A0A077ZC07_TRITR Loading...

Endophilin protein 1, b

AlphaFold DB , UniProt , Accession A0A077ZC07, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 273 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M52.9Low63Low229 Ų229137.6 Ų137.6100%1.12865%0.653SS**  0-19.80-76.1-176.3-134.900113.8F3M1-F3 PolarHBondContact O-N 3.04Å
2E53.1Low63.9Low158 Ų158130.3 Ų130.374%0.73863%0.633SS**Hα-helixtrans-66.4-27.3-177.4-67.8-167.4133.900116.1N4 F5 R6E2-N4 VanDerWaalsContact C-N 3.33Å; E2-N4 PolarHBondContact O-N 3.23Å; E2-F5 PolarHBondContact O-N 3.2Å; E2-R6 PolarHBondContact O-N 3.32Å
3F54.3Low64.8Low182 Ų182124.6 Ų124.680%0.79862%0.62SS**Hα-helixtrans-66.2-33-177.2-159.3-94.5000113.1M1M1-F3 PolarHBondContact O-N 3.04Å
4N62.6Low65.8Low126 Ų126119.3 Ų119.367%0.67460%0.598SS**Hα-helixtrans-76.4-32.8177-85.3-27.8000112.7E2 F8E2-N4 VanDerWaalsContact C-N 3.33Å; E2-N4 PolarHBondContact O-N 3.23Å; N4-F8 VanDerWaalsContact O-CB 3.3Å; N4-F8 WeakPolarHBondContact O-CB 3.33Å; N4-F8 PolarHBondContact O-N 3.38Å
5F66.5Low66.5Low138 Ų138114.7 Ų114.761%0.60559%0.586SS**Hα-helixtrans-68.9-44.2-179.3-166-99.9000111.5E2 K7 F8 T9E2-F5 PolarHBondContact O-N 3.2Å; F5-K7 PolarHBondContact O-N 2.96Å; F5-F8 PolarHBondContact O-N 3.37Å; F5-T9 HydrophobicContact CD1-CG2 3.97Å; F5-T9 HydrophobicContact CE1-CG2 3.68Å; F5-T9 HydrophobicContact CZ-CG2 4.08Å; F5-T9 WeakPolarHBondContact O-CG2 3.45Å; F5-T9 PolarHBondContact O-N 3.16Å; F5-T9 PolarHBondContact O-OG1 3.4Å
6R61.2Low67.2Low189 Ų189116.8 Ų116.871%0.71359%0.59SS**Hα-helixtrans-61.6-42.2177.1-76.9-172178.6170.62.4112.9E2 T9 S10E2-R6 PolarHBondContact O-N 3.32Å; R6-T9 WeakPolarHBondContact CA-OG1 3.4Å; R6-T9 PolarHBondContact O-N 3.47Å; R6-T9 PolarHBondContact O-OG1 3.4Å; R6-S10 WeakPolarHBondContact O-CB 3.3Å; R6-S10 PolarHBondContact O-N 3.43Å
7K61.1Low67.9Low130 Ų130111.9 Ų111.957%0.56557%0.567SS**Hα-helixtrans-63.5-47.1175.8-171.3179.1177.9-177.90111.2F5 T9 S10 D11F5-K7 PolarHBondContact O-N 2.96Å; K7-T9 VanDerWaalsContact C-N 3.34Å; K7-T9 PolarHBondContact O-N 2.89Å; K7-S10 PolarHBondContact O-N 3.04Å; K7-S10 VanDerWaalsContact O-N 3.16Å; K7-D11 PolarHBondContact O-N 3.37Å
8F68.4Low68.6Low143 Ų143108.8 Ų108.863%0.62755%0.548SS*.Hα-helixtrans-58.2-43.7176.2-177.7-98.3000112.4N4 F5 S10 D11 A12N4-F8 VanDerWaalsContact O-CB 3.3Å; N4-F8 WeakPolarHBondContact O-CB 3.33Å; N4-F8 PolarHBondContact O-N 3.38Å; F5-F8 PolarHBondContact O-N 3.37Å; F8-S10 PolarHBondContact O-N 3.05Å; F8-D11 PolarHBondContact O-N 3.42Å; F8-A12 WeakPolarHBondContact O-CB 3.39Å; F8-A12 PolarHBondContact O-N 3.05Å
9T71.4Confident68.9Low63 Ų63105.8 Ų105.839%0.38754%0.541SS..Hα-helixtrans-66-35.917753.80000112.9F5 R6 K7 A13F5-T9 HydrophobicContact CD1-CG2 3.97Å; F5-T9 HydrophobicContact CE1-CG2 3.68Å; F5-T9 HydrophobicContact CZ-CG2 4.08Å; F5-T9 WeakPolarHBondContact O-CG2 3.45Å; F5-T9 PolarHBondContact O-N 3.16Å; F5-T9 PolarHBondContact O-OG1 3.4Å; R6-T9 WeakPolarHBondContact CA-OG1 3.4Å; R6-T9 PolarHBondContact O-N 3.47Å; R6-T9 PolarHBondContact O-OG1 3.4Å; K7-T9 VanDerWaalsContact C-N 3.34Å; K7-T9 PolarHBondContact O-N 2.89Å; T9-A13 WeakPolarHBondContact O-CB 3.37Å; T9-A13 PolarHBondContact O-N 3.35Å
10S70.5Confident69.3Low69 Ų69103.4 Ų103.448%0.48353%0.531SS..Hα-helixtrans-69.2-41.7176.4-1770000111.7R6 K7 F8 A12 A13 T14R6-S10 WeakPolarHBondContact O-CB 3.3Å; R6-S10 PolarHBondContact O-N 3.43Å; K7-S10 PolarHBondContact O-N 3.04Å; K7-S10 VanDerWaalsContact O-N 3.16Å; F8-S10 PolarHBondContact O-N 3.05Å; S10-A12 VanDerWaalsContact C-N 3.35Å; S10-A13 PolarHBondContact O-N 3.33Å; S10-T14 WeakPolarHBondContact O-CG2 3.39Å; S10-T14 PolarHBondContact O-N 3.24Å; S10-T14 PolarHBondContact O-OG1 3.43Å
11D71.2Confident69.6Low87 Ų8799 Ų9947%0.46551%0.508SS..Hα-helixtrans-66.9-37.6176.8-69.2-17000111.1K7 F8 T14 A15K7-D11 PolarHBondContact O-N 3.37Å; F8-D11 PolarHBondContact O-N 3.42Å; D11-T14 WeakPolarHBondContact CA-OG1 3.44Å; D11-T14 PolarHBondContact O-OG1 3.15Å; D11-A15 WeakPolarHBondContact O-CB 3.27Å; D11-A15 PolarHBondContact O-N 3.23Å
12A73.3Confident70.3Confident50 Ų5092.8 Ų92.841%0.41348%0.475SS..Hα-helixtrans-67.3-41.9173.900000112.5F8 S10 A15 F16F8-A12 WeakPolarHBondContact O-CB 3.39Å; F8-A12 PolarHBondContact O-N 3.05Å; S10-A12 VanDerWaalsContact C-N 3.35Å; A12-A15 PolarHBondContact O-N 3.21Å; A12-F16 WeakPolarHBondContact O-CB 3.27Å; A12-F16 PolarHBondContact O-N 3.36Å
13A76.8Confident71.1Confident56 Ų5688.8 Ų88.846%0.46346%0.462SS..Hα-helixtrans-65.3-38.5177.500000112.3T9 S10 T17T9-A13 WeakPolarHBondContact O-CB 3.37Å; T9-A13 PolarHBondContact O-N 3.35Å; S10-A13 PolarHBondContact O-N 3.33Å; A13-T17 WeakPolarHBondContact O-CB 3.44Å; A13-T17 PolarHBondContact O-N 3.15Å; A13-T17 PolarHBondContact O-OG1 3.49Å
14T78.5Confident71.8Confident50 Ų5083.9 Ų83.931%0.30744%0.442SS..Hα-helixtrans-68.7-42.417448.70000111.6S10 D11 F16 T17 R18S10-T14 WeakPolarHBondContact O-CG2 3.39Å; S10-T14 PolarHBondContact O-N 3.24Å; S10-T14 PolarHBondContact O-OG1 3.43Å; D11-T14 WeakPolarHBondContact CA-OG1 3.44Å; D11-T14 PolarHBondContact O-OG1 3.15Å; T14-F16 PolarHBondContact O-N 2.94Å; T14-T17 PolarHBondContact O-N 3.3Å; T14-R18 WeakPolarHBondContact O-CG 3.4Å; T14-R18 PolarHBondContact O-N 3.49Å
15A75.3Confident72.3Confident51 Ų5179.3 Ų79.342%0.42142%0.416SS..Hα-helixtrans-60.1-42.8174.200000112.8D11 A12 R18 A19D11-A15 WeakPolarHBondContact O-CB 3.27Å; D11-A15 PolarHBondContact O-N 3.23Å; A12-A15 PolarHBondContact O-N 3.21Å; A15-R18 PolarHBondContact O-N 2.92Å; A15-A19 PolarHBondContact O-N 3.26Å
16F78.7Confident72.3Confident147 Ų14780.4 Ų80.465%0.64542%0.421SS*.Hα-helixtrans-63.6-44.2175.2-176.2-97.1000111.6A12 T14 R18 A19 V20A12-F16 WeakPolarHBondContact O-CB 3.27Å; A12-F16 PolarHBondContact O-N 3.36Å; T14-F16 PolarHBondContact O-N 2.94Å; F16-R18 VanDerWaalsContact C-N 3.32Å; F16-R18 PolarHBondContact O-N 3.03Å; F16-A19 WeakPolarHBondContact O-CB 3.43Å; F16-A19 PolarHBondContact O-N 3.47Å; F16-A19 VanDerWaalsContact O-N 3.15Å; F16-V20 HydrophobicContact CD1-CG2 4.03Å; F16-V20 HydrophobicContact CE1-CG2 3.61Å; F16-V20 HydrophobicContact CE2-CG2 4.47Å; F16-V20 HydrophobicContact CZ-CG2 3.86Å; F16-V20 WeakPolarHBondContact O-CG2 3.32Å; F16-V20 PolarHBondContact O-N 3.36Å
17T78Confident72.4Confident34 Ų3476.8 Ų76.821%0.20942%0.415CS..Hα-helixtrans-58.4-45.1176.2-56.80000111.1A13 T14 A19 V20 Q21 A171 R175A13-T17 WeakPolarHBondContact O-CB 3.44Å; A13-T17 PolarHBondContact O-N 3.15Å; A13-T17 PolarHBondContact O-OG1 3.49Å; T14-T17 PolarHBondContact O-N 3.3Å; T17-A19 VanDerWaalsContact C-N 3.33Å; T17-A19 PolarHBondContact O-N 3.12Å; T17-V20 PolarHBondContact O-N 2.85Å; T17-Q21 PolarHBondContact O-N 3.41Å; T17-A171 HydrophobicContact CG2-CB 3.55Å; T17-R175 VanDerWaalsContact CG2-NH2 3.34Å; T17-R175 PolarHBondContact OG1-NH2 3.23Å
18R81.6Confident72.5Confident57 Ų5773.9 Ų73.922%0.21542%0.422CS..Hα-helixtrans-60.3-42.5175.8-71.3174.9-174.7152.34.9112.1T14 A15 F16 Q21 F22 L167 D168T14-R18 WeakPolarHBondContact O-CG 3.4Å; T14-R18 PolarHBondContact O-N 3.49Å; A15-R18 PolarHBondContact O-N 2.92Å; F16-R18 VanDerWaalsContact C-N 3.32Å; F16-R18 PolarHBondContact O-N 3.03Å; R18-Q21 PolarHBondContact O-N 2.97Å; R18-F22 WeakPolarHBondContact O-CB 3.1Å; R18-F22 PolarHBondContact O-N 3.45Å; R18-L167 HydrophobicContact CB-CB 4.18Å; R18-L167 HydrophobicContact CB-CD1 4.07Å; R18-L167 HydrophobicContact CG-CB 3.98Å; R18-D168 VanDerWaalsContact CG-OD1 3.24Å; R18-D168 WeakPolarHBondContact CG-OD1 3.13Å; R18-D168 IonicContact CZ-OD1 2.67Å; R18-D168 IonicContact CZ-OD2 2.67Å; R18-D168 IonicContact NE-OD1 2.77Å; R18-D168 PolarHBondContact NE-OD1 2.95Å; R18-D168 IonicContact NE-OD2 3.33Å; R18-D168 PolarHBondContact NE-OD2 2.93Å; R18-D168 IonicContact NH2-OD1 3.92Å; R18-D168 PolarHBondContact NH2-OD1 3.07Å; R18-D168 IonicContact NH2-OD2 3.1Å; R18-D168 PolarHBondContact NH2-OD2 3.06Å
