolarHBondContact O-CB 3.27Å; P54-K58 VanDerWaalsContact O-CG 3.28Å; P54-K58 WeakPolarHBondContact O-CG 3.22Å; P54-K58 PolarHBondContact O-N 2.93Å
55L89.2Confident90.3Very high38 Ų3863.2 Ų63.220%0.19933%0.326CS..Hα-helixtrans-61.8-49.7179.9179.765000111.2Y53 K58 M59 E157 A158Y53-L55 VanDerWaalsContact C-N 3.33Å; Y53-L55 HydrophobicContact CD1-CB 3.67Å; Y53-L55 HydrophobicContact CE1-CB 3.42Å; Y53-L55 VanDerWaalsContact CE1-CB 3.42Å; Y53-L55 HydrophobicContact CE1-CD2 3.95Å; Y53-L55 HydrophobicContact CE1-CG 4.28Å; Y53-L55 PolarHBondContact O-N 3.39Å; L55-K58 PolarHBondContact O-N 3.3Å; L55-M59 PolarHBondContact O-N 3.31Å; L55-E157 HydrophobicContact CD1-CB 3.89Å; L55-E157 VanDerWaalsContact CD1-CD 3.45Å; L55-E157 HydrophobicContact CD1-CG 3.57Å; L55-A158 HydrophobicContact CD1-CB 4.28Å; L55-A158 HydrophobicContact CG-CB 4.03Å
56W90.1Very high89.8Confident96 Ų9661.2 Ų61.236%0.36431%0.311SS..Hα-helixtrans-64.5-47178.1-75.4112.4000110.2V50 Y53 K58 M59 F60 L159V50-W56 HydrophobicContact CG1-CB 4.09Å; V50-W56 WeakPolarHBondContact O-CB 3.47Å; Y53-W56 HydrophobicContact CD1-CB 4.44Å; Y53-W56 AromaticContact CD1-CD1 3.35Å; Y53-W56 HydrophobicContact CD1-CG 4.18Å; Y53-W56 PolarHBondContact O-N 2.98Å; W56-K58 VanDerWaalsContact C-N 3.33Å; W56-K58 PolarHBondContact O-N 2.87Å; W56-M59 HydrophobicContact CE3-CE 3.45Å; W56-M59 VanDerWaalsContact CE3-CE 3.45Å; W56-M59 HydrophobicContact CE3-SD 3.82Å; W56-M59 HydrophobicContact CZ3-CE 3.64Å; W56-M59 HydrophobicContact CZ3-SD 3.74Å; W56-M59 WeakPolarHBondContact O-CB 3.44Å; W56-M59 PolarHBondContact O-N 3.04Å; W56-M59 VanDerWaalsContact O-N 3.11Å; W56-F60 HydrophobicContact CE3-CE2 4.25Å; W56-F60 VanDerWaalsContact O-CD2 3.24Å; W56-F60 WeakPolarHBondContact O-CD2 2.98Å; W56-F60 PolarHBondContact O-N 3.46Å; W56-L159 HydrophobicContact CZ3-CD2 4.3Å
57L89Confident89.2Confident62 Ų6258.8 Ų58.833%0.32529%0.294SS..Hα-helixtrans-55.1-46.8177.6-177.863.5000112.4I51 Y53 P54 M59 F60 I61I51-L57 HydrophobicContact CG2-CD1 4.37Å; Y53-L57 PolarHBondContact O-N 2.93Å; P54-L57 PolarHBondContact O-N 3.01Å; L57-M59 PolarHBondContact O-N 3.34Å; L57-F60 PolarHBondContact O-N 3.5Å; L57-I61 HydrophobicContact CD1-CD1 4.23Å; L57-I61 HydrophobicContact CG-CD1 4.01Å; L57-I61 WeakPolarHBondContact O-CG1 3.18Å; L57-I61 PolarHBondContact O-N 3.05Å
58K89.6Confident88.3Confident107 Ų10762.4 Ų62.447%0.46531%0.312SS..Hα-helixtrans-61.7-41.7176.4-75.4177.5179.9-1750112.3P54 L55 W56 I61 S62 N154P54-K58 WeakPolarHBondContact O-CB 3.27Å; P54-K58 VanDerWaalsContact O-CG 3.28Å; P54-K58 WeakPolarHBondContact O-CG 3.22Å; P54-K58 PolarHBondContact O-N 2.93Å; L55-K58 PolarHBondContact O-N 3.3Å; W56-K58 VanDerWaalsContact C-N 3.33Å; W56-K58 PolarHBondContact O-N 2.87Å; K58-I61 PolarHBondContact O-N 3.41Å; K58-S62 VanDerWaalsContact O-CB 3.3Å; K58-S62 WeakPolarHBondContact O-CB 3.35Å; K58-S62 PolarHBondContact O-N 3.22Å; K58-S62 PolarHBondContact O-OG 3.48Å; K58-N154 HydrophobicContact CB-CB 4.19Å
59M90.4Very high87.3Confident0 Ų058.4 Ų58.40%029%0.291CS..Hα-helixtrans-59.3-48.9173.9-179-15674.300110.8L55 W56 L57 I61 S62 L63 I155 A158 L159 F244L55-M59 PolarHBondContact O-N 3.31Å; W56-M59 HydrophobicContact CE3-CE 3.45Å; W56-M59 VanDerWaalsContact CE3-CE 3.45Å; W56-M59 HydrophobicContact CE3-SD 3.82Å; W56-M59 HydrophobicContact CZ3-CE 3.64Å; W56-M59 HydrophobicContact CZ3-SD 3.74Å; W56-M59 WeakPolarHBondContact O-CB 3.44Å; W56-M59 PolarHBondContact O-N 3.04Å; W56-M59 VanDerWaalsContact O-N 3.11Å; L57-M59 PolarHBondContact O-N 3.34Å; M59-I61 PolarHBondContact O-N 2.95Å; M59-S62 WeakPolarHBondContact O-CB 3.37Å; M59-S62 PolarHBondContact O-N 2.87Å; M59-S62 VanDerWaalsContact O-N 3.16Å; M59-L63 HydrophobicContact CE-CD1 3.87Å; M59-L63 HydrophobicContact CG-CD1 3.89Å; M59-L63 HydrophobicContact CG-CG 4.42Å; M59-L63 WeakPolarHBondContact O-CG 3.48Å; M59-L63 PolarHBondContact O-N 3.42Å; M59-L63 HydrophobicContact SD-CD1 4.21Å; M59-I155 HydrophobicContact CG-CG1 4.44Å; M59-A158 HydrophobicContact CB-CB 3.58Å; M59-A158 HydrophobicContact CG-CB 3.71Å; M59-A158 HydrophobicContact SD-CB 3.56Å; M59-A158 VanDerWaalsContact SD-CB 3.56Å; M59-L159 HydrophobicContact SD-CD1 4.14Å; M59-L159 HydrophobicContact SD-CD2 3.68Å; M59-L159 HydrophobicContact SD-CG 3.65Å; M59-F244 HydrophobicContact CE-CD2 4.18Å; M59-F244 HydrophobicContact CE-CE2 3.69Å; M59-F244 HydrophobicContact CE-CZ 4.39Å
60F88.3Confident86.2Confident17 Ų1760 Ų608%0.07529%0.289CS..Hα-helixtrans-60.9-44.7179.2-87.9-84.8000112.5V50 W56 L57 S62 L63 Q64 L73 F244V50-F60 HydrophobicContact CG1-CD2 3.7Å; V50-F60 HydrophobicContact CG1-CE2 3.19Å; V50-F60 HydrophobicContact CG1-CZ 3.9Å; W56-F60 HydrophobicContact CE3-CE2 4.25Å; W56-F60 VanDerWaalsContact O-CD2 3.24Å; W56-F60 WeakPolarHBondContact O-CD2 2.98Å; W56-F60 PolarHBondContact O-N 3.46Å; L57-F60 PolarHBondContact O-N 3.5Å; F60-S62 VanDerWaalsContact C-N 3.29Å; F60-S62 PolarHBondContact O-N 3Å; F60-L63 PolarHBondContact O-N 3.4Å; F60-Q64 VanDerWaalsContact O-CG 3.3Å; F60-Q64 WeakPolarHBondContact O-CG 3.4Å; F60-Q64 PolarHBondContact O-N 2.95Å; F60-L73 HydrophobicContact CB-CD1 4.01Å; F60-L73 HydrophobicContact CD1-CD1 3.62Å; F60-L73 HydrophobicContact CD1-CD2 3.96Å; F60-L73 HydrophobicContact CD1-CG 3.65Å; F60-L73 HydrophobicContact CD2-CD1 3.97Å; F60-L73 HydrophobicContact CE1-CD1 3.96Å; F60-L73 HydrophobicContact CE1-CD2 3.45Å; F60-L73 VanDerWaalsContact CE1-CD2 3.45Å; F60-L73 HydrophobicContact CE1-CG 3.71Å; F60-L73 HydrophobicContact CE2-CD1 4.37Å; F60-L73 HydrophobicContact CG-CD1 3.6Å; F60-L73 HydrophobicContact CG-CG 4.18Å; F60-L73 HydrophobicContact CZ-CD1 4.34Å; F60-L73 HydrophobicContact CZ-CD2 3.79Å; F60-L73 HydrophobicContact CZ-CG 4.37Å; F60-F244 HydrophobicContact CD1-CZ 4.13Å; F60-F244 AromaticContact CE1-CE2 3.78Å; F60-F244 HydrophobicContact CE1-CE2 3.78Å; F60-F244 AromaticContact CE1-CZ 3.36Å; F60-F244 HydrophobicContact CE1-CZ 3.36Å; F60-F244 HydrophobicContact CE2-CE2 4.06Å; F60-F244 HydrophobicContact CE2-CZ 4.45Å; F60-F244 AromaticContact CZ-CE2 3.41Å; F60-F244 HydrophobicContact CZ-CE2 3.41Å; F60-F244 VanDerWaalsContact CZ-CE2 3.41Å; F60-F244 AromaticContact CZ-CZ 3.54Å; F60-F244 HydrophobicContact CZ-CZ 3.54Å
61I89Confident85.7Confident75 Ų7559.2 Ų59.239%0.38529%0.287SS..Hα-helixtrans-60.5-42.7175.2-68.2167000110.4L57 K58 M59 Q64 K65L57-I61 HydrophobicContact CD1-CD1 4.23Å; L57-I61 HydrophobicContact CG-CD1 4.01Å; L57-I61 WeakPolarHBondContact O-CG1 3.18Å; L57-I61 PolarHBondContact O-N 3.05Å; K58-I61 PolarHBondContact O-N 3.41Å; M59-I61 PolarHBondContact O-N 2.95Å; I61-Q64 PolarHBondContact O-N 3.34Å; I61-K65 WeakPolarHBondContact O-CG 3.33Å; I61-K65 PolarHBondContact O-N 3.06Å; I61-K65 VanDerWaalsContact O-N 3.13Å
62S89.3Confident85.6Confident3 Ų356.8 Ų56.82%0.02128%0.275CS..Hα-helixtrans-64.7-40.1178.5-59.70000112K58 M59 F60 K65 I66 V151 N154K58-S62 VanDerWaalsContact O-CB 3.3Å; K58-S62 WeakPolarHBondContact O-CB 3.35Å; K58-S62 PolarHBondContact O-N 3.22Å; K58-S62 PolarHBondContact O-OG 3.48Å; M59-S62 WeakPolarHBondContact O-CB 3.37Å; M59-S62 PolarHBondContact O-N 2.87Å; M59-S62 VanDerWaalsContact O-N 3.16Å; F60-S62 VanDerWaalsContact C-N 3.29Å; F60-S62 PolarHBondContact O-N 3Å; S62-K65 PolarHBondContact O-N 3.24Å; S62-I66 PolarHBondContact O-N 3.05Å; S62-V151 WeakPolarHBondContact CB-O 3.26Å; S62-N154 WeakPolarHBondContact OG-CB 3.28Å; S62-N154 PolarHBondContact OG-ND2 3.32Å
63L87.2Confident85.5Confident4 Ų453.4 Ų53.42%0.02125%0.25CS..Hα-helixtrans-67.5-38.1175.8-72.6168.8000112.8M59 F60 K65 I66 T67 W127 I155 L240 F244M59-L63 HydrophobicContact CE-CD1 3.87Å; M59-L63 HydrophobicContact CG-CD1 3.89Å; M59-L63 HydrophobicContact CG-CG 4.42Å; M59-L63 WeakPolarHBondContact O-CG 3.48Å; M59-L63 PolarHBondContact O-N 3.42Å; M59-L63 HydrophobicContact SD-CD1 4.21Å; F60-L63 PolarHBondContact O-N 3.4Å; L63-K65 VanDerWaalsContact C-N 3.33Å; L63-I66 PolarHBondContact O-N 3.31Å; L63-T67 WeakPolarHBondContact O-CB 3.36Å; L63-T67 PolarHBondContact O-N 3.03Å; L63-T67 PolarHBondContact O-OG1 3.38Å; L63-W127 HydrophobicContact CD1-CH2 4.2Å; L63-W127 HydrophobicContact CD2-CH2 4.29Å; L63-I155 HydrophobicContact CD2-CD1 3.78Å; L63-I155 HydrophobicContact CD2-CG1 4.16Å; L63-I155 HydrophobicContact CG-CD1 4.21Å; L63-I155 HydrophobicContact CG-CG1 4.21Å; L63-L240 HydrophobicContact CD1-CD2 3.73Å; L63-L240 HydrophobicContact CD2-CD1 3.7Å; L63-L240 HydrophobicContact CD2-CD2 3.44Å; L63-L240 VanDerWaalsContact CD2-CD2 3.44Å; L63-L240 HydrophobicContact CD2-CG 4.24Å; L63-L240 HydrophobicContact CG-CD2 4.23Å; L63-F244 HydrophobicContact CD1-CE1 4.43Å; L63-F244 HydrophobicContact CD1-CZ 4.35Å
64Q86.4Confident85.4Confident56 Ų5653 Ų5326%0.26226%0.255SS..Hα-helixtrans-62.7-41.3175-72.6176.22.800111.5F60 I61 I66 I68 S69F60-Q64 VanDerWaalsContact O-CG 3.3Å; F60-Q64 WeakPolarHBondContact O-CG 3.4Å; F60-Q64 PolarHBondContact O-N 2.95Å; I61-Q64 PolarHBondContact O-N 3.34Å; Q64-I66 VanDerWaalsContact C-N 3.3Å; Q64-I66 PolarHBondContact O-N 3.38Å; Q64-I68 PolarHBondContact O-N 2.9Å; Q64-I68 VanDerWaalsContact O-N 3.1Å; Q64-S69 WeakPolarHBondContact CG-O 3.42Å
65K86.3Confident85.5Confident143 Ų14353.2 Ų53.262%0.62225%0.246SC*.Hα-helixtrans-60.1-39.8174.8-71.4178.8178.8-175.60112.2I61 S62 L63 V151I61-K65 WeakPolarHBondContact O-CG 3.33Å; I61-K65 PolarHBondContact O-N 3.06Å; I61-K65 VanDerWaalsContact O-N 3.13Å; S62-K65 PolarHBondContact O-N 3.24Å; L63-K65 VanDerWaalsContact C-N 3.33Å; K65-V151 HydrophobicContact CD-CG2 4.19Å
66I85.4Confident85.7Confident18 Ų1851.8 Ų51.89%0.09224%0.238CC..Hα-helixtrans-75.9-45.7-177.6-79179.9000112.7S62 L63 Q64 I68 V135 A138 V151 I155S62-I66 PolarHBondContact O-N 3.05Å; L63-I66 PolarHBondContact O-N 3.31Å; Q64-I66 VanDerWaalsContact C-N 3.3Å; Q64-I66 PolarHBondContact O-N 3.38Å; I66-I68 VanDerWaalsContact C-N 3.35Å; I66-V135 HydrophobicContact CD1-CG2 4.45Å; I66-V135 HydrophobicContact CG2-CG2 4.27Å; I66-A138 HydrophobicContact CD1-CB 3.62Å; I66-A138 HydrophobicContact CG1-CB 4.29Å; I66-V151 HydrophobicContact CD1-CG1 3.71Å; I66-V151 HydrophobicContact CG1-CG1 3.86Å; I66-I155 HydrophobicContact CD1-CD1 3.44Å; I66-I155 VanDerWaalsContact CD1-CD1 3.44Å
67T81.9Confident85.9Confident0 Ų048.8 Ų48.80%023%0.23CC..Hα-helixtrans-86.8-8.4-172.454.70000113.1L63 S69 W127 L131L63-T67 WeakPolarHBondContact O-CB 3.36Å; L63-T67 PolarHBondContact O-N 3.03Å; L63-T67 PolarHBondContact O-OG1 3.38Å; T67-S69 PolarHBondContact O-N 3.41Å; T67-S69 VanDerWaalsContact OG1-CB 3.26Å; T67-S69 WeakPolarHBondContact OG1-CB 3.29Å; T67-S69 PolarHBondContact OG1-N 2.78Å; T67-W127 HydrophobicContact CG2-CD2 4.19Å; T67-W127 HydrophobicContact CG2-CE3 3.75Å; T67-W127 HydrophobicContact CG2-CZ3 3.99Å; T67-L131 HydrophobicContact CG2-CB 4.49Å; T67-L131 HydrophobicContact CG2-CD1 4Å
68I74.5Confident86.2Confident86 Ų8650.4 Ų50.444%0.44124%0.235SC..THydrogen-bonded Turntrans53.822.8-169.3-39.4176.2000110.4Q64 I66 Y70 Q126Q64-I68 PolarHBondContact O-N 2.9Å; Q64-I68 VanDerWaalsContact O-N 3.1Å; I66-I68 VanDerWaalsContact C-N 3.35Å; I68-Y70 HydrophobicContact CG2-CE1 4.42Å; I68-Y70 PolarHBondContact O-N 3.49Å; I68-Q126 PolarHBondContact O-NE2 3.15Å
69S72.5Confident86.6Confident2 Ų245.3 Ų45.31%0.01421%0.212CC..  trans-85.8112178.2-167.20000108.1Q64 T67 A71 I72Q64-S69 WeakPolarHBondContact CG-O 3.42Å; T67-S69 PolarHBondContact O-N 3.41Å; T67-S69 VanDerWaalsContact OG1-CB 3.26Å; T67-S69 WeakPolarHBondContact OG1-CB 3.29Å; T67-S69 PolarHBondContact OG1-N 2.78Å; S69-A71 PolarHBondContact O-N 2.89Å; S69-I72 WeakPolarHBondContact OG-CG1 3.3Å
70Y67.3Low86.9Confident160 Ų16045.3 Ų45.363%0.62721%0.212SC*.  trans-70.2118.7178.6-39.8-78.3000109I68 I72I68-Y70 HydrophobicContact CG2-CE1 4.42Å; I68-Y70 PolarHBondContact O-N 3.49Å; Y70-I72 PolarHBondContact O-N 3.38Å; Y70-I72 VanDerWaalsContact O-N 3.13Å
71A80.9Confident87.4Confident24 Ų2448.1 Ų48.120%0.19823%0.228CC..  trans57.638.5149.400000116.8S69 L73 I74 W75S69-A71 PolarHBondContact O-N 2.89Å; A71-L73 VanDerWaalsContact C-N 3.28Å; A71-L73 PolarHBondContact O-N 3.28Å; A71-I74 HydrophobicContact CB-CB 3.96Å; A71-I74 HydrophobicContact CB-CD1 3.68Å; A71-I74 HydrophobicContact CB-CG1 4.16Å; A71-I74 WeakPolarHBondContact O-CA 3.4Å; A71-I74 WeakPolarHBondContact O-CB 3.46Å; A71-I74 PolarHBondContact O-N 3.39Å; A71-W75 PolarHBondContact O-N 3.32Å
72I87.2Confident87.8Confident6 Ų646.1 Ų46.13%0.03122%0.219CC..Hα-helixtrans-46.1-49.5179.4-60.4173.9000112.2S69 Y70 I74 W75 I76 I123 W127 V248S69-I72 WeakPolarHBondContact OG-CG1 3.3Å; Y70-I72 PolarHBondContact O-N 3.38Å; Y70-I72 VanDerWaalsContact O-N 3.13Å; I72-I74 VanDerWaalsContact C-N 3.32Å; I72-I74 PolarHBondContact O-N 2.97Å; I72-W75 PolarHBondContact O-N 3.05Å; I72-I76 HydrophobicContact CG2-CD1 3.97Å; I72-I76 WeakPolarHBondContact O-CG1 3.29Å; I72-I76 PolarHBondContact O-N 3.36Å; I72-I123 HydrophobicContact CB-CD1 4.44Å; I72-I123 HydrophobicContact CD1-CG2 3.72Å; I72-I123 HydrophobicContact CG1-CD1 4Å; I72-I123 HydrophobicContact CG1-CG1 4.16Å; I72-I123 HydrophobicContact CG1-CG2 4Å; I72-I123 HydrophobicContact CG2-CD1 4.25Å; I72-W127 HydrophobicContact CD1-CE3 4.31Å; I72-W127 HydrophobicContact CD1-CZ3 4.13Å; I72-V248 HydrophobicContact CG2-CG1 4.14Å
73L88Confident88.2Confident14 Ų1446 Ų467%0.07322%0.218CC..Hα-helixtrans-63.3-36.7-179.6-66.3-177.7000112.8V47 V50 I51 F60 A71 I76 V77V47-L73 HydrophobicContact CG1-CB 4.42Å; V47-L73 HydrophobicContact CG1-CD2 4.06Å; V50-L73 HydrophobicContact CG1-CD1 4.37Å; I51-L73 HydrophobicContact CD1-CB 4.48Å; I51-L73 HydrophobicContact CD1-CD1 4.49Å; I51-L73 HydrophobicContact CG1-CD1 3.89Å; F60-L73 HydrophobicContact CB-CD1 4.01Å; F60-L73 HydrophobicContact CD1-CD1 3.62Å; F60-L73 HydrophobicContact CD1-CD2 3.96Å; F60-L73 HydrophobicContact CD1-CG 3.65Å; F60-L73 HydrophobicContact CD2-CD1 3.97Å; F60-L73 HydrophobicContact CE1-CD1 3.96Å; F60-L73 HydrophobicContact CE1-CD2 3.45Å; F60-L73 VanDerWaalsContact CE1-CD2 3.45Å; F60-L73 HydrophobicContact CE1-CG 3.71Å; F60-L73 HydrophobicContact CE2-CD1 4.37Å; F60-L73 HydrophobicContact CG-CD1 3.6Å; F60-L73 HydrophobicContact CG-CG 4.18Å; F60-L73 HydrophobicContact CZ-CD1 4.34Å; F60-L73 HydrophobicContact CZ-CD2 3.79Å; F60-L73 HydrophobicContact CZ-CG 4.37Å; A71-L73 VanDerWaalsContact C-N 3.28Å; A71-L73 PolarHBondContact O-N 3.28Å; L73-I76 PolarHBondContact O-N 3.3Å; L73-V77 VanDerWaalsContact O-CG2 3.3Å; L73-V77 WeakPolarHBondContact O-CG2 3.37Å; L73-V77 PolarHBondContact O-N 3.44Å
74I90.9Very high88.7Confident119 Ų11947.4 Ų47.461%0.6123%0.225SC*.Hα-helixtrans-66.7-42.4178.8-64.5168.2000109.8A71 I72 V77 F78A71-I74 HydrophobicContact CB-CB 3.96Å; A71-I74 HydrophobicContact CB-CD1 3.68Å; A71-I74 HydrophobicContact CB-CG1 4.16Å; A71-I74 WeakPolarHBondContact O-CA 3.4Å; A71-I74 WeakPolarHBondContact O-CB 3.46Å; A71-I74 PolarHBondContact O-N 3.39Å; I72-I74 VanDerWaalsContact C-N 3.32Å; I72-I74 PolarHBondContact O-N 2.97Å; I74-V77 PolarHBondContact O-N 3.4Å; I74-F78 WeakPolarHBondContact O-CB 3.48Å; I74-F78 PolarHBondContact O-N 2.85Å
75W92.7Very high89.2Confident88 Ų8849.4 Ų49.433%0.33324%0.237SC..Hα-helixtrans-61.9-45.8175.3-76.9114.5000112.3A71 I72 V77 F78 F79 I119A71-W75 PolarHBondContact O-N 3.32Å; I72-W75 PolarHBondContact O-N 3.05Å; W75-V77 VanDerWaalsContact C-N 3.31Å; W75-V77 PolarHBondContact O-N 3.49Å; W75-F78 HydrophobicContact CE3-CD1 4.19Å; W75-F78 HydrophobicContact CZ3-CD1 4.23Å; W75-F78 PolarHBondContact O-N 2.96Å; W75-F79 HydrophobicContact CB-CD2 4.43Å; W75-F79 HydrophobicContact CB-CE2 4.04Å; W75-F79 HydrophobicContact CE3-CE1 4.45Å; W75-F79 HydrophobicContact CE3-CE2 4.18Å; W75-F79 AromaticContact CE3-CZ 3.88Å; W75-F79 HydrophobicContact CE3-CZ 3.88Å; W75-F79 HydrophobicContact CZ3-CZ 4.45Å; W75-F79 WeakPolarHBondContact O-CD2 3.37Å; W75-F79 WeakPolarHBondContact O-CG 3.4Å; W75-F79 PolarHBondContact O-N 3.41Å; W75-I119 HydrophobicContact CB-CG2 4.2Å; W75-I119 HydrophobicContact CD2-CD1 4.4Å; W75-I119 HydrophobicContact CD2-CG1 4.42Å; W75-I119 HydrophobicContact CD2-CG2 4.31Å; W75-I119 HydrophobicContact CE3-CG1 4.39Å; W75-I119 HydrophobicContact CG-CG2 3.99Å; W75-I119 HydrophobicContact CH2-CD1 4.38Å; W75-I119 HydrophobicContact CZ2-CD1 4.14Å
76I93.1Very high89.8Confident8 Ų843.5 Ų43.54%0.04121%0.212CC..Hα-helixtrans-59.8-43.9177.2-63.6168.6000110.6I43 V47 I72 L73 F79 C80 F252I43-I76 HydrophobicContact CG2-CG2 3.85Å; V47-I76 HydrophobicContact CG2-CB 4.48Å; V47-I76 HydrophobicContact CG2-CG2 3.76Å; I72-I76 HydrophobicContact CG2-CD1 3.97Å; I72-I76 WeakPolarHBondContact O-CG1 3.29Å; I72-I76 PolarHBondContact O-N 3.36Å; L73-I76 PolarHBondContact O-N 3.3Å; I76-F79 PolarHBondContact O-N 3.37Å; I76-C80 PolarHBondContact O-N 3.14Å; I76-C80 PolarHBondContact O-SG 3.02Å; I76-F252 HydrophobicContact CD1-CE2 3.93Å; I76-F252 HydrophobicContact CG1-CD2 4.38Å; I76-F252 HydrophobicContact CG1-CE2 3.59Å; I76-F252 HydrophobicContact CG1-CZ 3.84Å
77V94.7Very high90.4Very high32 Ų3242.6 Ų42.619%0.19421%0.208CC..Hα-helixtrans-60.9-47.1176.41670000111.4F44 V47 L73 I74 W75 F79 C80 I81F44-V77 HydrophobicContact CD2-CG1 4.26Å; F44-V77 HydrophobicContact CE2-CG1 3.9Å; V47-V77 HydrophobicContact CB-CG2 4.46Å; V47-V77 HydrophobicContact CG1-CG2 3.61Å; L73-V77 VanDerWaalsContact O-CG2 3.3Å; L73-V77 WeakPolarHBondContact O-CG2 3.37Å; L73-V77 PolarHBondContact O-N 3.44Å; I74-V77 PolarHBondContact O-N 3.4Å; W75-V77 VanDerWaalsContact C-N 3.31Å; W75-V77 PolarHBondContact O-N 3.49Å; V77-F79 VanDerWaalsContact C-N 3.34Å; V77-F79 PolarHBondContact O-N 3.49Å; V77-C80 PolarHBondContact O-N 2.9Å; V77-I81 HydrophobicContact CG1-CD1 3.78Å; V77-I81 HydrophobicContact CG1-CG1 4.47Å; V77-I81 WeakPolarHBondContact O-CG1 3.44Å; V77-I81 PolarHBondContact O-N 3.32Å
78F95.5Very high91.1Very high96 Ų9646.9 Ų46.942%0.42123%0.23SC..Hα-helixtrans-58.2-45.4177.9172.9-97000112I74 W75 I81 T82I74-F78 WeakPolarHBondContact O-CB 3.48Å; I74-F78 PolarHBondContact O-N 2.85Å; W75-F78 HydrophobicContact CE3-CD1 4.19Å; W75-F78 HydrophobicContact CZ3-CD1 4.23Å; W75-F78 PolarHBondContact O-N 2.96Å; F78-I81 PolarHBondContact O-N 2.89Å; F78-T82 WeakPolarHBondContact O-CB 3.44Å; F78-T82 PolarHBondContact O-N 3Å; F78-T82 PolarHBondContact O-OG1 3.42Å
79F96.8Very high92.2Very high0 Ų046.2 Ų46.20%023%0.226CC..Hα-helixtrans-64.6-43.4177.1-65.8-44.6000111.9W75 I76 V77 I81 T82 S83 L112 L115 E116 I119 F252 L255W75-F79 HydrophobicContact CB-CD2 4.43Å; W75-F79 HydrophobicContact CB-CE2 4.04Å; W75-F79 HydrophobicContact CE3-CE1 4.45Å; W75-F79 HydrophobicContact CE3-CE2 4.18Å; W75-F79 AromaticContact CE3-CZ 3.88Å; W75-F79 HydrophobicContact CE3-CZ 3.88Å; W75-F79 HydrophobicContact CZ3-CZ 4.45Å; W75-F79 WeakPolarHBondContact O-CD2 3.37Å; W75-F79 WeakPolarHBondContact O-CG 3.4Å; W75-F79 PolarHBondContact O-N 3.41Å; I76-F79 PolarHBondContact O-N 3.37Å; V77-F79 VanDerWaalsContact C-N 3.34Å; V77-F79 PolarHBondContact O-N 3.49Å; F79-I81 PolarHBondContact O-N 2.74Å; F79-T82 PolarHBondContact O-N 3.44Å; F79-S83 WeakPolarHBondContact O-CB 3.49Å; F79-S83 PolarHBondContact O-N 2.91Å; F79-S83 PolarHBondContact O-OG 3.43Å; F79-L112 HydrophobicContact CD1-CD1 3.71Å; F79-L112 HydrophobicContact CE1-CD1 4.14Å; F79-L115 HydrophobicContact CE1-CD2 3.9Å; F79-L115 HydrophobicContact CE1-CG 3.94Å; F79-L115 HydrophobicContact CZ-CG 4.17Å; F79-E116 HydrophobicContact CB-CG 4.27Å; F79-E116 HydrophobicContact CD1-CG 3.66Å; F79-E116 HydrophobicContact CD2-CG 3.89Å; F79-E116 HydrophobicContact CE1-CG 3.87Å; F79-E116 HydrophobicContact CE2-CG 4.11Å; F79-E116 HydrophobicContact CG-CG 3.68Å; F79-E116 HydrophobicContact CZ-CG 4.08Å; F79-I119 HydrophobicContact CE2-CB 4.15Å; F79-I119 HydrophobicContact CE2-CG1 4.31Å; F79-I119 HydrophobicContact CE2-CG2 4.11Å; F79-I119 HydrophobicContact CZ-CB 4.13Å; F79-I119 HydrophobicContact CZ-CG1 3.85Å; F79-I119 HydrophobicContact CZ-CG2 4.48Å; F79-F252 AromaticContact CD2-CE1 3.91Å; F79-F252 HydrophobicContact CD2-CE1 3.91Å; F79-F252 AromaticContact CE2-CE1 3.73Å; F79-F252 HydrophobicContact CE2-CE1 3.73Å; F79-F252 HydrophobicContact CE2-CZ 4.41Å; F79-L255 HydrophobicContact CB-CD1 4.25Å