19A73.5Confident72.1Confident52 Ų5275.3 Ų75.343%0.4343%0.428SS..Hα-helixtrans-63.2-45.3178.600000111.7A15 F16 T17 F22 T23A15-A19 PolarHBondContact O-N 3.26Å; F16-A19 WeakPolarHBondContact O-CB 3.43Å; F16-A19 PolarHBondContact O-N 3.47Å; F16-A19 VanDerWaalsContact O-N 3.15Å; T17-A19 VanDerWaalsContact C-N 3.33Å; T17-A19 PolarHBondContact O-N 3.12Å; A19-F22 PolarHBondContact O-N 3.16Å; A19-T23 PolarHBondContact O-N 3.21Å; A19-T23 PolarHBondContact O-OG1 2.81Å; A19-T23 VanDerWaalsContact O-OG1 3.13Å
20V78.4Confident71.6Confident56 Ų5673.6 Ų73.634%0.33942%0.42SS..Hα-helixtrans-58.8-49.7175.6172.30000110.7F16 T17 F22 T23 E24F16-V20 HydrophobicContact CD1-CG2 4.03Å; F16-V20 HydrophobicContact CE1-CG2 3.61Å; F16-V20 HydrophobicContact CE2-CG2 4.47Å; F16-V20 HydrophobicContact CZ-CG2 3.86Å; F16-V20 WeakPolarHBondContact O-CG2 3.32Å; F16-V20 PolarHBondContact O-N 3.36Å; T17-V20 PolarHBondContact O-N 2.85Å; V20-F22 VanDerWaalsContact C-N 3.33Å; V20-F22 PolarHBondContact O-N 3.37Å; V20-T23 PolarHBondContact O-N 3Å; V20-T23 VanDerWaalsContact O-N 3.15Å; V20-E24 HydrophobicContact CG1-CG 4.44Å; V20-E24 WeakPolarHBondContact O-CG 3.46Å; V20-E24 PolarHBondContact O-N 3.3Å
21Q73.8Confident71Confident11 Ų1176.7 Ų76.75%0.05143%0.427CS..Hα-helixtrans-59.6-43.5179.3-171.463.538.500112T17 R18 T23 E24 E25 L167 D170T17-Q21 PolarHBondContact O-N 3.41Å; R18-Q21 PolarHBondContact O-N 2.97Å; Q21-T23 VanDerWaalsContact C-N 3.32Å; Q21-T23 PolarHBondContact O-N 3.43Å; Q21-E24 PolarHBondContact O-N 3.05Å; Q21-E25 WeakPolarHBondContact O-CG 3.38Å; Q21-E25 PolarHBondContact O-N 3.07Å; Q21-L167 HydrophobicContact CB-CD2 4.1Å; Q21-L167 HydrophobicContact CG-CD2 3.93Å; Q21-D170 HydrophobicContact CG-CB 3.9Å
22F67.6Low70.8Confident99 Ų9979.6 Ų79.643%0.43443%0.431SS..Hα-helixtrans-61.6-40.3176.9-176.8-93.7000112.2R18 A19 V20 K26 L167R18-F22 WeakPolarHBondContact O-CB 3.1Å; R18-F22 PolarHBondContact O-N 3.45Å; A19-F22 PolarHBondContact O-N 3.16Å; V20-F22 VanDerWaalsContact C-N 3.33Å; V20-F22 PolarHBondContact O-N 3.37Å; F22-K26 HydrophobicContact CD1-CG 4.45Å; F22-K26 HydrophobicContact CE1-CG 4.11Å; F22-K26 HydrophobicContact CZ-CG 4.43Å; F22-K26 WeakPolarHBondContact O-CG 3.47Å; F22-K26 PolarHBondContact O-N 3.46Å; F22-L167 HydrophobicContact CB-CD1 4.27Å; F22-L167 HydrophobicContact CB-CD2 3.99Å; F22-L167 HydrophobicContact CD2-CD1 4.49Å; F22-L167 HydrophobicContact CD2-CD2 4.47Å
23T70.3Confident70.9Confident75 Ų7578.1 Ų78.146%0.4642%0.417SS..Hα-helixtrans-66.9-41.7175.4-61.30000111.7A19 V20 Q21 E25 K26 L27A19-T23 PolarHBondContact O-N 3.21Å; A19-T23 PolarHBondContact O-OG1 2.81Å; A19-T23 VanDerWaalsContact O-OG1 3.13Å; V20-T23 PolarHBondContact O-N 3Å; V20-T23 VanDerWaalsContact O-N 3.15Å; Q21-T23 VanDerWaalsContact C-N 3.32Å; Q21-T23 PolarHBondContact O-N 3.43Å; T23-E25 VanDerWaalsContact C-N 3.34Å; T23-E25 PolarHBondContact O-N 2.99Å; T23-K26 PolarHBondContact O-N 3.11Å; T23-L27 HydrophobicContact CG2-CD1 3.86Å; T23-L27 HydrophobicContact CG2-CG 4.41Å; T23-L27 VanDerWaalsContact O-CG 3.29Å; T23-L27 WeakPolarHBondContact O-CG 3.43Å; T23-L27 PolarHBondContact O-N 2.96Å
24E70.1Confident70.8Confident79 Ų7983.8 Ų83.837%0.36943%0.434SS..Hα-helixtrans-64.4-36.8179-73.1-176.416800112.7V20 Q21 L27 G28 K29 A30V20-E24 HydrophobicContact CG1-CG 4.44Å; V20-E24 WeakPolarHBondContact O-CG 3.46Å; V20-E24 PolarHBondContact O-N 3.3Å; Q21-E24 PolarHBondContact O-N 3.05Å; E24-L27 PolarHBondContact O-N 3.35Å; E24-G28 PolarHBondContact O-N 3.38Å; E24-K29 PolarHBondContact O-N 2.95Å; E24-A30 HydrophobicContact CB-CB 3.97Å; E24-A30 PolarHBondContact O-N 3.46Å
25E72.5Confident70.8Confident30 Ų3083 Ų8314%0.1443%0.428CS..Hα-helixtrans-64.4-45.3172.2-73.3170.2-157.500112.3Q21 T23 L27 G28 A30 R166 L167Q21-E25 WeakPolarHBondContact O-CG 3.38Å; Q21-E25 PolarHBondContact O-N 3.07Å; T23-E25 VanDerWaalsContact C-N 3.34Å; T23-E25 PolarHBondContact O-N 2.99Å; E25-L27 PolarHBondContact O-N 3.29Å; E25-G28 PolarHBondContact O-N 2.95Å; E25-A30 HydrophobicContact CG-CB 4.22Å; E25-R166 IonicContact OE1-CZ 2.96Å; E25-R166 IonicContact OE1-NH1 3.22Å; E25-R166 PolarHBondContact OE1-NH1 3.15Å; E25-R166 IonicContact OE1-NH2 3.1Å; E25-R166 PolarHBondContact OE1-NH2 3.43Å; E25-R166 IonicContact OE2-CZ 3.69Å; E25-R166 VanDerWaalsContact OE2-CZ 3.32Å; E25-R166 IonicContact OE2-NH1 3.09Å; E25-R166 PolarHBondContact OE2-NH1 2.97Å; E25-R166 VanDerWaalsContact OE2-NH1 3.1Å; E25-R166 IonicContact OE2-NH2 3.29Å; E25-R166 PolarHBondContact OE2-NH2 3.3Å; E25-L167 WeakPolarHBondContact OE1-CD2 3.27Å
26K66.5Low71.3Confident160 Ų16085 Ų8570%0.69643%0.432SS*.Hα-helixtrans-63.4-28.1177.8-75.4-69.8-178-178.80112.7F22 T23 G28F22-K26 HydrophobicContact CD1-CG 4.45Å; F22-K26 HydrophobicContact CE1-CG 4.11Å; F22-K26 HydrophobicContact CZ-CG 4.43Å; F22-K26 WeakPolarHBondContact O-CG 3.47Å; F22-K26 PolarHBondContact O-N 3.46Å; T23-K26 PolarHBondContact O-N 3.11Å; K26-G28 VanDerWaalsContact C-N 3.32Å
27L64.3Low71.8Confident114 Ų11482.2 Ų82.260%0.59744%0.435SS*.THydrogen-bonded Turntrans-86.71.2175.3-66.5173.4000113.4T23 E24 E25 K29T23-L27 HydrophobicContact CG2-CD1 3.86Å; T23-L27 HydrophobicContact CG2-CG 4.41Å; T23-L27 VanDerWaalsContact O-CG 3.29Å; T23-L27 WeakPolarHBondContact O-CG 3.43Å; T23-L27 PolarHBondContact O-N 2.96Å; E24-L27 PolarHBondContact O-N 3.35Å; E25-L27 PolarHBondContact O-N 3.29Å; L27-K29 VanDerWaalsContact C-N 3.25Å; L27-K29 HydrophobicContact CB-CG 4.45Å; L27-K29 PolarHBondContact O-N 3.12Å
28G63.2Low72.4Confident69 Ų6985.7 Ų85.771%0.71145%0.445SS*.THydrogen-bonded Turntrans7114.8179.300000114.7E24 E25 K26E24-G28 PolarHBondContact O-N 3.38Å; E25-G28 PolarHBondContact O-N 2.95Å; K26-G28 VanDerWaalsContact C-N 3.32Å
29K58.8Low72.8Confident173 Ų17383.2 Ų83.275%0.75244%0.436SS*.  trans-93.7-9.2-176.6-67.1-174.8179.4-179.60113.7E24 L27E24-K29 PolarHBondContact O-N 2.95Å; L27-K29 VanDerWaalsContact C-N 3.25Å; L27-K29 HydrophobicContact CB-CG 4.45Å; L27-K29 PolarHBondContact O-N 3.12Å
30A60.5Low73.7Confident26 Ų2684.4 Ų84.422%0.21543%0.433CS..SBendtrans-129.8137.1-179.900000111.5E24 E25E24-A30 HydrophobicContact CB-CB 3.97Å; E24-A30 PolarHBondContact O-N 3.46Å; E25-A30 HydrophobicContact CG-CB 4.22Å
31E58.5Low74.4Confident134 Ų13484.5 Ų84.563%0.62643%0.432SS*.  trans-68.8134170.4-79.2173.8147.600110R177E31-R177 IonicContact OE2-CZ 2.6Å; E31-R177 IonicContact OE2-NH1 3.3Å; E31-R177 PolarHBondContact OE2-NH1 3.45Å; E31-R177 IonicContact OE2-NH2 3.44Å; E31-R177 PolarHBondContact OE2-NH2 3.1Å
32R66.7Low75.4Confident148 Ų14884.2 Ų84.256%0.55843%0.43SS*.  trans-92.5132.6176.8168.2162.8178.8-163.2-3.9109.3E34R32-E34 PolarHBondContact O-N 3.26Å
33T75.5Confident76.6Confident19 Ų1980 Ų8012%0.11741%0.413CS..  trans-60.4114.8166.1-660000109.1L169 D170 K173 F210T33-L169 HydrophobicContact CG2-CD2 4.35Å; T33-D170 WeakPolarHBondContact CB-OD1 3.45Å; T33-D170 PolarHBondContact N-OD2 2.78Å; T33-D170 PolarHBondContact OG1-OD1 3.03Å; T33-K173 PolarHBondContact OG1-NZ 3.11Å; T33-F210 HydrophobicContact CG2-CE1 3.88Å; T33-F210 HydrophobicContact CG2-CZ 3.92Å
34E74.7Confident77.7Confident176 Ų17682.3 Ų82.382%0.82242%0.418SS*.PPolyproline II helixtrans-79.3142.6176.7-63.4-175.1170.300110.3R32R32-E34 PolarHBondContact O-N 3.26Å
35L78.6Confident78.9Confident34 Ų3483.6 Ų83.618%0.17842%0.422CS..PPolyproline II helixtrans-87.4151.4169.4-62.2167.2000108F39 E40 L43 L162 F210L35-F39 HydrophobicContact CB-CB 4.43Å; L35-F39 HydrophobicContact CB-CD1 4.1Å; L35-F39 HydrophobicContact CD1-CD1 3.71Å; L35-F39 HydrophobicContact CD1-CE1 3.8Å; L35-F39 HydrophobicContact CD2-CD1 4.18Å; L35-F39 HydrophobicContact CD2-CE1 4.29Å; L35-F39 HydrophobicContact CG-CD1 4.21Å; L35-E40 HydrophobicContact CB-CG 4.05Å; L35-L43 HydrophobicContact CD1-CD1 4.02Å; L35-L162 HydrophobicContact CD2-CD2 4.42Å; L35-F210 HydrophobicContact CD2-CZ 3.93Å
36D86.6Confident80Confident93 Ų9382.4 Ų82.450%0.49742%0.417SS..PPolyproline II helixtrans-66.1157.8177.271.955.7000111.7Y38 F39 E40D36-Y38 PolarHBondContact O-N 3.07Å; D36-Y38 WeakPolarHBondContact OD1-CA 3.4Å; D36-Y38 WeakPolarHBondContact OD1-CB 3.41Å; D36-Y38 PolarHBondContact OD1-N 3.13Å; D36-F39 PolarHBondContact O-N 3.29Å; D36-F39 VanDerWaalsContact O-N 3.16Å; D36-F39 WeakPolarHBondContact OD1-CB 3.5Å; D36-F39 PolarHBondContact OD1-N 3Å; D36-E40 PolarHBondContact O-N 2.85Å
37A88.1Confident81.4Confident88 Ų8877 Ų7773%0.72740%0.4SS*.Hα-helixtrans-61.6-29.1-175.700000113.4N41A37-N41 WeakPolarHBondContact O-CB 3.43Å; A37-N41 PolarHBondContact O-N 3.31Å; A37-N41 VanDerWaalsContact O-N 3.07Å
38Y90.6Very high82.9Confident106 Ų10674.9 Ų74.942%0.41639%0.392SS..Hα-helixtrans-70.4-43.8177.6174.1-101.2000110.8D36 N41 L42 K218 E222D36-Y38 PolarHBondContact O-N 3.07Å; D36-Y38 WeakPolarHBondContact OD1-CA 3.4Å; D36-Y38 WeakPolarHBondContact OD1-CB 3.41Å; D36-Y38 PolarHBondContact OD1-N 3.13Å; Y38-N41 WeakPolarHBondContact O-CB 3.29Å; Y38-N41 PolarHBondContact O-N 3.24Å; Y38-L42 HydrophobicContact CD1-CD1 3.97Å; Y38-L42 HydrophobicContact CD1-CG 4.48Å; Y38-L42 HydrophobicContact CE1-CD1 3.37Å; Y38-L42 HydrophobicContact CE1-CG 4.03Å; Y38-L42 PolarHBondContact O-N 3.19Å; Y38-K218 VanDerWaalsContact CE1-CE 3.45Å; Y38-E222 WeakPolarHBondContact CE1-OE1 3.43Å; Y38-E222 PolarHBondContact OH-OE1 2.93Å
39F91.1Very high84.4Confident5 Ų572 Ų722%0.02236%0.361CS..Hα-helixtrans-64-43.2177.1-164-81.7000112L35 D36 N41 L42 L43 L162 C214 L217 K218 L221L35-F39 HydrophobicContact CB-CB 4.43Å; L35-F39 HydrophobicContact CB-CD1 4.1Å; L35-F39 HydrophobicContact CD1-CD1 3.71Å; L35-F39 HydrophobicContact CD1-CE1 3.8Å; L35-F39 HydrophobicContact CD2-CD1 4.18Å; L35-F39 HydrophobicContact CD2-CE1 4.29Å; L35-F39 HydrophobicContact CG-CD1 4.21Å; D36-F39 PolarHBondContact O-N 3.29Å; D36-F39 VanDerWaalsContact O-N 3.16Å; D36-F39 WeakPolarHBondContact OD1-CB 3.5Å; D36-F39 PolarHBondContact OD1-N 3Å; F39-N41 VanDerWaalsContact C-N 3.32Å; F39-N41 PolarHBondContact O-N 3.34Å; F39-L42 WeakPolarHBondContact O-CB 3.22Å; F39-L42 PolarHBondContact O-N 3.4Å; F39-L43 HydrophobicContact CD1-CD1 3.8Å; F39-L43 HydrophobicContact CD1-CG 4.04Å; F39-L43 HydrophobicContact CE1-CD1 3.74Å; F39-L43 HydrophobicContact CE1-CD2 4.27Å; F39-L43 HydrophobicContact CE1-CG 3.91Å; F39-L43 PolarHBondContact O-N 3.22Å; F39-L162 HydrophobicContact CE1-CD2 3.96Å; F39-L162 HydrophobicContact CZ-CD2 3.82Å; F39-C214 HydrophobicContact CE2-CB 4.46Å; F39-C214 WeakPolarHBondContact CE2-O 3.43Å; F39-L217 HydrophobicContact CE1-CD2 4.15Å; F39-L217 HydrophobicContact CZ-CB 3.98Å; F39-L217 HydrophobicContact CZ-CD2 3.77Å; F39-L217 HydrophobicContact CZ-CG 3.8Å; F39-K218 HydrophobicContact CD2-CB 4.16Å; F39-K218 HydrophobicContact CD2-CG 4.31Å; F39-K218 HydrophobicContact CE2-CB 3.83Å; F39-K218 HydrophobicContact CE2-CG 4.45Å; F39-L221 HydrophobicContact CE1-CD1 4.33Å; F39-L221 HydrophobicContact CE2-CD1 4.5Å; F39-L221 HydrophobicContact CZ-CD1 4.18Å
40E91.4Very high86.2Confident78 Ų7865 Ų6536%0.36433%0.331SS..Hα-helixtrans-62.2-40174.5-70.1-68.1176.300111.4L35 D36 L42 L43 E44L35-E40 HydrophobicContact CB-CG 4.05Å; D36-E40 PolarHBondContact O-N 2.85Å; E40-L42 VanDerWaalsContact C-N 3.32Å; E40-L42 PolarHBondContact O-N 3.33Å; E40-L43 WeakPolarHBondContact O-CB 3.43Å; E40-L43 PolarHBondContact O-N 3.17Å; E40-E44 PolarHBondContact O-N 3.15Å
41N93.4Very high88Confident58 Ų5870 Ų7031%0.3135%0.35SS..Hα-helixtrans-63.2-37.1174.1-175.8-106.5000112.9A37 Y38 F39 E44 K45A37-N41 WeakPolarHBondContact O-CB 3.43Å; A37-N41 PolarHBondContact O-N 3.31Å; A37-N41 VanDerWaalsContact O-N 3.07Å; Y38-N41 WeakPolarHBondContact O-CB 3.29Å; Y38-N41 PolarHBondContact O-N 3.24Å; F39-N41 VanDerWaalsContact C-N 3.32Å; F39-N41 PolarHBondContact O-N 3.34Å; N41-E44 PolarHBondContact O-N 2.97Å; N41-K45 WeakPolarHBondContact O-CB 3.43Å; N41-K45 WeakPolarHBondContact O-CG 3.39Å; N41-K45 PolarHBondContact O-N 3.34Å; N41-K45 WeakPolarHBondContact OD1-CE 3.27Å; N41-K45 PolarHBondContact OD1-NZ 3.44Å
42L94.2Very high89.8Confident5 Ų568.4 Ų68.43%0.02634%0.342CS..Hα-helixtrans-65-41.4174.4-76.8178.5000112Y38 F39 E40 K45 A46 K218 L221 E222Y38-L42 HydrophobicContact CD1-CD1 3.97Å; Y38-L42 HydrophobicContact CD1-CG 4.48Å; Y38-L42 HydrophobicContact CE1-CD1 3.37Å; Y38-L42 HydrophobicContact CE1-CG 4.03Å; Y38-L42 PolarHBondContact O-N 3.19Å; F39-L42 WeakPolarHBondContact O-CB 3.22Å; F39-L42 PolarHBondContact O-N 3.4Å; E40-L42 VanDerWaalsContact C-N 3.32Å; E40-L42 PolarHBondContact O-N 3.33Å; L42-K45 PolarHBondContact O-N 3.12Å; L42-A46 WeakPolarHBondContact O-CB 3.39Å; L42-A46 PolarHBondContact O-N 2.8Å; L42-K218 HydrophobicContact CD1-CG 4.03Å; L42-L221 HydrophobicContact CB-CB 3.91Å; L42-L221 HydrophobicContact CB-CD1 3.91Å; L42-L221 HydrophobicContact CB-CG 4.48Å; L42-L221 HydrophobicContact CD1-CB 4.29Å; L42-E222 HydrophobicContact CD1-CG 3.81Å; L42-E222 HydrophobicContact CD2-CG 4.19Å
43L93.6Very high91.3Very high11 Ų1161.8 Ų61.86%0.05832%0.318CS..Hα-helixtrans-63.1-41.1175.2-74.6173.2000112.2L35 F39 E40 A46 S47 L217 L221L35-L43 HydrophobicContact CD1-CD1 4.02Å; F39-L43 HydrophobicContact CD1-CD1 3.8Å; F39-L43 HydrophobicContact CD1-CG 4.04Å; F39-L43 HydrophobicContact CE1-CD1 3.74Å; F39-L43 HydrophobicContact CE1-CD2 4.27Å; F39-L43 HydrophobicContact CE1-CG 3.91Å; F39-L43 PolarHBondContact O-N 3.22Å; E40-L43 WeakPolarHBondContact O-CB 3.43Å; E40-L43 PolarHBondContact O-N 3.17Å; L43-A46 PolarHBondContact O-N 3.48Å; L43-S47 PolarHBondContact O-N 2.9Å; L43-S47 PolarHBondContact O-OG 3.48Å; L43-L217 HydrophobicContact CD2-CD2 4.26Å; L43-L221 HydrophobicContact CD2-CD1 3.75Å; L43-L221 HydrophobicContact CD2-CD2 4.19Å; L43-L221 HydrophobicContact CG-CD1 4Å
44E93.9Very high92.3Very high122 Ų12265.8 Ų65.857%0.5733%0.334SS*.Hα-helixtrans-62.5-49.8175.8-175.7179.5-165.800110.6E40 N41 A46 S47 V48E40-E44 PolarHBondContact O-N 3.15Å; N41-E44 PolarHBondContact O-N 2.97Å; E44-A46 VanDerWaalsContact C-N 3.29Å; E44-A46 PolarHBondContact O-N 3.39Å; E44-S47 WeakPolarHBondContact O-CB 3.34Å; E44-S47 PolarHBondContact O-N 3.46Å; E44-V48 WeakPolarHBondContact O-CG2 3.32Å; E44-V48 PolarHBondContact O-N 3.44Å
45K93.8Very high93.4Very high106 Ų10659.7 Ų59.746%0.46131%0.314SS..Hα-helixtrans-56.9-41.4176.5-78.2172.3174.2159.90112.6N41 L42 S47 V48 A49N41-K45 WeakPolarHBondContact O-CB 3.43Å; N41-K45 WeakPolarHBondContact O-CG 3.39Å; N41-K45 PolarHBondContact O-N 3.34Å; N41-K45 WeakPolarHBondContact OD1-CE 3.27Å; N41-K45 PolarHBondContact OD1-NZ 3.44Å; L42-K45 PolarHBondContact O-N 3.12Å; K45-S47 VanDerWaalsContact C-N 3.34Å; K45-V48 PolarHBondContact O-N 3.33Å; K45-A49 VanDerWaalsContact O-CB 3.27Å; K45-A49 WeakPolarHBondContact O-CB 3.4Å; K45-A49 PolarHBondContact O-N 2.83Å