80C97.1Very high93.4Very high0 Ų046.1 Ų46.10%023%0.226CC..Hα-helixtrans-60.4-46.3176.8-66.50000112.2I43 F44 I76 V77 T82 S83 I84I43-C80 VanDerWaalsContact CG2-SG 3.59Å; F44-C80 HydrophobicContact CB-CB 3.88Å; F44-C80 HydrophobicContact CD2-CB 4.33Å; I76-C80 PolarHBondContact O-N 3.14Å; I76-C80 PolarHBondContact O-SG 3.02Å; V77-C80 PolarHBondContact O-N 2.9Å; C80-T82 PolarHBondContact O-N 2.94Å; C80-S83 PolarHBondContact O-N 3.29Å; C80-I84 WeakPolarHBondContact O-CD1 3.42Å; C80-I84 WeakPolarHBondContact O-CG1 3.3Å; C80-I84 PolarHBondContact O-N 3.1Å
81I97.8Very high94.9Very high77 Ų7739.9 Ų39.940%0.39520%0.203SC..Hα-helixtrans-61.3-46.9178.6-67.7168.4000110.3F44 V77 F78 F79 S83 I84 L85F44-I81 HydrophobicContact CD2-CG1 4.32Å; F44-I81 HydrophobicContact CE2-CD1 4.2Å; F44-I81 HydrophobicContact CE2-CG1 4.09Å; V77-I81 HydrophobicContact CG1-CD1 3.78Å; V77-I81 HydrophobicContact CG1-CG1 4.47Å; V77-I81 WeakPolarHBondContact O-CG1 3.44Å; V77-I81 PolarHBondContact O-N 3.32Å; F78-I81 PolarHBondContact O-N 2.89Å; F79-I81 PolarHBondContact O-N 2.74Å; I81-S83 PolarHBondContact O-N 3.46Å; I81-I84 PolarHBondContact O-N 3.29Å; I81-L85 HydrophobicContact CG2-CD1 4.11Å; I81-L85 WeakPolarHBondContact O-CG 3.28Å; I81-L85 PolarHBondContact O-N 2.96Å
82T97.7Very high95.6Very high33 Ų3344.3 Ų44.320%0.20222%0.215CC..Hα-helixtrans-63.2-43.9-179.4-53.20000111.3F78 F79 C80 I84 L85 L86 L112F78-T82 WeakPolarHBondContact O-CB 3.44Å; F78-T82 PolarHBondContact O-N 3Å; F78-T82 PolarHBondContact O-OG1 3.42Å; F79-T82 PolarHBondContact O-N 3.44Å; C80-T82 PolarHBondContact O-N 2.94Å; T82-I84 PolarHBondContact O-N 3.18Å; T82-L85 PolarHBondContact O-N 3.17Å; T82-L86 HydrophobicContact CG2-CD1 4.2Å; T82-L86 HydrophobicContact CG2-CG 4.46Å; T82-L86 WeakPolarHBondContact O-CB 3.35Å; T82-L86 WeakPolarHBondContact O-CG 3.42Å; T82-L86 PolarHBondContact O-N 3.26Å; T82-L112 HydrophobicContact CG2-CD1 3.91Å; T82-L112 HydrophobicContact CG2-CD2 3.94Å
83S97.7Very high96.1Very high0 Ų044 Ų440%021%0.214CC..Hα-helixtrans-62.5-39.6176.4-65.50000112.7S40 F79 C80 I81 G87 L112S40-S83 VanDerWaalsContact OG-CB 3.32Å; S40-S83 WeakPolarHBondContact OG-CB 3.29Å; F79-S83 WeakPolarHBondContact O-CB 3.49Å; F79-S83 PolarHBondContact O-N 2.91Å; F79-S83 PolarHBondContact O-OG 3.43Å; C80-S83 PolarHBondContact O-N 3.29Å; I81-S83 PolarHBondContact O-N 3.46Å; S83-G87 PolarHBondContact O-N 3.38Å; S83-L112 WeakPolarHBondContact OG-CD2 3.28Å
84I98Very high96.4Very high33 Ų3343.4 Ų43.417%0.16921%0.21CC..Hα-helixtrans-62.4-49.1174.5-69.5163.6000110.5I37 C80 I81 T82 L86 G87 I88I37-I84 HydrophobicContact CG2-CG2 4.38Å; C80-I84 WeakPolarHBondContact O-CD1 3.42Å; C80-I84 WeakPolarHBondContact O-CG1 3.3Å; C80-I84 PolarHBondContact O-N 3.1Å; I81-I84 PolarHBondContact O-N 3.29Å; T82-I84 PolarHBondContact O-N 3.18Å; I84-L86 PolarHBondContact O-N 2.9Å; I84-G87 PolarHBondContact O-N 2.93Å; I84-I88 HydrophobicContact CG2-CD1 3.92Å; I84-I88 WeakPolarHBondContact O-CG1 3.48Å; I84-I88 PolarHBondContact O-N 3.07Å
85L98.1Very high96.6Very high98 Ų9843.4 Ų43.451%0.51321%0.208SC..Hα-helixtrans-60.7-45.7179.2-69.4173.9000111.5I81 T82 G87 I88 I89I81-L85 HydrophobicContact CG2-CD1 4.11Å; I81-L85 WeakPolarHBondContact O-CG 3.28Å; I81-L85 PolarHBondContact O-N 2.96Å; T82-L85 PolarHBondContact O-N 3.17Å; L85-G87 VanDerWaalsContact C-N 3.34Å; L85-G87 PolarHBondContact O-N 2.98Å; L85-I88 PolarHBondContact O-N 3.22Å; L85-I89 VanDerWaalsContact O-CG1 3.27Å; L85-I89 WeakPolarHBondContact O-CG1 3.35Å; L85-I89 PolarHBondContact O-N 3.26Å
86L97.9Very high96.6Very high19 Ų1947.6 Ų47.610%0.09922%0.224CC..Hα-helixtrans-64.2-37.5177-71.3178.6000112.2T82 I84 I89 G90 Q105 A108 L109 L112T82-L86 HydrophobicContact CG2-CD1 4.2Å; T82-L86 HydrophobicContact CG2-CG 4.46Å; T82-L86 WeakPolarHBondContact O-CB 3.35Å; T82-L86 WeakPolarHBondContact O-CG 3.42Å; T82-L86 PolarHBondContact O-N 3.26Å; I84-L86 PolarHBondContact O-N 2.9Å; L86-I89 PolarHBondContact O-N 3.33Å; L86-G90 PolarHBondContact O-N 3.48Å; L86-Q105 HydrophobicContact CD2-CG 4.42Å; L86-Q105 WeakPolarHBondContact O-CG 3.44Å; L86-Q105 PolarHBondContact O-NE2 3.46Å; L86-A108 HydrophobicContact CD1-CB 4Å; L86-A108 HydrophobicContact CD2-CB 3.66Å; L86-L109 HydrophobicContact CB-CD2 3.96Å; L86-L109 HydrophobicContact CB-CG 4.49Å; L86-L109 HydrophobicContact CD1-CD2 3.81Å; L86-L109 HydrophobicContact CD1-CG 4.2Å; L86-L112 HydrophobicContact CD1-CD2 3.91Å
87G97.7Very high96.4Very high0 Ų052.6 Ų52.60%025%0.245CC..Hα-helixtrans-61.8-44.4173.500000112.3S83 I84 L85 G90 I91S83-G87 PolarHBondContact O-N 3.38Å; I84-G87 PolarHBondContact O-N 2.93Å; L85-G87 VanDerWaalsContact C-N 3.34Å; L85-G87 PolarHBondContact O-N 2.98Å; G87-G90 PolarHBondContact O-N 3.27Å; G87-I91 WeakPolarHBondContact O-CG1 3.47Å; G87-I91 PolarHBondContact O-N 2.93Å
88I98Very high96.4Very high89 Ų8952.3 Ų52.346%0.45625%0.246SC..Hα-helixtrans-63.4-46.4177-66.4166.4000110.7I37 I84 L85 G90 I91 Y92I37-I88 HydrophobicContact CD1-CG1 3.85Å; I37-I88 HydrophobicContact CG1-CG1 4.46Å; I84-I88 HydrophobicContact CG2-CD1 3.92Å; I84-I88 WeakPolarHBondContact O-CG1 3.48Å; I84-I88 PolarHBondContact O-N 3.07Å; L85-I88 PolarHBondContact O-N 3.22Å; I88-G90 VanDerWaalsContact C-N 3.27Å; I88-G90 PolarHBondContact O-N 3.47Å; I88-I91 PolarHBondContact O-N 2.83Å; I88-Y92 WeakPolarHBondContact O-CB 3.43Å; I88-Y92 PolarHBondContact O-N 3.46Å
89I97.7Very high96.2Very high73 Ų7349.6 Ų49.637%0.37424%0.237SC..Hα-helixtrans-58.8-41.4176.1-69.2165.5000110.6L85 L86 Y92 A93 I101 Q105L85-I89 VanDerWaalsContact O-CG1 3.27Å; L85-I89 WeakPolarHBondContact O-CG1 3.35Å; L85-I89 PolarHBondContact O-N 3.26Å; L86-I89 PolarHBondContact O-N 3.33Å; I89-Y92 PolarHBondContact O-N 2.9Å; I89-A93 WeakPolarHBondContact O-CB 3.31Å; I89-A93 PolarHBondContact O-N 3.21Å; I89-I101 HydrophobicContact CG2-CG2 3.86Å; I89-Q105 HydrophobicContact CG2-CB 4.33Å; I89-Q105 HydrophobicContact CG2-CG 4.35Å
90G97.4Very high96Very high0 Ų055.6 Ų55.60%027%0.269CS..Hα-helixtrans-58.5-53.4175.600000112.4L86 G87 I88 Y92 A93 I94 Q105L86-G90 PolarHBondContact O-N 3.48Å; G87-G90 PolarHBondContact O-N 3.27Å; I88-G90 VanDerWaalsContact C-N 3.27Å; I88-G90 PolarHBondContact O-N 3.47Å; G90-Y92 VanDerWaalsContact C-N 3.3Å; G90-Y92 PolarHBondContact O-N 3.1Å; G90-A93 PolarHBondContact O-N 3.03Å; G90-I94 WeakPolarHBondContact O-CD1 3.44Å; G90-I94 WeakPolarHBondContact O-CG1 3.47Å; G90-I94 PolarHBondContact O-N 2.98Å; G90-Q105 VanDerWaalsContact CA-CD 3.42Å; G90-Q105 VanDerWaalsContact CA-NE2 3.31Å
91I97.4Very high96Very high29 Ų2958.7 Ų58.715%0.14929%0.285CS..Hα-helixtrans-57-46.4177.8-65.5171.1000110.7N33 I37 G87 I88 A93 I94 Q95N33-I91 HydrophobicContact CB-CD1 4.27Å; N33-I91 HydrophobicContact CB-CG1 3.69Å; I37-I91 HydrophobicContact CD1-CD1 3.67Å; G87-I91 WeakPolarHBondContact O-CG1 3.47Å; G87-I91 PolarHBondContact O-N 2.93Å; I88-I91 PolarHBondContact O-N 2.83Å; I91-A93 PolarHBondContact O-N 3.33Å; I91-I94 PolarHBondContact O-N 3.4Å; I91-Q95 HydrophobicContact CG2-CG 4.45Å; I91-Q95 WeakPolarHBondContact O-CG 3.26Å; I91-Q95 PolarHBondContact O-N 2.9Å
92Y97.3Very high95.8Very high117 Ų11755.1 Ų55.146%0.45927%0.266SS..Hα-helixtrans-59.3-47.5178.1175.9-97.4000112.1I88 I89 G90 I94 Q95 R96I88-Y92 WeakPolarHBondContact O-CB 3.43Å; I88-Y92 PolarHBondContact O-N 3.46Å; I89-Y92 PolarHBondContact O-N 2.9Å; G90-Y92 VanDerWaalsContact C-N 3.3Å; G90-Y92 PolarHBondContact O-N 3.1Å; Y92-I94 PolarHBondContact O-N 3.33Å; Y92-Q95 PolarHBondContact O-N 2.87Å; Y92-R96 HydrophobicContact CD2-CG 4.45Å; Y92-R96 HydrophobicContact CE1-CG 4.32Å; Y92-R96 HydrophobicContact CE2-CG 4.03Å; Y92-R96 WeakPolarHBondContact O-CG 3.34Å; Y92-R96 PolarHBondContact O-N 3.36Å; Y92-R96 VanDerWaalsContact O-N 3.07Å
93A96.2Very high95.7Very high0 Ų055 Ų550%027%0.272CS..Hα-helixtrans-63-42-179.800000112I89 G90 I91 R96 K97 A98 I101 L102I89-A93 WeakPolarHBondContact O-CB 3.31Å; I89-A93 PolarHBondContact O-N 3.21Å; G90-A93 PolarHBondContact O-N 3.03Å; I91-A93 PolarHBondContact O-N 3.33Å; A93-R96 PolarHBondContact O-N 3.25Å; A93-K97 PolarHBondContact O-N 2.99Å; A93-A98 PolarHBondContact O-N 2.9Å; A93-I101 HydrophobicContact CB-CB 4.09Å; A93-I101 HydrophobicContact CB-CG2 3.9Å; A93-L102 HydrophobicContact CB-CB 3.97Å; A93-L102 HydrophobicContact CB-CD1 4.28Å
94I95.6Very high95.7Very high0 Ų060.2 Ų60.20%030%0.298CS..Hα-helixtrans-65.3-41.2177.7-63.2154.6000111.5K26 S29 I30 G90 I91 Y92 R96 K97 L102 Y269K26-I94 HydrophobicContact CD-CG2 4.42Å; K26-I94 HydrophobicContact CG-CG2 3.6Å; S29-I94 WeakPolarHBondContact OG-CD1 3.45Å; I30-I94 HydrophobicContact CD1-CG2 4.08Å; I30-I94 HydrophobicContact CG1-CB 4.41Å; I30-I94 HydrophobicContact CG1-CD1 4.36Å; I30-I94 HydrophobicContact CG1-CG2 3.82Å; G90-I94 WeakPolarHBondContact O-CD1 3.44Å; G90-I94 WeakPolarHBondContact O-CG1 3.47Å; G90-I94 PolarHBondContact O-N 2.98Å; I91-I94 PolarHBondContact O-N 3.4Å; Y92-I94 PolarHBondContact O-N 3.33Å; I94-R96 VanDerWaalsContact C-N 3.33Å; I94-R96 PolarHBondContact O-N 2.85Å; I94-K97 PolarHBondContact O-N 3.25Å; I94-L102 HydrophobicContact CG1-CD1 4.12Å; I94-L102 HydrophobicContact CG1-CD2 3.99Å; I94-Y269 HydrophobicContact CB-CE1 4.49Å; I94-Y269 HydrophobicContact CG1-CD1 4.47Å; I94-Y269 HydrophobicContact CG1-CE1 4.22Å; I94-Y269 HydrophobicContact CG2-CE1 4.12Å
95Q94Very high95.6Very high119 Ų11958.8 Ų58.856%0.55629%0.291SS*.Hα-helixtrans-65-39.4178.6-75.2179.5-5.500111.9I91 Y92 K97I91-Q95 HydrophobicContact CG2-CG 4.45Å; I91-Q95 WeakPolarHBondContact O-CG 3.26Å; I91-Q95 PolarHBondContact O-N 2.9Å; Y92-Q95 PolarHBondContact O-N 2.87Å; Q95-K97 VanDerWaalsContact C-N 3.33Å
96R93.5Very high95.6Very high177 Ų17755.1 Ų55.167%0.66827%0.272SS*.THydrogen-bonded Turntrans-84.7-0.8179.4-66.4-66.2-172177.80.2114.3Y92 A93 I94 A98Y92-R96 HydrophobicContact CD2-CG 4.45Å; Y92-R96 HydrophobicContact CE1-CG 4.32Å; Y92-R96 HydrophobicContact CE2-CG 4.03Å; Y92-R96 WeakPolarHBondContact O-CG 3.34Å; Y92-R96 PolarHBondContact O-N 3.36Å; Y92-R96 VanDerWaalsContact O-N 3.07Å; A93-R96 PolarHBondContact O-N 3.25Å; I94-R96 VanDerWaalsContact C-N 3.33Å; I94-R96 PolarHBondContact O-N 2.85Å; R96-A98 HydrophobicContact CB-CB 4.31Å; R96-A98 PolarHBondContact O-N 3.41Å
97K89.3Confident95.6Very high113 Ų11361.3 Ų61.349%0.49130%0.298SS..THydrogen-bonded Turntrans50.933.9-170.1-60.1-172.3173.8-161.90112.5A93 I94 Q95 T99 E276A93-K97 PolarHBondContact O-N 2.99Å; I94-K97 PolarHBondContact O-N 3.25Å; Q95-K97 VanDerWaalsContact C-N 3.33Å; K97-T99 PolarHBondContact O-N 3.02Å; K97-T99 VanDerWaalsContact O-N 3.12Å; K97-E276 IonicContact NZ-OE2 3.69Å
98A92.9Very high95.6Very high26 Ų2662.6 Ų62.622%0.21531%0.309CS..  trans-85.383-178.100000110.5A93 R96 L100 I101 L102A93-A98 PolarHBondContact O-N 2.9Å; R96-A98 HydrophobicContact CB-CB 4.31Å; R96-A98 PolarHBondContact O-N 3.41Å; A98-L100 VanDerWaalsContact C-N 3.31Å; A98-L100 PolarHBondContact O-N 3.25Å; A98-I101 HydrophobicContact CB-CB 4.19Å; A98-I101 HydrophobicContact CB-CD1 3.94Å; A98-I101 HydrophobicContact CB-CG1 4.17Å; A98-I101 PolarHBondContact O-N 3.42Å; A98-L102 PolarHBondContact O-N 2.78Å
99T92Very high95.6Very high39 Ų3958.4 Ų58.424%0.23929%0.287CS..Hα-helixtrans-56.8-39.1-175.250.90000113.3K97 L102 G103 A273 E277K97-T99 PolarHBondContact O-N 3.02Å; K97-T99 VanDerWaalsContact O-N 3.12Å; T99-L102 PolarHBondContact O-N 2.91Å; T99-G103 PolarHBondContact O-N 3.26Å; T99-A273 HydrophobicContact CG2-CB 3.76Å; T99-E277 WeakPolarHBondContact CG2-OE1 3.08Å
100L93.7Very high95.6Very high126 Ų12658.2 Ų58.266%0.6629%0.289SS*.Hα-helixtrans-63.3-47.8177.2-176.7150.8000112.7A98 L102 G103 I104A98-L100 VanDerWaalsContact C-N 3.31Å; A98-L100 PolarHBondContact O-N 3.25Å; L100-L102 VanDerWaalsContact C-N 3.27Å; L100-L102 PolarHBondContact O-N 2.7Å; L100-G103 PolarHBondContact O-N 2.84Å; L100-I104 HydrophobicContact CD2-CD1 3.66Å; L100-I104 HydrophobicContact CD2-CG1 4.49Å; L100-I104 WeakPolarHBondContact O-CG1 3.2Å; L100-I104 PolarHBondContact O-N 2.63Å
101I95.5Very high95.6Very high65 Ų6564.1 Ų64.133%0.33332%0.315SS..Hα-helixtrans-63.9-39.8179.2-60.7177.4000109.6I89 A93 A98 I104 Q105I89-I101 HydrophobicContact CG2-CG2 3.86Å; A93-I101 HydrophobicContact CB-CB 4.09Å; A93-I101 HydrophobicContact CB-CG2 3.9Å; A98-I101 HydrophobicContact CB-CB 4.19Å; A98-I101 HydrophobicContact CB-CD1 3.94Å; A98-I101 HydrophobicContact CB-CG1 4.17Å; A98-I101 PolarHBondContact O-N 3.42Å; I101-I104 PolarHBondContact O-N 3.42Å; I101-Q105 WeakPolarHBondContact O-CB 3.18Å; I101-Q105 PolarHBondContact O-N 3.39Å
102L95.2Very high95.6Very high2 Ų263 Ų631%0.0131%0.31CS..Hα-helixtrans-65.3-38.8177.1-16957000112A93 I94 A98 T99 L100 Q105 I106 N266 Y269 V270A93-L102 HydrophobicContact CB-CB 3.97Å; A93-L102 HydrophobicContact CB-CD1 4.28Å; I94-L102 HydrophobicContact CG1-CD1 4.12Å; I94-L102 HydrophobicContact CG1-CD2 3.99Å; A98-L102 PolarHBondContact O-N 2.78Å; T99-L102 PolarHBondContact O-N 2.91Å; L100-L102 VanDerWaalsContact C-N 3.27Å; L100-L102 PolarHBondContact O-N 2.7Å; L102-Q105 WeakPolarHBondContact O-CB 3.31Å; L102-Q105 PolarHBondContact O-N 3.11Å; L102-I106 HydrophobicContact CG-CD1 4.46Å; L102-I106 VanDerWaalsContact O-CG1 3.29Å; L102-I106 WeakPolarHBondContact O-CG1 3.37Å; L102-I106 PolarHBondContact O-N 3.49Å; L102-N266 HydrophobicContact CD1-CB 4.48Å; L102-Y269 HydrophobicContact CD2-CD1 3.4Å; L102-Y269 HydrophobicContact CD2-CE1 3.71Å; L102-V270 HydrophobicContact CB-CG2 3.99Å; L102-V270 HydrophobicContact CD2-CG2 3.42Å; L102-V270 VanDerWaalsContact CD2-CG2 3.42Å; L102-V270 HydrophobicContact CG-CG2 3.5Å; L102-V270 VanDerWaalsContact CG-CG2 3.5Å
103G95.5Very high95.6Very high31 Ų3157.9 Ų57.932%0.3229%0.292SS..Hα-helixtrans-61-43.4173.100000113.1T99 L100 Q105 I106 F107T99-G103 PolarHBondContact O-N 3.26Å; L100-G103 PolarHBondContact O-N 2.84Å; G103-Q105 VanDerWaalsContact C-N 3.34Å; G103-I106 PolarHBondContact O-N 3.04Å; G103-F107 PolarHBondContact O-N 2.95Å; G103-F107 VanDerWaalsContact O-N 3.07Å
104I96.4Very high95.7Very high108 Ų10862.8 Ų62.855%0.55432%0.321SS*.Hα-helixtrans-63.5-41.3174.4-64.9170.9000110.8L100 I101 F107 A108L100-I104 HydrophobicContact CD2-CD1 3.66Å; L100-I104 HydrophobicContact CD2-CG1 4.49Å; L100-I104 WeakPolarHBondContact O-CG1 3.2Å; L100-I104 PolarHBondContact O-N 2.63Å; I101-I104 PolarHBondContact O-N 3.42Å; I104-F107 PolarHBondContact O-N 3.28Å; I104-A108 WeakPolarHBondContact O-CB 3.42Å; I104-A108 PolarHBondContact O-N 3.39Å
105Q97.2Very high95.7Very high3 Ų365.6 Ų65.61%0.01434%0.336CS..Hα-helixtrans-61.6-44.2177.1-173-123.93.500111.9N33 L86 I89 G90 I101 L102 G103 A108 L109 N266N33-Q105 PolarHBondContact OD1-NE2 2.96Å; L86-Q105 HydrophobicContact CD2-CG 4.42Å; L86-Q105 WeakPolarHBondContact O-CG 3.44Å; L86-Q105 PolarHBondContact O-NE2 3.46Å; I89-Q105 HydrophobicContact CG2-CB 4.33Å; I89-Q105 HydrophobicContact CG2-CG 4.35Å; G90-Q105 VanDerWaalsContact CA-CD 3.42Å; G90-Q105 VanDerWaalsContact CA-NE2 3.31Å; I101-Q105 WeakPolarHBondContact O-CB 3.18Å; I101-Q105 PolarHBondContact O-N 3.39Å; L102-Q105 WeakPolarHBondContact O-CB 3.31Å; L102-Q105 PolarHBondContact O-N 3.11Å; G103-Q105 VanDerWaalsContact C-N 3.34Å; Q105-A108 PolarHBondContact O-N 3.35Å; Q105-L109 HydrophobicContact CG-CD1 4.48Å; Q105-L109 WeakPolarHBondContact O-CG 3.37Å; Q105-L109 PolarHBondContact O-N 3.37Å; Q105-N266 PolarHBondContact OE1-ND2 3.1Å; Q105-N266 VanDerWaalsContact OE1-ND2 3.1Å
106I97Very high95.8Very high21 Ų2159.9 Ų59.911%0.10831%0.309CS..Hα-helixtrans-58.1-49.2175-71.9166.5000110.5L102 G103 A108 L109 V110 T263 N266 C267 V270L102-I106 HydrophobicContact CG-CD1 4.46Å; L102-I106 VanDerWaalsContact O-CG1 3.29Å; L102-I106 WeakPolarHBondContact O-CG1 3.37Å; L102-I106 PolarHBondContact O-N 3.49Å; G103-I106 PolarHBondContact O-N 3.04Å; I106-A108 VanDerWaalsContact C-N 3.31Å; I106-A108 PolarHBondContact O-N 2.89Å; I106-L109 PolarHBondContact O-N 3.06Å; I106-V110 WeakPolarHBondContact O-CG2 3.21Å; I106-V110 PolarHBondContact O-N 2.89Å; I106-T263 HydrophobicContact CG2-CG2 3.78Å; I106-N266 HydrophobicContact CD1-CB 3.88Å; I106-N266 HydrophobicContact CG1-CB 3.73Å; I106-C267 WeakPolarHBondContact CG2-SG 3.34Å; I106-V270 HydrophobicContact CD1-CB 4.29Å; I106-V270 HydrophobicContact CD1-CG2 3.61Å
107F97.3Very high96Very high150 Ų15052.9 Ų52.966%0.65829%0.292SS*.Hα-helixtrans-59.1-43.8177.3178-96.5000111.7G103 I104 L109 V110 F111G103-F107 PolarHBondContact O-N 2.95Å; G103-F107 VanDerWaalsContact O-N 3.07Å; I104-F107 PolarHBondContact O-N 3.28Å; F107-L109 PolarHBondContact O-N 3.5Å; F107-V110 PolarHBondContact O-N 3.27Å; F107-F111 WeakPolarHBondContact O-CB 3.32Å; F107-F111 PolarHBondContact O-N 3.49Å
108A98Very high96.3Very high27 Ų2749.2 Ų49.222%0.22329%0.286CS..Hα-helixtrans-63.8-39.417800000112.7L86 I104 Q105 I106 F111 L112L86-A108 HydrophobicContact CD1-CB 4Å; L86-A108 HydrophobicContact CD2-CB 3.66Å; I104-A108 WeakPolarHBondContact O-CB 3.42Å; I104-A108 PolarHBondContact O-N 3.39Å; Q105-A108 PolarHBondContact O-N 3.35Å; I106-A108 VanDerWaalsContact C-N 3.31Å; I106-A108 PolarHBondContact O-N 2.89Å; A108-F111 PolarHBondContact O-N 3.48Å; A108-L112 VanDerWaalsContact O-CB 3.26Å; A108-L112 WeakPolarHBondContact O-CB 3.4Å; A108-L112 PolarHBondContact O-N 3.23Å
109L97.9Very high96.4Very high0 Ų049.3 Ų49.30%028%0.283CS..Hα-helixtrans-65.4-41.6175.9-74.1171.7000112.2L36 L86 Q105 I106 F107 L112 A113 A262 T263L36-L109 HydrophobicContact CD2-CD2 3.94Å; L86-L109 HydrophobicContact CB-CD2 3.96Å; L86-L109 HydrophobicContact CB-CG 4.49Å; L86-L109 HydrophobicContact CD1-CD2 3.81Å; L86-L109 HydrophobicContact CD1-CG 4.2Å; Q105-L109 HydrophobicContact CG-CD1 4.48Å; Q105-L109 WeakPolarHBondContact O-CG 3.37Å; Q105-L109 PolarHBondContact O-N 3.37Å; I106-L109 PolarHBondContact O-N 3.06Å; F107-L109 PolarHBondContact O-N 3.5Å; L109-L112 PolarHBondContact O-N 2.96Å; L109-A113 WeakPolarHBondContact O-CB 3.49Å; L109-A113 PolarHBondContact O-N 3.49Å; L109-A262 HydrophobicContact CD1-CB 4.38Å; L109-T263 WeakPolarHBondContact CB-OG1 3.24Å
110V97.6Very high96.5Very high69 Ų6948.4 Ų48.442%0.41828%0.276SS..Hα-helixtrans-62.7-47.7174.81750000110.5I106 F107 L112 A113 V114 T263I106-V110 WeakPolarHBondContact O-CG2 3.21Å; I106-V110 PolarHBondContact O-N 2.89Å; F107-V110 PolarHBondContact O-N 3.27Å; V110-L112 VanDerWaalsContact C-N 3.29Å; V110-L112 PolarHBondContact O-N 2.82Å; V110-A113 PolarHBondContact O-N 2.84Å; V110-V114 WeakPolarHBondContact O-CG2 3.2Å; V110-V114 PolarHBondContact O-N 3.44Å; V110-T263 HydrophobicContact CG2-CG2 3.38Å
111F98Very high96.5Very high124 Ų12450 Ų5054%0.54428%0.275SS..Hα-helixtrans-59.2-43.2177.3179.7-100.8000111.4F107 A108 V114 L115F107-F111 WeakPolarHBondContact O-CB 3.32Å; F107-F111 PolarHBondContact O-N 3.49Å; A108-F111 PolarHBondContact O-N 3.48Å; F111-V114 PolarHBondContact O-N 3.25Å; F111-L115 HydrophobicContact CE1-CD2 4.37Å; F111-L115 WeakPolarHBondContact O-CB 3.38Å; F111-L115 PolarHBondContact O-N 3.41Å
112L97.9Very high96.4Very high7 Ų750.1 Ų50.14%0.03728%0.278CS..Hα-helixtrans-61.2-46176.6-169.363.9000111.6F79 T82 S83 L86 A108 L109 V110 V114 L115 E116F79-L112 HydrophobicContact CD1-CD1 3.71Å; F79-L112 HydrophobicContact CE1-CD1 4.14Å; T82-L112 HydrophobicContact CG2-CD1 3.91Å; T82-L112 HydrophobicContact CG2-CD2 3.94Å; S83-L112 WeakPolarHBondContact OG-CD2 3.28Å; L86-L112 HydrophobicContact CD1-CD2 3.91Å; A108-L112 VanDerWaalsContact O-CB 3.26Å; A108-L112 WeakPolarHBondContact O-CB 3.4Å; A108-L112 PolarHBondContact O-N 3.23Å; L109-L112 PolarHBondContact O-N 2.96Å; V110-L112 VanDerWaalsContact C-N 3.29Å; V110-L112 PolarHBondContact O-N 2.82Å; L112-V114 VanDerWaalsContact C-N 3.35Å; L112-V114 PolarHBondContact O-N 3.32Å; L112-L115 PolarHBondContact O-N 3.3Å; L112-E116 WeakPolarHBondContact O-CB 3.22Å; L112-E116 VanDerWaalsContact O-CG 3.28Å; L112-E116 WeakPolarHBondContact O-CG 3.32Å; L112-E116 PolarHBondContact O-N 3.02Å
113A97.3Very high96.2Very high9 Ų950.3 Ų50.37%0.07428%0.279CS..Hα-helixtrans-62.5-39.5177.900000112.6L109 V110 G117 N259 I260L109-A113 WeakPolarHBondContact O-CB 3.49Å; L109-A113 PolarHBondContact O-N 3.49Å; V110-A113 PolarHBondContact O-N 2.84Å; A113-G117 PolarHBondContact O-N 3.34Å; A113-N259 HydrophobicContact CB-CB 4.11Å; A113-I260 HydrophobicContact CB-CG1 3.97Å