46A95.6Very high94.3Very high5 Ų562 Ų624%0.04133%0.326CS..Hα-helixtrans-63.9-39.6176.200000112.6L42 L43 E44 A49 E50 L221 I224L42-A46 WeakPolarHBondContact O-CB 3.39Å; L42-A46 PolarHBondContact O-N 2.8Å; L43-A46 PolarHBondContact O-N 3.48Å; E44-A46 VanDerWaalsContact C-N 3.29Å; E44-A46 PolarHBondContact O-N 3.39Å; A46-A49 PolarHBondContact O-N 2.93Å; A46-E50 WeakPolarHBondContact O-CB 3.49Å; A46-E50 PolarHBondContact O-N 3.06Å; A46-L221 HydrophobicContact CB-CD2 3.42Å; A46-L221 VanDerWaalsContact CB-CD2 3.42Å; A46-I224 HydrophobicContact CB-CD1 3.26Å
47S95.3Very high94.8Very high48 Ų4858.4 Ų58.434%0.33631%0.306SS..Hα-helixtrans-65.3-45.7178-540000111L43 E44 K45 A49 E50 E51L43-S47 PolarHBondContact O-N 2.9Å; L43-S47 PolarHBondContact O-OG 3.48Å; E44-S47 WeakPolarHBondContact O-CB 3.34Å; E44-S47 PolarHBondContact O-N 3.46Å; K45-S47 VanDerWaalsContact C-N 3.34Å; S47-A49 VanDerWaalsContact C-N 3.35Å; S47-A49 PolarHBondContact O-N 2.86Å; S47-E50 PolarHBondContact O-N 3.26Å; S47-E51 WeakPolarHBondContact O-CB 3.39Å; S47-E51 PolarHBondContact O-N 2.96Å
48V95.9Very high95.1Very high69 Ų6958.3 Ų58.342%0.41829%0.293SS..Hα-helixtrans-61-44.2174.7172.60000110.9E44 K45 E50 E51 H52E44-V48 WeakPolarHBondContact O-CG2 3.32Å; E44-V48 PolarHBondContact O-N 3.44Å; K45-V48 PolarHBondContact O-N 3.33Å; V48-E50 PolarHBondContact O-N 2.98Å; V48-E51 PolarHBondContact O-N 3.5Å; V48-H52 PolarHBondContact O-CD2 2.78Å; V48-H52 VanDerWaalsContact O-CD2 3.23Å; V48-H52 PolarHBondContact O-N 3.2Å
49A96Very high95.4Very high8 Ų857.1 Ų57.17%0.06630%0.3CS..Hα-helixtrans-61.8-44.3178.200000111.9K45 A46 S47 T53 F147 I224K45-A49 VanDerWaalsContact O-CB 3.27Å; K45-A49 WeakPolarHBondContact O-CB 3.4Å; K45-A49 PolarHBondContact O-N 2.83Å; A46-A49 PolarHBondContact O-N 2.93Å; S47-A49 VanDerWaalsContact C-N 3.35Å; S47-A49 PolarHBondContact O-N 2.86Å; A49-T53 WeakPolarHBondContact O-CB 3.47Å; A49-T53 PolarHBondContact O-N 3.37Å; A49-T53 PolarHBondContact O-OG1 3.43Å; A49-F147 HydrophobicContact CB-CZ 4.4Å; A49-I224 HydrophobicContact CB-CG2 4.03Å
50E97.3Very high95.7Very high27 Ų2757.8 Ų57.813%0.12630%0.303CS..Hα-helixtrans-61.7-52.3175.8175.1179.8-174.200112A46 S47 V48 H52 T53 K54 L148 I152 H156A46-E50 WeakPolarHBondContact O-CB 3.49Å; A46-E50 PolarHBondContact O-N 3.06Å; S47-E50 PolarHBondContact O-N 3.26Å; V48-E50 PolarHBondContact O-N 2.98Å; E50-H52 PolarHBondContact O-N 3.02Å; E50-T53 PolarHBondContact O-N 3.41Å; E50-K54 HydrophobicContact CG-CD 4.01Å; E50-K54 WeakPolarHBondContact O-CB 3.4Å; E50-K54 WeakPolarHBondContact O-CG 3.39Å; E50-K54 PolarHBondContact O-N 3.5Å; E50-K54 WeakPolarHBondContact OE1-CE 3.28Å; E50-K54 IonicContact OE1-NZ 3.63Å; E50-K54 PolarHBondContact OE1-NZ 3.03Å; E50-L148 HydrophobicContact CG-CD2 4.37Å; E50-I152 HydrophobicContact CB-CD1 4.03Å; E50-I152 HydrophobicContact CB-CG1 4.26Å; E50-I152 HydrophobicContact CB-CG2 4.15Å; E50-I152 HydrophobicContact CG-CG2 3.76Å; E50-H156 VanDerWaalsContact CD-CE1 3.5Å; E50-H156 IonicContact OE1-CE1 3.59Å; E50-H156 PolarHBondContact OE1-CE1 3.31Å; E50-H156 IonicContact OE2-CE1 3.75Å; E50-H156 PolarHBondContact OE2-CE1 3.05Å; E50-H156 IonicContact OE2-NE2 2.68Å; E50-H156 PolarHBondContact OE2-NE2 3.39Å; E50-H156 VanDerWaalsContact OE2-NE2 3.1Å
51E97.2Very high95.8Very high130 Ų13056.3 Ų56.361%0.60730%0.297SS*.Hα-helixtrans-58-52.3-175.8-179.6178173.300111.1S47 V48 K54 A55S47-E51 WeakPolarHBondContact O-CB 3.39Å; S47-E51 PolarHBondContact O-N 2.96Å; V48-E51 PolarHBondContact O-N 3.5Å; E51-K54 PolarHBondContact O-N 2.94Å; E51-A55 PolarHBondContact O-N 3.49Å
52H96.9Very high95.9Very high100 Ų10055.6 Ų55.646%0.46330%0.296SS..Hα-helixtrans-73.3-33.1-177.3-67.5-56.6000112.5V48 E50 K54 A55 I56V48-H52 PolarHBondContact O-CD2 2.78Å; V48-H52 VanDerWaalsContact O-CD2 3.23Å; V48-H52 PolarHBondContact O-N 3.2Å; E50-H52 PolarHBondContact O-N 3.02Å; H52-K54 VanDerWaalsContact C-N 3.32Å; H52-K54 PolarHBondContact O-N 2.81Å; H52-A55 PolarHBondContact O-N 2.89Å; H52-I56 WeakPolarHBondContact O-CB 3.47Å; H52-I56 WeakPolarHBondContact O-CD1 3.47Å; H52-I56 WeakPolarHBondContact O-CG1 3.48Å; H52-I56 PolarHBondContact O-N 2.94Å
53T97.2Very high96Very high9 Ų960.6 Ų60.66%0.05532%0.315CS..Hα-helixtrans-64.6-39.4174.6-58.40000111.1A49 E50 L57 L144 F147 L148A49-T53 WeakPolarHBondContact O-CB 3.47Å; A49-T53 PolarHBondContact O-N 3.37Å; A49-T53 PolarHBondContact O-OG1 3.43Å; E50-T53 PolarHBondContact O-N 3.41Å; T53-L57 VanDerWaalsContact O-CB 3.23Å; T53-L57 WeakPolarHBondContact O-CB 3.46Å; T53-L57 PolarHBondContact O-N 3.19Å; T53-L144 HydrophobicContact CG2-CB 4.13Å; T53-L144 HydrophobicContact CG2-CD2 3.93Å; T53-L144 HydrophobicContact CG2-CG 4.47Å; T53-F147 HydrophobicContact CG2-CD1 3.91Å; T53-F147 HydrophobicContact CG2-CE1 4.4Å; T53-L148 HydrophobicContact CG2-CD1 4.18Å; T53-L148 HydrophobicContact CG2-CD2 4.08Å; T53-L148 HydrophobicContact CG2-CG 4.02Å
54K97.7Very high96.1Very high103 Ų10360.5 Ų60.545%0.44831%0.314SS..Hα-helixtrans-62.2-46.9173.2-77.3172.9171.4176.80112.3E50 E51 H52 L57 N58 L148E50-K54 HydrophobicContact CG-CD 4.01Å; E50-K54 WeakPolarHBondContact O-CB 3.4Å; E50-K54 WeakPolarHBondContact O-CG 3.39Å; E50-K54 PolarHBondContact O-N 3.5Å; E50-K54 WeakPolarHBondContact OE1-CE 3.28Å; E50-K54 IonicContact OE1-NZ 3.63Å; E50-K54 PolarHBondContact OE1-NZ 3.03Å; E51-K54 PolarHBondContact O-N 2.94Å; H52-K54 VanDerWaalsContact C-N 3.32Å; H52-K54 PolarHBondContact O-N 2.81Å; K54-L57 PolarHBondContact O-N 3.12Å; K54-N58 WeakPolarHBondContact O-CB 3.32Å; K54-N58 PolarHBondContact O-N 3.33Å; K54-L148 HydrophobicContact CG-CD1 3.71Å; K54-L148 HydrophobicContact CG-CD2 3.79Å; K54-L148 HydrophobicContact CG-CG 4.4Å
55A97.9Very high96Very high49 Ų4956.3 Ų56.341%0.40530%0.295SS..Hα-helixtrans-61.9-46.8-179.900000111.4E51 H52 N58 C59E51-A55 PolarHBondContact O-N 3.49Å; H52-A55 PolarHBondContact O-N 2.89Å; A55-N58 PolarHBondContact O-N 2.66Å; A55-C59 PolarHBondContact O-N 2.76Å; A55-C59 PolarHBondContact O-SG 3.47Å; A55-C59 VanDerWaalsContact O-SG 3.38Å
56I96.7Very high96Very high82 Ų8256 Ų5642%0.42130%0.303SS..Hα-helixtrans-61.2-49.2177.1-68.8164.5000110.3H52 N58 C59 M60 L144H52-I56 WeakPolarHBondContact O-CB 3.47Å; H52-I56 WeakPolarHBondContact O-CD1 3.47Å; H52-I56 WeakPolarHBondContact O-CG1 3.48Å; H52-I56 PolarHBondContact O-N 2.94Å; I56-N58 VanDerWaalsContact C-N 3.35Å; I56-N58 PolarHBondContact O-N 3.46Å; I56-C59 PolarHBondContact O-N 3.38Å; I56-M60 HydrophobicContact CG2-CG 4.16Å; I56-M60 HydrophobicContact CG2-SD 3.99Å; I56-M60 WeakPolarHBondContact O-CG 3.49Å; I56-M60 PolarHBondContact O-N 2.92Å; I56-L144 HydrophobicContact CG2-CD1 4.22Å
57L96.4Very high95.8Very high18 Ų1859 Ų599%0.09432%0.319CS..Hα-helixtrans-55.6-49.7179.4175.865.8000111.3T53 K54 C59 M60 E61 L141 L144 K145 L148T53-L57 VanDerWaalsContact O-CB 3.23Å; T53-L57 WeakPolarHBondContact O-CB 3.46Å; T53-L57 PolarHBondContact O-N 3.19Å; K54-L57 PolarHBondContact O-N 3.12Å; L57-C59 VanDerWaalsContact C-N 3.34Å; L57-C59 PolarHBondContact O-N 2.98Å; L57-M60 PolarHBondContact O-N 2.92Å; L57-E61 HydrophobicContact CD1-CG 4.3Å; L57-E61 WeakPolarHBondContact O-CG 3.38Å; L57-E61 PolarHBondContact O-N 3.46Å; L57-L141 HydrophobicContact CD1-CB 4.07Å; L57-L141 HydrophobicContact CD1-CD2 3.77Å; L57-L141 HydrophobicContact CD1-CG 4.48Å; L57-L144 HydrophobicContact CD1-CB 4.19Å; L57-K145 HydrophobicContact CD1-CG 3.97Å; L57-K145 HydrophobicContact CD2-CG 3.75Å; L57-L148 HydrophobicContact CD2-CD1 3.7Å