114V97.8Very high96Very high103 Ų10350.7 Ų50.762%0.62427%0.274SS*.Hα-helixtrans-65.7-42.7174.7172.80000110.8V110 F111 L112 G117 G118V110-V114 WeakPolarHBondContact O-CG2 3.2Å; V110-V114 PolarHBondContact O-N 3.44Å; F111-V114 PolarHBondContact O-N 3.25Å; L112-V114 VanDerWaalsContact C-N 3.35Å; L112-V114 PolarHBondContact O-N 3.32Å; V114-G117 PolarHBondContact O-N 3.47Å; V114-G118 PolarHBondContact O-N 3.47Å
115L96.6Very high95.8Very high58 Ų5847.8 Ų47.830%0.30426%0.263SS..Hα-helixtrans-64.2-45.2177.7-176.363.3000111.6F79 F111 L112 G117 G118 I119F79-L115 HydrophobicContact CE1-CD2 3.9Å; F79-L115 HydrophobicContact CE1-CG 3.94Å; F79-L115 HydrophobicContact CZ-CG 4.17Å; F111-L115 HydrophobicContact CE1-CD2 4.37Å; F111-L115 WeakPolarHBondContact O-CB 3.38Å; F111-L115 PolarHBondContact O-N 3.41Å; L112-L115 PolarHBondContact O-N 3.3Å; L115-G117 VanDerWaalsContact C-N 3.32Å; L115-G117 PolarHBondContact O-N 2.66Å; L115-G118 PolarHBondContact O-N 2.96Å; L115-I119 HydrophobicContact CD1-CG1 4.49Å; L115-I119 WeakPolarHBondContact O-CG1 3.39Å; L115-I119 PolarHBondContact O-N 3.33Å
116E96.6Very high95.5Very high0 Ų049.3 Ų49.30%027%0.271CS..Hα-helixtrans-56.5-45.7173.6-75.7171.2168.600111.1F79 L112 I119 L120 I256 N259F79-E116 HydrophobicContact CB-CG 4.27Å; F79-E116 HydrophobicContact CD1-CG 3.66Å; F79-E116 HydrophobicContact CD2-CG 3.89Å; F79-E116 HydrophobicContact CE1-CG 3.87Å; F79-E116 HydrophobicContact CE2-CG 4.11Å; F79-E116 HydrophobicContact CG-CG 3.68Å; F79-E116 HydrophobicContact CZ-CG 4.08Å; L112-E116 WeakPolarHBondContact O-CB 3.22Å; L112-E116 VanDerWaalsContact O-CG 3.28Å; L112-E116 WeakPolarHBondContact O-CG 3.32Å; L112-E116 PolarHBondContact O-N 3.02Å; E116-I119 PolarHBondContact O-N 3.49Å; E116-L120 VanDerWaalsContact O-CB 3.29Å; E116-L120 WeakPolarHBondContact O-CB 3.49Å; E116-L120 PolarHBondContact O-N 3.23Å; E116-I256 HydrophobicContact CB-CD1 3.99Å; E116-I256 HydrophobicContact CB-CG1 3.56Å; E116-I256 HydrophobicContact CG-CG1 4.47Å; E116-I256 WeakPolarHBondContact OE2-CA 3.32Å; E116-I256 VanDerWaalsContact OE2-CG1 3.32Å; E116-I256 WeakPolarHBondContact OE2-CG1 3.37Å; E116-I256 PolarHBondContact OE2-N 3.48Å; E116-N259 PolarHBondContact OE1-ND2 2.87Å; E116-N259 PolarHBondContact OE2-ND2 3.37Å
117G96.7Very high95.2Very high30 Ų3048.5 Ų48.531%0.30927%0.266SS..Hα-helixtrans-62.2-42.717600000113.3A113 V114 L115 L120 Y121A113-G117 PolarHBondContact O-N 3.34Å; V114-G117 PolarHBondContact O-N 3.47Å; L115-G117 VanDerWaalsContact C-N 3.32Å; L115-G117 PolarHBondContact O-N 2.66Å; G117-L120 PolarHBondContact O-N 2.97Å; G117-Y121 WeakPolarHBondContact O-CB 3.03Å; G117-Y121 PolarHBondContact O-N 2.86Å
118G96Very high94.8Very high36 Ų3647.1 Ų47.137%0.37127%0.265SS..Hα-helixtrans-65.3-41.917700000113.3V114 L115 Y121 T122V114-G118 PolarHBondContact O-N 3.47Å; L115-G118 PolarHBondContact O-N 2.96Å; G118-Y121 PolarHBondContact O-N 3.21Å; G118-T122 PolarHBondContact O-N 3.31Å; G118-T122 PolarHBondContact O-OG1 3.19Å
119I94.1Very high94.5Very high28 Ų2855 Ų5514%0.14429%0.289CS..Hα-helixtrans-67.6-43.9175.5-67.1-57.5000110.9W75 F79 L115 E116 Y121 T122 I123 F252W75-I119 HydrophobicContact CB-CG2 4.2Å; W75-I119 HydrophobicContact CD2-CD1 4.4Å; W75-I119 HydrophobicContact CD2-CG1 4.42Å; W75-I119 HydrophobicContact CD2-CG2 4.31Å; W75-I119 HydrophobicContact CE3-CG1 4.39Å; W75-I119 HydrophobicContact CG-CG2 3.99Å; W75-I119 HydrophobicContact CH2-CD1 4.38Å; W75-I119 HydrophobicContact CZ2-CD1 4.14Å; F79-I119 HydrophobicContact CE2-CB 4.15Å; F79-I119 HydrophobicContact CE2-CG1 4.31Å; F79-I119 HydrophobicContact CE2-CG2 4.11Å; F79-I119 HydrophobicContact CZ-CB 4.13Å; F79-I119 HydrophobicContact CZ-CG1 3.85Å; F79-I119 HydrophobicContact CZ-CG2 4.48Å; L115-I119 HydrophobicContact CD1-CG1 4.49Å; L115-I119 WeakPolarHBondContact O-CG1 3.39Å; L115-I119 PolarHBondContact O-N 3.33Å; E116-I119 PolarHBondContact O-N 3.49Å; I119-Y121 VanDerWaalsContact C-N 3.34Å; I119-Y121 PolarHBondContact O-N 3.44Å; I119-T122 PolarHBondContact O-N 3.44Å; I119-I123 HydrophobicContact CG2-CD1 3.64Å; I119-I123 HydrophobicContact CG2-CG1 4.3Å; I119-I123 WeakPolarHBondContact O-CG1 3.42Å; I119-I123 PolarHBondContact O-N 2.99Å; I119-F252 HydrophobicContact CG2-CE1 4.17Å; I119-F252 HydrophobicContact CG2-CZ 4.26Å
120L94.4Very high94.2Very high19 Ų1957.7 Ų57.710%0.09930%0.301CS..Hα-helixtrans-56.1-48.8174.3176.662.4000111E116 G117 T122 I123 L124 I249 F252 I256E116-L120 VanDerWaalsContact O-CB 3.29Å; E116-L120 WeakPolarHBondContact O-CB 3.49Å; E116-L120 PolarHBondContact O-N 3.23Å; G117-L120 PolarHBondContact O-N 2.97Å; L120-T122 VanDerWaalsContact C-N 3.31Å; L120-T122 PolarHBondContact O-N 2.9Å; L120-I123 PolarHBondContact O-N 3.42Å; L120-L124 HydrophobicContact CD1-CD1 3.88Å; L120-L124 HydrophobicContact CD1-CD2 4.47Å; L120-L124 HydrophobicContact CD1-CG 3.94Å; L120-L124 HydrophobicContact CG-CD1 3.91Å; L120-L124 HydrophobicContact CG-CG 4.33Å; L120-L124 WeakPolarHBondContact O-CB 3.42Å; L120-L124 VanDerWaalsContact O-CG 3.25Å; L120-L124 WeakPolarHBondContact O-CG 3.32Å; L120-L124 PolarHBondContact O-N 3.01Å; L120-I249 HydrophobicContact CD1-CG1 4.44Å; L120-F252 HydrophobicContact CB-CB 4.37Å; L120-F252 HydrophobicContact CB-CD1 3.98Å; L120-F252 HydrophobicContact CB-CE1 4.48Å; L120-F252 HydrophobicContact CB-CG 4.19Å; L120-F252 HydrophobicContact CD1-CB 3.92Å; L120-F252 HydrophobicContact CD1-CD2 4.04Å; L120-F252 HydrophobicContact CD1-CG 3.93Å; L120-F252 HydrophobicContact CD2-CB 3.93Å; L120-F252 HydrophobicContact CG-CB 4.29Å; L120-F252 HydrophobicContact CG-CG 4.46Å; L120-I256 HydrophobicContact CD2-CD1 4.44Å
121Y94.6Very high93.9Very high161 Ų16154.4 Ų54.463%0.63128%0.281SS*.Hα-helixtrans-57.5-43.6177.2173.9-97.4000112.4G117 G118 I119 L124 S125G117-Y121 WeakPolarHBondContact O-CB 3.03Å; G117-Y121 PolarHBondContact O-N 2.86Å; G118-Y121 PolarHBondContact O-N 3.21Å; I119-Y121 VanDerWaalsContact C-N 3.34Å; I119-Y121 PolarHBondContact O-N 3.44Å; Y121-L124 PolarHBondContact O-N 3.2Å; Y121-S125 VanDerWaalsContact O-CB 3.3Å; Y121-S125 WeakPolarHBondContact O-CB 3.42Å; Y121-S125 PolarHBondContact O-N 2.87Å; Y121-S125 PolarHBondContact O-OG 3.01Å
122T92.5Very high93.7Very high66 Ų6652.3 Ų52.341%0.40527%0.273SS..Hα-helixtrans-63.5-48.3179.2-580000111.2G118 I119 L120 L124 S125 Q126G118-T122 PolarHBondContact O-N 3.31Å; G118-T122 PolarHBondContact O-OG1 3.19Å; I119-T122 PolarHBondContact O-N 3.44Å; L120-T122 VanDerWaalsContact C-N 3.31Å; L120-T122 PolarHBondContact O-N 2.9Å; T122-L124 PolarHBondContact O-N 2.87Å; T122-S125 PolarHBondContact O-N 2.71Å; T122-Q126 WeakPolarHBondContact O-CG 3.45Å; T122-Q126 PolarHBondContact O-N 3.19Å
123I90.9Very high93.5Very high6 Ų656.7 Ų56.73%0.03130%0.3CS..Hα-helixtrans-59.3-48.9177.6-68.6165.9000110.1I72 I119 L120 S125 Q126 W127 F252I72-I123 HydrophobicContact CB-CD1 4.44Å; I72-I123 HydrophobicContact CD1-CG2 3.72Å; I72-I123 HydrophobicContact CG1-CD1 4Å; I72-I123 HydrophobicContact CG1-CG1 4.16Å; I72-I123 HydrophobicContact CG1-CG2 4Å; I72-I123 HydrophobicContact CG2-CD1 4.25Å; I119-I123 HydrophobicContact CG2-CD1 3.64Å; I119-I123 HydrophobicContact CG2-CG1 4.3Å; I119-I123 WeakPolarHBondContact O-CG1 3.42Å; I119-I123 PolarHBondContact O-N 2.99Å; L120-I123 PolarHBondContact O-N 3.42Å; I123-S125 PolarHBondContact O-N 3.46Å; I123-Q126 PolarHBondContact O-N 3.38Å; I123-W127 WeakPolarHBondContact O-CB 3.32Å; I123-W127 PolarHBondContact O-N 3.34Å; I123-F252 HydrophobicContact CD1-CE2 4.19Å; I123-F252 HydrophobicContact CD1-CZ 3.84Å
124L92Very high93.3Very high40 Ų4056.9 Ų56.921%0.20930%0.303CS..Hα-helixtrans-62.2-42.9-179.9-69.9179.4000112.3L120 Y121 T122 W127 L128 L245 I249L120-L124 HydrophobicContact CD1-CD1 3.88Å; L120-L124 HydrophobicContact CD1-CD2 4.47Å; L120-L124 HydrophobicContact CD1-CG 3.94Å; L120-L124 HydrophobicContact CG-CD1 3.91Å; L120-L124 HydrophobicContact CG-CG 4.33Å; L120-L124 WeakPolarHBondContact O-CB 3.42Å; L120-L124 VanDerWaalsContact O-CG 3.25Å; L120-L124 WeakPolarHBondContact O-CG 3.32Å; L120-L124 PolarHBondContact O-N 3.01Å; Y121-L124 PolarHBondContact O-N 3.2Å; T122-L124 PolarHBondContact O-N 2.87Å; L124-W127 PolarHBondContact O-N 2.87Å; L124-L128 WeakPolarHBondContact O-CB 3.3Å; L124-L128 VanDerWaalsContact O-CG 3.27Å; L124-L128 WeakPolarHBondContact O-CG 3.28Å; L124-L128 PolarHBondContact O-N 2.75Å; L124-L245 HydrophobicContact CD2-CD1 3.58Å; L124-L245 HydrophobicContact CD2-CG 4.33Å; L124-I249 HydrophobicContact CD1-CD1 4.45Å; L124-I249 HydrophobicContact CD1-CG1 4.36Å; L124-I249 HydrophobicContact CD2-CD1 3.75Å; L124-I249 HydrophobicContact CD2-CG1 3.72Å
125S91.9Very high93.1Very high47 Ų4752 Ų5233%0.32927%0.273SS..Hα-helixtrans-63.3-43.7178.9-61.20000111.5Y121 T122 I123 R129Y121-S125 VanDerWaalsContact O-CB 3.3Å; Y121-S125 WeakPolarHBondContact O-CB 3.42Å; Y121-S125 PolarHBondContact O-N 2.87Å; Y121-S125 PolarHBondContact O-OG 3.01Å; T122-S125 PolarHBondContact O-N 2.71Å; I123-S125 PolarHBondContact O-N 3.46Å; S125-R129 VanDerWaalsContact O-CB 3.29Å; S125-R129 WeakPolarHBondContact O-CB 3.49Å; S125-R129 PolarHBondContact O-N 3.35Å
126Q90.4Very high93Very high35 Ų3551.2 Ų51.216%0.16427%0.271CS..Hα-helixtrans-65.6-44.2175.2-72-178.7-40.300111.7I68 T122 I123 R129 H130I68-Q126 PolarHBondContact O-NE2 3.15Å; T122-Q126 WeakPolarHBondContact O-CG 3.45Å; T122-Q126 PolarHBondContact O-N 3.19Å; I123-Q126 PolarHBondContact O-N 3.38Å; Q126-R129 PolarHBondContact O-N 2.88Å; Q126-H130 WeakPolarHBondContact O-CB 3.3Å; Q126-H130 PolarHBondContact O-CD2 3.37Å; Q126-H130 PolarHBondContact O-N 2.91Å
127W90.5Very high92.8Very high4 Ų456.7 Ų56.72%0.01530%0.295CS..Hα-helixtrans-59.9-52.2179.4-165.7-85.6000111.3L63 T67 I72 I123 L124 R129 H130 L131 L240 F244 L245L63-W127 HydrophobicContact CD1-CH2 4.2Å; L63-W127 HydrophobicContact CD2-CH2 4.29Å; T67-W127 HydrophobicContact CG2-CD2 4.19Å; T67-W127 HydrophobicContact CG2-CE3 3.75Å; T67-W127 HydrophobicContact CG2-CZ3 3.99Å; I72-W127 HydrophobicContact CD1-CE3 4.31Å; I72-W127 HydrophobicContact CD1-CZ3 4.13Å; I123-W127 WeakPolarHBondContact O-CB 3.32Å; I123-W127 PolarHBondContact O-N 3.34Å; L124-W127 PolarHBondContact O-N 2.87Å; W127-R129 VanDerWaalsContact C-N 3.26Å; W127-R129 PolarHBondContact O-N 2.92Å; W127-H130 PolarHBondContact O-N 2.92Å; W127-L131 HydrophobicContact CD2-CD1 4.36Å; W127-L131 HydrophobicContact CH2-CD1 4.43Å; W127-L131 HydrophobicContact CZ2-CD1 3.81Å; W127-L131 WeakPolarHBondContact O-CB 3.47Å; W127-L131 PolarHBondContact O-N 2.99Å; W127-L240 HydrophobicContact CH2-CD2 4.05Å; W127-L240 HydrophobicContact CZ2-CB 4.13Å; W127-L240 HydrophobicContact CZ2-CD2 3.81Å; W127-F244 AromaticContact CH2-CD1 3.49Å; W127-F244 HydrophobicContact CH2-CD1 3.49Å; W127-F244 VanDerWaalsContact CH2-CD1 3.49Å; W127-F244 AromaticContact CH2-CE1 3.33Å; W127-F244 HydrophobicContact CH2-CE1 3.33Å; W127-F244 HydrophobicContact CH2-CZ 4.46Å; W127-F244 AromaticContact CZ2-CD1 3.6Å; W127-F244 HydrophobicContact CZ2-CD1 3.6Å; W127-F244 AromaticContact CZ2-CE1 3.94Å; W127-F244 HydrophobicContact CZ2-CE1 3.94Å; W127-F244 HydrophobicContact CZ3-CD1 4.47Å; W127-F244 AromaticContact CZ3-CE1 3.98Å; W127-F244 HydrophobicContact CZ3-CE1 3.98Å; W127-L245 HydrophobicContact CD2-CD1 4.24Å; W127-L245 HydrophobicContact CG-CD1 4Å
128L89.7Confident92.6Very high120 Ų12055.8 Ų55.863%0.62828%0.284SS*.Hα-helixtrans-62.2-34.2-179.9-69.6173.4000112.5L124L124-L128 WeakPolarHBondContact O-CB 3.3Å; L124-L128 VanDerWaalsContact O-CG 3.27Å; L124-L128 WeakPolarHBondContact O-CG 3.28Å; L124-L128 PolarHBondContact O-N 2.75Å
129R91.2Very high92.5Very high194 Ų19454.1 Ų54.173%0.73227%0.267SS*.Hα-helixtrans-79.3-39.8-179-171.3176.1-176.2178.71113.7S125 Q126 W127S125-R129 VanDerWaalsContact O-CB 3.29Å; S125-R129 WeakPolarHBondContact O-CB 3.49Å; S125-R129 PolarHBondContact O-N 3.35Å; Q126-R129 PolarHBondContact O-N 2.88Å; W127-R129 VanDerWaalsContact C-N 3.26Å; W127-R129 PolarHBondContact O-N 2.92Å
130H92.2Very high92.4Very high55 Ų5557.4 Ų57.426%0.25528%0.282SS..Hα-helixtrans-110.2-17.6-166.4-64.6-64.1000114.7Q126 W127 E132 G134Q126-H130 WeakPolarHBondContact O-CB 3.3Å; Q126-H130 PolarHBondContact O-CD2 3.37Å; Q126-H130 PolarHBondContact O-N 2.91Å; W127-H130 PolarHBondContact O-N 2.92Å; H130-E132 PolarHBondContact O-N 3.35Å; H130-G134 PolarHBondContact O-N 3.41Å
131L91.7Very high92.2Very high1 Ų160.8 Ų60.81%0.00530%0.298CS..Hα-helixtrans-55.9-54.3-175.8-178.976.4000112.3T67 W127 G134 V135 V237 L240 K241T67-L131 HydrophobicContact CG2-CB 4.49Å; T67-L131 HydrophobicContact CG2-CD1 4Å; W127-L131 HydrophobicContact CD2-CD1 4.36Å; W127-L131 HydrophobicContact CH2-CD1 4.43Å; W127-L131 HydrophobicContact CZ2-CD1 3.81Å; W127-L131 WeakPolarHBondContact O-CB 3.47Å; W127-L131 PolarHBondContact O-N 2.99Å; L131-G134 PolarHBondContact O-N 3.35Å; L131-V135 HydrophobicContact CD1-CG2 4.41Å; L131-V135 WeakPolarHBondContact O-CB 3.42Å; L131-V135 VanDerWaalsContact O-CG2 3.23Å; L131-V135 WeakPolarHBondContact O-CG2 3.22Å; L131-V135 PolarHBondContact O-N 2.93Å; L131-V237 HydrophobicContact CD2-CG1 4.38Å; L131-L240 HydrophobicContact CD1-CB 4.03Å; L131-L240 HydrophobicContact CD1-CD1 3.74Å; L131-L240 HydrophobicContact CD1-CG 4.34Å; L131-L240 HydrophobicContact CD2-CB 3.99Å; L131-K241 HydrophobicContact CD2-CD 4.44Å; L131-K241 HydrophobicContact CD2-CG 3.68Å
132E93.4Very high91.9Very high79 Ų7953.4 Ų53.437%0.36927%0.269SS..Hα-helixtrans-67.9-43.9-173.3-175.8161.7-179.300112H130 T136 R164 K241H130-E132 PolarHBondContact O-N 3.35Å; E132-T136 WeakPolarHBondContact O-CB 3.44Å; E132-T136 PolarHBondContact O-N 3.44Å; E132-T136 PolarHBondContact O-OG1 3.26Å; E132-R164 IonicContact OE1-NH1 2.92Å; E132-R164 PolarHBondContact OE1-NH1 2.9Å; E132-K241 IonicContact OE2-NZ 2.78Å; E132-K241 PolarHBondContact OE2-NZ 3.44Å
133V93.3Very high91.5Very high100 Ų10053.7 Ų53.761%0.60627%0.266SS*.Hα-helixtrans-63.3-46.1177.1178.20000110.8T136 F137V133-T136 WeakPolarHBondContact O-CB 3.4Å; V133-T136 PolarHBondContact O-N 3.22Å; V133-F137 WeakPolarHBondContact O-CB 3.36Å; V133-F137 PolarHBondContact O-N 3.37Å
134G92.8Very high90.9Very high12 Ų1253.9 Ų53.912%0.12427%0.268CS..Hα-helixtrans-71.9-33.3-177.400000112.9H130 L131 F137 A138H130-G134 PolarHBondContact O-N 3.41Å; L131-G134 PolarHBondContact O-N 3.35Å; G134-F137 PolarHBondContact O-N 2.87Å; G134-A138 WeakPolarHBondContact O-CB 3.42Å; G134-A138 PolarHBondContact O-N 2.92Å
135V94Very high89.9Confident0 Ų053.6 Ų53.60%027%0.274CS..Hα-helixtrans-66.1-42.7170.7172.30000110.5I66 L131 F137 A138 V139 M152 R164 V237 L240I66-V135 HydrophobicContact CD1-CG2 4.45Å; I66-V135 HydrophobicContact CG2-CG2 4.27Å; L131-V135 HydrophobicContact CD1-CG2 4.41Å; L131-V135 WeakPolarHBondContact O-CB 3.42Å; L131-V135 VanDerWaalsContact O-CG2 3.23Å; L131-V135 WeakPolarHBondContact O-CG2 3.22Å; L131-V135 PolarHBondContact O-N 2.93Å; V135-F137 VanDerWaalsContact C-N 3.31Å; V135-F137 PolarHBondContact O-N 3Å; V135-A138 PolarHBondContact O-N 3.27Å; V135-V139 WeakPolarHBondContact O-CG2 3.34Å; V135-V139 PolarHBondContact O-N 3.39Å; V135-M152 HydrophobicContact CG1-CE 4.18Å; V135-M152 HydrophobicContact CG1-SD 4.28Å; V135-R164 HydrophobicContact CG1-CB 4.03Å; V135-R164 HydrophobicContact CG1-CG 4.11Å; V135-V237 HydrophobicContact CB-CG2 3.97Å; V135-V237 HydrophobicContact CG1-CG2 3.88Å; V135-V237 HydrophobicContact CG2-CG2 4.24Å; V135-L240 HydrophobicContact CG2-CD1 4.07Å
136T94.3Very high89.2Confident42 Ų4254.2 Ų54.226%0.25827%0.273SS..Hα-helixtrans-56.2-48.2174.5-52.70000110.9E132 V133 A138 V139 Q140 R164E132-T136 WeakPolarHBondContact O-CB 3.44Å; E132-T136 PolarHBondContact O-N 3.44Å; E132-T136 PolarHBondContact O-OG1 3.26Å; V133-T136 WeakPolarHBondContact O-CB 3.4Å; V133-T136 PolarHBondContact O-N 3.22Å; T136-A138 VanDerWaalsContact C-N 3.34Å; T136-A138 PolarHBondContact O-N 3.01Å; T136-V139 PolarHBondContact O-N 3.39Å; T136-Q140 WeakPolarHBondContact O-CG 3.16Å; T136-Q140 PolarHBondContact O-N 2.94Å; T136-R164 WeakPolarHBondContact OG1-CD 3.41Å
137F92.4Very high88Confident116 Ų11659.6 Ų59.651%0.50930%0.299SS..Hα-helixtrans-63.1-39.3177.9-175.7-101.3000112.4V133 G134 V135 Q140 M141V133-F137 WeakPolarHBondContact O-CB 3.36Å; V133-F137 PolarHBondContact O-N 3.37Å; G134-F137 PolarHBondContact O-N 2.87Å; V135-F137 VanDerWaalsContact C-N 3.31Å; V135-F137 PolarHBondContact O-N 3Å; F137-Q140 PolarHBondContact O-N 2.81Å; F137-M141 HydrophobicContact CD1-CG 4.21Å; F137-M141 HydrophobicContact CD2-CG 4.19Å; F137-M141 HydrophobicContact CE1-CG 3.79Å; F137-M141 HydrophobicContact CE2-CE 3.53Å; F137-M141 HydrophobicContact CE2-CG 3.78Å; F137-M141 HydrophobicContact CG-CG 4.41Å; F137-M141 HydrophobicContact CZ-CE 3.69Å; F137-M141 HydrophobicContact CZ-CG 3.56Å; F137-M141 HydrophobicContact CZ-SD 4.35Å; F137-M141 WeakPolarHBondContact O-CB 3.45Å; F137-M141 WeakPolarHBondContact O-CG 3.43Å; F137-M141 PolarHBondContact O-N 3.13Å
138A92.3Very high86.9Confident10 Ų1066.5 Ų66.58%0.08334%0.336CS..Hα-helixtrans-65.1-38.1177.300000112.5I66 G134 V135 T136 F142 V151 M152I66-A138 HydrophobicContact CD1-CB 3.62Å; I66-A138 HydrophobicContact CG1-CB 4.29Å; G134-A138 WeakPolarHBondContact O-CB 3.42Å; G134-A138 PolarHBondContact O-N 2.92Å; V135-A138 PolarHBondContact O-N 3.27Å; T136-A138 VanDerWaalsContact C-N 3.34Å; T136-A138 PolarHBondContact O-N 3.01Å; A138-F142 WeakPolarHBondContact O-CB 3.31Å; A138-F142 PolarHBondContact O-N 2.88Å; A138-F142 VanDerWaalsContact O-N 3.12Å; A138-V151 HydrophobicContact CB-CG1 4.46Å; A138-M152 HydrophobicContact CB-CB 4.16Å; A138-M152 HydrophobicContact CB-SD 4.2Å
139V93.6Very high86.3Confident2 Ų263.8 Ų63.81%0.01232%0.319CS..Hα-helixtrans-64.3-47.1173.2171.70000110.8V135 T136 M141 F142 M152 D169 Y170 N174V135-V139 WeakPolarHBondContact O-CG2 3.34Å; V135-V139 PolarHBondContact O-N 3.39Å; T136-V139 PolarHBondContact O-N 3.39Å; V139-M141 PolarHBondContact O-N 3.35Å; V139-F142 PolarHBondContact O-N 3.41Å; V139-M152 HydrophobicContact CG2-CE 3.61Å; V139-M152 HydrophobicContact CG2-CG 4.04Å; V139-M152 HydrophobicContact CG2-SD 3.83Å; V139-D169 HydrophobicContact CG1-CB 4.35Å; V139-Y170 HydrophobicContact CG1-CD1 3.93Å; V139-Y170 HydrophobicContact CG1-CE1 3.86Å; V139-Y170 HydrophobicContact CG1-CG 4.35Å; V139-N174 PolarHBondContact O-ND2 3.22Å
140Q92.4Very high86Confident97 Ų9755.9 Ų55.945%0.45329%0.292SS..Hα-helixtrans-63.7-40.8-179.7-73.3173.5-21.100113T136 F137 A173T136-Q140 WeakPolarHBondContact O-CG 3.16Å; T136-Q140 PolarHBondContact O-N 2.94Å; F137-Q140 PolarHBondContact O-N 2.81Å; Q140-A173 HydrophobicContact CG-CB 3.86Å; Q140-A173 WeakPolarHBondContact CG-O 3.3Å
141M89.4Confident85.8Confident90 Ų9054.4 Ų54.444%0.44329%0.287SS..Hα-helixtrans-85.7-8.8-176.4-73.8-67.617900113.8F137 V139 Q143 K149F137-M141 HydrophobicContact CD1-CG 4.21Å; F137-M141 HydrophobicContact CD2-CG 4.19Å; F137-M141 HydrophobicContact CE1-CG 3.79Å; F137-M141 HydrophobicContact CE2-CE 3.53Å; F137-M141 HydrophobicContact CE2-CG 3.78Å; F137-M141 HydrophobicContact CG-CG 4.41Å; F137-M141 HydrophobicContact CZ-CE 3.69Å; F137-M141 HydrophobicContact CZ-CG 3.56Å; F137-M141 HydrophobicContact CZ-SD 4.35Å; F137-M141 WeakPolarHBondContact O-CB 3.45Å; F137-M141 WeakPolarHBondContact O-CG 3.43Å; F137-M141 PolarHBondContact O-N 3.13Å; V139-M141 PolarHBondContact O-N 3.35Å; M141-Q143 PolarHBondContact O-N 3.32Å; M141-K149 VanDerWaalsContact O-CD 3.3Å; M141-K149 WeakPolarHBondContact O-CD 3.42Å
142F88.6Confident85.8Confident5 Ų554.4 Ų54.42%0.02229%0.287CS..  trans-59128.3179.5-176.7-92.8000110.4A138 V139 P144 K149 M152 A153 Y170 N174 I177 P183A138-F142 WeakPolarHBondContact O-CB 3.31Å; A138-F142 PolarHBondContact O-N 2.88Å; A138-F142 VanDerWaalsContact O-N 3.12Å; V139-F142 PolarHBondContact O-N 3.41Å; F142-P144 HydrophobicContact CE1-CG 4.03Å; F142-K149 WeakPolarHBondContact CD2-O 3.35Å; F142-M152 HydrophobicContact CD2-CB 4.06Å; F142-A153 HydrophobicContact CE2-CB 3.71Å; F142-A153 HydrophobicContact CZ-CB 4.31Å; F142-Y170 HydrophobicContact CB-CE1 4.33Å; F142-Y170 HydrophobicContact CD1-CE1 4.35Å; F142-Y170 HydrophobicContact CG-CE1 4.49Å; F142-N174 PolarHBondContact O-ND2 3.22Å; F142-I177 HydrophobicContact CD1-CD1 3.99Å; F142-I177 HydrophobicContact CE1-CD1 4.33Å; F142-P183 HydrophobicContact CD1-CB 4.44Å; F142-P183 HydrophobicContact CD1-CG 3.71Å; F142-P183 HydrophobicContact CE1-CB 3.64Å; F142-P183 HydrophobicContact CE1-CG 3.38Å; F142-P183 HydrophobicContact CG-CG 4.49Å; F142-P183 HydrophobicContact CZ-CB 3.77Å; F142-P183 HydrophobicContact CZ-CG 3.93Å
143Q84.6Confident85.7Confident72 Ų7250.7 Ų50.734%0.33627%0.27SS..  trans-129.6121.5173.6-74-178.1-20.400108.9M141 G145 L146 K149 A176M141-Q143 PolarHBondContact O-N 3.32Å; Q143-G145 PolarHBondContact O-N 3.03Å; Q143-L146 HydrophobicContact CB-CB 4.39Å; Q143-L146 PolarHBondContact O-N 3.41Å; Q143-K149 HydrophobicContact CB-CD 3.75Å; Q143-K149 HydrophobicContact CG-CD 3.87Å; Q143-A176 HydrophobicContact CG-CB 4.1Å
144P77.6Confident85.6Confident11 Ų1146.5 Ų46.57%0.07124%0.244CC..THydrogen-bonded Turntrans-54.4130.6175.8-24.232.7000111.1F142 L146 I177 T204 H222 V225F142-P144 HydrophobicContact CE1-CG 4.03Å; P144-L146 PolarHBondContact O-N 3.44Å; P144-I177 HydrophobicContact CG-CG1 4.22Å; P144-T204 HydrophobicContact CB-CG2 4.3Å; P144-T204 HydrophobicContact CG-CG2 4.11Å; P144-T204 WeakPolarHBondContact CG-OG1 3.4Å; P144-H222 WeakPolarHBondContact CA-O 3.48Å; P144-V225 HydrophobicContact CG-CG1 4.03Å
145G71.9Confident85.7Confident33 Ų3345.9 Ų45.934%0.3424%0.238SC..THydrogen-bonded Turntrans82.1-4.5176.500000117.8Q143 H222Q143-G145 PolarHBondContact O-N 3.03Å; G145-H222 PolarHBondContact N-O 2.92Å
146L76.1Confident85.7Confident60 Ų6045.9 Ų45.931%0.31424%0.238SC..  trans-91113.8169.5-103.475.6000110.2Q143 P144 D148 K149Q143-L146 HydrophobicContact CB-CB 4.39Å; Q143-L146 PolarHBondContact O-N 3.41Å; P144-L146 PolarHBondContact O-N 3.44Å; L146-D148 VanDerWaalsContact C-N 3.27Å; L146-D148 PolarHBondContact O-N 2.93Å; L146-K149 HydrophobicContact CB-CB 4.08Å; L146-K149 HydrophobicContact CB-CD 4.15Å; L146-K149 HydrophobicContact CB-CG 4.28Å; L146-K149 HydrophobicContact CD2-CD 3.84Å; L146-K149 HydrophobicContact CD2-CG 4.48Å; L146-K149 PolarHBondContact O-N 3.22Å
147E66.8Low85.6Confident149 Ų14947.9 Ų47.970%0.69624%0.244SC*.G310 helixtrans-55.8-40.1-179.4-65.8-173.2171.900112.6K149 T150E147-K149 PolarHBondContact O-N 3.46Å; E147-K149 VanDerWaalsContact O-N 3.16Å; E147-T150 WeakPolarHBondContact O-CB 3.37Å; E147-T150 VanDerWaalsContact O-CG2 3.24Å; E147-T150 WeakPolarHBondContact O-CG2 3.41Å; E147-T150 PolarHBondContact O-N 2.85Å; E147-T150 PolarHBondContact O-OG1 3.42Å
148D67.1Low85.6Confident149 Ų14942.6 Ų42.680%0.79722%0.222SC*.G310 helixtrans-65.8-17.7179-70-25000113.6L146L146-D148 VanDerWaalsContact C-N 3.27Å; L146-D148 PolarHBondContact O-N 2.93Å
149K76.4Confident85.7Confident62 Ų6242.4 Ų42.427%0.2722%0.22SC..G310 helixtrans-107.923.9-175.8-67178.7167.9-1670112.7M141 F142 Q143 L146 E147 V151M141-K149 VanDerWaalsContact O-CD 3.3Å; M141-K149 WeakPolarHBondContact O-CD 3.42Å; F142-K149 WeakPolarHBondContact CD2-O 3.35Å; Q143-K149 HydrophobicContact CB-CD 3.75Å; Q143-K149 HydrophobicContact CG-CD 3.87Å; L146-K149 HydrophobicContact CB-CB 4.08Å; L146-K149 HydrophobicContact CB-CD 4.15Å; L146-K149 HydrophobicContact CB-CG 4.28Å; L146-K149 HydrophobicContact CD2-CD 3.84Å; L146-K149 HydrophobicContact CD2-CG 4.48Å; L146-K149 PolarHBondContact O-N 3.22Å; E147-K149 PolarHBondContact O-N 3.46Å; E147-K149 VanDerWaalsContact O-N 3.16Å; K149-V151 VanDerWaalsContact C-N 3.33Å
150T84.3Confident85.7Confident28 Ų2845.6 Ų45.617%0.17223%0.234CC..  trans-85.11.1178.554.70000114.5E147 M152 A153 N154 H222E147-T150 WeakPolarHBondContact O-CB 3.37Å; E147-T150 VanDerWaalsContact O-CG2 3.24Å; E147-T150 WeakPolarHBondContact O-CG2 3.41Å; E147-T150 PolarHBondContact O-N 2.85Å; E147-T150 PolarHBondContact O-OG1 3.42Å; T150-M152 VanDerWaalsContact C-N 3.32Å; T150-M152 PolarHBondContact O-N 2.92Å; T150-A153 PolarHBondContact O-N 2.9Å; T150-A153 VanDerWaalsContact O-N 3.1Å; T150-N154 VanDerWaalsContact O-CG 3.28Å; T150-N154 PolarHBondContact O-N 3.32Å; T150-N154 PolarHBondContact O-ND2 3.41Å; T150-H222 HydrophobicContact CG2-CB 4.35Å
151V88.7Confident85.9Confident25 Ų2541 Ų4115%0.15221%0.213CC..Hα-helixtrans-51.6-48.7-176.71780000111.8S62 K65 I66 A138 K149 I155S62-V151 WeakPolarHBondContact CB-O 3.26Å; K65-V151 HydrophobicContact CD-CG2 4.19Å; I66-V151 HydrophobicContact CD1-CG1 3.71Å; I66-V151 HydrophobicContact CG1-CG1 3.86Å; A138-V151 HydrophobicContact CB-CG1 4.46Å; K149-V151 VanDerWaalsContact C-N 3.33Å; V151-I155 WeakPolarHBondContact O-CG1 3.23Å; V151-I155 PolarHBondContact O-N 3.41Å
152M91.8Very high86.2Confident1 Ų136.7 Ų36.71%0.00519%0.191CC..Hα-helixtrans-68.8-42.7-180-167.558.5-167.600111.6V135 A138 V139 F142 T150 N154 I155 Q156 G163 Y170 C236V135-M152 HydrophobicContact CG1-CE 4.18Å; V135-M152 HydrophobicContact CG1-SD 4.28Å; A138-M152 HydrophobicContact CB-CB 4.16Å; A138-M152 HydrophobicContact CB-SD 4.2Å; V139-M152 HydrophobicContact CG2-CE 3.61Å; V139-M152 HydrophobicContact CG2-CG 4.04Å; V139-M152 HydrophobicContact CG2-SD 3.83Å; F142-M152 HydrophobicContact CD2-CB 4.06Å; T150-M152 VanDerWaalsContact C-N 3.32Å; T150-M152 PolarHBondContact O-N 2.92Å; M152-N154 VanDerWaalsContact C-N 3.33Å; M152-N154 PolarHBondContact O-N 2.98Å; M152-I155 PolarHBondContact O-N 2.97Å; M152-Q156 HydrophobicContact CE-CG 3.75Å; M152-Q156 HydrophobicContact CG-CG 4.24Å; M152-Q156 VanDerWaalsContact O-CG 3.22Å; M152-Q156 WeakPolarHBondContact O-CG 3.35Å; M152-Q156 PolarHBondContact O-N 2.7Å; M152-Q156 PolarHBondContact O-OE1 2.96Å; M152-Q156 HydrophobicContact SD-CG 4.49Å; M152-G163 VanDerWaalsContact CE-O 3.24Å; M152-G163 WeakPolarHBondContact CE-O 3.29Å; M152-Y170 WeakPolarHBondContact CG-OH 3.49Å; M152-C236 HydrophobicContact CE-CB 3.96Å; M152-C236 VanDerWaalsContact CE-SG 3.5Å
153A91.7Very high86.6Confident0 Ų036.4 Ų36.40%019%0.19CC..Hα-helixtrans-58.7-42.3178.600000113F142 T150 I155 Q156 E157 S185 H222F142-A153 HydrophobicContact CE2-CB 3.71Å; F142-A153 HydrophobicContact CZ-CB 4.31Å; T150-A153 PolarHBondContact O-N 2.9Å; T150-A153 VanDerWaalsContact O-N 3.1Å; A153-I155 VanDerWaalsContact C-N 3.25Å; A153-I155 PolarHBondContact O-N 3.2Å; A153-Q156 PolarHBondContact O-N 3.29Å; A153-E157 WeakPolarHBondContact O-CB 3.42Å; A153-E157 PolarHBondContact O-N 2.93Å; A153-S185 WeakPolarHBondContact CA-OG 3.24Å; A153-S185 WeakPolarHBondContact CB-OG 3.47Å; A153-H222 WeakPolarHBondContact CB-ND1 3.22Å
154N91.6Very high87.1Confident12 Ų1236.6 Ų36.66%0.06419%0.188CC..Hα-helixtrans-61.3-34.3177-64.9-35.1000112.5K58 S62 T150 M152 A158K58-N154 HydrophobicContact CB-CB 4.19Å; S62-N154 WeakPolarHBondContact OG-CB 3.28Å; S62-N154 PolarHBondContact OG-ND2 3.32Å; T150-N154 VanDerWaalsContact O-CG 3.28Å; T150-N154 PolarHBondContact O-N 3.32Å; T150-N154 PolarHBondContact O-ND2 3.41Å; M152-N154 VanDerWaalsContact C-N 3.33Å; M152-N154 PolarHBondContact O-N 2.98Å; N154-A158 WeakPolarHBondContact O-CB 3.16Å; N154-A158 PolarHBondContact O-N 3.46Å
155I93.3Very high87.9Confident0 Ų038 Ų380%021%0.205CC..Hα-helixtrans-73.2-44.1178.2-66.9169.4000110.5M59 L63 I66 V151 M152 A153 A158 L159 C236 L240M59-I155 HydrophobicContact CG-CG1 4.44Å; L63-I155 HydrophobicContact CD2-CD1 3.78Å; L63-I155 HydrophobicContact CD2-CG1 4.16Å; L63-I155 HydrophobicContact CG-CD1 4.21Å; L63-I155 HydrophobicContact CG-CG1 4.21Å; I66-I155 HydrophobicContact CD1-CD1 3.44Å; I66-I155 VanDerWaalsContact CD1-CD1 3.44Å; V151-I155 WeakPolarHBondContact O-CG1 3.23Å; V151-I155 PolarHBondContact O-N 3.41Å; M152-I155 PolarHBondContact O-N 2.97Å; A153-I155 VanDerWaalsContact C-N 3.25Å; A153-I155 PolarHBondContact O-N 3.2Å; I155-A158 PolarHBondContact O-N 2.92Å; I155-L159 HydrophobicContact CG2-CD1 4.03Å; I155-L159 WeakPolarHBondContact O-CB 3.25Å; I155-L159 PolarHBondContact O-N 3.44Å; I155-C236 HydrophobicContact CG2-CB 4.16Å; I155-L240 HydrophobicContact CG2-CD1 4.22Å
156Q94.7Very high89.1Confident0 Ų037.9 Ų37.90%020%0.198CC..Hα-helixtrans-64.9-45.4-177.8-67.6173.5-66.200112.4M152 A153 A158 H160 C161 Y170 S185 C186M152-Q156 HydrophobicContact CE-CG 3.75Å; M152-Q156 HydrophobicContact CG-CG 4.24Å; M152-Q156 VanDerWaalsContact O-CG 3.22Å; M152-Q156 WeakPolarHBondContact O-CG 3.35Å; M152-Q156 PolarHBondContact O-N 2.7Å; M152-Q156 PolarHBondContact O-OE1 2.96Å; M152-Q156 HydrophobicContact SD-CG 4.49Å; A153-Q156 PolarHBondContact O-N 3.29Å; Q156-A158 VanDerWaalsContact C-N 3.33Å; Q156-A158 PolarHBondContact O-N 3.24Å; Q156-H160 WeakPolarHBondContact O-CA 3.41Å; Q156-H160 PolarHBondContact O-N 2.88Å; Q156-C161 WeakPolarHBondContact CA-O 3.33Å; Q156-C161 VanDerWaalsContact CB-O 3.22Å; Q156-C161 WeakPolarHBondContact CB-O 3.5Å; Q156-C161 VanDerWaalsContact CG-O 3.3Å; Q156-C161 WeakPolarHBondContact CG-O 3.42Å; Q156-C161 PolarHBondContact O-N 3.14Å; Q156-Y170 PolarHBondContact NE2-OH 2.86Å; Q156-Y170 PolarHBondContact OE1-OH 3.08Å; Q156-Y170 VanDerWaalsContact OE1-OH 3.1Å; Q156-S185 PolarHBondContact OE1-OG 3.19Å; Q156-C186 PolarHBondContact NE2-SG 3.37Å
157E92.1Very high90Very high84 Ų8437.9 Ų37.939%0.39320%0.195SC..Hα-helixtrans-64.6-38.4-179.8-167.9-176.1171.500111.7L55 A153L55-E157 HydrophobicContact CD1-CB 3.89Å; L55-E157 VanDerWaalsContact CD1-CD 3.45Å; L55-E157 HydrophobicContact CD1-CG 3.57Å; A153-E157 WeakPolarHBondContact O-CB 3.42Å; A153-E157 PolarHBondContact O-N 2.93Å
158A92.5Very high91.3Very high5 Ų534.4 Ų34.44%0.04118%0.181CC..Hα-helixtrans-79.7-34.5-17900000113.9L55 M59 N154 I155 Q156L55-A158 HydrophobicContact CD1-CB 4.28Å; L55-A158 HydrophobicContact CG-CB 4.03Å; M59-A158 HydrophobicContact CB-CB 3.58Å; M59-A158 HydrophobicContact CG-CB 3.71Å; M59-A158 HydrophobicContact SD-CB 3.56Å; M59-A158 VanDerWaalsContact SD-CB 3.56Å; N154-A158 WeakPolarHBondContact O-CB 3.16Å; N154-A158 PolarHBondContact O-N 3.46Å; I155-A158 PolarHBondContact O-N 2.92Å; Q156-A158 VanDerWaalsContact C-N 3.33Å; Q156-A158 PolarHBondContact O-N 3.24Å
159L93.8Very high92.6Very high6 Ų628.7 Ų28.73%0.03115%0.151CC..Hα-helixtrans-102.7-0.3-175.1-65.4-179.4000114.5W56 M59 I155 R239 L240W56-L159 HydrophobicContact CZ3-CD2 4.3Å; M59-L159 HydrophobicContact SD-CD1 4.14Å; M59-L159 HydrophobicContact SD-CD2 3.68Å; M59-L159 HydrophobicContact SD-CG 3.65Å; I155-L159 HydrophobicContact CG2-CD1 4.03Å; I155-L159 WeakPolarHBondContact O-CB 3.25Å; I155-L159 PolarHBondContact O-N 3.44Å; L159-R239 HydrophobicContact CB-CB 4.3Å; L159-R239 HydrophobicContact CD1-CB 4.48Å; L159-L240 HydrophobicContact CD1-CD1 4.39Å; L159-L240 HydrophobicContact CD1-CD2 3.41Å; L159-L240 VanDerWaalsContact CD1-CD2 3.41Å; L159-L240 HydrophobicContact CD1-CG 3.61Å
160H95Very high93.4Very high68 Ų6825.8 Ų25.832%0.31514%0.138SC..THydrogen-bonded Turntrans53.856.1-178.5-57.2-56.5000111.6Q156 Y232Q156-H160 WeakPolarHBondContact O-CA 3.41Å; Q156-H160 PolarHBondContact O-N 2.88Å; H160-Y232 VanDerWaalsContact C-CD2 3.41Å; H160-Y232 VanDerWaalsContact C-CG 3.47Å; H160-Y232 HydrophobicContact CB-CD1 4.1Å; H160-Y232 HydrophobicContact CB-CD2 4.42Å; H160-Y232 HydrophobicContact CB-CE1 3.61Å; H160-Y232 HydrophobicContact CB-CE2 3.97Å; H160-Y232 HydrophobicContact CB-CG 4.48Å; H160-Y232 AromaticContact CG-CZ 3.86Å; H160-Y232 AromaticContact ND1-CZ 3.5Å; H160-Y232 PolarHBondContact ND1-OH 3.2Å
161C96.2Very high93.7Very high0 Ų027.4 Ų27.40%015%0.146CC..  trans-137.8159.4-176.161.30000111.6Q156 E234 C236 R239Q156-C161 WeakPolarHBondContact CA-O 3.33Å; Q156-C161 VanDerWaalsContact CB-O 3.22Å; Q156-C161 WeakPolarHBondContact CB-O 3.5Å; Q156-C161 VanDerWaalsContact CG-O 3.3Å; Q156-C161 WeakPolarHBondContact CG-O 3.42Å; Q156-C161 PolarHBondContact O-N 3.14Å; C161-E234 CarbonylContact C-O 3.49Å; C161-E234 WeakPolarHBondContact CA-O 3.33Å; C161-E234 WeakPolarHBondContact CB-O 3.3Å; C161-C236 HydrophobicContact CB-CB 3.93Å; C161-C236 WeakPolarHBondContact CB-SG 3.07Å; C161-C236 WeakPolarHBondContact SG-CA 3.42Å; C161-C236 WeakPolarHBondContact SG-CB 3.44Å; C161-C236 CovalentContact SG-SG 2.04Å; C161-C236 PolarHBondContact SG-SG 2.97Å; C161-R239 HydrophobicContact CB-CG 4.06Å
162C96Very high93.8Very high0 Ų032.5 Ų32.50%018%0.176CC..  trans-134.6130.1176.9-166.50000112.1S166 Y167 C186 A231 Y232 E234 G235C162-S166 CarbonylContact O-C 3.42Å; C162-Y167 PolarHBondContact O-N 2.93Å; C162-Y167 VanDerWaalsContact SG-CB 3.55Å; C162-C186 HydrophobicContact CB-CB 3.7Å; C162-C186 WeakPolarHBondContact CB-SG 3.33Å; C162-C186 WeakPolarHBondContact SG-CB 3.44Å; C162-C186 CovalentContact SG-SG 2.04Å; C162-C186 PolarHBondContact SG-SG 3.05Å; C162-A231 HydrophobicContact CB-CB 4.38Å; C162-Y232 WeakPolarHBondContact CB-O 3.28Å; C162-E234 PolarHBondContact N-O 2.77Å; C162-G235 WeakPolarHBondContact O-CA 3.25Å
163G95.6Very high93.7Very high0 Ų034 Ų340%019%0.189CC..SBendtrans67.4-165.1-178.700000113.6M152 S166 C236M152-G163 VanDerWaalsContact CE-O 3.24Å; M152-G163 WeakPolarHBondContact CE-O 3.29Å; G163-S166 WeakPolarHBondContact CA-O 3.3Å; G163-C236 WeakPolarHBondContact O-CB 3.26Å; G163-C236 PolarHBondContact O-N 3.07Å; G163-C236 PolarHBondContact O-SG 3.15Å
164R95.6Very high93.5Very high75 Ų7534.4 Ų34.428%0.28319%0.191SC..SBendtrans-83.8-59.6-176.9176.7-163.266.890.26.5110.3E132 V135 T136 D169 G235 C236 V237E132-R164 IonicContact OE1-NH1 2.92Å; E132-R164 PolarHBondContact OE1-NH1 2.9Å; V135-R164 HydrophobicContact CG1-CB 4.03Å; V135-R164 HydrophobicContact CG1-CG 4.11Å; T136-R164 WeakPolarHBondContact OG1-CD 3.41Å; R164-D169 WeakPolarHBondContact CA-OD2 3.41Å; R164-D169 WeakPolarHBondContact CB-OD2 3.24Å; R164-D169 PolarHBondContact N-OD2 3.34Å; R164-D169 IonicContact NE-OD1 3.7Å; R164-D169 IonicContact NH2-OD1 3.64Å; R164-G235 CarbonylContact O-C 3.48Å; R164-G235 WeakPolarHBondContact O-CA 3.36Å; R164-C236 PolarHBondContact O-N 3.43Å; R164-V237 HydrophobicContact CG-CG2 3.58Å; R164-V237 WeakPolarHBondContact O-CB 3.24Å; R164-V237 WeakPolarHBondContact O-CG2 3.36Å; R164-V237 PolarHBondContact O-N 3.07Å
165G95.4Very high93.3Very high42 Ų4243.4 Ų43.443%0.43323%0.233SC..SBendtrans-105.3-34.9174.200000113.2D169 G235G165-D169 PolarHBondContact N-OD2 3.06Å; G165-G235 WeakPolarHBondContact O-CA 3.36Å; G165-G235 PolarHBondContact O-N 3.19Å
166S95.9Very high93Very high29 Ų2945.2 Ų45.220%0.20325%0.248CC..SBendtrans-155.7173.9173.269.40000110.9C162 G163 D168 D169C162-S166 CarbonylContact O-C 3.42Å; G163-S166 WeakPolarHBondContact CA-O 3.3Å; S166-D168 PolarHBondContact O-N 2.92Å; S166-D168 WeakPolarHBondContact OG-CB 3.32Å; S166-D168 PolarHBondContact OG-N 3.17Å; S166-D168 PolarHBondContact OG-OD2 3.29Å; S166-D169 PolarHBondContact N-OD2 3.4Å; S166-D169 PolarHBondContact O-N 3Å
167Y95.1Very high92.6Very high61 Ų6145.8 Ų45.824%0.23925%0.251CS..THydrogen-bonded Turntrans-58.6-25.4173.957.2-104.9000113.3C162 D169 Y170 Y228 A231C162-Y167 PolarHBondContact O-N 2.93Å; C162-Y167 VanDerWaalsContact SG-CB 3.55Å; Y167-D169 PolarHBondContact O-N 2.88Å; Y167-D169 VanDerWaalsContact O-N 3.17Å; Y167-Y170 PolarHBondContact O-N 3.2Å; Y167-Y228 HydrophobicContact CD2-CD2 4.08Å; Y167-Y228 HydrophobicContact CD2-CG 4.38Å; Y167-Y228 AromaticContact CE2-CD2 3.56Å; Y167-Y228 HydrophobicContact CE2-CD2 3.56Å; Y167-Y228 HydrophobicContact CE2-CE2 4.29Å; Y167-Y228 HydrophobicContact CE2-CG 4.25Å; Y167-A231 HydrophobicContact CD1-CB 4.34Å; Y167-A231 HydrophobicContact CG-CB 4.31Å
168D94.5Very high92.5Very high76 Ų7644.4 Ų44.441%0.40625%0.249SC..THydrogen-bonded Turntrans-63.2-20.7179.7-54.8-60.9000113.1S166 Y170 D171 V172S166-D168 PolarHBondContact O-N 2.92Å; S166-D168 WeakPolarHBondContact OG-CB 3.32Å; S166-D168 PolarHBondContact OG-N 3.17Å; S166-D168 PolarHBondContact OG-OD2 3.29Å; D168-Y170 PolarHBondContact O-N 3.15Å; D168-D171 PolarHBondContact O-N 3.37Å; D168-D171 VanDerWaalsContact O-N 3.15Å; D168-V172 PolarHBondContact O-N 2.93Å
169D94.1Very high92.3Very high29 Ų2952.3 Ų52.316%0.15528%0.282CS..Hα-helixtrans-60-28177.7-68.1-62.4000111.8V139 R164 G165 S166 Y167 A173V139-D169 HydrophobicContact CG1-CB 4.35Å; R164-D169 WeakPolarHBondContact CA-OD2 3.41Å; R164-D169 WeakPolarHBondContact CB-OD2 3.24Å; R164-D169 PolarHBondContact N-OD2 3.34Å; R164-D169 IonicContact NE-OD1 3.7Å; R164-D169 IonicContact NH2-OD1 3.64Å; G165-D169 PolarHBondContact N-OD2 3.06Å; S166-D169 PolarHBondContact N-OD2 3.4Å; S166-D169 PolarHBondContact O-N 3Å; Y167-D169 PolarHBondContact O-N 2.88Å; Y167-D169 VanDerWaalsContact O-N 3.17Å; D169-A173 WeakPolarHBondContact O-CB 3.35Å; D169-A173 PolarHBondContact O-N 3.42Å
170Y93.6Very high92.3Very high1 Ų157.8 Ų57.80%0.00431%0.308CS..Hα-helixtrans-69.3-40.8176.5-81.1-70.7000112.7V139 F142 M152 Q156 Y167 D168 V172 N174 I177 V182 P183V139-Y170 HydrophobicContact CG1-CD1 3.93Å; V139-Y170 HydrophobicContact CG1-CE1 3.86Å; V139-Y170 HydrophobicContact CG1-CG 4.35Å; F142-Y170 HydrophobicContact CB-CE1 4.33Å; F142-Y170 HydrophobicContact CD1-CE1 4.35Å; F142-Y170 HydrophobicContact CG-CE1 4.49Å; M152-Y170 WeakPolarHBondContact CG-OH 3.49Å; Q156-Y170 PolarHBondContact NE2-OH 2.86Å; Q156-Y170 PolarHBondContact OE1-OH 3.08Å; Q156-Y170 VanDerWaalsContact OE1-OH 3.1Å; Y167-Y170 PolarHBondContact O-N 3.2Å; D168-Y170 PolarHBondContact O-N 3.15Å; Y170-V172 PolarHBondContact O-N 3.27Å; Y170-N174 HydrophobicContact CD1-CB 3.97Å; Y170-N174 PolarHBondContact O-N 3.45Å; Y170-N174 VanDerWaalsContact O-N 3.14Å; Y170-I177 HydrophobicContact CD1-CD1 3.42Å; Y170-I177 VanDerWaalsContact CD1-CD1 3.42Å; Y170-I177 HydrophobicContact CE1-CD1 3.73Å; Y170-I177 HydrophobicContact CG-CD1 4.15Å; Y170-V182 HydrophobicContact CD2-CB 4.34Å; Y170-V182 HydrophobicContact CD2-CG1 4.09Å; Y170-P183 HydrophobicContact CD1-CG 4.35Å; Y170-P183 HydrophobicContact CE1-CG 3.7Å; Y170-P183 HydrophobicContact CE2-CG 4.01Å
171D91.5Very high92.2Very high62 Ų6256.3 Ų56.333%0.33230%0.301SS..Hα-helixtrans-63.4-28179.6-87.3-8.4000112.4D168 K179 Q180D168-D171 PolarHBondContact O-N 3.37Å; D168-D171 VanDerWaalsContact O-N 3.15Å; D171-K179 WeakPolarHBondContact OD1-CA 3.45Å; D171-Q180 PolarHBondContact OD1-N 3.36Å; D171-Q180 PolarHBondContact OD2-N 3.41Å
172V90.2Very high92.1Very high132 Ų13256.4 Ų56.480%0.830%0.301SS*.Hα-helixtrans-96.3-41.5-177.7-178.30000112.3D168 Y170D168-V172 PolarHBondContact O-N 2.93Å; Y170-V172 PolarHBondContact O-N 3.27Å
173A88.8Confident92Very high33 Ų3356.5 Ų56.527%0.27330%0.302SS..Hα-helixtrans-104.5-11.4-16500000114.5Q140 D169Q140-A173 HydrophobicContact CG-CB 3.86Å; Q140-A173 WeakPolarHBondContact CG-O 3.3Å; D169-A173 WeakPolarHBondContact O-CB 3.35Å; D169-A173 PolarHBondContact O-N 3.42Å
174N89.1Confident91.8Very high8 Ų857.2 Ų57.24%0.04331%0.305CS..  trans-128.3104.7-174.6-168.6-35.9000112.5V139 F142 Y170 A176V139-N174 PolarHBondContact O-ND2 3.22Å; F142-N174 PolarHBondContact O-ND2 3.22Å; Y170-N174 HydrophobicContact CD1-CB 3.97Å; Y170-N174 PolarHBondContact O-N 3.45Å; Y170-N174 VanDerWaalsContact O-N 3.14Å; N174-A176 VanDerWaalsContact C-N 3.27Å; N174-A176 PolarHBondContact O-N 2.89Å; N174-A176 WeakPolarHBondContact OD1-CA 3.38Å; N174-A176 VanDerWaalsContact OD1-CB 3.25Å; N174-A176 WeakPolarHBondContact OD1-CB 3.3Å; N174-A176 PolarHBondContact OD1-N 3.5Å
175E86.5Confident91.7Very high201 Ų20154.3 Ų54.394%0.93930%0.296SS*.THydrogen-bonded Turntrans-73.9-14.5179-60.8-179.1174.400114.1I177E175-I177 VanDerWaalsContact C-N 3.28Å
176A86.1Confident91.7Very high38 Ų3852.3 Ų52.331%0.31428%0.275SS..THydrogen-bonded Turntrans-78.4-15.3-179.600000112.8Q143 N174Q143-A176 HydrophobicContact CG-CB 4.1Å; N174-A176 VanDerWaalsContact C-N 3.27Å; N174-A176 PolarHBondContact O-N 2.89Å; N174-A176 WeakPolarHBondContact OD1-CA 3.38Å; N174-A176 VanDerWaalsContact OD1-CB 3.25Å; N174-A176 WeakPolarHBondContact OD1-CB 3.3Å; N174-A176 PolarHBondContact OD1-N 3.5Å
177I87.8Confident91.7Very high12 Ų1251 Ų516%0.06227%0.267CS..SBendtrans-104.5133.5178.9-56.3-172.9000109.1F142 P144 Y170 E175 H181 P183 V225F142-I177 HydrophobicContact CD1-CD1 3.99Å; F142-I177 HydrophobicContact CE1-CD1 4.33Å; P144-I177 HydrophobicContact CG-CG1 4.22Å; Y170-I177 HydrophobicContact CD1-CD1 3.42Å; Y170-I177 VanDerWaalsContact CD1-CD1 3.42Å; Y170-I177 HydrophobicContact CE1-CD1 3.73Å; Y170-I177 HydrophobicContact CG-CD1 4.15Å; E175-I177 VanDerWaalsContact C-N 3.28Å; I177-H181 HydrophobicContact CG2-CB 4.07Å; I177-H181 VanDerWaalsContact CG2-O 3.22Å; I177-H181 WeakPolarHBondContact CG2-O 3.44Å; I177-P183 HydrophobicContact CD1-CG 3.57Å; I177-V225 HydrophobicContact CG2-CG1 4.1Å