58N95.6Very high95.6Very high85 Ų8560.3 Ų60.346%0.45533%0.326SS..Hα-helixtrans-61.4-41.6179.4179.159.4000112.1K54 A55 I56 E61 C62K54-N58 WeakPolarHBondContact O-CB 3.32Å; K54-N58 PolarHBondContact O-N 3.33Å; A55-N58 PolarHBondContact O-N 2.66Å; I56-N58 VanDerWaalsContact C-N 3.35Å; I56-N58 PolarHBondContact O-N 3.46Å; N58-E61 PolarHBondContact O-N 3.4Å; N58-C62 PolarHBondContact O-N 2.86Å; N58-C62 PolarHBondContact O-SG 3.46Å
59C96.8Very high95.4Very high82 Ų8261.8 Ų61.855%0.55434%0.335SS*.Hα-helixtrans-65.2-41.1175.9-72.90000112.2A55 I56 L57 C62 Y63A55-C59 PolarHBondContact O-N 2.76Å; A55-C59 PolarHBondContact O-SG 3.47Å; A55-C59 VanDerWaalsContact O-SG 3.38Å; I56-C59 PolarHBondContact O-N 3.38Å; L57-C59 VanDerWaalsContact C-N 3.34Å; L57-C59 PolarHBondContact O-N 2.98Å; C59-C62 PolarHBondContact O-N 2.93Å; C59-Y63 WeakPolarHBondContact O-CB 3.28Å; C59-Y63 PolarHBondContact O-N 3.41Å
60M96.2Very high95Very high18 Ų1863 Ų639%0.08934%0.341CS..Hα-helixtrans-69-36.5178.3-68.2-165.774.500112.2I56 L57 Y63 L64 V140 L141 F238I56-M60 HydrophobicContact CG2-CG 4.16Å; I56-M60 HydrophobicContact CG2-SD 3.99Å; I56-M60 WeakPolarHBondContact O-CG 3.49Å; I56-M60 PolarHBondContact O-N 2.92Å; L57-M60 PolarHBondContact O-N 2.92Å; M60-Y63 PolarHBondContact O-N 3.28Å; M60-L64 WeakPolarHBondContact O-CG 3.42Å; M60-L64 PolarHBondContact O-N 3.03Å; M60-V140 HydrophobicContact CE-CB 3.99Å; M60-V140 HydrophobicContact CE-CG1 3.46Å; M60-V140 VanDerWaalsContact CE-CG1 3.46Å; M60-V140 HydrophobicContact CE-CG2 4.26Å; M60-V140 HydrophobicContact SD-CG1 3.51Å; M60-V140 VanDerWaalsContact SD-CG1 3.51Å; M60-L141 HydrophobicContact CB-CD2 3.52Å; M60-F238 HydrophobicContact CE-CD1 3.87Å; M60-F238 HydrophobicContact CE-CD2 3.63Å; M60-F238 HydrophobicContact CE-CE1 3.87Å; M60-F238 HydrophobicContact CE-CE2 3.63Å; M60-F238 HydrophobicContact CE-CG 3.75Å; M60-F238 HydrophobicContact CE-CZ 3.75Å
61E94.9Very high94.7Very high48 Ų4864.9 Ų64.922%0.22435%0.347CS..Hα-helixtrans-61.9-46.7171.8-75.4-179.916000111.5L57 N58 Y63 L64 Q65 L141 K145L57-E61 HydrophobicContact CD1-CG 4.3Å; L57-E61 WeakPolarHBondContact O-CG 3.38Å; L57-E61 PolarHBondContact O-N 3.46Å; N58-E61 PolarHBondContact O-N 3.4Å; E61-Y63 VanDerWaalsContact C-N 3.29Å; E61-Y63 PolarHBondContact O-N 3.25Å; E61-L64 PolarHBondContact O-N 3.02Å; E61-Q65 PolarHBondContact O-N 3.34Å; E61-L141 HydrophobicContact CG-CD1 3.86Å; E61-L141 HydrophobicContact CG-CD2 4.12Å; E61-K145 WeakPolarHBondContact OE1-CE 3.11Å; E61-K145 IonicContact OE1-NZ 2.86Å
62C95.7Very high94.2Very high43 Ų4362.6 Ų62.629%0.29134%0.342SS..Hα-helixtrans-63.4-34.7175.2-70.60000112.6N58 C59 Q65 P66 R71N58-C62 PolarHBondContact O-N 2.86Å; N58-C62 PolarHBondContact O-SG 3.46Å; C59-C62 PolarHBondContact O-N 2.93Å; C62-Q65 CarbonylContact O-C 3.47Å; C62-P66 VanDerWaalsContact O-CA 3.25Å; C62-P66 WeakPolarHBondContact O-CA 3.33Å; C62-P66 WeakPolarHBondContact O-CG 3.28Å; C62-R71 VanDerWaalsContact SG-CZ 3.52Å
63Y95.6Very high93.7Very high109 Ų10960.4 Ų60.443%0.42733%0.331SS..Hα-helixtrans-67.2-45.8177.1171.1-97.2000111.8C59 M60 E61 F132 F238 Q242C59-Y63 WeakPolarHBondContact O-CB 3.28Å; C59-Y63 PolarHBondContact O-N 3.41Å; M60-Y63 PolarHBondContact O-N 3.28Å; E61-Y63 VanDerWaalsContact C-N 3.29Å; E61-Y63 PolarHBondContact O-N 3.25Å; Y63-F132 HydrophobicContact CE1-CE1 4.12Å; Y63-F132 HydrophobicContact CE1-CZ 4.06Å; Y63-F238 HydrophobicContact CD1-CE2 4.5Å; Y63-F238 AromaticContact CD1-CZ 3.99Å; Y63-F238 HydrophobicContact CD1-CZ 3.99Å; Y63-F238 HydrophobicContact CE1-CE2 4.12Å; Y63-F238 AromaticContact CE1-CZ 3.62Å; Y63-F238 HydrophobicContact CE1-CZ 3.62Å; Y63-Q242 PolarHBondContact OH-NE2 3.35Å
64L94.4Very high93Very high9 Ų962.9 Ų62.95%0.04734%0.343CS..Hα-helixtrans-77.7-32.2-178.5-66.7-179000113M60 E61 F132 I133 A137 L141M60-L64 WeakPolarHBondContact O-CG 3.42Å; M60-L64 PolarHBondContact O-N 3.03Å; E61-L64 PolarHBondContact O-N 3.02Å; L64-F132 HydrophobicContact CD2-CE1 3.88Å; L64-F132 HydrophobicContact CD2-CZ 4.2Å; L64-I133 HydrophobicContact CB-CG2 4.36Å; L64-I133 HydrophobicContact CD2-CG1 4.48Å; L64-I133 WeakPolarHBondContact O-CD1 3.4Å; L64-A137 HydrophobicContact CD1-CB 4.46Å; L64-L141 HydrophobicContact CD1-CD1 3.91Å; L64-L141 HydrophobicContact CD1-CG 4.18Å
65Q93.4Very high92.3Very high35 Ų3562.6 Ų62.616%0.16434%0.341CS..  trans-13987.7177.3-178.254.8-93.200110.3E61 C62 N67 L70 R71E61-Q65 PolarHBondContact O-N 3.34Å; C62-Q65 CarbonylContact O-C 3.47Å; Q65-N67 PolarHBondContact O-N 3.03Å; Q65-L70 HydrophobicContact CG-CB 3.83Å; Q65-R71 HydrophobicContact CB-CG 3.69Å; Q65-R71 HydrophobicContact CG-CG 3.51Å; Q65-R71 WeakPolarHBondContact O-CD 3.44Å; Q65-R71 VanDerWaalsContact O-CG 3.24Å; Q65-R71 WeakPolarHBondContact O-CG 3.48Å; Q65-R71 PolarHBondContact O-NE 3.47Å
66P93.9Very high91.6Very high98 Ų9865.9 Ų65.964%0.63635%0.347SS*.  trans-62.5-27.7-179.1-24.834.7000113.6C62 P68C62-P66 VanDerWaalsContact O-CA 3.25Å; C62-P66 WeakPolarHBondContact O-CA 3.33Å; C62-P66 WeakPolarHBondContact O-CG 3.28Å; P66-P68 VanDerWaalsContact O-CD 3.27Å; P66-P68 WeakPolarHBondContact O-CD 3.42Å
67N91.2Very high90.9Very high69 Ų6965.3 Ų65.337%0.36934%0.34SS..  trans-75.5113.3-178.3-173.3-29.9000110.7Q65 T69 L70 R71Q65-N67 PolarHBondContact O-N 3.03Å; N67-T69 VanDerWaalsContact C-N 3.29Å; N67-T69 PolarHBondContact O-N 3.5Å; N67-T69 WeakPolarHBondContact OD1-CB 3.31Å; N67-T69 PolarHBondContact OD1-N 3.38Å; N67-L70 HydrophobicContact CB-CB 4.11Å; N67-L70 HydrophobicContact CB-CD1 3.88Å; N67-L70 HydrophobicContact CB-CG 3.91Å; N67-L70 PolarHBondContact O-N 2.94Å; N67-L70 PolarHBondContact OD1-N 2.94Å; N67-R71 PolarHBondContact O-N 2.87Å; N67-R71 VanDerWaalsContact O-N 3.11Å
68P91.5Very high90.1Very high75 Ų7568.9 Ų68.949%0.48736%0.356SS..Hα-helixtrans-64.1-33.7-176.926.7-34.4000112.8P66 L70 R71 V72P66-P68 VanDerWaalsContact O-CD 3.27Å; P66-P68 WeakPolarHBondContact O-CD 3.42Å; P68-L70 VanDerWaalsContact C-N 3.33Å; P68-L70 PolarHBondContact O-N 3.33Å; P68-R71 PolarHBondContact O-N 3.31Å; P68-V72 WeakPolarHBondContact O-CG2 3.48Å; P68-V72 PolarHBondContact O-N 2.91Å
69T90.7Very high89.4Confident100 Ų10069.8 Ų69.861%0.61336%0.356SS*.Hα-helixtrans-63.6-42.3178-53.70000110.7N67 V72 E73N67-T69 VanDerWaalsContact C-N 3.29Å; N67-T69 PolarHBondContact O-N 3.5Å; N67-T69 WeakPolarHBondContact OD1-CB 3.31Å; N67-T69 PolarHBondContact OD1-N 3.38Å; T69-V72 PolarHBondContact O-N 2.88Å; T69-E73 WeakPolarHBondContact O-CB 3.15Å; T69-E73 PolarHBondContact O-N 3.3Å
70L88.2Confident88.7Confident35 Ų3571 Ų7118%0.18336%0.356CS..Hα-helixtrans-67.9-37.5177.6-64.6-177.1000112.1Q65 N67 P68 E73 E74Q65-L70 HydrophobicContact CG-CB 3.83Å; N67-L70 HydrophobicContact CB-CB 4.11Å; N67-L70 HydrophobicContact CB-CD1 3.88Å; N67-L70 HydrophobicContact CB-CG 3.91Å; N67-L70 PolarHBondContact O-N 2.94Å; N67-L70 PolarHBondContact OD1-N 2.94Å; P68-L70 VanDerWaalsContact C-N 3.33Å; P68-L70 PolarHBondContact O-N 3.33Å; L70-E73 PolarHBondContact O-N 2.9Å; L70-E74 WeakPolarHBondContact O-CG 3.32Å; L70-E74 PolarHBondContact O-N 2.63Å
71R89.9Confident87.7Confident65 Ų6577.5 Ų77.525%0.24539%0.392CS..Hα-helixtrans-62.2-43.7175.3-71.6-165.5-70.2139.1-1.3112.5C62 Q65 N67 P68 E73 E74 F75C62-R71 VanDerWaalsContact SG-CZ 3.52Å; Q65-R71 HydrophobicContact CB-CG 3.69Å; Q65-R71 HydrophobicContact CG-CG 3.51Å; Q65-R71 WeakPolarHBondContact O-CD 3.44Å; Q65-R71 VanDerWaalsContact O-CG 3.24Å; Q65-R71 WeakPolarHBondContact O-CG 3.48Å; Q65-R71 PolarHBondContact O-NE 3.47Å; N67-R71 PolarHBondContact O-N 2.87Å; N67-R71 VanDerWaalsContact O-N 3.11Å; P68-R71 PolarHBondContact O-N 3.31Å; R71-E73 VanDerWaalsContact C-N 3.35Å; R71-E74 PolarHBondContact O-N 3.37Å; R71-F75 PolarHBondContact O-N 2.95Å
72V88.1Confident86.9Confident83 Ų8380 Ų8050%0.50341%0.406SS..Hα-helixtrans-64-44.2177.4171.40000110.3P68 T69 E74 F75 F76P68-V72 WeakPolarHBondContact O-CG2 3.48Å; P68-V72 PolarHBondContact O-N 2.91Å; T69-V72 PolarHBondContact O-N 2.88Å; V72-E74 PolarHBondContact O-N 3.47Å; V72-F75 WeakPolarHBondContact O-CB 3.32Å; V72-F75 PolarHBondContact O-N 3Å; V72-F76 HydrophobicContact CG1-CD2 3.86Å; V72-F76 HydrophobicContact CG1-CE2 3.48Å; V72-F76 VanDerWaalsContact CG1-CE2 3.48Å; V72-F76 WeakPolarHBondContact O-CD2 3.36Å; V72-F76 PolarHBondContact O-N 3.32Å; V72-F76 VanDerWaalsContact O-N 3.16Å
73E85Confident85.7Confident53 Ų5387.7 Ų87.725%0.24843%0.434CS..Hα-helixtrans-58.1-46.2175.5-177.3176.3-177.600111.5T69 L70 R71 F75 F76 Y77 R87T69-E73 WeakPolarHBondContact O-CB 3.15Å; T69-E73 PolarHBondContact O-N 3.3Å; L70-E73 PolarHBondContact O-N 2.9Å; R71-E73 VanDerWaalsContact C-N 3.35Å; E73-F75 PolarHBondContact O-N 2.96Å; E73-F76 PolarHBondContact O-N 2.94Å; E73-F76 VanDerWaalsContact O-N 3.16Å; E73-Y77 HydrophobicContact CG-CD2 3.86Å; E73-Y77 HydrophobicContact CG-CE2 3.46Å; E73-Y77 VanDerWaalsContact CG-CE2 3.46Å; E73-Y77 WeakPolarHBondContact O-CD2 3.23Å; E73-Y77 PolarHBondContact O-N 3.41Å; E73-Y77 VanDerWaalsContact O-N 3.09Å; E73-R87 IonicContact OE1-NH2 3.32Å; E73-R87 IonicContact OE2-NH1 3.82Å; E73-R87 IonicContact OE2-NH2 2.74Å
74E82.9Confident84.4Confident62 Ų6287.7 Ų87.729%0.2944%0.436SS..Hα-helixtrans-60.4-42.4176.3-77.5177.9174.100113L70 R71 V72 F76 Y77 E78 K84L70-E74 WeakPolarHBondContact O-CG 3.32Å; L70-E74 PolarHBondContact O-N 2.63Å; R71-E74 PolarHBondContact O-N 3.37Å; V72-E74 PolarHBondContact O-N 3.47Å; E74-F76 VanDerWaalsContact C-N 3.27Å; E74-F76 PolarHBondContact O-N 2.93Å; E74-Y77 PolarHBondContact O-N 3.33Å; E74-E78 WeakPolarHBondContact O-CB 3.43Å; E74-E78 PolarHBondContact O-N 2.99Å; E74-K84 IonicContact OE1-NZ 2.66Å; E74-K84 PolarHBondContact OE1-NZ 3.22Å
75F82.5Confident83.3Confident97 Ų9795.5 Ų95.543%0.42547%0.473SS..Hα-helixtrans-59-38.9175.3177-95.1000112.2R71 V72 E73 K79R71-F75 PolarHBondContact O-N 2.95Å; V72-F75 WeakPolarHBondContact O-CB 3.32Å; V72-F75 PolarHBondContact O-N 3Å; E73-F75 PolarHBondContact O-N 2.96Å; F75-K79 HydrophobicContact CD1-CG 4.39Å; F75-K79 HydrophobicContact CD2-CG 4.44Å; F75-K79 HydrophobicContact CE1-CG 3.96Å; F75-K79 HydrophobicContact CE2-CD 4.45Å; F75-K79 HydrophobicContact CE2-CG 4.03Å; F75-K79 HydrophobicContact CZ-CD 4.32Å; F75-K79 HydrophobicContact CZ-CG 3.77Å; F75-K79 WeakPolarHBondContact O-CB 3.31Å; F75-K79 WeakPolarHBondContact O-CG 3.38Å; F75-K79 PolarHBondContact O-N 3.09Å
76F84.5Confident82.5Confident117 Ų117100.3 Ų100.351%0.51350%0.495SS..Hα-helixtrans-68-44.2176.6-78.2-68000112.6V72 E73 E74 E78 K79 L80V72-F76 HydrophobicContact CG1-CD2 3.86Å; V72-F76 HydrophobicContact CG1-CE2 3.48Å; V72-F76 VanDerWaalsContact CG1-CE2 3.48Å; V72-F76 WeakPolarHBondContact O-CD2 3.36Å; V72-F76 PolarHBondContact O-N 3.32Å; V72-F76 VanDerWaalsContact O-N 3.16Å; E73-F76 PolarHBondContact O-N 2.94Å; E73-F76 VanDerWaalsContact O-N 3.16Å; E74-F76 VanDerWaalsContact C-N 3.27Å; E74-F76 PolarHBondContact O-N 2.93Å; F76-E78 VanDerWaalsContact C-N 3.32Å; F76-E78 PolarHBondContact O-N 3.49Å; F76-K79 PolarHBondContact O-N 2.86Å; F76-L80 VanDerWaalsContact O-CB 3.28Å; F76-L80 WeakPolarHBondContact O-CB 3.43Å; F76-L80 VanDerWaalsContact O-CG 3.28Å; F76-L80 WeakPolarHBondContact O-CG 3.29Å; F76-L80 PolarHBondContact O-N 3.47Å
77Y82.2Confident82Confident70 Ų70103.1 Ų103.128%0.27549%0.493SS..Hα-helixtrans-61.5-41.6176.1-76.9-71.5000111.7E73 E74 L80 D81 L82 K84E73-Y77 HydrophobicContact CG-CD2 3.86Å; E73-Y77 HydrophobicContact CG-CE2 3.46Å; E73-Y77 VanDerWaalsContact CG-CE2 3.46Å; E73-Y77 WeakPolarHBondContact O-CD2 3.23Å; E73-Y77 PolarHBondContact O-N 3.41Å; E73-Y77 VanDerWaalsContact O-N 3.09Å; E74-Y77 PolarHBondContact O-N 3.33Å; Y77-L80 PolarHBondContact O-N 3.38Å; Y77-D81 PolarHBondContact O-N 2.88Å; Y77-D81 VanDerWaalsContact O-N 3.13Å; Y77-L82 HydrophobicContact CD1-CB 3.51Å; Y77-L82 HydrophobicContact CE1-CB 3.99Å; Y77-L82 PolarHBondContact O-N 3.47Å; Y77-K84 HydrophobicContact CD1-CB 4.28Å; Y77-K84 HydrophobicContact CD2-CB 4.4Å; Y77-K84 HydrophobicContact CD2-CG 4.25Å; Y77-K84 HydrophobicContact CE2-CG 4.35Å; Y77-K84 HydrophobicContact CG-CB 4.23Å
78E79.8Confident81.8Confident93 Ų93101.8 Ų101.844%0.43549%0.492SS..Hα-helixtrans-64.2-42.7177.4-172.6178.4-167.500111.8E74 F76 K145E74-E78 WeakPolarHBondContact O-CB 3.43Å; E74-E78 PolarHBondContact O-N 2.99Å; F76-E78 VanDerWaalsContact C-N 3.32Å; F76-E78 PolarHBondContact O-N 3.49Å; E78-K145 IonicContact OE1-NZ 3.44Å; E78-K145 IonicContact OE2-NZ 2.63Å; E78-K145 PolarHBondContact OE2-NZ 3Å
79K80.4Confident81.9Confident104 Ų10499.6 Ų99.645%0.45248%0.476SS..Hα-helixtrans-76.6-21-179.9-71-64.5-173.4-164.90114.1F75 F76 E149F75-K79 HydrophobicContact CD1-CG 4.39Å; F75-K79 HydrophobicContact CD2-CG 4.44Å; F75-K79 HydrophobicContact CE1-CG 3.96Å; F75-K79 HydrophobicContact CE2-CD 4.45Å; F75-K79 HydrophobicContact CE2-CG 4.03Å; F75-K79 HydrophobicContact CZ-CD 4.32Å; F75-K79 HydrophobicContact CZ-CG 3.77Å; F75-K79 WeakPolarHBondContact O-CB 3.31Å; F75-K79 WeakPolarHBondContact O-CG 3.38Å; F75-K79 PolarHBondContact O-N 3.09Å; F76-K79 PolarHBondContact O-N 2.86Å; K79-E149 IonicContact NZ-OE1 2.63Å; K79-E149 PolarHBondContact NZ-OE1 3.12Å; K79-E149 IonicContact NZ-OE2 2.91Å; K79-E149 PolarHBondContact NZ-OE2 3.41Å
80L82.3Confident82.1Confident108 Ų108101.4 Ų101.457%0.56548%0.482SS*.Hα-helixtrans-1061.7-175.8-63.1174.7000113.8F76 Y77 L82F76-L80 VanDerWaalsContact O-CB 3.28Å; F76-L80 WeakPolarHBondContact O-CB 3.43Å; F76-L80 VanDerWaalsContact O-CG 3.28Å; F76-L80 WeakPolarHBondContact O-CG 3.29Å; F76-L80 PolarHBondContact O-N 3.47Å; Y77-L80 PolarHBondContact O-N 3.38Å; L80-L82 HydrophobicContact CB-CB 4.5Å; L80-L82 HydrophobicContact CB-CD1 3.73Å; L80-L82 HydrophobicContact CB-CG 3.72Å; L80-L82 HydrophobicContact CD1-CD1 3.81Å; L80-L82 HydrophobicContact CG-CD1 4.43Å; L80-L82 PolarHBondContact O-N 3.22Å; L80-L82 VanDerWaalsContact O-N 3.13Å
81D74.8Confident82.5Confident155 Ų155101.8 Ų101.883%0.82948%0.484SS*.THydrogen-bonded Turntrans50.234.1-174.8-69.6-38.2000113.1Y77Y77-D81 PolarHBondContact O-N 2.88Å; Y77-D81 VanDerWaalsContact O-N 3.13Å
82L78.8Confident82.9Confident99 Ų9999.8 Ų99.852%0.51848%0.477SS..PPolyproline II helixtrans-86.8142.1-178.7-71.5173.7000110.4Y77 L80 K84Y77-L82 HydrophobicContact CD1-CB 3.51Å; Y77-L82 HydrophobicContact CE1-CB 3.99Å; Y77-L82 PolarHBondContact O-N 3.47Å; L80-L82 HydrophobicContact CB-CB 4.5Å; L80-L82 HydrophobicContact CB-CD1 3.73Å; L80-L82 HydrophobicContact CB-CG 3.72Å; L80-L82 HydrophobicContact CD1-CD1 3.81Å; L80-L82 HydrophobicContact CG-CD1 4.43Å; L80-L82 PolarHBondContact O-N 3.22Å; L80-L82 VanDerWaalsContact O-N 3.13Å; L82-K84 PolarHBondContact O-N 2.85Å