178P88.9Confident91.7Very high55 Ų5549 Ų4936%0.35726%0.26SS..  trans-58.6146.6173.5-21.832.9000111.6H181P178-H181 HydrophobicContact CB-CB 4.47Å; P178-H181 WeakPolarHBondContact O-CB 3.45Å; P178-H181 PolarHBondContact O-N 3.45Å; P178-H181 VanDerWaalsContact O-N 3.16Å
179K89.9Confident91.6Very high170 Ų17049 Ų4974%0.73926%0.259SS*.THydrogen-bonded Turntrans-53.4147.1173.1-65.2-171.4176.5-171.90111.1D171 H181D171-K179 WeakPolarHBondContact OD1-CA 3.45Å; K179-H181 PolarHBondContact O-N 3.35Å; K179-H181 PolarHBondContact O-ND1 3.26Å
180Q92.1Very high91.6Very high121 Ų12154.3 Ų54.357%0.56528%0.283SS*.THydrogen-bonded Turntrans64.615-177.7-55.9176.7-28.400114.1D171 Y228D171-Q180 PolarHBondContact OD1-N 3.36Å; D171-Q180 PolarHBondContact OD2-N 3.41Å; Q180-Y228 HydrophobicContact CB-CD1 3.74Å; Q180-Y228 HydrophobicContact CB-CE1 3.95Å; Q180-Y228 HydrophobicContact CG-CD1 4.31Å; Q180-Y228 HydrophobicContact CG-CE1 4.13Å; Q180-Y228 WeakPolarHBondContact O-CD1 3.26Å; Q180-Y228 PolarHBondContact O-N 3.42Å
181H93.7Very high91.6Very high38 Ų3858.7 Ų58.718%0.17631%0.31CS..EExtended strand (participates in β ladder)trans-125.9155.1176.7-62.470.6000110.5I177 P178 K179 I202 V225 I226I177-H181 HydrophobicContact CG2-CB 4.07Å; I177-H181 VanDerWaalsContact CG2-O 3.22Å; I177-H181 WeakPolarHBondContact CG2-O 3.44Å; P178-H181 HydrophobicContact CB-CB 4.47Å; P178-H181 WeakPolarHBondContact O-CB 3.45Å; P178-H181 PolarHBondContact O-N 3.45Å; P178-H181 VanDerWaalsContact O-N 3.16Å; K179-H181 PolarHBondContact O-N 3.35Å; K179-H181 PolarHBondContact O-ND1 3.26Å; H181-I202 WeakPolarHBondContact NE2-CD1 3.34Å; H181-V225 HydrophobicContact CB-CB 4.17Å; H181-V225 HydrophobicContact CB-CG2 4.15Å; H181-I226 CarbonylContact C-O 3.54Å; H181-I226 WeakPolarHBondContact CA-O 3.02Å
182V94.4Very high91.8Very high1 Ų159.3 Ų59.31%0.00631%0.308CS..EExtended strand (participates in β ladder)trans-136163.2177-63.40000109.9Y170 C186 V225 I226 A231Y170-V182 HydrophobicContact CD2-CB 4.34Å; Y170-V182 HydrophobicContact CD2-CG1 4.09Å; V182-C186 HydrophobicContact CB-CB 4.12Å; V182-C186 HydrophobicContact CG2-CB 3.58Å; V182-V225 CarbonylContact O-C 3.52Å; V182-V225 WeakPolarHBondContact O-CA 3.49Å; V182-V225 WeakPolarHBondContact O-CB 3.38Å; V182-I226 HydrophobicContact CG2-CD1 4.18Å; V182-I226 HydrophobicContact CG2-CG1 3.64Å; V182-I226 PolarHBondContact N-O 3.26Å; V182-I226 PolarHBondContact O-N 2.83Å; V182-A231 HydrophobicContact CG2-CB 3.84Å
183P93.2Very high91.9Very high2 Ų257.3 Ų57.31%0.01330%0.297CS..EExtended strand (participates in β ladder)trans-57.9148.6174.9-24.235.8000112.1F142 Y170 I177 S185 C186F142-P183 HydrophobicContact CD1-CB 4.44Å; F142-P183 HydrophobicContact CD1-CG 3.71Å; F142-P183 HydrophobicContact CE1-CB 3.64Å; F142-P183 HydrophobicContact CE1-CG 3.38Å; F142-P183 HydrophobicContact CG-CG 4.49Å; F142-P183 HydrophobicContact CZ-CB 3.77Å; F142-P183 HydrophobicContact CZ-CG 3.93Å; Y170-P183 HydrophobicContact CD1-CG 4.35Å; Y170-P183 HydrophobicContact CE1-CG 3.7Å; Y170-P183 HydrophobicContact CE2-CG 4.01Å; I177-P183 HydrophobicContact CD1-CG 3.57Å; P183-S185 WeakPolarHBondContact CB-OG 3.38Å; P183-S185 PolarHBondContact O-N 3.22Å; P183-S185 VanDerWaalsContact O-N 3.09Å; P183-C186 VanDerWaalsContact O-CB 3.27Å; P183-C186 WeakPolarHBondContact O-CB 3.46Å; P183-C186 PolarHBondContact O-N 2.91Å
184Y92.7Very high92Very high16 Ų1659.9 Ų59.96%0.06331%0.306CS..G310 helixtrans-54.9-30.5175.7-174.3-84.4000113.3C186 C187 N194 C197 N198 H221 Y224 I226Y184-C186 PolarHBondContact O-N 3.05Å; Y184-C187 VanDerWaalsContact O-CB 3.26Å; Y184-C187 WeakPolarHBondContact O-CB 3.36Å; Y184-C187 PolarHBondContact O-N 2.87Å; Y184-N194 PolarHBondContact OH-O 3.04Å; Y184-N194 PolarHBondContact OH-OD1 3.46Å; Y184-C197 HydrophobicContact CE2-CB 3.67Å; Y184-N198 WeakPolarHBondContact CE2-OD1 3.18Å; Y184-N198 PolarHBondContact OH-OD1 3.27Å; Y184-H221 WeakPolarHBondContact CB-O 3.42Å; Y184-H221 HydrophobicContact CD1-CB 3.69Å; Y184-H221 AromaticContact CD1-CD2 3.82Å; Y184-H221 HydrophobicContact CE1-CB 4.1Å; Y184-H221 AromaticContact CE1-CD2 3.37Å; Y184-H221 WeakPolarHBondContact CE1-CD2 3.37Å; Y184-H221 AromaticContact CE1-CG 3.97Å; Y184-H221 HydrophobicContact CG-CB 4.22Å; Y184-H221 AromaticContact CZ-CD2 3.52Å; Y184-Y224 WeakPolarHBondContact CB-O 3.21Å; Y184-Y224 PolarHBondContact N-O 3.49Å; Y184-I226 HydrophobicContact CD2-CG2 3.7Å; Y184-I226 HydrophobicContact CE2-CG2 4.39Å; Y184-I226 HydrophobicContact CG-CG2 4.46Å
185S92.7Very high92.2Very high13 Ų1366 Ų669%0.09133%0.334CS..G310 helixtrans-60-13.5174.551.10000114.4A153 Q156 P183A153-S185 WeakPolarHBondContact CA-OG 3.24Å; A153-S185 WeakPolarHBondContact CB-OG 3.47Å; Q156-S185 PolarHBondContact OE1-OG 3.19Å; P183-S185 WeakPolarHBondContact CB-OG 3.38Å; P183-S185 PolarHBondContact O-N 3.22Å; P183-S185 VanDerWaalsContact O-N 3.09Å
186C94.9Very high92.5Very high0 Ų060.3 Ų60.30%031%0.307CS..G310 helixtrans-83.6-11.4171.2-73.30000114.5Q156 C162 V182 P183 Y184 D188 A231 Y232Q156-C186 PolarHBondContact NE2-SG 3.37Å; C162-C186 HydrophobicContact CB-CB 3.7Å; C162-C186 WeakPolarHBondContact CB-SG 3.33Å; C162-C186 WeakPolarHBondContact SG-CB 3.44Å; C162-C186 CovalentContact SG-SG 2.04Å; C162-C186 PolarHBondContact SG-SG 3.05Å; V182-C186 HydrophobicContact CB-CB 4.12Å; V182-C186 HydrophobicContact CG2-CB 3.58Å; P183-C186 VanDerWaalsContact O-CB 3.27Å; P183-C186 WeakPolarHBondContact O-CB 3.46Å; P183-C186 PolarHBondContact O-N 2.91Å; Y184-C186 PolarHBondContact O-N 3.05Å; C186-D188 PolarHBondContact O-N 3.45Å; C186-A231 HydrophobicContact CB-CB 4.04Å; C186-A231 CarbonylContact O-C 3.12Å; C186-A231 VanDerWaalsContact O-CA 3.25Å; C186-A231 WeakPolarHBondContact O-CA 3.45Å; C186-Y232 WeakPolarHBondContact O-CD2 3.44Å; C186-Y232 PolarHBondContact O-N 3.48Å
187C95.3Very high92.8Very high3 Ų358.5 Ų58.52%0.0229%0.292CS..BIsolated β-bridgetrans-54.3124.6-176.1167.50000110.4Y184 L189 C197 I226 Y232Y184-C187 VanDerWaalsContact O-CB 3.26Å; Y184-C187 WeakPolarHBondContact O-CB 3.36Å; Y184-C187 PolarHBondContact O-N 2.87Å; C187-L189 VanDerWaalsContact C-N 3.31Å; C187-L189 PolarHBondContact O-N 3.32Å; C187-L189 WeakPolarHBondContact SG-CD2 3.37Å; C187-C197 HydrophobicContact CB-CB 3.84Å; C187-C197 WeakPolarHBondContact CB-SG 3.41Å; C187-C197 WeakPolarHBondContact SG-CB 3.27Å; C187-C197 CovalentContact SG-SG 2.02Å; C187-C197 PolarHBondContact SG-SG 3.25Å; C187-I226 HydrophobicContact CB-CD1 3.57Å; C187-Y232 WeakPolarHBondContact O-CE2 3.36Å; C187-Y232 VanDerWaalsContact O-CZ 3.31Å; C187-Y232 PolarHBondContact O-OH 2.71Å
188D96Very high93Very high19 Ų1960 Ų6010%0.10230%0.301CS..  trans-73.687.1174.2-177.10.7000110.9C186 Q190 T191 Y192 L230 Y232C186-D188 PolarHBondContact O-N 3.45Å; D188-Q190 PolarHBondContact O-N 3.13Å; D188-Q190 WeakPolarHBondContact OD1-CA 3.49Å; D188-Q190 VanDerWaalsContact OD1-CB 3.29Å; D188-Q190 WeakPolarHBondContact OD1-CB 3.4Å; D188-Q190 PolarHBondContact OD1-N 3.42Å; D188-T191 PolarHBondContact O-N 2.92Å; D188-T191 PolarHBondContact OD1-N 2.94Å; D188-T191 WeakPolarHBondContact OD2-CB 3.25Å; D188-T191 PolarHBondContact OD2-OG1 2.9Å; D188-Y192 HydrophobicContact CB-CD2 4.14Å; D188-Y192 HydrophobicContact CB-CE2 4.49Å; D188-Y192 WeakPolarHBondContact O-CB 3.28Å; D188-Y192 WeakPolarHBondContact O-CD2 3.46Å; D188-Y192 PolarHBondContact O-N 3.47Å; D188-L230 PolarHBondContact N-O 3.16Å; D188-Y232 HydrophobicContact CB-CD1 3.79Å; D188-Y232 HydrophobicContact CB-CE1 3.78Å; D188-Y232 HydrophobicContact CB-CG 4.35Å; D188-Y232 WeakPolarHBondContact OD1-CE1 3.38Å
189L93.3Very high93.1Very high74 Ų7463.4 Ų63.439%0.38732%0.316SS..THydrogen-bonded Turntrans-71.3-4.2177.8-65.5176.7000114.3C187 Y192 N194 Y232C187-L189 VanDerWaalsContact C-N 3.31Å; C187-L189 PolarHBondContact O-N 3.32Å; C187-L189 WeakPolarHBondContact SG-CD2 3.37Å; L189-Y192 CarbonylContact C-O 3.58Å; L189-Y192 VanDerWaalsContact CA-O 3.29Å; L189-Y192 WeakPolarHBondContact CA-O 3.44Å; L189-N194 HydrophobicContact CD2-CB 4.38Å; L189-N194 WeakPolarHBondContact CD2-OD1 3.39Å; L189-Y232 PolarHBondContact N-OH 2.83Å
190Q92.1Very high93.1Very high141 Ų14156.6 Ų56.666%0.65929%0.291SS*.THydrogen-bonded Turntrans-84.7-31.8172.3-57.3-176.7-11.200110.8D188D188-Q190 PolarHBondContact O-N 3.13Å; D188-Q190 WeakPolarHBondContact OD1-CA 3.49Å; D188-Q190 VanDerWaalsContact OD1-CB 3.29Å; D188-Q190 WeakPolarHBondContact OD1-CB 3.4Å; D188-Q190 PolarHBondContact OD1-N 3.42Å
191T95.1Very high93Very high94 Ų9451.8 Ų51.858%0.57727%0.271SS*.THydrogen-bonded Turntrans-96.5-37.6179.2-56.30000112.3D188D188-T191 PolarHBondContact O-N 2.92Å; D188-T191 PolarHBondContact OD1-N 2.94Å; D188-T191 WeakPolarHBondContact OD2-CB 3.25Å; D188-T191 PolarHBondContact OD2-OG1 2.9Å
192Y94.5Very high92.7Very high74 Ų7453.7 Ų53.729%0.2928%0.282SS..SBendtrans-117.6149.9-174.1-55.7-73.9000111.6D188 L189 H196 L230D188-Y192 HydrophobicContact CB-CD2 4.14Å; D188-Y192 HydrophobicContact CB-CE2 4.49Å; D188-Y192 WeakPolarHBondContact O-CB 3.28Å; D188-Y192 WeakPolarHBondContact O-CD2 3.46Å; D188-Y192 PolarHBondContact O-N 3.47Å; L189-Y192 CarbonylContact C-O 3.58Å; L189-Y192 VanDerWaalsContact CA-O 3.29Å; L189-Y192 WeakPolarHBondContact CA-O 3.44Å; Y192-H196 AromaticContact CD1-CD2 3.52Å; Y192-H196 AromaticContact CD1-NE2 3.86Å; Y192-L230 HydrophobicContact CD1-CD2 3.72Å; Y192-L230 HydrophobicContact CD2-CB 4.41Å; Y192-L230 HydrophobicContact CD2-CD2 3.8Å; Y192-L230 HydrophobicContact CE1-CD2 3.63Å; Y192-L230 HydrophobicContact CE2-CB 4.42Å; Y192-L230 HydrophobicContact CE2-CD2 3.72Å; Y192-L230 HydrophobicContact CG-CD2 3.81Å
193T93.6Very high91.9Very high90 Ų9056.7 Ų56.755%0.55230%0.297SS*.  trans-79155.5174.464.20000110.9E195 H196 C197T193-E195 PolarHBondContact O-N 2.94Å; T193-H196 WeakPolarHBondContact O-CB 3.08Å; T193-H196 PolarHBondContact O-N 3.31Å; T193-H196 WeakPolarHBondContact OG1-CB 3.38Å; T193-H196 PolarHBondContact OG1-N 3.49Å; T193-C197 PolarHBondContact O-N 3.03Å; T193-C197 VanDerWaalsContact O-N 3.1Å
194N91.2Very high90.6Very high87 Ų8758 Ų5847%0.46531%0.305SS..Hα-helixtrans-52.3-39.9171-84.7-49.6000112Y184 L189 H196 C197 N198Y184-N194 PolarHBondContact OH-O 3.04Å; Y184-N194 PolarHBondContact OH-OD1 3.46Å; L189-N194 HydrophobicContact CD2-CB 4.38Å; L189-N194 WeakPolarHBondContact CD2-OD1 3.39Å; N194-H196 PolarHBondContact O-N 3.48Å; N194-C197 PolarHBondContact O-N 2.96Å; N194-N198 VanDerWaalsContact O-CB 3.28Å; N194-N198 WeakPolarHBondContact O-CB 3Å; N194-N198 VanDerWaalsContact O-CG 3.26Å; N194-N198 PolarHBondContact O-N 2.74Å; N194-N198 PolarHBondContact O-ND2 3.33Å; N194-N198 VanDerWaalsContact O-ND2 3.11Å
195E91.6Very high88.8Confident136 Ų13666.4 Ų66.464%0.63634%0.342SS*.Hα-helixtrans-62.2-42.7176.9-174.4-179.4178.200112T193 N198 N199T193-E195 PolarHBondContact O-N 2.94Å; E195-N198 PolarHBondContact O-N 3.43Å; E195-N199 WeakPolarHBondContact O-CB 3.29Å; E195-N199 VanDerWaalsContact O-CG 3.23Å; E195-N199 PolarHBondContact O-N 3.29Å; E195-N199 PolarHBondContact O-ND2 3.43Å
196H93.1Very high87Confident82 Ų8268.8 Ų68.838%0.3835%0.354SS..Hα-helixtrans-61.9-47.7178.1-170.977000111.8Y192 T193 N194 N199 A200Y192-H196 AromaticContact CD1-CD2 3.52Å; Y192-H196 AromaticContact CD1-NE2 3.86Å; T193-H196 WeakPolarHBondContact O-CB 3.08Å; T193-H196 PolarHBondContact O-N 3.31Å; T193-H196 WeakPolarHBondContact OG1-CB 3.38Å; T193-H196 PolarHBondContact OG1-N 3.49Å; N194-H196 PolarHBondContact O-N 3.48Å; H196-N199 PolarHBondContact O-N 2.88Å; H196-A200 WeakPolarHBondContact O-CB 3.46Å; H196-A200 PolarHBondContact O-N 3.39Å; H196-A200 VanDerWaalsContact O-N 3.08Å
197C93.2Very high84.8Confident0 Ų078 Ų780%039%0.394CS..Hα-helixtrans-65.5-38.3177.1-78.20000112.5Y184 C187 T193 N194 A200 S201Y184-C197 HydrophobicContact CE2-CB 3.67Å; C187-C197 HydrophobicContact CB-CB 3.84Å; C187-C197 WeakPolarHBondContact CB-SG 3.41Å; C187-C197 WeakPolarHBondContact SG-CB 3.27Å; C187-C197 CovalentContact SG-SG 2.02Å; C187-C197 PolarHBondContact SG-SG 3.25Å; T193-C197 PolarHBondContact O-N 3.03Å; T193-C197 VanDerWaalsContact O-N 3.1Å; N194-C197 PolarHBondContact O-N 2.96Å; C197-A200 PolarHBondContact O-N 3.11Å; C197-S201 WeakPolarHBondContact O-CB 3.4Å; C197-S201 PolarHBondContact O-N 3.26Å
198N90.8Very high82.5Confident44 Ų4484.9 Ų84.924%0.23543%0.43CS..Hα-helixtrans-64.9-42.6176.7-80.1-35.5000112.2Y184 N194 E195 A200 S201 H221Y184-N198 WeakPolarHBondContact CE2-OD1 3.18Å; Y184-N198 PolarHBondContact OH-OD1 3.27Å; N194-N198 VanDerWaalsContact O-CB 3.28Å; N194-N198 WeakPolarHBondContact O-CB 3Å; N194-N198 VanDerWaalsContact O-CG 3.26Å; N194-N198 PolarHBondContact O-N 2.74Å; N194-N198 PolarHBondContact O-ND2 3.33Å; N194-N198 VanDerWaalsContact O-ND2 3.11Å; E195-N198 PolarHBondContact O-N 3.43Å; N198-A200 VanDerWaalsContact C-N 3.32Å; N198-A200 PolarHBondContact O-N 2.93Å; N198-S201 WeakPolarHBondContact O-CB 3.25Å; N198-S201 PolarHBondContact O-N 3.28Å; N198-S201 VanDerWaalsContact O-N 3.13Å; N198-S201 PolarHBondContact O-OG 3.29Å; N198-H221 PolarHBondContact OD1-CD2 3.41Å
199N91.2Very high80.3Confident127 Ų12788.1 Ų88.168%0.67945%0.451SS*.Hα-helixtrans-68.1-32.2178.3-71-20000112.7E195 H196 S201E195-N199 WeakPolarHBondContact O-CB 3.29Å; E195-N199 VanDerWaalsContact O-CG 3.23Å; E195-N199 PolarHBondContact O-N 3.29Å; E195-N199 PolarHBondContact O-ND2 3.43Å; H196-N199 PolarHBondContact O-N 2.88Å; N199-S201 VanDerWaalsContact C-N 3.29Å
200A90.9Very high77.8Confident26 Ų2690 Ų9022%0.21547%0.467CS..Hα-helixtrans-80.5-11.1174.200000113.1H196 C197 N198 P227 L230H196-A200 WeakPolarHBondContact O-CB 3.46Å; H196-A200 PolarHBondContact O-N 3.39Å; H196-A200 VanDerWaalsContact O-N 3.08Å; C197-A200 PolarHBondContact O-N 3.11Å; N198-A200 VanDerWaalsContact C-N 3.32Å; N198-A200 PolarHBondContact O-N 2.93Å; A200-P227 WeakPolarHBondContact O-CD 3.36Å; A200-L230 HydrophobicContact CB-CD1 3.52Å
201S89.9Confident75.4Confident21 Ų2189.6 Ų89.615%0.14747%0.469CS..  trans-76.2142.3-174.877.80000112.2C197 N198 N199 Y224 V225C197-S201 WeakPolarHBondContact O-CB 3.4Å; C197-S201 PolarHBondContact O-N 3.26Å; N198-S201 WeakPolarHBondContact O-CB 3.25Å; N198-S201 PolarHBondContact O-N 3.28Å; N198-S201 VanDerWaalsContact O-N 3.13Å; N198-S201 PolarHBondContact O-OG 3.29Å; N199-S201 VanDerWaalsContact C-N 3.29Å; S201-Y224 VanDerWaalsContact OG-CD1 3.25Å; S201-Y224 WeakPolarHBondContact OG-CD1 3.22Å; S201-V225 WeakPolarHBondContact CA-O 3.09Å
202I86.7Confident72.9Confident78 Ų7888.4 Ų88.440%0.446%0.463SS..EExtended strand (participates in β ladder)trans-117.9145.3170.463.7172.8000109.4H181 V225H181-I202 WeakPolarHBondContact NE2-CD1 3.34Å; I202-V225 HydrophobicContact CD1-CG2 4.17Å; I202-V225 HydrophobicContact CG1-CG2 3.55Å; I202-V225 PolarHBondContact N-O 3.47Å; I202-V225 PolarHBondContact O-N 2.87Å
203L77.8Confident70.2Confident63 Ų6390 Ų9033%0.3348%0.481SS..EExtended strand (participates in β ladder)trans-74128.7175.2-172.668000109.4K205 L211 L223 Y224L203-K205 PolarHBondContact O-N 3.49Å; L203-L211 HydrophobicContact CD2-CD1 3.54Å; L203-L223 HydrophobicContact CD1-CB 3.73Å; L203-L223 HydrophobicContact CD1-CD2 4.09Å; L203-L223 HydrophobicContact CD1-CG 4.5Å; L203-Y224 HydrophobicContact CD1-CE1 4.47Å
204T66.3Low67.9Low29 Ų2991.8 Ų91.818%0.17849%0.494CS..  trans-68.7117.5170.1-53.60000108.9P144 N206 L223 V225P144-T204 HydrophobicContact CB-CG2 4.3Å; P144-T204 HydrophobicContact CG-CG2 4.11Å; P144-T204 WeakPolarHBondContact CG-OG1 3.4Å; T204-N206 VanDerWaalsContact C-N 3.3Å; T204-N206 PolarHBondContact O-N 2.98Å; T204-L223 PolarHBondContact N-O 3.36Å; T204-V225 VanDerWaalsContact OG1-CG1 3.28Å; T204-V225 WeakPolarHBondContact OG1-CG1 3.43Å
205K55.2Low65.2Low193 Ų19395.9 Ų95.984%0.83951%0.51SS*.  trans-69.787.5171.9-173.1-179.4-178.6177.40108.8L203 K207L203-K205 PolarHBondContact O-N 3.49Å; K205-K207 PolarHBondContact O-N 3.46Å
206N53.3Low62.7Low63 Ų6392.9 Ų92.934%0.33750%0.504SS..  trans-64.7127.8162.7-170.4-15.4000107.6T204 N208 T209T204-N206 VanDerWaalsContact C-N 3.3Å; T204-N206 PolarHBondContact O-N 2.98Å; N206-N208 PolarHBondContact O-N 3.11Å; N206-N208 PolarHBondContact OD1-N 3.41Å; N206-T209 WeakPolarHBondContact CB-OG1 3.32Å; N206-T209 PolarHBondContact ND2-OG1 3.19Å
207K50Low60.4Low195 Ų19595.1 Ų95.185%0.84853%0.526SS*.THydrogen-bonded Turntrans-55.5-20.8179.8-88.4-179.4176.8174.50113.1K205K205-K207 PolarHBondContact O-N 3.46Å
208N47.4Very low57.9Low146 Ų146102.5 Ų102.578%0.78156%0.56SS**THydrogen-bonded Turntrans-121.78.8-169.7-63.5-12.5000115.6N206N206-N208 PolarHBondContact O-N 3.11Å; N206-N208 PolarHBondContact OD1-N 3.41Å
209T49.3Very low56Low87 Ų87104.6 Ų104.653%0.53457%0.571SS.*SBendtrans-112.4121.1178-36.90000110.8N206 L211N206-T209 WeakPolarHBondContact CB-OG1 3.32Å; N206-T209 PolarHBondContact ND2-OG1 3.19Å; T209-L211 PolarHBondContact O-N 3.18Å
210P40.1Very low54.5Low113 Ų113102.2 Ų102.273%0.73456%0.558SS**PPolyproline II helixtrans-57.4137.8170.2-20.531.4000110.4P212P210-P212 WeakPolarHBondContact O-CD 3.46Å
211L42.2Very low53.2Low133 Ų133104 Ų10470%0.69656%0.562SS**PPolyproline II helixtrans-52.2119.1177.7-155.879.3000109.5L203 T209 T213L203-L211 HydrophobicContact CD2-CD1 3.54Å; T209-L211 PolarHBondContact O-N 3.18Å; L211-T213 PolarHBondContact O-N 3.37Å
212P41.8Very low52Low70 Ų70105.1 Ų105.146%0.45556%0.564SS.*PPolyproline II helixtrans-61.1124.7166.2-17.530.4000107.4P210 L223P210-P212 WeakPolarHBondContact O-CD 3.46Å; P212-L223 HydrophobicContact CG-CD2 4.15Å
213T38.6Very low51.2Low107 Ų107103.1 Ų103.166%0.65655%0.554SS**PPolyproline II helixtrans-55.6137.2174-19.90000108L211 Q215 S216L211-T213 PolarHBondContact O-N 3.37Å; T213-Q215 PolarHBondContact O-N 2.78Å; T213-S216 PolarHBondContact O-N 3.38Å
214P45.8Very low51.5Low127 Ų127103.4 Ų103.483%0.82555%0.552SS**THydrogen-bonded Turntrans-65.817-174.223.4-32.6000115.4
215Q34.4Very low52.7Low174 Ų174102 Ų10281%0.81354%0.543SS*.THydrogen-bonded Turntrans-111.39.1179.7-67.3-174.3-8.700114T213 P217T213-Q215 PolarHBondContact O-N 2.78Å; Q215-P217 VanDerWaalsContact O-CD 3.3Å; Q215-P217 WeakPolarHBondContact O-CD 3.36Å
216S38.5Very low54.5Low72 Ų7292.8 Ų92.850%0.50350%0.503SS..  trans-73.3118.7166.1-177.30000109.5T213 Q218T213-S216 PolarHBondContact O-N 3.38Å; S216-Q218 PolarHBondContact O-N 3.13Å; S216-Q218 VanDerWaalsContact O-N 3.11Å
217P44.1Very low56.5Low129 Ų12990.9 Ų90.984%0.83849%0.494SS*.SBendtrans-70.6-4.6-177.7-13.428.4000113.8Q215Q215-P217 VanDerWaalsContact O-CD 3.3Å; Q215-P217 WeakPolarHBondContact O-CD 3.36Å
218Q42.5Very low58.6Low155 Ų15585.8 Ų85.872%0.72447%0.47SS*.SBendtrans-107.490.8174.7-63.1-149.2-20.100109S216 N220S216-Q218 PolarHBondContact O-N 3.13Å; S216-Q218 VanDerWaalsContact O-N 3.11Å; Q218-N220 VanDerWaalsContact C-N 3.33Å; Q218-N220 PolarHBondContact O-N 3.1Å
219I49.6Very low60.9Low88 Ų8885.2 Ų85.245%0.45146%0.458SS..  trans-61.498.5169.1-59.2171.5000106.5H221 Y224I219-H221 PolarHBondContact O-N 3.41Å; I219-H221 PolarHBondContact O-ND1 3.04Å; I219-Y224 HydrophobicContact CG2-CD2 4.37Å; I219-Y224 HydrophobicContact CG2-CE2 3.69Å
220N60.6Low63.2Low77 Ų7781.1 Ų81.141%0.41243%0.433SS..  trans-71.886.6168.8-87.1-11.2000107.5Q218 H222 L223Q218-N220 VanDerWaalsContact C-N 3.33Å; Q218-N220 PolarHBondContact O-N 3.1Å; N220-H222 PolarHBondContact O-N 3.35Å; N220-L223 HydrophobicContact CB-CD1 3.57Å; N220-L223 WeakPolarHBondContact O-CD1 3.3Å; N220-L223 PolarHBondContact O-N 3Å
221H63.2Low65.8Low65 Ų6576.2 Ų76.230%0.30140%0.402SS..G310 helixtrans-51.7-22.4-179-6886.7000112.8Y184 N198 I219 L223 Y224Y184-H221 WeakPolarHBondContact CB-O 3.42Å; Y184-H221 HydrophobicContact CD1-CB 3.69Å; Y184-H221 AromaticContact CD1-CD2 3.82Å; Y184-H221 HydrophobicContact CE1-CB 4.1Å; Y184-H221 AromaticContact CE1-CD2 3.37Å; Y184-H221 WeakPolarHBondContact CE1-CD2 3.37Å; Y184-H221 AromaticContact CE1-CG 3.97Å; Y184-H221 HydrophobicContact CG-CB 4.22Å; Y184-H221 AromaticContact CZ-CD2 3.52Å; N198-H221 PolarHBondContact OD1-CD2 3.41Å; I219-H221 PolarHBondContact O-N 3.41Å; I219-H221 PolarHBondContact O-ND1 3.04Å; H221-L223 PolarHBondContact O-N 3.46Å; H221-Y224 PolarHBondContact O-N 2.9Å; H221-Y224 VanDerWaalsContact O-N 3.13Å
222H64.5Low68.4Low43 Ų4370.4 Ų70.420%0.19937%0.37CS..G310 helixtrans-64.4-12.1174.3-58.1-54.9000115.5P144 G145 T150 A153 N220P144-H222 WeakPolarHBondContact CA-O 3.48Å; G145-H222 PolarHBondContact N-O 2.92Å; T150-H222 HydrophobicContact CG2-CB 4.35Å; A153-H222 WeakPolarHBondContact CB-ND1 3.22Å; N220-H222 PolarHBondContact O-N 3.35Å
223L70.8Confident70.9Confident36 Ų3671.2 Ų71.219%0.18838%0.376CS..G310 helixtrans-84.4-16.5174.1-82.978000112.9L203 T204 P212 N220 H221L203-L223 HydrophobicContact CD1-CB 3.73Å; L203-L223 HydrophobicContact CD1-CD2 4.09Å; L203-L223 HydrophobicContact CD1-CG 4.5Å; T204-L223 PolarHBondContact N-O 3.36Å; P212-L223 HydrophobicContact CG-CD2 4.15Å; N220-L223 HydrophobicContact CB-CD1 3.57Å; N220-L223 WeakPolarHBondContact O-CD1 3.3Å; N220-L223 PolarHBondContact O-N 3Å; H221-L223 PolarHBondContact O-N 3.46Å
224Y82.7Confident73.5Confident69 Ų6969.5 Ų69.527%0.27136%0.36SS..EExtended strand (participates in β ladder)trans-97.6143.8-169.6-66.6-88.7000111.4Y184 S201 L203 I219 H221Y184-Y224 WeakPolarHBondContact CB-O 3.21Å; Y184-Y224 PolarHBondContact N-O 3.49Å; S201-Y224 VanDerWaalsContact OG-CD1 3.25Å; S201-Y224 WeakPolarHBondContact OG-CD1 3.22Å; L203-Y224 HydrophobicContact CD1-CE1 4.47Å; I219-Y224 HydrophobicContact CG2-CD2 4.37Å; I219-Y224 HydrophobicContact CG2-CE2 3.69Å; H221-Y224 PolarHBondContact O-N 2.9Å; H221-Y224 VanDerWaalsContact O-N 3.13Å
225V91.5Very high75.9Confident0 Ų063.5 Ų63.50%032%0.322CS..EExtended strand (participates in β ladder)trans-117.4146.6169.1-63.30000109P144 I177 H181 V182 S201 I202 T204P144-V225 HydrophobicContact CG-CG1 4.03Å; I177-V225 HydrophobicContact CG2-CG1 4.1Å; H181-V225 HydrophobicContact CB-CB 4.17Å; H181-V225 HydrophobicContact CB-CG2 4.15Å; V182-V225 CarbonylContact O-C 3.52Å; V182-V225 WeakPolarHBondContact O-CA 3.49Å; V182-V225 WeakPolarHBondContact O-CB 3.38Å; S201-V225 WeakPolarHBondContact CA-O 3.09Å; I202-V225 HydrophobicContact CD1-CG2 4.17Å; I202-V225 HydrophobicContact CG1-CG2 3.55Å; I202-V225 PolarHBondContact N-O 3.47Å; I202-V225 PolarHBondContact O-N 2.87Å; T204-V225 VanDerWaalsContact OG1-CG1 3.28Å; T204-V225 WeakPolarHBondContact OG1-CG1 3.43Å
226I93.7Very high78.9Confident0 Ų055.2 Ų55.20%028%0.283CS..EExtended strand (participates in β ladder)trans-119.9156.1-179.263.7177.7000109.5H181 V182 Y184 C187 L230H181-I226 CarbonylContact C-O 3.54Å; H181-I226 WeakPolarHBondContact CA-O 3.02Å; V182-I226 HydrophobicContact CG2-CD1 4.18Å; V182-I226 HydrophobicContact CG2-CG1 3.64Å; V182-I226 PolarHBondContact N-O 3.26Å; V182-I226 PolarHBondContact O-N 2.83Å; Y184-I226 HydrophobicContact CD2-CG2 3.7Å; Y184-I226 HydrophobicContact CE2-CG2 4.39Å; Y184-I226 HydrophobicContact CG-CG2 4.46Å; C187-I226 HydrophobicContact CB-CD1 3.57Å; I226-L230 HydrophobicContact CD1-CB 4.12Å
227P95.3Very high81.6Confident22 Ų2252.3 Ų52.314%0.14326%0.262CS..EExtended strand (participates in β ladder)trans-57.4141.6169.9-25.433.9000112.8A200 Y229 L230A200-P227 WeakPolarHBondContact O-CD 3.36Å; P227-Y229 HydrophobicContact CB-CD1 3.53Å; P227-Y229 HydrophobicContact CB-CE1 3.18Å; P227-Y229 HydrophobicContact CB-CG 4.47Å; P227-Y229 HydrophobicContact CG-CE1 3.83Å; P227-Y229 PolarHBondContact O-N 3.19Å; P227-Y229 VanDerWaalsContact O-N 3.14Å; P227-L230 PolarHBondContact O-N 3.26Å; P227-L230 VanDerWaalsContact O-N 3.14Å
228Y94.9Very high84Confident88 Ų8849.5 Ų49.535%0.34524%0.24SC..G310 helixtrans-60.2-26.9-175.774.9-94.4000114.3Y167 Q180 L230 A231Y167-Y228 HydrophobicContact CD2-CD2 4.08Å; Y167-Y228 HydrophobicContact CD2-CG 4.38Å; Y167-Y228 AromaticContact CE2-CD2 3.56Å; Y167-Y228 HydrophobicContact CE2-CD2 3.56Å; Y167-Y228 HydrophobicContact CE2-CE2 4.29Å; Y167-Y228 HydrophobicContact CE2-CG 4.25Å; Q180-Y228 HydrophobicContact CB-CD1 3.74Å; Q180-Y228 HydrophobicContact CB-CE1 3.95Å; Q180-Y228 HydrophobicContact CG-CD1 4.31Å; Q180-Y228 HydrophobicContact CG-CE1 4.13Å; Q180-Y228 WeakPolarHBondContact O-CD1 3.26Å; Q180-Y228 PolarHBondContact O-N 3.42Å; Y228-L230 PolarHBondContact O-N 2.94Å; Y228-A231 WeakPolarHBondContact O-CB 3.32Å; Y228-A231 PolarHBondContact O-N 3.37Å
229Y95.2Very high86.5Confident135 Ų13545.2 Ų45.253%0.52922%0.217SC..G310 helixtrans-68.6-13.2-178.869.5-99.1000113.2P227P227-Y229 HydrophobicContact CB-CD1 3.53Å; P227-Y229 HydrophobicContact CB-CE1 3.18Å; P227-Y229 HydrophobicContact CB-CG 4.47Å; P227-Y229 HydrophobicContact CG-CE1 3.83Å; P227-Y229 PolarHBondContact O-N 3.19Å; P227-Y229 VanDerWaalsContact O-N 3.14Å
230L96.2Very high88.6Confident0 Ų041 Ų410%020%0.196CC..G310 helixtrans-90.5-2.2172.8-63.5174.6000112.7D188 Y192 A200 I226 P227 Y228D188-L230 PolarHBondContact N-O 3.16Å; Y192-L230 HydrophobicContact CD1-CD2 3.72Å; Y192-L230 HydrophobicContact CD2-CB 4.41Å; Y192-L230 HydrophobicContact CD2-CD2 3.8Å; Y192-L230 HydrophobicContact CE1-CD2 3.63Å; Y192-L230 HydrophobicContact CE2-CB 4.42Å; Y192-L230 HydrophobicContact CE2-CD2 3.72Å; Y192-L230 HydrophobicContact CG-CD2 3.81Å; A200-L230 HydrophobicContact CB-CD1 3.52Å; I226-L230 HydrophobicContact CD1-CB 4.12Å; P227-L230 PolarHBondContact O-N 3.26Å; P227-L230 VanDerWaalsContact O-N 3.14Å; Y228-L230 PolarHBondContact O-N 2.94Å
231A96.5Very high90.1Very high10 Ų1040.8 Ų40.88%0.08319%0.191CC..BIsolated β-bridgetrans-84.6154.5-171.400000112.9C162 Y167 V182 C186 Y228C162-A231 HydrophobicContact CB-CB 4.38Å; Y167-A231 HydrophobicContact CD1-CB 4.34Å; Y167-A231 HydrophobicContact CG-CB 4.31Å; V182-A231 HydrophobicContact CG2-CB 3.84Å; C186-A231 HydrophobicContact CB-CB 4.04Å; C186-A231 CarbonylContact O-C 3.12Å; C186-A231 VanDerWaalsContact O-CA 3.25Å; C186-A231 WeakPolarHBondContact O-CA 3.45Å; Y228-A231 WeakPolarHBondContact O-CB 3.32Å; Y228-A231 PolarHBondContact O-N 3.37Å
232Y96.1Very high91.6Very high11 Ų1143.1 Ų43.14%0.04321%0.206CC..  trans-56.3131.4164.3-66.2-66.9000110.9H160 C162 C186 C187 D188 L189 E234H160-Y232 VanDerWaalsContact C-CD2 3.41Å; H160-Y232 VanDerWaalsContact C-CG 3.47Å; H160-Y232 HydrophobicContact CB-CD1 4.1Å; H160-Y232 HydrophobicContact CB-CD2 4.42Å; H160-Y232 HydrophobicContact CB-CE1 3.61Å; H160-Y232 HydrophobicContact CB-CE2 3.97Å; H160-Y232 HydrophobicContact CB-CG 4.48Å; H160-Y232 AromaticContact CG-CZ 3.86Å; H160-Y232 AromaticContact ND1-CZ 3.5Å; H160-Y232 PolarHBondContact ND1-OH 3.2Å; C162-Y232 WeakPolarHBondContact CB-O 3.28Å; C186-Y232 WeakPolarHBondContact O-CD2 3.44Å; C186-Y232 PolarHBondContact O-N 3.48Å; C187-Y232 WeakPolarHBondContact O-CE2 3.36Å; C187-Y232 VanDerWaalsContact O-CZ 3.31Å; C187-Y232 PolarHBondContact O-OH 2.71Å; D188-Y232 HydrophobicContact CB-CD1 3.79Å; D188-Y232 HydrophobicContact CB-CE1 3.78Å; D188-Y232 HydrophobicContact CB-CG 4.35Å; D188-Y232 WeakPolarHBondContact OD1-CE1 3.38Å; L189-Y232 PolarHBondContact N-OH 2.83Å; Y232-E234 VanDerWaalsContact C-N 3.32Å; Y232-E234 PolarHBondContact O-N 3.35Å
233P93.7Very high92.9Very high88 Ų8845.1 Ų45.157%0.57122%0.218SC*.SBendtrans-72.5-25.8-178.827.8-34.3000112.9
234E94.7Very high93.8Very high70 Ų7044.2 Ų44.233%0.32721%0.212SC..SBendtrans-89.5139-174.7-69.5-173.9-141.900113.7C161 C162 Y232 N238 R239C161-E234 CarbonylContact C-O 3.49Å; C161-E234 WeakPolarHBondContact CA-O 3.33Å; C161-E234 WeakPolarHBondContact CB-O 3.3Å; C162-E234 PolarHBondContact N-O 2.77Å; Y232-E234 VanDerWaalsContact C-N 3.32Å; Y232-E234 PolarHBondContact O-N 3.35Å; E234-N238 PolarHBondContact OE2-ND2 3.32Å; E234-N238 VanDerWaalsContact OE2-ND2 3.1Å; E234-R239 IonicContact OE1-CZ 3.65Å; E234-R239 IonicContact OE1-NE 2.93Å; E234-R239 IonicContact OE1-NH2 2.74Å; E234-R239 PolarHBondContact OE1-NH2 2.73Å; E234-R239 IonicContact OE2-CZ 3.11Å; E234-R239 IonicContact OE2-NE 2.98Å; E234-R239 PolarHBondContact OE2-NE 3.07Å; E234-R239 IonicContact OE2-NH2 3.97Å; E234-R239 PolarHBondContact OE2-NH2 3.41Å
235G95.9Very high94.2Very high1 Ų141.8 Ų41.81%0.0120%0.204CC..  trans-71.5151171.600000115C162 R164 G165 V237 N238 R239C162-G235 WeakPolarHBondContact O-CA 3.25Å; R164-G235 CarbonylContact O-C 3.48Å; R164-G235 WeakPolarHBondContact O-CA 3.36Å; G165-G235 WeakPolarHBondContact O-CA 3.36Å; G165-G235 PolarHBondContact O-N 3.19Å; G235-V237 VanDerWaalsContact C-N 3.33Å; G235-V237 PolarHBondContact O-N 3.47Å; G235-N238 PolarHBondContact O-N 3.48Å; G235-R239 PolarHBondContact O-N 3.06Å
236C95.8Very high94.4Very high0 Ų044.7 Ų44.70%022%0.222CC..Hα-helixtrans-68.8-28-178.4-64.70000113.9M152 I155 C161 G163 R164 N238 R239 L240M152-C236 HydrophobicContact CE-CB 3.96Å; M152-C236 VanDerWaalsContact CE-SG 3.5Å; I155-C236 HydrophobicContact CG2-CB 4.16Å; C161-C236 HydrophobicContact CB-CB 3.93Å; C161-C236 WeakPolarHBondContact CB-SG 3.07Å; C161-C236 WeakPolarHBondContact SG-CA 3.42Å; C161-C236 WeakPolarHBondContact SG-CB 3.44Å; C161-C236 CovalentContact SG-SG 2.04Å; C161-C236 PolarHBondContact SG-SG 2.97Å; G163-C236 WeakPolarHBondContact O-CB 3.26Å; G163-C236 PolarHBondContact O-N 3.07Å; G163-C236 PolarHBondContact O-SG 3.15Å; R164-C236 PolarHBondContact O-N 3.43Å; C236-N238 VanDerWaalsContact C-N 3.29Å; C236-N238 PolarHBondContact O-N 3.36Å; C236-R239 PolarHBondContact O-N 3.34Å; C236-L240 WeakPolarHBondContact O-CB 3.16Å; C236-L240 WeakPolarHBondContact O-CD1 3.34Å; C236-L240 VanDerWaalsContact O-CG 3.25Å; C236-L240 WeakPolarHBondContact O-CG 3.39Å; C236-L240 PolarHBondContact O-N 2.9Å
237V95.6Very high94.3Very high12 Ų1249.3 Ų49.37%0.07325%0.246CC..Hα-helixtrans-63.3-39176.2175.70000110.9L131 V135 R164 G235 L240 K241L131-V237 HydrophobicContact CD2-CG1 4.38Å; V135-V237 HydrophobicContact CB-CG2 3.97Å; V135-V237 HydrophobicContact CG1-CG2 3.88Å; V135-V237 HydrophobicContact CG2-CG2 4.24Å; R164-V237 HydrophobicContact CG-CG2 3.58Å; R164-V237 WeakPolarHBondContact O-CB 3.24Å; R164-V237 WeakPolarHBondContact O-CG2 3.36Å; R164-V237 PolarHBondContact O-N 3.07Å; G235-V237 VanDerWaalsContact C-N 3.33Å; G235-V237 PolarHBondContact O-N 3.47Å; V237-L240 PolarHBondContact O-N 3.45Å; V237-K241 HydrophobicContact CG1-CD 3.9Å; V237-K241 HydrophobicContact CG1-CG 4.32Å; V237-K241 WeakPolarHBondContact O-CB 3.15Å; V237-K241 WeakPolarHBondContact O-CG 3.01Å; V237-K241 PolarHBondContact O-N 2.89Å
238N94.9Very high94.1Very high69 Ų6948.9 Ų48.937%0.36924%0.243SC..Hα-helixtrans-62.6-50.4177.6-177.258.2000111.2E234 G235 C236 L240 K241 N242E234-N238 PolarHBondContact OE2-ND2 3.32Å; E234-N238 VanDerWaalsContact OE2-ND2 3.1Å; G235-N238 PolarHBondContact O-N 3.48Å; C236-N238 VanDerWaalsContact C-N 3.29Å; C236-N238 PolarHBondContact O-N 3.36Å; N238-L240 VanDerWaalsContact C-N 3.32Å; N238-L240 PolarHBondContact O-N 2.98Å; N238-K241 PolarHBondContact O-N 2.91Å; N238-N242 WeakPolarHBondContact O-CB 3.4Å; N238-N242 PolarHBondContact O-N 3.26Å; N238-N242 PolarHBondContact OD1-ND2 3.41Å
239R94.6Very high94Very high65 Ų6547.3 Ų47.325%0.24524%0.24CC..Hα-helixtrans-60.4-41.6177.2-68.7-75.1168.7149-3.7111.7L159 C161 E234 G235 C236 L243 F244L159-R239 HydrophobicContact CB-CB 4.3Å; L159-R239 HydrophobicContact CD1-CB 4.48Å; C161-R239 HydrophobicContact CB-CG 4.06Å; E234-R239 IonicContact OE1-CZ 3.65Å; E234-R239 IonicContact OE1-NE 2.93Å; E234-R239 IonicContact OE1-NH2 2.74Å; E234-R239 PolarHBondContact OE1-NH2 2.73Å; E234-R239 IonicContact OE2-CZ 3.11Å; E234-R239 IonicContact OE2-NE 2.98Å; E234-R239 PolarHBondContact OE2-NE 3.07Å; E234-R239 IonicContact OE2-NH2 3.97Å; E234-R239 PolarHBondContact OE2-NH2 3.41Å; G235-R239 PolarHBondContact O-N 3.06Å; C236-R239 PolarHBondContact O-N 3.34Å; R239-L243 WeakPolarHBondContact O-CA 3.15Å; R239-L243 VanDerWaalsContact O-CB 3.25Å; R239-L243 WeakPolarHBondContact O-CB 3.29Å; R239-L243 PolarHBondContact O-N 2.98Å; R239-F244 PolarHBondContact O-N 2.88Å; R239-F244 VanDerWaalsContact O-N 3.07Å
240L94Very high94Very high0 Ų043.7 Ų43.70%024%0.235CC..Iπ-helixtrans-65.9-40.8178.5-74.5163000112.9L63 W127 L131 V135 I155 L159 C236 V237 N238 F244 L245L63-L240 HydrophobicContact CD1-CD2 3.73Å; L63-L240 HydrophobicContact CD2-CD1 3.7Å; L63-L240 HydrophobicContact CD2-CD2 3.44Å; L63-L240 VanDerWaalsContact CD2-CD2 3.44Å; L63-L240 HydrophobicContact CD2-CG 4.24Å; L63-L240 HydrophobicContact CG-CD2 4.23Å; W127-L240 HydrophobicContact CH2-CD2 4.05Å; W127-L240 HydrophobicContact CZ2-CB 4.13Å; W127-L240 HydrophobicContact CZ2-CD2 3.81Å; L131-L240 HydrophobicContact CD1-CB 4.03Å; L131-L240 HydrophobicContact CD1-CD1 3.74Å; L131-L240 HydrophobicContact CD1-CG 4.34Å; L131-L240 HydrophobicContact CD2-CB 3.99Å; V135-L240 HydrophobicContact CG2-CD1 4.07Å; I155-L240 HydrophobicContact CG2-CD1 4.22Å; L159-L240 HydrophobicContact CD1-CD1 4.39Å; L159-L240 HydrophobicContact CD1-CD2 3.41Å; L159-L240 VanDerWaalsContact CD1-CD2 3.41Å; L159-L240 HydrophobicContact CD1-CG 3.61Å; C236-L240 WeakPolarHBondContact O-CB 3.16Å; C236-L240 WeakPolarHBondContact O-CD1 3.34Å; C236-L240 VanDerWaalsContact O-CG 3.25Å; C236-L240 WeakPolarHBondContact O-CG 3.39Å; C236-L240 PolarHBondContact O-N 2.9Å; V237-L240 PolarHBondContact O-N 3.45Å; N238-L240 VanDerWaalsContact C-N 3.32Å; N238-L240 PolarHBondContact O-N 2.98Å; L240-F244 HydrophobicContact CD2-CB 4.32Å; L240-F244 HydrophobicContact CD2-CD1 4.3Å; L240-F244 HydrophobicContact CD2-CG 4.36Å; L240-L245 VanDerWaalsContact O-CB 3.28Å; L240-L245 WeakPolarHBondContact O-CB 3.29Å; L240-L245 PolarHBondContact O-N 3.48Å
241K93.3Very high93.9Very high73 Ų7345 Ų4532%0.31724%0.243SC..Iπ-helixtrans-76.8-41.4179.9-72.8-178.6179.91730113.1L131 E132 V237 N238 P246L131-K241 HydrophobicContact CD2-CD 4.44Å; L131-K241 HydrophobicContact CD2-CG 3.68Å; E132-K241 IonicContact OE2-NZ 2.78Å; E132-K241 PolarHBondContact OE2-NZ 3.44Å; V237-K241 HydrophobicContact CG1-CD 3.9Å; V237-K241 HydrophobicContact CG1-CG 4.32Å; V237-K241 WeakPolarHBondContact O-CB 3.15Å; V237-K241 WeakPolarHBondContact O-CG 3.01Å; V237-K241 PolarHBondContact O-N 2.89Å; N238-K241 PolarHBondContact O-N 2.91Å; K241-P246 WeakPolarHBondContact O-CD 3.46Å
242N92.9Very high93.9Very high114 Ų11444.5 Ų44.561%0.6124%0.239SC*.Iπ-helixtrans-102.3-19.3-167.8-67.7-28.4000114.2N238N238-N242 WeakPolarHBondContact O-CB 3.4Å; N238-N242 PolarHBondContact O-N 3.26Å; N238-N242 PolarHBondContact OD1-ND2 3.41Å
243L91.9Very high93.9Very high85 Ų8546.9 Ų46.945%0.44526%0.257SS..Iπ-helixtrans-110.4-53.9177.6179.864.7000111.4R239 I247R239-L243 WeakPolarHBondContact O-CA 3.15Å; R239-L243 VanDerWaalsContact O-CB 3.25Å; R239-L243 WeakPolarHBondContact O-CB 3.29Å; R239-L243 PolarHBondContact O-N 2.98Å; L243-I247 VanDerWaalsContact O-CD1 3.32Å; L243-I247 WeakPolarHBondContact O-CD1 3.41Å; L243-I247 WeakPolarHBondContact O-CG1 3.28Å
244F90.4Very high94Very high16 Ų1646.6 Ų46.67%0.0725%0.25CS..Iπ-helixtrans-77.2-50.4-171.5-178.7-94.6000113.5M59 F60 L63 W127 R239 L240 I247 V248M59-F244 HydrophobicContact CE-CD2 4.18Å; M59-F244 HydrophobicContact CE-CE2 3.69Å; M59-F244 HydrophobicContact CE-CZ 4.39Å; F60-F244 HydrophobicContact CD1-CZ 4.13Å; F60-F244 AromaticContact CE1-CE2 3.78Å; F60-F244 HydrophobicContact CE1-CE2 3.78Å; F60-F244 AromaticContact CE1-CZ 3.36Å; F60-F244 HydrophobicContact CE1-CZ 3.36Å; F60-F244 HydrophobicContact CE2-CE2 4.06Å; F60-F244 HydrophobicContact CE2-CZ 4.45Å; F60-F244 AromaticContact CZ-CE2 3.41Å; F60-F244 HydrophobicContact CZ-CE2 3.41Å; F60-F244 VanDerWaalsContact CZ-CE2 3.41Å; F60-F244 AromaticContact CZ-CZ 3.54Å; F60-F244 HydrophobicContact CZ-CZ 3.54Å; L63-F244 HydrophobicContact CD1-CE1 4.43Å; L63-F244 HydrophobicContact CD1-CZ 4.35Å; W127-F244 AromaticContact CH2-CD1 3.49Å; W127-F244 HydrophobicContact CH2-CD1 3.49Å; W127-F244 VanDerWaalsContact CH2-CD1 3.49Å; W127-F244 AromaticContact CH2-CE1 3.33Å; W127-F244 HydrophobicContact CH2-CE1 3.33Å; W127-F244 HydrophobicContact CH2-CZ 4.46Å; W127-F244 AromaticContact CZ2-CD1 3.6Å; W127-F244 HydrophobicContact CZ2-CD1 3.6Å; W127-F244 AromaticContact CZ2-CE1 3.94Å; W127-F244 HydrophobicContact CZ2-CE1 3.94Å; W127-F244 HydrophobicContact CZ3-CD1 4.47Å; W127-F244 AromaticContact CZ3-CE1 3.98Å; W127-F244 HydrophobicContact CZ3-CE1 3.98Å; R239-F244 PolarHBondContact O-N 2.88Å; R239-F244 VanDerWaalsContact O-N 3.07Å; L240-F244 HydrophobicContact CD2-CB 4.32Å; L240-F244 HydrophobicContact CD2-CD1 4.3Å; L240-F244 HydrophobicContact CD2-CG 4.36Å; F244-I247 WeakPolarHBondContact O-CB 3.11Å; F244-I247 PolarHBondContact O-N 2.89Å; F244-I247 VanDerWaalsContact O-N 3.15Å; F244-V248 HydrophobicContact CD1-CG2 4.21Å; F244-V248 HydrophobicContact CE1-CG2 3.71Å; F244-V248 HydrophobicContact CZ-CG2 3.92Å; F244-V248 PolarHBondContact O-N 3.17Å
245L91.1Very high94Very high18 Ų1843.4 Ų43.49%0.09424%0.235CC..Hα-helixtrans-57.6-42.9-177.1-176.966.3000113.5L124 W127 L240 I247 V248 I249L124-L245 HydrophobicContact CD2-CD1 3.58Å; L124-L245 HydrophobicContact CD2-CG 4.33Å; W127-L245 HydrophobicContact CD2-CD1 4.24Å; W127-L245 HydrophobicContact CG-CD1 4Å; L240-L245 VanDerWaalsContact O-CB 3.28Å; L240-L245 WeakPolarHBondContact O-CB 3.29Å; L240-L245 PolarHBondContact O-N 3.48Å; L245-I247 VanDerWaalsContact C-N 3.3Å; L245-I247 PolarHBondContact O-N 3.33Å; L245-V248 PolarHBondContact O-N 3.3Å; L245-I249 HydrophobicContact CD1-CD1 4.33Å; L245-I249 HydrophobicContact CD1-CG1 4.49Å; L245-I249 HydrophobicContact CD2-CD1 4.48Å; L245-I249 HydrophobicContact CG-CD1 3.89Å; L245-I249 HydrophobicContact CG-CG1 4.47Å; L245-I249 WeakPolarHBondContact O-CG1 3.48Å; L245-I249 PolarHBondContact O-N 2.98Å
246P94.6Very high94.1Very high61 Ų6144.8 Ų44.840%0.39624%0.242SC..Hα-helixtrans-62.7-33.6177.2-24.936.9000113.6K241 I249 S250K241-P246 WeakPolarHBondContact O-CD 3.46Å; P246-I249 PolarHBondContact O-N 3.16Å; P246-S250 VanDerWaalsContact O-CB 3.24Å; P246-S250 WeakPolarHBondContact O-CB 3.49Å; P246-S250 PolarHBondContact O-N 2.98Å
247I92.4Very high94.1Very high97 Ų9750.7 Ų50.750%0.49727%0.268SS..Hα-helixtrans-63.9-47.6176.4-64.3167.9000109.8L243 F244 L245 S250 C251L243-I247 VanDerWaalsContact O-CD1 3.32Å; L243-I247 WeakPolarHBondContact O-CD1 3.41Å; L243-I247 WeakPolarHBondContact O-CG1 3.28Å; F244-I247 WeakPolarHBondContact O-CB 3.11Å; F244-I247 PolarHBondContact O-N 2.89Å; F244-I247 VanDerWaalsContact O-N 3.15Å; L245-I247 VanDerWaalsContact C-N 3.3Å; L245-I247 PolarHBondContact O-N 3.33Å; I247-S250 PolarHBondContact O-N 3.32Å; I247-C251 PolarHBondContact O-N 3.29Å; I247-C251 PolarHBondContact O-SG 3.26Å; I247-C251 VanDerWaalsContact O-SG 3.41Å
248V91Very high94.1Very high13 Ų1351.4 Ų51.48%0.07927%0.271CS..Hα-helixtrans-61-48.4177.6178.50000110.8I72 F244 L245 S250 C251 F252I72-V248 HydrophobicContact CG2-CG1 4.14Å; F244-V248 HydrophobicContact CD1-CG2 4.21Å; F244-V248 HydrophobicContact CE1-CG2 3.71Å; F244-V248 HydrophobicContact CZ-CG2 3.92Å; F244-V248 PolarHBondContact O-N 3.17Å; L245-V248 PolarHBondContact O-N 3.3Å; V248-S250 VanDerWaalsContact C-N 3.31Å; V248-S250 PolarHBondContact O-N 2.87Å; V248-C251 PolarHBondContact O-N 3.1Å; V248-F252 HydrophobicContact CG1-CD2 4.09Å; V248-F252 HydrophobicContact CG1-CE2 4.06Å; V248-F252 WeakPolarHBondContact O-CD2 3.33Å; V248-F252 PolarHBondContact O-N 3.45Å
249I94.1Very high94.2Very high55 Ų5548.1 Ų48.128%0.28225%0.253SS..Hα-helixtrans-57.3-46.2177.2-68.4168.9000110.7L120 L124 L245 P246 C251 F252 C253L120-I249 HydrophobicContact CD1-CG1 4.44Å; L124-I249 HydrophobicContact CD1-CD1 4.45Å; L124-I249 HydrophobicContact CD1-CG1 4.36Å; L124-I249 HydrophobicContact CD2-CD1 3.75Å; L124-I249 HydrophobicContact CD2-CG1 3.72Å; L245-I249 HydrophobicContact CD1-CD1 4.33Å; L245-I249 HydrophobicContact CD1-CG1 4.49Å; L245-I249 HydrophobicContact CD2-CD1 4.48Å; L245-I249 HydrophobicContact CG-CD1 3.89Å; L245-I249 HydrophobicContact CG-CG1 4.47Å; L245-I249 WeakPolarHBondContact O-CG1 3.48Å; L245-I249 PolarHBondContact O-N 2.98Å; P246-I249 PolarHBondContact O-N 3.16Å; I249-C251 VanDerWaalsContact C-N 3.35Å; I249-C251 PolarHBondContact O-N 2.97Å; I249-F252 PolarHBondContact O-N 3.3Å; I249-C253 WeakPolarHBondContact O-CB 3.41Å; I249-C253 PolarHBondContact O-N 3.18Å; I249-C253 PolarHBondContact O-SG 2.92Å