83K68.9Low83.3Confident206 Ų20699.9 Ų99.990%0.89648%0.475SS*.PPolyproline II helixtrans-69.9118.6172.5-87.6-174.2174.6-178.60110.1
84K69.4Low84Confident108 Ų108100.9 Ų100.947%0.4748%0.481SS..PPolyproline II helixtrans-77.4129.2172.4-175180179-171.10110E74 Y77 L82E74-K84 IonicContact OE1-NZ 2.66Å; E74-K84 PolarHBondContact OE1-NZ 3.22Å; Y77-K84 HydrophobicContact CD1-CB 4.28Å; Y77-K84 HydrophobicContact CD2-CB 4.4Å; Y77-K84 HydrophobicContact CD2-CG 4.25Å; Y77-K84 HydrophobicContact CE2-CG 4.35Å; Y77-K84 HydrophobicContact CG-CB 4.23Å; L82-K84 PolarHBondContact O-N 2.85Å
85E72Confident84.7Confident174 Ų17497.9 Ų97.981%0.81347%0.468SS*.PPolyproline II helixtrans-70.3133.4165.3-73-172.1165.900109.7R87E85-R87 PolarHBondContact O-N 3.47Å
86Q76.1Confident85.5Confident135 Ų13598.1 Ų98.163%0.63147%0.47SS*.  trans-71.2104.3179.7-174.2-180-31.900109.5R130Q86-R130 VanDerWaalsContact NE2-NH2 3.18Å
87R82.6Confident86.2Confident157 Ų15795.3 Ų95.359%0.59247%0.468SS*.  trans-79.2136.1172.4-170.3173.9-68.5161.311.7109.7E73 E85E73-R87 IonicContact OE1-NH2 3.32Å; E73-R87 IonicContact OE2-NH1 3.82Å; E73-R87 IonicContact OE2-NH2 2.74Å; E85-R87 PolarHBondContact O-N 3.47Å
88A88.5Confident86.9Confident41 Ų4194 Ų9434%0.33947%0.465SS..  trans-64.2131.6171.400000110.3E92 N93A88-E92 VanDerWaalsContact CA-OE2 3.28Å; A88-E92 WeakPolarHBondContact CA-OE2 3.26Å; A88-E92 HydrophobicContact CB-CB 3.87Å; A88-N93 WeakPolarHBondContact CB-OD1 3.45Å; A88-N93 PolarHBondContact O-ND2 2.91Å
89N92.7Very high87.8Confident29 Ų2990.8 Ų90.816%0.15545%0.45CS..  trans-77.4175.3172.363.213.9000111.4L91 E92 N93 G126 E129N89-L91 PolarHBondContact O-N 2.87Å; N89-E92 PolarHBondContact N-OE2 2.88Å; N89-E92 VanDerWaalsContact N-OE2 3.12Å; N89-E92 PolarHBondContact O-N 2.81Å; N89-E92 VanDerWaalsContact O-N 3.08Å; N89-E92 WeakPolarHBondContact OD1-CB 3.44Å; N89-E92 VanDerWaalsContact OD1-CG 3.28Å; N89-E92 WeakPolarHBondContact OD1-CG 3.34Å; N89-E92 PolarHBondContact OD1-N 3.19Å; N89-E92 PolarHBondContact OD1-OE2 3.28Å; N89-N93 PolarHBondContact O-N 3.42Å; N89-N93 PolarHBondContact O-ND2 2.78Å; N89-N93 VanDerWaalsContact O-ND2 3.14Å; N89-G126 WeakPolarHBondContact ND2-CA 3.28Å; N89-G126 PolarHBondContact ND2-O 3.24Å; N89-G126 WeakPolarHBondContact OD1-CA 3.28Å; N89-E129 PolarHBondContact ND2-OE2 3.49Å
90D95.1Very high88.7Confident138 Ų13889.1 Ų89.174%0.73845%0.449SS*.Hα-helixtrans-61.7-35.1-175.2-65.4-27000112.4N93 L94D90-N93 PolarHBondContact O-N 3.02Å; D90-L94 WeakPolarHBondContact O-CB 3.34Å; D90-L94 PolarHBondContact O-N 3.39Å
91L97Very high89.5Confident44 Ų4485.5 Ų85.523%0.2344%0.435CS..Hα-helixtrans-63.6-44174-69.6166.9000111.5N89 L94 G95 L125 E129N89-L91 PolarHBondContact O-N 2.87Å; L91-L94 PolarHBondContact O-N 2.85Å; L91-G95 PolarHBondContact O-N 2.94Å; L91-L125 HydrophobicContact CD1-CB 4.31Å; L91-E129 HydrophobicContact CD1-CB 4.16Å
92E97.4Very high90.6Very high23 Ų2378.1 Ų78.111%0.10740%0.395CS..Hα-helixtrans-67.1-42.1176.7-76.3172145.900112.3A88 N89 L94 G95 Q96 L123 R130A88-E92 VanDerWaalsContact CA-OE2 3.28Å; A88-E92 WeakPolarHBondContact CA-OE2 3.26Å; A88-E92 HydrophobicContact CB-CB 3.87Å; N89-E92 PolarHBondContact N-OE2 2.88Å; N89-E92 VanDerWaalsContact N-OE2 3.12Å; N89-E92 PolarHBondContact O-N 2.81Å; N89-E92 VanDerWaalsContact O-N 3.08Å; N89-E92 WeakPolarHBondContact OD1-CB 3.44Å; N89-E92 VanDerWaalsContact OD1-CG 3.28Å; N89-E92 WeakPolarHBondContact OD1-CG 3.34Å; N89-E92 PolarHBondContact OD1-N 3.19Å; N89-E92 PolarHBondContact OD1-OE2 3.28Å; E92-L94 VanDerWaalsContact C-N 3.34Å; E92-L94 PolarHBondContact O-N 3.38Å; E92-G95 PolarHBondContact O-N 2.96Å; E92-Q96 WeakPolarHBondContact O-CB 3.49Å; E92-Q96 PolarHBondContact O-N 3.29Å; E92-L123 HydrophobicContact CB-CD2 4.15Å; E92-L123 HydrophobicContact CG-CD2 4.24Å; E92-L123 WeakPolarHBondContact O-CD2 3.35Å; E92-R130 IonicContact OE1-CZ 2.72Å; E92-R130 IonicContact OE1-NH1 3.49Å; E92-R130 PolarHBondContact OE1-NH1 3.47Å; E92-R130 IonicContact OE1-NH2 3.12Å; E92-R130 PolarHBondContact OE1-NH2 3.31Å; E92-R130 VanDerWaalsContact OE1-NH2 3.12Å; E92-R130 IonicContact OE2-NH1 3.35Å; E92-R130 PolarHBondContact OE2-NH1 2.96Å
93N97.5Very high91.5Very high84 Ų8477.8 Ų77.845%0.44939%0.394SS..Hα-helixtrans-61.5-43.5176.5-70.2-40.5000111.3A88 N89 D90 Q96 A97A88-N93 WeakPolarHBondContact CB-OD1 3.45Å; A88-N93 PolarHBondContact O-ND2 2.91Å; N89-N93 PolarHBondContact O-N 3.42Å; N89-N93 PolarHBondContact O-ND2 2.78Å; N89-N93 VanDerWaalsContact O-ND2 3.14Å; D90-N93 PolarHBondContact O-N 3.02Å; N93-Q96 PolarHBondContact O-N 3.48Å; N93-A97 WeakPolarHBondContact O-CB 3.44Å; N93-A97 PolarHBondContact O-N 2.63Å
94L98.4Very high92.9Very high74 Ų7475.7 Ų75.739%0.38739%0.387SS..Hα-helixtrans-62.1-45.5173.8178.661.5000111.5D90 L91 E92 Q96 A97 M98 Q122D90-L94 WeakPolarHBondContact O-CB 3.34Å; D90-L94 PolarHBondContact O-N 3.39Å; L91-L94 PolarHBondContact O-N 2.85Å; E92-L94 VanDerWaalsContact C-N 3.34Å; E92-L94 PolarHBondContact O-N 3.38Å; L94-Q96 VanDerWaalsContact C-N 3.34Å; L94-Q96 PolarHBondContact O-N 2.94Å; L94-A97 PolarHBondContact O-N 2.91Å; L94-M98 HydrophobicContact CD1-CE 3.78Å; L94-M98 HydrophobicContact CD1-CG 4.39Å; L94-M98 HydrophobicContact CD1-SD 4.33Å; L94-M98 HydrophobicContact CD2-CE 4.28Å; L94-M98 HydrophobicContact CG-CE 4.01Å; L94-M98 HydrophobicContact CG-SD 4.16Å; L94-M98 WeakPolarHBondContact O-CG 3.36Å; L94-M98 PolarHBondContact O-N 2.99Å; L94-Q122 HydrophobicContact CD2-CG 4.31Å
95G98.5Very high94.3Very high0 Ų076 Ų760%039%0.389CS..Hα-helixtrans-58.3-46.4177.800000112.1L91 E92 A97 M98 I99 G119L91-G95 PolarHBondContact O-N 2.94Å; E92-G95 PolarHBondContact O-N 2.96Å; G95-A97 PolarHBondContact O-N 3.32Å; G95-M98 PolarHBondContact O-N 3.08Å; G95-I99 VanDerWaalsContact O-CG1 3.32Å; G95-I99 WeakPolarHBondContact O-CG1 3.41Å; G95-I99 PolarHBondContact O-N 2.91Å; G95-G119 WeakPolarHBondContact CA-O 3.41Å
96Q98.4Very high95.3Very high102 Ų10268.8 Ų68.848%0.47736%0.361SS..Hα-helixtrans-64-40178.1-169.658.155.200112.5E92 N93 L94 I99 T100E92-Q96 WeakPolarHBondContact O-CB 3.49Å; E92-Q96 PolarHBondContact O-N 3.29Å; N93-Q96 PolarHBondContact O-N 3.48Å; L94-Q96 VanDerWaalsContact C-N 3.34Å; L94-Q96 PolarHBondContact O-N 2.94Å; Q96-I99 PolarHBondContact O-N 3.46Å; Q96-T100 WeakPolarHBondContact O-CB 3.37Å; Q96-T100 PolarHBondContact O-N 3Å; Q96-T100 PolarHBondContact O-OG1 3.15Å
97A98.6Very high96.1Very high57 Ų5766 Ų6647%0.47136%0.355SS..Hα-helixtrans-63.8-44.4175.700000111.5N93 L94 G95 T100 A101N93-A97 WeakPolarHBondContact O-CB 3.44Å; N93-A97 PolarHBondContact O-N 2.63Å; L94-A97 PolarHBondContact O-N 2.91Å; G95-A97 PolarHBondContact O-N 3.32Å; A97-T100 PolarHBondContact O-N 3.5Å; A97-A101 WeakPolarHBondContact O-CB 3.49Å; A97-A101 PolarHBondContact O-N 3.48Å
98M98.6Very high96.5Very high44 Ų4462.5 Ų62.522%0.21737%0.367CS..Hα-helixtrans-63.6-42.2177-73.6175.7167.100112.1L94 G95 A101 G102 L115 V118 Q122L94-M98 HydrophobicContact CD1-CE 3.78Å; L94-M98 HydrophobicContact CD1-CG 4.39Å; L94-M98 HydrophobicContact CD1-SD 4.33Å; L94-M98 HydrophobicContact CD2-CE 4.28Å; L94-M98 HydrophobicContact CG-CE 4.01Å; L94-M98 HydrophobicContact CG-SD 4.16Å; L94-M98 WeakPolarHBondContact O-CG 3.36Å; L94-M98 PolarHBondContact O-N 2.99Å; G95-M98 PolarHBondContact O-N 3.08Å; M98-A101 PolarHBondContact O-N 3.2Å; M98-G102 PolarHBondContact O-N 3.42Å; M98-L115 HydrophobicContact CB-CD2 4.37Å; M98-L115 HydrophobicContact CG-CD2 4.18Å; M98-V118 HydrophobicContact CE-CG1 3.96Å; M98-V118 HydrophobicContact SD-CB 4.09Å; M98-V118 HydrophobicContact SD-CG1 3.48Å; M98-V118 WeakPolarHBondContact SD-CG1 3.24Å; M98-Q122 HydrophobicContact SD-CG 4.33Å