250S95.2Very high94.3Very high59 Ų5949.7 Ų49.741%0.41327%0.265SS..Hα-helixtrans-58.7-44.6179.8-174.20000111.9P246 I247 V248 F252 C253 L254P246-S250 VanDerWaalsContact O-CB 3.24Å; P246-S250 WeakPolarHBondContact O-CB 3.49Å; P246-S250 PolarHBondContact O-N 2.98Å; I247-S250 PolarHBondContact O-N 3.32Å; V248-S250 VanDerWaalsContact C-N 3.31Å; V248-S250 PolarHBondContact O-N 2.87Å; S250-F252 PolarHBondContact O-N 2.96Å; S250-C253 PolarHBondContact O-N 2.96Å; S250-L254 WeakPolarHBondContact O-CB 3.47Å; S250-L254 VanDerWaalsContact O-CG 3.23Å; S250-L254 WeakPolarHBondContact O-CG 3.3Å; S250-L254 PolarHBondContact O-N 3.43Å
251C93.9Very high94.4Very high27 Ų2753.8 Ų53.818%0.18228%0.284CS..Hα-helixtrans-58.3-47.8176.5-69.70000112.6I247 V248 I249 L255I247-C251 PolarHBondContact O-N 3.29Å; I247-C251 PolarHBondContact O-SG 3.26Å; I247-C251 VanDerWaalsContact O-SG 3.41Å; V248-C251 PolarHBondContact O-N 3.1Å; I249-C251 VanDerWaalsContact C-N 3.35Å; I249-C251 PolarHBondContact O-N 2.97Å; C251-L255 WeakPolarHBondContact O-CG 3.44Å; C251-L255 PolarHBondContact O-N 3.04Å; C251-L255 VanDerWaalsContact O-N 3.15Å
252F95.1Very high94.5Very high1 Ų150.4 Ų50.40%0.00427%0.269CS..Hα-helixtrans-64.7-47.3177.3-85.4-90.8000112I76 F79 I119 L120 I123 V248 I249 S250 L254 L255 I256I76-F252 HydrophobicContact CD1-CE2 3.93Å; I76-F252 HydrophobicContact CG1-CD2 4.38Å; I76-F252 HydrophobicContact CG1-CE2 3.59Å; I76-F252 HydrophobicContact CG1-CZ 3.84Å; F79-F252 AromaticContact CD2-CE1 3.91Å; F79-F252 HydrophobicContact CD2-CE1 3.91Å; F79-F252 AromaticContact CE2-CE1 3.73Å; F79-F252 HydrophobicContact CE2-CE1 3.73Å; F79-F252 HydrophobicContact CE2-CZ 4.41Å; I119-F252 HydrophobicContact CG2-CE1 4.17Å; I119-F252 HydrophobicContact CG2-CZ 4.26Å; L120-F252 HydrophobicContact CB-CB 4.37Å; L120-F252 HydrophobicContact CB-CD1 3.98Å; L120-F252 HydrophobicContact CB-CE1 4.48Å; L120-F252 HydrophobicContact CB-CG 4.19Å; L120-F252 HydrophobicContact CD1-CB 3.92Å; L120-F252 HydrophobicContact CD1-CD2 4.04Å; L120-F252 HydrophobicContact CD1-CG 3.93Å; L120-F252 HydrophobicContact CD2-CB 3.93Å; L120-F252 HydrophobicContact CG-CB 4.29Å; L120-F252 HydrophobicContact CG-CG 4.46Å; I123-F252 HydrophobicContact CD1-CE2 4.19Å; I123-F252 HydrophobicContact CD1-CZ 3.84Å; V248-F252 HydrophobicContact CG1-CD2 4.09Å; V248-F252 HydrophobicContact CG1-CE2 4.06Å; V248-F252 WeakPolarHBondContact O-CD2 3.33Å; V248-F252 PolarHBondContact O-N 3.45Å; I249-F252 PolarHBondContact O-N 3.3Å; S250-F252 PolarHBondContact O-N 2.96Å; F252-L254 VanDerWaalsContact C-N 3.29Å; F252-L254 PolarHBondContact O-N 3.2Å; F252-L255 PolarHBondContact O-N 2.96Å; F252-I256 VanDerWaalsContact O-CG1 3.28Å; F252-I256 WeakPolarHBondContact O-CG1 3.48Å; F252-I256 PolarHBondContact O-N 2.97Å
253C96.3Very high94.7Very high61 Ų6145.5 Ų45.541%0.41224%0.243SC..Hα-helixtrans-60.9-38.7179.8-72.90000112.1I249 S250 F257I249-C253 WeakPolarHBondContact O-CB 3.41Å; I249-C253 PolarHBondContact O-N 3.18Å; I249-C253 PolarHBondContact O-SG 2.92Å; S250-C253 PolarHBondContact O-N 2.96Å; C253-F257 WeakPolarHBondContact O-CB 3.36Å; C253-F257 PolarHBondContact O-N 3.27Å
254L96.1Very high94.9Very high82 Ų8247.2 Ų47.243%0.42925%0.247SC..Hα-helixtrans-63.7-45.7175.1-75.4170.9000111.6S250 F252 F257 M258S250-L254 WeakPolarHBondContact O-CB 3.47Å; S250-L254 VanDerWaalsContact O-CG 3.23Å; S250-L254 WeakPolarHBondContact O-CG 3.3Å; S250-L254 PolarHBondContact O-N 3.43Å; F252-L254 VanDerWaalsContact C-N 3.29Å; F252-L254 PolarHBondContact O-N 3.2Å; L254-F257 PolarHBondContact O-N 3Å; L254-M258 WeakPolarHBondContact O-CB 3.4Å; L254-M258 WeakPolarHBondContact O-CG 3.45Å; L254-M258 PolarHBondContact O-N 2.04Å
255L95.7Very high95.1Very high2 Ų247.2 Ų47.21%0.0125%0.248CC..Hα-helixtrans-61.1-50.1176.5-71.7173.4000111.6I43 F79 C251 F252 F257 M258 N259I43-L255 HydrophobicContact CD1-CD2 3.91Å; I43-L255 HydrophobicContact CD1-CG 3.92Å; F79-L255 HydrophobicContact CB-CD1 4.25Å; C251-L255 WeakPolarHBondContact O-CG 3.44Å; C251-L255 PolarHBondContact O-N 3.04Å; C251-L255 VanDerWaalsContact O-N 3.15Å; F252-L255 PolarHBondContact O-N 2.96Å; L255-F257 PolarHBondContact O-N 3.31Å; L255-M258 PolarHBondContact O-N 3.43Å; L255-N259 WeakPolarHBondContact O-CB 3.4Å; L255-N259 VanDerWaalsContact O-CG 3.32Å; L255-N259 PolarHBondContact O-N 3.4Å; L255-N259 PolarHBondContact O-ND2 3.4Å
256I97Very high95.3Very high30 Ų3046.3 Ų46.315%0.15424%0.244CC..Hα-helixtrans-57.9-48.8179.1-68.1165.9000110.6E116 L120 F252 M258 N259 I260E116-I256 HydrophobicContact CB-CD1 3.99Å; E116-I256 HydrophobicContact CB-CG1 3.56Å; E116-I256 HydrophobicContact CG-CG1 4.47Å; E116-I256 WeakPolarHBondContact OE2-CA 3.32Å; E116-I256 VanDerWaalsContact OE2-CG1 3.32Å; E116-I256 WeakPolarHBondContact OE2-CG1 3.37Å; E116-I256 PolarHBondContact OE2-N 3.48Å; L120-I256 HydrophobicContact CD2-CD1 4.44Å; F252-I256 VanDerWaalsContact O-CG1 3.28Å; F252-I256 WeakPolarHBondContact O-CG1 3.48Å; F252-I256 PolarHBondContact O-N 2.97Å; I256-M258 VanDerWaalsContact C-N 3.32Å; I256-M258 PolarHBondContact O-N 2.91Å; I256-N259 PolarHBondContact O-N 2.97Å; I256-I260 HydrophobicContact CG2-CD1 3.65Å; I256-I260 HydrophobicContact CG2-CG1 4.38Å; I256-I260 WeakPolarHBondContact O-CB 3.5Å; I256-I260 VanDerWaalsContact O-CG1 3.3Å; I256-I260 WeakPolarHBondContact O-CG1 3.24Å; I256-I260 PolarHBondContact O-N 3.1Å
257F97.2Very high95.4Very high124 Ų12446 Ų4654%0.54424%0.243SC..Hα-helixtrans-58.7-45.7179.9175.6-97.3000111.3C253 L254 L255 I260 F261C253-F257 WeakPolarHBondContact O-CB 3.36Å; C253-F257 PolarHBondContact O-N 3.27Å; L254-F257 PolarHBondContact O-N 3Å; L255-F257 PolarHBondContact O-N 3.31Å; F257-I260 PolarHBondContact O-N 3.49Å; F257-F261 WeakPolarHBondContact O-CB 3.19Å; F257-F261 PolarHBondContact O-N 3.42Å
258M95.1Very high95.5Very high28 Ų2845.9 Ų45.914%0.13824%0.239CC..Hα-helixtrans-68.4-38.9-179.6-65.1-57.7-81.300112.2I35 L36 I39 L254 L255 I256 F261 A262I35-M258 HydrophobicContact CB-CE 3.99Å; I35-M258 HydrophobicContact CG2-CE 3.22Å; L36-M258 HydrophobicContact CD1-CB 3.87Å; I39-M258 HydrophobicContact CG1-CE 4.28Å; L254-M258 WeakPolarHBondContact O-CB 3.4Å; L254-M258 WeakPolarHBondContact O-CG 3.45Å; L254-M258 PolarHBondContact O-N 2.04Å; L255-M258 PolarHBondContact O-N 3.43Å; I256-M258 VanDerWaalsContact C-N 3.32Å; I256-M258 PolarHBondContact O-N 2.91Å; M258-F261 PolarHBondContact O-N 2.86Å; M258-A262 VanDerWaalsContact O-CB 3.24Å; M258-A262 WeakPolarHBondContact O-CB 3.38Å; M258-A262 PolarHBondContact O-N 3.09Å
259N95.9Very high95.6Very high0 Ų045.6 Ų45.60%024%0.236CC..Hα-helixtrans-60.2-48.6173.7-76-27000111.3L36 A113 E116 L255 I256 T263L36-N259 WeakPolarHBondContact CD1-OD1 3.23Å; A113-N259 HydrophobicContact CB-CB 4.11Å; E116-N259 PolarHBondContact OE1-ND2 2.87Å; E116-N259 PolarHBondContact OE2-ND2 3.37Å; L255-N259 WeakPolarHBondContact O-CB 3.4Å; L255-N259 VanDerWaalsContact O-CG 3.32Å; L255-N259 PolarHBondContact O-N 3.4Å; L255-N259 PolarHBondContact O-ND2 3.4Å; I256-N259 PolarHBondContact O-N 2.97Å; N259-T263 VanDerWaalsContact O-CB 3.31Å; N259-T263 WeakPolarHBondContact O-CB 3.44Å; N259-T263 PolarHBondContact O-N 3.04Å; N259-T263 PolarHBondContact O-OG1 3.26Å
260I96.7Very high95.6Very high97 Ų9744.5 Ų44.550%0.49723%0.232SC..Hα-helixtrans-64.9-43.5178.4-67.6172000111A113 I256 F257 T263 F264A113-I260 HydrophobicContact CB-CG1 3.97Å; I256-I260 HydrophobicContact CG2-CD1 3.65Å; I256-I260 HydrophobicContact CG2-CG1 4.38Å; I256-I260 WeakPolarHBondContact O-CB 3.5Å; I256-I260 VanDerWaalsContact O-CG1 3.3Å; I256-I260 WeakPolarHBondContact O-CG1 3.24Å; I256-I260 PolarHBondContact O-N 3.1Å; F257-I260 PolarHBondContact O-N 3.49Å; I260-T263 WeakPolarHBondContact O-CB 3.38Å; I260-T263 PolarHBondContact O-N 2.9Å; I260-F264 WeakPolarHBondContact O-CB 3.45Å; I260-F264 PolarHBondContact O-N 2.82Å
261F96.1Very high95.5Very high87 Ų8747.2 Ų47.238%0.38224%0.238SC..Hα-helixtrans-68-42.8-177.6-170.6-125.4000112.2L32 F257 M258 T263 F264 V265L32-F261 HydrophobicContact CD1-CD1 4.31Å; L32-F261 HydrophobicContact CD1-CE1 4.08Å; L32-F261 HydrophobicContact CD2-CD1 3.64Å; L32-F261 HydrophobicContact CD2-CE1 3.35Å; L32-F261 HydrophobicContact CD2-CZ 4.4Å; L32-F261 HydrophobicContact CG-CE1 4.38Å; F257-F261 WeakPolarHBondContact O-CB 3.19Å; F257-F261 PolarHBondContact O-N 3.42Å; M258-F261 PolarHBondContact O-N 2.86Å; F261-T263 VanDerWaalsContact C-N 3.35Å; F261-F264 PolarHBondContact O-N 2.76Å; F261-V265 PolarHBondContact O-N 3.13Å
262A95.9Very high95.4Very high1 Ų149.6 Ų49.61%0.00825%0.246CC..Hα-helixtrans-61.4-44172.600000111.3L36 L109 M258 F264 V265 N266L36-A262 HydrophobicContact CD2-CB 4.47Å; L109-A262 HydrophobicContact CD1-CB 4.38Å; M258-A262 VanDerWaalsContact O-CB 3.24Å; M258-A262 WeakPolarHBondContact O-CB 3.38Å; M258-A262 PolarHBondContact O-N 3.09Å; A262-F264 PolarHBondContact O-N 3.37Å; A262-V265 PolarHBondContact O-N 2.9Å; A262-N266 VanDerWaalsContact O-CB 3.3Å; A262-N266 WeakPolarHBondContact O-CB 3.28Å; A262-N266 PolarHBondContact O-N 3.11Å; A262-N266 PolarHBondContact O-ND2 3.37Å; A262-N266 PolarHBondContact O-OD1 2.91Å
263T96.6Very high95.1Very high11 Ų1149.9 Ų49.97%0.06725%0.248CC..Hα-helixtrans-55.4-52.7174.6-60.60000111I106 L109 V110 N259 I260 F261 V265 N266 C267I106-T263 HydrophobicContact CG2-CG2 3.78Å; L109-T263 WeakPolarHBondContact CB-OG1 3.24Å; V110-T263 HydrophobicContact CG2-CG2 3.38Å; N259-T263 VanDerWaalsContact O-CB 3.31Å; N259-T263 WeakPolarHBondContact O-CB 3.44Å; N259-T263 PolarHBondContact O-N 3.04Å; N259-T263 PolarHBondContact O-OG1 3.26Å; I260-T263 WeakPolarHBondContact O-CB 3.38Å; I260-T263 PolarHBondContact O-N 2.9Å; F261-T263 VanDerWaalsContact C-N 3.35Å; T263-V265 VanDerWaalsContact C-N 3.33Å; T263-V265 PolarHBondContact O-N 3.36Å; T263-N266 PolarHBondContact O-N 2.93Å; T263-C267 PolarHBondContact O-N 3.23Å; T263-C267 PolarHBondContact O-SG 2.92Å
264F96.4Very high94.8Very high121 Ų12149.2 Ų49.253%0.53125%0.247SC..Hα-helixtrans-56-47.3-176.9-178.4-105.3000111.8I260 F261 A262 C267 F268I260-F264 WeakPolarHBondContact O-CB 3.45Å; I260-F264 PolarHBondContact O-N 2.82Å; F261-F264 PolarHBondContact O-N 2.76Å; A262-F264 PolarHBondContact O-N 3.37Å; F264-C267 WeakPolarHBondContact O-CB 3.5Å; F264-C267 PolarHBondContact O-N 2.91Å; F264-F268 HydrophobicContact CD1-CD2 4.28Å; F264-F268 AromaticContact CD1-CE2 3.91Å; F264-F268 HydrophobicContact CD1-CE2 3.91Å; F264-F268 HydrophobicContact CD2-CE2 4.09Å; F264-F268 HydrophobicContact CE1-CD2 4.18Å; F264-F268 AromaticContact CE1-CE2 3.47Å; F264-F268 HydrophobicContact CE1-CE2 3.47Å; F264-F268 VanDerWaalsContact CE1-CE2 3.47Å; F264-F268 HydrophobicContact CE1-CZ 4.39Å; F264-F268 AromaticContact CE2-CE2 3.66Å; F264-F268 HydrophobicContact CE2-CE2 3.66Å; F264-F268 HydrophobicContact CE2-CZ 4.26Å; F264-F268 HydrophobicContact CG-CE2 4.23Å; F264-F268 HydrophobicContact CZ-CD2 4.44Å; F264-F268 AromaticContact CZ-CE2 3.36Å; F264-F268 HydrophobicContact CZ-CE2 3.36Å; F264-F268 AromaticContact CZ-CZ 3.94Å; F264-F268 HydrophobicContact CZ-CZ 3.94Å; F264-F268 WeakPolarHBondContact O-CD2 3.36Å; F264-F268 PolarHBondContact O-N 3.34Å
265V95Very high94.5Very high16 Ų1648 Ų4810%0.09724%0.241CC..Hα-helixtrans-71.5-38.3179.3176.80000112.5L25 I28 L32 F261 A262 T263 C267 F268 Y269L25-V265 HydrophobicContact CD1-CG1 4.04Å; I28-V265 HydrophobicContact CG2-CG1 3.92Å; L32-V265 HydrophobicContact CD1-CB 3.49Å; L32-V265 VanDerWaalsContact CD1-CB 3.49Å; L32-V265 HydrophobicContact CD1-CG1 3.72Å; L32-V265 HydrophobicContact CD1-CG2 3.37Å; F261-V265 PolarHBondContact O-N 3.13Å; A262-V265 PolarHBondContact O-N 2.9Å; T263-V265 VanDerWaalsContact C-N 3.33Å; T263-V265 PolarHBondContact O-N 3.36Å; V265-C267 VanDerWaalsContact C-N 3.27Å; V265-C267 PolarHBondContact O-N 3.34Å; V265-F268 PolarHBondContact O-N 3.22Å; V265-Y269 PolarHBondContact O-N 3.46Å
266N95.9Very high94Very high0 Ų048.6 Ų48.60%024%0.244CC..Hα-helixtrans-63.6-34.9175.4-67.7-9.9000111.2S29 N33 L102 Q105 I106 A262 T263 Y269 V270S29-N266 PolarHBondContact OG-OD1 3.2Å; N33-N266 PolarHBondContact ND2-ND2 2.02Å; N33-N266 PolarHBondContact ND2-OD1 3.3Å; L102-N266 HydrophobicContact CD1-CB 4.48Å; Q105-N266 PolarHBondContact OE1-ND2 3.1Å; Q105-N266 VanDerWaalsContact OE1-ND2 3.1Å; I106-N266 HydrophobicContact CD1-CB 3.88Å; I106-N266 HydrophobicContact CG1-CB 3.73Å; A262-N266 VanDerWaalsContact O-CB 3.3Å; A262-N266 WeakPolarHBondContact O-CB 3.28Å; A262-N266 PolarHBondContact O-N 3.11Å; A262-N266 PolarHBondContact O-ND2 3.37Å; A262-N266 PolarHBondContact O-OD1 2.91Å; T263-N266 PolarHBondContact O-N 2.93Å; N266-Y269 PolarHBondContact O-N 3.5Å; N266-V270 WeakPolarHBondContact O-CG2 3.42Å; N266-V270 PolarHBondContact O-N 3.18Å
267C96Very high93.5Very high54 Ų5451.8 Ų51.837%0.36526%0.258SS..Hα-helixtrans-59.1-48.6172.8-72.20000111.9I106 T263 F264 V265 Y269 V270 Q271I106-C267 WeakPolarHBondContact CG2-SG 3.34Å; T263-C267 PolarHBondContact O-N 3.23Å; T263-C267 PolarHBondContact O-SG 2.92Å; F264-C267 WeakPolarHBondContact O-CB 3.5Å; F264-C267 PolarHBondContact O-N 2.91Å; V265-C267 VanDerWaalsContact C-N 3.27Å; V265-C267 PolarHBondContact O-N 3.34Å; C267-Y269 VanDerWaalsContact C-N 3.26Å; C267-Y269 PolarHBondContact O-N 3.1Å; C267-V270 PolarHBondContact O-N 2.81Å; C267-Q271 PolarHBondContact O-N 2.9Å
268F94Very high93.1Very high95 Ų9551.9 Ų51.942%0.41726%0.26SS..Hα-helixtrans-60-40.1175.5-78.4-74.4000111.8L25 F264 V265 K272L25-F268 HydrophobicContact CD1-CB 4.28Å; L25-F268 HydrophobicContact CD2-CB 4.03Å; F264-F268 HydrophobicContact CD1-CD2 4.28Å; F264-F268 AromaticContact CD1-CE2 3.91Å; F264-F268 HydrophobicContact CD1-CE2 3.91Å; F264-F268 HydrophobicContact CD2-CE2 4.09Å; F264-F268 HydrophobicContact CE1-CD2 4.18Å; F264-F268 AromaticContact CE1-CE2 3.47Å; F264-F268 HydrophobicContact CE1-CE2 3.47Å; F264-F268 VanDerWaalsContact CE1-CE2 3.47Å; F264-F268 HydrophobicContact CE1-CZ 4.39Å; F264-F268 AromaticContact CE2-CE2 3.66Å; F264-F268 HydrophobicContact CE2-CE2 3.66Å; F264-F268 HydrophobicContact CE2-CZ 4.26Å; F264-F268 HydrophobicContact CG-CE2 4.23Å; F264-F268 HydrophobicContact CZ-CD2 4.44Å; F264-F268 AromaticContact CZ-CE2 3.36Å; F264-F268 HydrophobicContact CZ-CE2 3.36Å; F264-F268 AromaticContact CZ-CZ 3.94Å; F264-F268 HydrophobicContact CZ-CZ 3.94Å; F264-F268 WeakPolarHBondContact O-CD2 3.36Å; F264-F268 PolarHBondContact O-N 3.34Å; V265-F268 PolarHBondContact O-N 3.22Å; F268-K272 WeakPolarHBondContact O-CG 3.34Å; F268-K272 PolarHBondContact O-N 3.42Å
269Y94.5Very high92.6Very high6 Ų654.6 Ų54.62%0.02427%0.269CS..Hα-helixtrans-64-46.7179.1179.9-98.2000111.8M22 L25 K26 I94 L102 V265 N266 C267 Q271 K272 A273M22-Y269 HydrophobicContact CE-CD2 4.08Å; M22-Y269 HydrophobicContact CE-CE2 3.54Å; L25-Y269 HydrophobicContact CB-CD2 4.29Å; L25-Y269 VanDerWaalsContact CD2-CA 3.48Å; L25-Y269 HydrophobicContact CD2-CD2 4.42Å; L25-Y269 HydrophobicContact CG-CD2 4.06Å; K26-Y269 HydrophobicContact CB-CD2 4.4Å; K26-Y269 HydrophobicContact CB-CE2 3.7Å; K26-Y269 HydrophobicContact CG-CE2 4.11Å; I94-Y269 HydrophobicContact CB-CE1 4.49Å; I94-Y269 HydrophobicContact CG1-CD1 4.47Å; I94-Y269 HydrophobicContact CG1-CE1 4.22Å; I94-Y269 HydrophobicContact CG2-CE1 4.12Å; L102-Y269 HydrophobicContact CD2-CD1 3.4Å; L102-Y269 HydrophobicContact CD2-CE1 3.71Å; V265-Y269 PolarHBondContact O-N 3.46Å; N266-Y269 PolarHBondContact O-N 3.5Å; C267-Y269 VanDerWaalsContact C-N 3.26Å; C267-Y269 PolarHBondContact O-N 3.1Å; Y269-Q271 PolarHBondContact O-N 3.02Å; Y269-K272 PolarHBondContact O-N 3.45Å; Y269-A273 WeakPolarHBondContact O-CB 3.34Å; Y269-A273 PolarHBondContact O-N 3.12Å
270V93.9Very high92.1Very high33 Ų3359.1 Ų59.120%0.229%0.29CS..Hα-helixtrans-61.5-44.4177.4169.70000111.3L102 I106 N266 C267 K272 A273 A274L102-V270 HydrophobicContact CB-CG2 3.99Å; L102-V270 HydrophobicContact CD2-CG2 3.42Å; L102-V270 VanDerWaalsContact CD2-CG2 3.42Å; L102-V270 HydrophobicContact CG-CG2 3.5Å; L102-V270 VanDerWaalsContact CG-CG2 3.5Å; I106-V270 HydrophobicContact CD1-CB 4.29Å; I106-V270 HydrophobicContact CD1-CG2 3.61Å; N266-V270 WeakPolarHBondContact O-CG2 3.42Å; N266-V270 PolarHBondContact O-N 3.18Å; C267-V270 PolarHBondContact O-N 2.81Å; V270-K272 VanDerWaalsContact C-N 3.32Å; V270-K272 PolarHBondContact O-N 3.21Å; V270-A273 WeakPolarHBondContact O-CB 3.44Å; V270-A273 PolarHBondContact O-N 3.22Å; V270-A273 VanDerWaalsContact O-N 3.15Å; V270-A274 PolarHBondContact O-N 3.49Å
271Q92.2Very high91.7Very high115 Ų11559.3 Ų59.354%0.53729%0.289SS..Hα-helixtrans-60.4-44.3178.5-173.4176.93.500111.3C267 Y269 A273 A274 D275C267-Q271 PolarHBondContact O-N 2.9Å; Y269-Q271 PolarHBondContact O-N 3.02Å; Q271-A273 VanDerWaalsContact C-N 3.33Å; Q271-A273 PolarHBondContact O-N 2.84Å; Q271-A274 PolarHBondContact O-N 2.91Å; Q271-D275 VanDerWaalsContact O-CG 3.26Å; Q271-D275 PolarHBondContact O-N 3.45Å
272K91.2Very high91.3Very high78 Ų7859.1 Ų59.134%0.33929%0.292SS..Hα-helixtrans-68.6-31.6176.3-72.4-75.2153.4-133.10112.8F18 M22 L25 F268 Y269 V270 D275 E276F18-K272 HydrophobicContact CE2-CD 3.93Å; F18-K272 HydrophobicContact CZ-CD 4.29Å; F18-K272 VanDerWaalsContact CZ-O 3.27Å; F18-K272 WeakPolarHBondContact CZ-O 3.21Å; M22-K272 HydrophobicContact CE-CB 4.49Å; M22-K272 HydrophobicContact SD-CB 3.66Å; L25-K272 HydrophobicContact CD2-CB 4.26Å; L25-K272 HydrophobicContact CD2-CG 4.09Å; F268-K272 WeakPolarHBondContact O-CG 3.34Å; F268-K272 PolarHBondContact O-N 3.42Å; Y269-K272 PolarHBondContact O-N 3.45Å; V270-K272 VanDerWaalsContact C-N 3.32Å; V270-K272 PolarHBondContact O-N 3.21Å; K272-D275 IonicContact NZ-OD2 3.4Å; K272-D275 PolarHBondContact NZ-OD2 3.35Å; K272-E276 PolarHBondContact O-N 3.41Å; K272-E276 VanDerWaalsContact O-N 3.12Å
273A90.2Very high90.7Very high7 Ų765 Ų656%0.05831%0.314CS..Hα-helixtrans-66.8-43.417400000111.6M22 T99 Y269 V270 Q271 E276 E277M22-A273 HydrophobicContact CE-CB 3.49Å; M22-A273 VanDerWaalsContact CE-CB 3.49Å; T99-A273 HydrophobicContact CG2-CB 3.76Å; Y269-A273 WeakPolarHBondContact O-CB 3.34Å; Y269-A273 PolarHBondContact O-N 3.12Å; V270-A273 WeakPolarHBondContact O-CB 3.44Å; V270-A273 PolarHBondContact O-N 3.22Å; V270-A273 VanDerWaalsContact O-N 3.15Å; Q271-A273 VanDerWaalsContact C-N 3.33Å; Q271-A273 PolarHBondContact O-N 2.84Å; A273-E276 VanDerWaalsContact O-CB 3.31Å; A273-E276 WeakPolarHBondContact O-CB 3.19Å; A273-E276 PolarHBondContact O-N 3.31Å; A273-E276 VanDerWaalsContact O-N 3.13Å; A273-E277 PolarHBondContact O-N 2.97Å
274A89.4Confident90.3Very high47 Ų4768.9 Ų68.939%0.38833%0.334SS..Hα-helixtrans-63.1-42.6176.700000111.7V270 Q271 E276 E277 E278V270-A274 PolarHBondContact O-N 3.49Å; Q271-A274 PolarHBondContact O-N 2.91Å; A274-E276 PolarHBondContact O-N 3.17Å; A274-E277 PolarHBondContact O-N 3.31Å; A274-E278 PolarHBondContact O-N 2.9Å
275D88.9Confident89.9Confident55 Ų5567 Ų6729%0.29433%0.329SS..Hα-helixtrans-58.7-35.7173.3-67.2-15.2000111.7F18 Q271 K272 Y279F18-D275 HydrophobicContact CE2-CB 4.04Å; F18-D275 HydrophobicContact CZ-CB 3.81Å; Q271-D275 VanDerWaalsContact O-CG 3.26Å; Q271-D275 PolarHBondContact O-N 3.45Å; K272-D275 IonicContact NZ-OD2 3.4Å; K272-D275 PolarHBondContact NZ-OD2 3.35Å; D275-Y279 VanDerWaalsContact O-CB 3.31Å; D275-Y279 WeakPolarHBondContact O-CB 3.25Å; D275-Y279 PolarHBondContact O-N 3.48Å; D275-Y279 VanDerWaalsContact O-N 3.1Å
276E86.6Confident89.5Confident16 Ų1669.4 Ų69.48%0.07535%0.347CS..Hα-helixtrans-66.5-48.3177.3-159.2172.2-159.900111F18 H19 K97 K272 A273 A274 Y279 E280F18-E276 HydrophobicContact CD1-CG 4.46Å; F18-E276 HydrophobicContact CE1-CB 3.64Å; F18-E276 HydrophobicContact CE1-CG 3.78Å; F18-E276 HydrophobicContact CZ-CB 4.15Å; H19-E276 IonicContact CE1-OE1 2.76Å; H19-E276 PolarHBondContact CE1-OE1 2.93Å; H19-E276 IonicContact ND1-OE1 3.86Å; H19-E276 PolarHBondContact ND1-OE1 3.44Å; K97-E276 IonicContact NZ-OE2 3.69Å; K272-E276 PolarHBondContact O-N 3.41Å; K272-E276 VanDerWaalsContact O-N 3.12Å; A273-E276 VanDerWaalsContact O-CB 3.31Å; A273-E276 WeakPolarHBondContact O-CB 3.19Å; A273-E276 PolarHBondContact O-N 3.31Å; A273-E276 VanDerWaalsContact O-N 3.13Å; A274-E276 PolarHBondContact O-N 3.17Å; E276-Y279 PolarHBondContact O-N 2.68Å; E276-E280 WeakPolarHBondContact O-CG 3.27Å; E276-E280 PolarHBondContact O-N 3.3Å
277E86.2Confident89.1Confident96 Ų9673.5 Ų73.545%0.44937%0.366SS..Hα-helixtrans-62.5-44.4179.8-71.1175-173.800111.5T99 A273 A274 Y279 E280 Q281T99-E277 WeakPolarHBondContact CG2-OE1 3.08Å; A273-E277 PolarHBondContact O-N 2.97Å; A274-E277 PolarHBondContact O-N 3.31Å; E277-Y279 VanDerWaalsContact C-N 3.35Å; E277-Y279 PolarHBondContact O-N 2.98Å; E277-E280 PolarHBondContact O-N 3.34Å; E277-Q281 WeakPolarHBondContact O-CB 3.36Å; E277-Q281 PolarHBondContact O-N 3.31Å
278E87.7Confident88.7Confident126 Ų12676.1 Ų76.159%0.58937%0.373SS*.Hα-helixtrans-64-40.3176.5-173.2-177.7170.400111.6A274 N282A274-E278 PolarHBondContact O-N 2.9Å; E278-N282 WeakPolarHBondContact O-CB 3.38Å; E278-N282 VanDerWaalsContact O-CG 3.27Å; E278-N282 PolarHBondContact O-N 3.02Å; E278-N282 PolarHBondContact O-ND2 2.91Å; E278-N282 VanDerWaalsContact O-ND2 3.08Å
279Y84.4Confident88.3Confident85 Ų8577.8 Ų77.833%0.33338%0.38SS..Hα-helixtrans-66.6-43.3176.9-179.5-92.9000112.3Q15 D275 E276 E277 N282 W283Q15-Y279 HydrophobicContact CG-CE1 4.48Å; D275-Y279 VanDerWaalsContact O-CB 3.31Å; D275-Y279 WeakPolarHBondContact O-CB 3.25Å; D275-Y279 PolarHBondContact O-N 3.48Å; D275-Y279 VanDerWaalsContact O-N 3.1Å; E276-Y279 PolarHBondContact O-N 2.68Å; E277-Y279 VanDerWaalsContact C-N 3.35Å; E277-Y279 PolarHBondContact O-N 2.98Å; Y279-N282 PolarHBondContact O-N 3.42Å; Y279-W283 WeakPolarHBondContact O-CB 3.02Å; Y279-W283 PolarHBondContact O-N 3.4Å
280E85.5Confident87.8Confident95 Ų9581.6 Ų81.644%0.44440%0.4SS..Hα-helixtrans-62.1-43.5176.5-76-172171.100111.3E276 E277 W283 L284E276-E280 WeakPolarHBondContact O-CG 3.27Å; E276-E280 PolarHBondContact O-N 3.3Å; E277-E280 PolarHBondContact O-N 3.34Å; E280-W283 PolarHBondContact O-N 2.99Å; E280-L284 WeakPolarHBondContact O-CG 3.35Å; E280-L284 PolarHBondContact O-N 3.49Å
281Q89.3Confident87.5Confident101 Ų10186.2 Ų86.247%0.47242%0.418SS..Hα-helixtrans-62.2-49.9176.5-173.259.53400111.6E277 W283 L284 D285E277-Q281 WeakPolarHBondContact O-CB 3.36Å; E277-Q281 PolarHBondContact O-N 3.31Å; Q281-W283 VanDerWaalsContact C-N 3.26Å; Q281-W283 PolarHBondContact O-N 2.8Å; Q281-L284 PolarHBondContact O-N 3.25Å; Q281-L284 VanDerWaalsContact O-N 3.16Å; Q281-D285 PolarHBondContact NE2-OD1 3.42Å; Q281-D285 VanDerWaalsContact NE2-OD1 3.15Å; Q281-D285 PolarHBondContact NE2-OD2 3.18Å; Q281-D285 VanDerWaalsContact O-CG 3.29Å; Q281-D285 PolarHBondContact O-N 2.88Å
282N87.7Confident87.3Confident84 Ų8485.6 Ų85.645%0.44942%0.415SS..Hα-helixtrans-60.1-35.6177-78.1-36.8000112.7E278 Y279 S286E278-N282 WeakPolarHBondContact O-CB 3.38Å; E278-N282 VanDerWaalsContact O-CG 3.27Å; E278-N282 PolarHBondContact O-N 3.02Å; E278-N282 PolarHBondContact O-ND2 2.91Å; E278-N282 VanDerWaalsContact O-ND2 3.08Å; Y279-N282 PolarHBondContact O-N 3.42Å; N282-S286 WeakPolarHBondContact O-CB 3.34Å; N282-S286 PolarHBondContact O-N 2.93Å; N282-S286 PolarHBondContact O-OG 3.38Å
283W83Confident86.9Confident125 Ų12584 Ų8447%0.47341%0.411SS..Hα-helixtrans-68.7-43.7176.1-176.488.1000111.6Y279 E280 Q281 S286 Q287Y279-W283 WeakPolarHBondContact O-CB 3.02Å; Y279-W283 PolarHBondContact O-N 3.4Å; E280-W283 PolarHBondContact O-N 2.99Å; Q281-W283 VanDerWaalsContact C-N 3.26Å; Q281-W283 PolarHBondContact O-N 2.8Å; W283-S286 WeakPolarHBondContact O-CB 3.46Å; W283-S286 PolarHBondContact O-N 2.99Å; W283-Q287 HydrophobicContact CD2-CG 4.01Å; W283-Q287 HydrophobicContact CE3-CG 3.98Å; W283-Q287 HydrophobicContact CH2-CG 3.68Å; W283-Q287 HydrophobicContact CZ2-CG 3.7Å; W283-Q287 HydrophobicContact CZ3-CG 3.82Å; W283-Q287 WeakPolarHBondContact O-CG 3.5Å; W283-Q287 PolarHBondContact O-N 3.28Å
284L87.6Confident86.6Confident91 Ų9190.8 Ų90.848%0.47644%0.44SS..Hα-helixtrans-61.7-45.2175.6-73.8170.1000111.5E280 Q281 S286 Q287 H288E280-L284 WeakPolarHBondContact O-CG 3.35Å; E280-L284 PolarHBondContact O-N 3.49Å; Q281-L284 PolarHBondContact O-N 3.25Å; Q281-L284 VanDerWaalsContact O-N 3.16Å; L284-S286 VanDerWaalsContact C-N 3.3Å; L284-S286 PolarHBondContact O-N 3.4Å; L284-Q287 PolarHBondContact O-N 2.97Å; L284-Q287 VanDerWaalsContact O-N 3.13Å; L284-H288 PolarHBondContact O-N 3.03Å
285D88.8Confident86.4Confident81 Ų8193.2 Ų93.243%0.43344%0.443SS..Hα-helixtrans-62.2-39.4176.9-66.7-20.6000111.2Q281 H288 F289Q281-D285 PolarHBondContact NE2-OD1 3.42Å; Q281-D285 VanDerWaalsContact NE2-OD1 3.15Å; Q281-D285 PolarHBondContact NE2-OD2 3.18Å; Q281-D285 VanDerWaalsContact O-CG 3.29Å; Q281-D285 PolarHBondContact O-N 2.88Å; D285-H288 PolarHBondContact O-N 2.85Å; D285-F289 WeakPolarHBondContact O-CB 3.36Å; D285-F289 PolarHBondContact O-N 2.95Å
286S86.5Confident86.1Confident67 Ų6793.6 Ų93.647%0.46945%0.454SS..Hα-helixtrans-64.7-39.1174-63.20000112.7N282 W283 L284 L290N282-S286 WeakPolarHBondContact O-CB 3.34Å; N282-S286 PolarHBondContact O-N 2.93Å; N282-S286 PolarHBondContact O-OG 3.38Å; W283-S286 WeakPolarHBondContact O-CB 3.46Å; W283-S286 PolarHBondContact O-N 2.99Å; L284-S286 VanDerWaalsContact C-N 3.3Å; L284-S286 PolarHBondContact O-N 3.4Å; S286-L290 WeakPolarHBondContact O-CB 3.43Å; S286-L290 VanDerWaalsContact O-CG 3.31Å; S286-L290 WeakPolarHBondContact O-CG 3.12Å; S286-L290 PolarHBondContact O-N 3.45Å; S286-L290 VanDerWaalsContact O-N 3.07Å
287Q86.8Confident85.7Confident87 Ų87100.6 Ų100.641%0.40749%0.485SS..Hα-helixtrans-66.6-41.8174.8-69.9-57.6-48.300111.4W283 L284 L290 K291W283-Q287 HydrophobicContact CD2-CG 4.01Å; W283-Q287 HydrophobicContact CE3-CG 3.98Å; W283-Q287 HydrophobicContact CH2-CG 3.68Å; W283-Q287 HydrophobicContact CZ2-CG 3.7Å; W283-Q287 HydrophobicContact CZ3-CG 3.82Å; W283-Q287 WeakPolarHBondContact O-CG 3.5Å; W283-Q287 PolarHBondContact O-N 3.28Å; L284-Q287 PolarHBondContact O-N 2.97Å; L284-Q287 VanDerWaalsContact O-N 3.13Å; Q287-L290 PolarHBondContact O-N 2.77Å; Q287-K291 PolarHBondContact O-N 3.1Å
288H87.4Confident85.3Confident109 Ų109101.5 Ų101.551%0.50550%0.5SS..Hα-helixtrans-59.4-50.1176.6-170.1-90000111L284 D285 L290 K291 E292L284-H288 PolarHBondContact O-N 3.03Å; D285-H288 PolarHBondContact O-N 2.85Å; H288-L290 VanDerWaalsContact C-N 3.35Å; H288-L290 PolarHBondContact O-N 2.92Å; H288-K291 WeakPolarHBondContact O-CB 3.48Å; H288-K291 PolarHBondContact O-N 2.98Å; H288-E292 IonicContact CE1-OE1 3.26Å; H288-E292 PolarHBondContact CE1-OE1 3.13Å; H288-E292 IonicContact CE1-OE2 3.4Å; H288-E292 IonicContact ND1-OE1 2.82Å; H288-E292 IonicContact ND1-OE2 3.73Å; H288-E292 PolarHBondContact ND1-OE2 3.01Å; H288-E292 PolarHBondContact O-N 2.04Å
289F86.6Confident84.2Confident129 Ų129102 Ų10257%0.56651%0.506SS*.Hα-helixtrans-59-42177.1179.8-98.1000113D285 K291 E292 T293D285-F289 WeakPolarHBondContact O-CB 3.36Å; D285-F289 PolarHBondContact O-N 2.95Å; F289-K291 VanDerWaalsContact C-N 3.28Å; F289-K291 PolarHBondContact O-N 3.21Å; F289-E292 PolarHBondContact O-N 2.67Å; F289-T293 HydrophobicContact CD1-CG2 4.28Å; F289-T293 HydrophobicContact CD2-CG2 4.49Å; F289-T293 HydrophobicContact CE1-CG2 3.82Å; F289-T293 HydrophobicContact CE2-CG2 4.05Å; F289-T293 HydrophobicContact CZ-CG2 3.7Å; F289-T293 WeakPolarHBondContact O-CB 3.02Å; F289-T293 WeakPolarHBondContact O-CG2 3.25Å; F289-T293 PolarHBondContact O-N 3.46Å; F289-T293 PolarHBondContact O-OG1 2.87Å
290L84.2Confident82.6Confident86 Ų86107.3 Ų107.345%0.4553%0.525SS..Hα-helixtrans-65.7-31.2176.3-76172.9000112.9S286 Q287 H288 T293 K294S286-L290 WeakPolarHBondContact O-CB 3.43Å; S286-L290 VanDerWaalsContact O-CG 3.31Å; S286-L290 WeakPolarHBondContact O-CG 3.12Å; S286-L290 PolarHBondContact O-N 3.45Å; S286-L290 VanDerWaalsContact O-N 3.07Å; Q287-L290 PolarHBondContact O-N 2.77Å; H288-L290 VanDerWaalsContact C-N 3.35Å; H288-L290 PolarHBondContact O-N 2.92Å; L290-T293 WeakPolarHBondContact CA-OG1 3.36Å; L290-T293 PolarHBondContact O-OG1 2.98Å; L290-K294 VanDerWaalsContact O-CG 3.31Å; L290-K294 WeakPolarHBondContact O-CG 3.22Å; L290-K294 PolarHBondContact O-N 2.85Å
291K87.8Confident80.9Confident131 Ų131107.9 Ų107.957%0.5754%0.538SS*.Hα-helixtrans-72-49.5175.7-172-176.3174.1-167.60110.8Q287 H288 F289 T293 K294 E295Q287-K291 PolarHBondContact O-N 3.1Å; H288-K291 WeakPolarHBondContact O-CB 3.48Å; H288-K291 PolarHBondContact O-N 2.98Å; F289-K291 VanDerWaalsContact C-N 3.28Å; F289-K291 PolarHBondContact O-N 3.21Å; K291-T293 VanDerWaalsContact C-N 3.33Å; K291-T293 PolarHBondContact O-N 3.41Å; K291-K294 PolarHBondContact O-N 2.68Å; K291-E295 VanDerWaalsContact CE-OE1 3.22Å; K291-E295 WeakPolarHBondContact CE-OE1 3.46Å; K291-E295 WeakPolarHBondContact O-CG 3.46Å; K291-E295 PolarHBondContact O-N 3.42Å
292E86.5Confident79.1Confident102 Ų102112.3 Ų112.348%0.47756%0.558SS.*Hα-helixtrans-59.5-42.5177.7-71.2-176.9136.200112.2H288 F289 E295 A296H288-E292 IonicContact CE1-OE1 3.26Å; H288-E292 PolarHBondContact CE1-OE1 3.13Å; H288-E292 IonicContact CE1-OE2 3.4Å; H288-E292 IonicContact ND1-OE1 2.82Å; H288-E292 IonicContact ND1-OE2 3.73Å; H288-E292 PolarHBondContact ND1-OE2 3.01Å; H288-E292 PolarHBondContact O-N 2.04Å; F289-E292 PolarHBondContact O-N 2.67Å; E292-E295 PolarHBondContact O-N 3.05Å; E292-A296 WeakPolarHBondContact O-CB 3.21Å; E292-A296 PolarHBondContact O-N 2.86Å
293T84.4Confident77.1Confident43 Ų43117.3 Ų117.326%0.26458%0.576SS.*Hα-helixtrans-66-38.8177.8470000112.5F289 L290 K291 A296 F297F289-T293 HydrophobicContact CD1-CG2 4.28Å; F289-T293 HydrophobicContact CD2-CG2 4.49Å; F289-T293 HydrophobicContact CE1-CG2 3.82Å; F289-T293 HydrophobicContact CE2-CG2 4.05Å; F289-T293 HydrophobicContact CZ-CG2 3.7Å; F289-T293 WeakPolarHBondContact O-CB 3.02Å; F289-T293 WeakPolarHBondContact O-CG2 3.25Å; F289-T293 PolarHBondContact O-N 3.46Å; F289-T293 PolarHBondContact O-OG1 2.87Å; L290-T293 WeakPolarHBondContact CA-OG1 3.36Å; L290-T293 PolarHBondContact O-OG1 2.98Å; K291-T293 VanDerWaalsContact C-N 3.33Å; K291-T293 PolarHBondContact O-N 3.41Å; T293-A296 PolarHBondContact O-N 3.37Å; T293-F297 WeakPolarHBondContact O-CD2 3.1Å; T293-F297 PolarHBondContact O-N 2.89Å
294K83.5Confident75.1Confident150 Ų150118.9 Ų118.965%0.65259%0.589SS**Hα-helixtrans-62.5-45173.6-78.8177.3179.9-178.90111.8L290 K291 A296 F297 C298L290-K294 VanDerWaalsContact O-CG 3.31Å; L290-K294 WeakPolarHBondContact O-CG 3.22Å; L290-K294 PolarHBondContact O-N 2.85Å; K291-K294 PolarHBondContact O-N 2.68Å; K294-A296 VanDerWaalsContact C-N 3.35Å; K294-A296 PolarHBondContact O-N 2.81Å; K294-F297 PolarHBondContact O-N 2.84Å; K294-C298 WeakPolarHBondContact O-CB 3.42Å; K294-C298 PolarHBondContact O-N 3.19Å; K294-C298 PolarHBondContact O-SG 3.08Å; K294-C298 VanDerWaalsContact O-SG 3.39Å
295E84.5Confident72.8Confident99 Ų99121 Ų12146%0.46360%0.599SS.*Hα-helixtrans-61-43.9176.4-70.7173.2-172.700111K291 E292 F297 C298 L299K291-E295 VanDerWaalsContact CE-OE1 3.22Å; K291-E295 WeakPolarHBondContact CE-OE1 3.46Å; K291-E295 WeakPolarHBondContact O-CG 3.46Å; K291-E295 PolarHBondContact O-N 3.42Å; E292-E295 PolarHBondContact O-N 3.05Å; E295-F297 PolarHBondContact O-N 3.31Å; E295-C298 PolarHBondContact O-N 2.92Å; E295-L299 WeakPolarHBondContact O-CB 3.39Å; E295-L299 VanDerWaalsContact O-CG 3.26Å; E295-L299 WeakPolarHBondContact O-CG 3.38Å; E295-L299 PolarHBondContact O-N 3.37Å
296A82.3Confident70.2Confident63 Ų63123.7 Ų123.752%0.52161%0.614SS.*Hα-helixtrans-64.2-37.7176.600000113.7E292 T293 K294 R300E292-A296 WeakPolarHBondContact O-CB 3.21Å; E292-A296 PolarHBondContact O-N 2.86Å; T293-A296 PolarHBondContact O-N 3.37Å; K294-A296 VanDerWaalsContact C-N 3.35Å; K294-A296 PolarHBondContact O-N 2.81Å; A296-R300 PolarHBondContact O-N 3.22Å
297F78.4Confident68Low163 Ų163127 Ų12772%0.71563%0.625SS**Hα-helixtrans-72.3-37.8176.5-93.8-80.4000112.6T293 K294 E295 L299T293-F297 WeakPolarHBondContact O-CD2 3.1Å; T293-F297 PolarHBondContact O-N 2.89Å; K294-F297 PolarHBondContact O-N 2.84Å; E295-F297 PolarHBondContact O-N 3.31Å; F297-L299 VanDerWaalsContact C-N 3.34Å
298C77.7Confident65.4Low115 Ų115126.9 Ų126.978%0.77763%0.633SS**Hα-helixtrans-72.2-27.2176.4-70.80000112.8K294 E295K294-C298 WeakPolarHBondContact O-CB 3.42Å; K294-C298 PolarHBondContact O-N 3.19Å; K294-C298 PolarHBondContact O-SG 3.08Å; K294-C298 VanDerWaalsContact O-SG 3.39Å; E295-C298 PolarHBondContact O-N 2.92Å
299L64.9Low62.7Low137 Ų137128 Ų12872%0.71765%0.652SS**THydrogen-bonded Turntrans-84.5-8.9177.5-73.9171.5000114.3E295 F297 P301E295-L299 WeakPolarHBondContact O-CB 3.39Å; E295-L299 VanDerWaalsContact O-CG 3.26Å; E295-L299 WeakPolarHBondContact O-CG 3.38Å; E295-L299 PolarHBondContact O-N 3.37Å; F297-L299 VanDerWaalsContact C-N 3.34Å; L299-P301 WeakPolarHBondContact O-CD 3.42Å; L299-P301 VanDerWaalsContact O-N 3.13Å
300R50.7Low60.2Low195 Ų195128.6 Ų128.674%0.73666%0.661SS**SBendtrans-71.9107.3173.6-167.6-179.3-89.4-176.4-5.6107.3A296 Q302A296-R300 PolarHBondContact O-N 3.22Å; R300-Q302 PolarHBondContact O-N 3.18Å
301P51.4Low57.7Low108 Ų108129.2 Ų129.270%0.70168%0.678SS**  trans-60.7133.5177.3-11.527.5000106.6L299 K303L299-P301 WeakPolarHBondContact O-CD 3.42Å; L299-P301 VanDerWaalsContact O-N 3.13Å; P301-K303 PolarHBondContact O-N 3.17Å
302Q49.9Very low55.1Low194 Ų194127.9 Ų127.991%0.90769%0.685SS**  trans-52.898.9151.8-93-178.7-46.700105.2R300 E304R300-Q302 PolarHBondContact O-N 3.18Å; Q302-E304 PolarHBondContact O-N 3.34Å
303K45.3Very low52.5Low189 Ų189130.7 Ų130.782%0.82270%0.702SS**  trans-63.797.9157.9-163.3178.3-172.9-177.60103.2P301 I305P301-K303 PolarHBondContact O-N 3.17Å; K303-I305 VanDerWaalsContact C-N 3.34Å; K303-I305 PolarHBondContact O-N 3.22Å
304E41.6Very low50Low157 Ų157133.7 Ų133.773%0.73473%0.725SS**  trans-12.794.4156.2-106.6155.4170.400109.8Q302 D306Q302-E304 PolarHBondContact O-N 3.34Å; E304-D306 PolarHBondContact O-N 3.18Å
305I40.1Very low47.6Very low137 Ų137134.6 Ų134.670%0.70374%0.737SS**  trans-92.481.5154.7-65.3176.9000102.2K303 I307K303-I305 VanDerWaalsContact C-N 3.34Å; K303-I305 PolarHBondContact O-N 3.22Å; I305-I307 HydrophobicContact CG2-CB 4.22Å; I305-I307 HydrophobicContact CG2-CD1 3.29Å; I305-I307 HydrophobicContact CG2-CG1 3.41Å; I305-I307 VanDerWaalsContact CG2-CG1 3.41Å; I305-I307 PolarHBondContact O-N 3.07Å
306D34.9Very low45.3Very low137 Ų137136.8 Ų136.873%0.73375%0.75SS**  trans-6382.9157.4-75.8-30.9000106.6E304E304-D306 PolarHBondContact O-N 3.18Å
307I38.5Very low43.3Very low137 Ų137140.4 Ų140.470%0.70376%0.761SS**  trans-93.9101.2157.7-71.3165.2000105.2I305 C309I305-I307 HydrophobicContact CG2-CB 4.22Å; I305-I307 HydrophobicContact CG2-CD1 3.29Å; I305-I307 HydrophobicContact CG2-CG1 3.41Å; I305-I307 VanDerWaalsContact CG2-CG1 3.41Å; I305-I307 PolarHBondContact O-N 3.07Å; I307-C309 PolarHBondContact O-N 2.69Å
308S32.1Very low41.8Very low83 Ų83139.6 Ų139.658%0.5876%0.764SS**  trans-29.8116.9162.9-174.20000110.8D310S308-D310 PolarHBondContact O-N 2.91Å; S308-D310 PolarHBondContact OG-OD2 2.86Å; S308-D310 VanDerWaalsContact OG-OD2 3.1Å
309C30.9Very low40.2Very low133 Ų133138.3 Ų138.390%0.89976%0.756SS**  trans-6974.5165.3-73.30000109I307I307-C309 PolarHBondContact O-N 2.69Å
310D35.2Very low39.4Very low142 Ų142134.9 Ų134.976%0.75974%0.744SS**  trans-89.4118.3160.5-79.3-48.2000109.3S308S308-D310 PolarHBondContact O-N 2.91Å; S308-D310 PolarHBondContact OG-OD2 2.86Å; S308-D310 VanDerWaalsContact OG-OD2 3.1Å
311A32.3Very low39.3Very low98 Ų98131.3 Ų131.381%0.8174%0.738SS**  trans-59.5130.6-17500000112.8
312S32.6Very low39Very low103 Ų103133.9 Ų133.972%0.7274%0.738SS**  trans-178.6110.2131.253.90000111.8
313I30.6Very low39Very low162 Ų162131.3 Ų131.383%0.83173%0.726SS**  39.2107.6128.3-52.4167.9000117.1
314S32.7Very low39.1Very low105 Ų105131.9 Ų131.973%0.73472%0.723SS**  166.9141.3113.145.80000112.3I316S314-I316 PolarHBondContact O-N 3.14Å
315N33.2Very low39.5Very low170 Ų170132.1 Ų132.191%0.90972%0.724SS**  trans-45.2118.8176.2-79.7-30000113
316I37.1Very low39.9Very low144 Ų144130.9 Ų130.974%0.73872%0.719SS**  trans-135.8121158.2-61.8-177.9000108.6S314S314-I316 PolarHBondContact O-N 3.14Å
317D39Very low40.5Very low139 Ų139127.8 Ų127.874%0.74371%0.707SS**  trans-48.7127.7-176-76.2-51.9000115.1S319D317-S319 PolarHBondContact O-N 3.14Å
318D47Very low40.6Very low147 Ų147128.7 Ų128.779%0.78671%0.708SS**THydrogen-bonded Turntrans-62.85.2178-94.4-31.6000115.5
319S45Very low41.2Very low87 Ų87135.7 Ų135.761%0.60872%0.722SS**Hα-helixtrans-83.1-25.6178.4-171.10000113.1D317D317-S319 PolarHBondContact O-N 3.14Å
320S46.7Very low41.7Very low66 Ų66137.6 Ų137.646%0.46272%0.718SS.*Hα-helixtrans-81-25.2-171.266.50000114.6R324S320-R324 PolarHBondContact O-N 3.17Å
321I49.4Very low41.7Very low119 Ų119136.4 Ų136.461%0.6172%0.716SS**Hα-helixtrans-73.6-35.1-179.8-61.5177.8000110.7R324I321-R324 PolarHBondContact O-N 3.14Å
322F45.9Very low42Very low162 Ų162137.3 Ų137.371%0.71172%0.716SS**Hα-helixtrans-71.1-31.9179-147.3-93.7000112.4L326F322-L326 HydrophobicContact CD1-CD1 4.25Å; F322-L326 HydrophobicContact CE1-CD1 4.34Å
323Q49.5Very low42.2Very low140 Ų140137.9 Ų137.965%0.65472%0.72SS**Hα-helixtrans-72.2-32.2176.6-103.1178.1-30.200113.5Q325 L326 S327Q323-Q325 VanDerWaalsContact C-N 3.35Å; Q323-Q325 PolarHBondContact O-N 3.26Å; Q323-L326 PolarHBondContact O-N 3.16Å; Q323-S327 PolarHBondContact O-N 3.44Å
324R47.4Very low42.5Very low201 Ų201139.5 Ų139.576%0.75872%0.721SS**Hα-helixtrans-67.9-30.5177.1-103.8-176.1-165.7162.96.3113.9S320 I321 S327S320-R324 PolarHBondContact O-N 3.17Å; I321-R324 PolarHBondContact O-N 3.14Å; R324-S327 PolarHBondContact O-OG 2.79Å
325Q50.2Low42.7Very low162 Ų162140 Ų14076%0.75772%0.722SS**Hα-helixtrans-75.7-26177.4-70.7-133.1-3400113Q323Q323-Q325 VanDerWaalsContact C-N 3.35Å; Q323-Q325 PolarHBondContact O-N 3.26Å
326L47Very low42.9Very low112 Ų112140.1 Ų140.159%0.58672%0.721SS**Hα-helixtrans-79.6-33.7176.3-78.2162.6000112.5F322 Q323 H328 R329F322-L326 HydrophobicContact CD1-CD1 4.25Å; F322-L326 HydrophobicContact CE1-CD1 4.34Å; Q323-L326 PolarHBondContact O-N 3.16Å; L326-H328 PolarHBondContact O-N 3.15Å; L326-R329 PolarHBondContact O-N 2.88Å
327S47.7Very low43.1Very low71 Ų71140.9 Ų140.950%0.49773%0.726SS.*Hα-helixtrans-69.4-30.8177.668.80000113.2Q323 R324 R329 Q330Q323-S327 PolarHBondContact O-N 3.44Å; R324-S327 PolarHBondContact O-OG 2.79Å; S327-R329 PolarHBondContact O-N 3.28Å; S327-Q330 PolarHBondContact O-N 3.02Å
328H41.5Very low42.7Very low156 Ų156142.7 Ų142.772%0.72273%0.733SS**THydrogen-bonded Turntrans-70.5-13.7177.6-108.3-62000114.4L326L326-H328 PolarHBondContact O-N 3.15Å
329R43.5Very low42.8Very low230 Ų230147.2 Ų147.287%0.86876%0.757SS**THydrogen-bonded Turntrans-91.3-4.8179.1-130.3178.7-169.5-179.13.4114.1L326 S327L326-R329 PolarHBondContact O-N 2.88Å; S327-R329 PolarHBondContact O-N 3.28Å
330Q42.6Very low42.7Very low174 Ų174150.2 Ų150.281%0.81376%0.764SS**SBendtrans-110.57.8-177.5-99.8-176.9-23.200115.7S327S327-Q330 PolarHBondContact O-N 3.02Å
331T35.9Very low42.5Very low116 Ų116154.6 Ų154.671%0.71278%0.78SS**  trans-12567.1173.949.50000112.1
332S37.5Very low42.1Very low117 Ų117156.6 Ų156.682%0.81879%0.79SS**  trans-150.355.2157.6-175.50000111.1
333S36.8Very low41.9Very low116 Ų116156.3 Ų156.381%0.81179%0.794SS**  trans-98.69315356.20000107.2
334K36.4Very low41.5Very low196 Ų196157.3 Ų157.385%0.85280%0.803SS**PPolyproline II helixtrans-85.1128.1168.5-117.8-178.2-179-178.60108.2
335P37.8Very low41.1Very low116 Ų116154.4 Ų154.475%0.75381%0.806SS**PPolyproline II helixtrans-75144.6178.729.4-31.2000111.4N337P335-N337 PolarHBondContact O-N 3.46Å
336I37.9Very low40.4Very low172 Ų172153.9 Ų153.988%0.88281%0.809SS**PPolyproline II helixtrans-68.5116.2173.8-65.3164.1000107.5
337N39.7Very low39.9Very low159 Ų159157.1 Ų157.185%0.8583%0.827SS**PPolyproline II helixtrans-94.2131.6172.3-119.92.6000109.6P335P335-N337 PolarHBondContact O-N 3.46Å
338M31.1Very low39.2Very low177 Ų177164.3 Ų164.387%0.87285%0.854SS**PPolyproline II helixtrans-59.7140.3169.9-69.7172.7165.700111.2
339N50.3Low39Very low242 Ų242165 Ų165100%1.29487%0.866SS**  trans-128.10138.4-105.54.7000107.3

Retrieved 339 of 339 residues in 592.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).