99I98.7Very high96.8Very high24 Ų2463.5 Ų63.512%0.12337%0.369CS..Hα-helixtrans-63.1-46177-71163.9000110.6G95 Q96 A101 G102 N103 L116 D120 L123G95-I99 VanDerWaalsContact O-CG1 3.32Å; G95-I99 WeakPolarHBondContact O-CG1 3.41Å; G95-I99 PolarHBondContact O-N 2.91Å; Q96-I99 PolarHBondContact O-N 3.46Å; I99-A101 VanDerWaalsContact C-N 3.35Å; I99-A101 PolarHBondContact O-N 3.08Å; I99-G102 PolarHBondContact O-N 3.21Å; I99-N103 PolarHBondContact O-N 3.28Å; I99-N103 PolarHBondContact O-ND2 3.28Å; I99-N103 VanDerWaalsContact O-ND2 3.12Å; I99-L116 HydrophobicContact CB-CD2 4.45Å; I99-L116 HydrophobicContact CG2-CD2 4.1Å; I99-D120 WeakPolarHBondContact CD1-OD1 3.3Å; I99-L123 HydrophobicContact CD1-CD1 3.44Å; I99-L123 VanDerWaalsContact CD1-CD1 3.44Å; I99-L123 HydrophobicContact CD1-CG 4.05Å
100T98.6Very high96.8Very high70 Ų7067.1 Ų67.143%0.42939%0.388SS..Hα-helixtrans-58.6-48.9177.7-56.80000110.6Q96 A97 N103 Q104Q96-T100 WeakPolarHBondContact O-CB 3.37Å; Q96-T100 PolarHBondContact O-N 3Å; Q96-T100 PolarHBondContact O-OG1 3.15Å; A97-T100 PolarHBondContact O-N 3.5Å; T100-N103 PolarHBondContact O-N 3.34Å; T100-Q104 WeakPolarHBondContact O-CG 3.48Å; T100-Q104 PolarHBondContact O-N 3.03Å; T100-Q104 VanDerWaalsContact O-N 3.13Å
101A98.5Very high96.9Very high31 Ų3167.3 Ų67.326%0.25638%0.38SS..Hα-helixtrans-63.1-43177.200000112.1A97 M98 I99 N103 Q104 F105 L115A97-A101 WeakPolarHBondContact O-CB 3.49Å; A97-A101 PolarHBondContact O-N 3.48Å; M98-A101 PolarHBondContact O-N 3.2Å; I99-A101 VanDerWaalsContact C-N 3.35Å; I99-A101 PolarHBondContact O-N 3.08Å; A101-N103 VanDerWaalsContact C-N 3.29Å; A101-N103 PolarHBondContact O-N 2.96Å; A101-Q104 PolarHBondContact O-N 2.9Å; A101-Q104 VanDerWaalsContact O-N 3.07Å; A101-F105 HydrophobicContact CB-CD2 4.24Å; A101-F105 HydrophobicContact CB-CE2 4.06Å; A101-F105 WeakPolarHBondContact O-CD2 3.45Å; A101-F105 PolarHBondContact O-N 3.29Å; A101-L115 HydrophobicContact CB-CD1 4.07Å
102G98.4Very high96.9Very high0 Ų065.2 Ų65.20%037%0.369CS..Hα-helixtrans-60.3-37.8179.300000113M98 I99 G106M98-G102 PolarHBondContact O-N 3.42Å; I99-G102 PolarHBondContact O-N 3.21Å; G102-G106 CarbonylContact O-C 3.52Å; G102-G106 PolarHBondContact O-N 2.93Å
103N98.4Very high96.9Very high92 Ų9265.5 Ų65.549%0.49237%0.373SS..Hα-helixtrans-68.2-39.1173-72.7-40.9000112.4I99 T100 A101 G106I99-N103 PolarHBondContact O-N 3.28Å; I99-N103 PolarHBondContact O-ND2 3.28Å; I99-N103 VanDerWaalsContact O-ND2 3.12Å; T100-N103 PolarHBondContact O-N 3.34Å; A101-N103 VanDerWaalsContact C-N 3.29Å; A101-N103 PolarHBondContact O-N 2.96Å; N103-G106 PolarHBondContact O-N 3.31Å
104Q98.2Very high96.9Very high162 Ų16262.7 Ų62.776%0.75736%0.362SS*.Hα-helixtrans-72.3-39.7179.7-68.3-64.4-21.500113.2T100 A101 G106T100-Q104 WeakPolarHBondContact O-CG 3.48Å; T100-Q104 PolarHBondContact O-N 3.03Å; T100-Q104 VanDerWaalsContact O-N 3.13Å; A101-Q104 PolarHBondContact O-N 2.9Å; A101-Q104 VanDerWaalsContact O-N 3.07Å; Q104-G106 PolarHBondContact O-N 2.68Å
105F97.2Very high96.8Very high115 Ų11560 Ų6050%0.50435%0.348SS..Hα-helixtrans-68.3-17.9172.1-71.3-60.7000112.6A101 T109 Y111 L115A101-F105 HydrophobicContact CB-CD2 4.24Å; A101-F105 HydrophobicContact CB-CE2 4.06Å; A101-F105 WeakPolarHBondContact O-CD2 3.45Å; A101-F105 PolarHBondContact O-N 3.29Å; F105-T109 VanDerWaalsContact O-CG2 3.27Å; F105-T109 WeakPolarHBondContact O-CG2 3.43Å; F105-T109 PolarHBondContact O-OG1 3.11Å; F105-Y111 AromaticContact CD2-CD1 3.91Å; F105-Y111 HydrophobicContact CD2-CD1 3.91Å; F105-Y111 AromaticContact CD2-CE1 3.89Å; F105-Y111 HydrophobicContact CD2-CE1 3.89Å; F105-Y111 HydrophobicContact CE2-CD1 4.05Å; F105-Y111 AromaticContact CE2-CE1 3.59Å; F105-Y111 HydrophobicContact CE2-CE1 3.59Å; F105-Y111 HydrophobicContact CG-CD1 4.21Å; F105-Y111 HydrophobicContact CZ-CD1 4.47Å; F105-Y111 HydrophobicContact CZ-CE1 4.03Å; F105-L115 HydrophobicContact CD2-CD1 3.58Å; F105-L115 HydrophobicContact CE2-CD1 3.91Å
106G94Very high96.8Very high22 Ų2261.5 Ų61.523%0.22736%0.355CS..  trans92.3126.6-179.400000111.7G102 N103 Q104 G108 T109G102-G106 CarbonylContact O-C 3.52Å; G102-G106 PolarHBondContact O-N 2.93Å; N103-G106 PolarHBondContact O-N 3.31Å; Q104-G106 PolarHBondContact O-N 2.68Å; G106-G108 PolarHBondContact O-N 3.26Å; G106-G108 VanDerWaalsContact O-N 3.12Å; G106-T109 PolarHBondContact O-N 3.14Å; G106-T109 PolarHBondContact O-OG1 3.04Å
107P92Very high96.8Very high77 Ų7759.8 Ų59.850%0.535%0.346SS..THydrogen-bonded Turntrans-65.6-17.2-177.125.3-34.4000113.8T109 S113 L116P107-T109 VanDerWaalsContact C-N 3.31Å; P107-S113 WeakPolarHBondContact O-CB 3.43Å; P107-L116 HydrophobicContact CB-CD1 3.76Å
108G92.2Very high96.8Very high83 Ų8358.6 Ų58.686%0.85633%0.333SS*.THydrogen-bonded Turntrans-76.1-15.7174.700000114G106G106-G108 PolarHBondContact O-N 3.26Å; G106-G108 VanDerWaalsContact O-N 3.12Å
109T93.9Very high96.8Very high62 Ų6256.5 Ų56.538%0.3832%0.323SS..SBendtrans-81.1148.6174.869.60000110.3F105 G106 P107 Y111 G112 S113F105-T109 VanDerWaalsContact O-CG2 3.27Å; F105-T109 WeakPolarHBondContact O-CG2 3.43Å; F105-T109 PolarHBondContact O-OG1 3.11Å; G106-T109 PolarHBondContact O-N 3.14Å; G106-T109 PolarHBondContact O-OG1 3.04Å; P107-T109 VanDerWaalsContact C-N 3.31Å; T109-Y111 PolarHBondContact O-N 2.96Å; T109-G112 PolarHBondContact O-N 3.44Å; T109-G112 WeakPolarHBondContact OG1-CA 3.44Å; T109-G112 PolarHBondContact OG1-N 3.02Å; T109-S113 WeakPolarHBondContact O-CB 3.19Å; T109-S113 PolarHBondContact O-N 3.08Å
110L93.9Very high96.8Very high105 Ų10559.1 Ų59.155%0.5534%0.337SS..Hα-helixtrans-57.8-40.1176.8-66.9174.1000111.7A114 A267L110-A114 VanDerWaalsContact O-CB 3.27Å; L110-A114 WeakPolarHBondContact O-CB 3.38Å; L110-A114 PolarHBondContact O-N 2.95Å; L110-A267 HydrophobicContact CD1-CB 3.54Å; L110-A267 HydrophobicContact CD2-CB 4.35Å
111Y96.1Very high96.8Very high143 Ų14356.5 Ų56.556%0.56132%0.321SS*.Hα-helixtrans-72.4-46.1179.8-173-130.3000112.2F105 T109 S113 A114 L115F105-Y111 AromaticContact CD2-CD1 3.91Å; F105-Y111 HydrophobicContact CD2-CD1 3.91Å; F105-Y111 AromaticContact CD2-CE1 3.89Å; F105-Y111 HydrophobicContact CD2-CE1 3.89Å; F105-Y111 HydrophobicContact CE2-CD1 4.05Å; F105-Y111 AromaticContact CE2-CE1 3.59Å; F105-Y111 HydrophobicContact CE2-CE1 3.59Å; F105-Y111 HydrophobicContact CG-CD1 4.21Å; F105-Y111 HydrophobicContact CZ-CD1 4.47Å; F105-Y111 HydrophobicContact CZ-CE1 4.03Å; T109-Y111 PolarHBondContact O-N 2.96Å; Y111-S113 PolarHBondContact O-N 3.39Å; Y111-A114 PolarHBondContact O-N 3.13Å; Y111-L115 HydrophobicContact CD1-CD1 3.87Å; Y111-L115 HydrophobicContact CD2-CD1 4.37Å; Y111-L115 HydrophobicContact CD2-CG 4.21Å; Y111-L115 HydrophobicContact CE1-CD1 3.56Å; Y111-L115 HydrophobicContact CE1-CG 4.3Å; Y111-L115 HydrophobicContact CE2-CD1 4.08Å; Y111-L115 HydrophobicContact CE2-CD2 4.07Å; Y111-L115 HydrophobicContact CE2-CG 3.89Å; Y111-L115 HydrophobicContact CG-CD1 4.27Å; Y111-L115 WeakPolarHBondContact O-CB 3.4Å; Y111-L115 WeakPolarHBondContact O-CG 3.33Å; Y111-L115 PolarHBondContact O-N 3.43Å
112G97.3Very high96.8Very high0 Ų056.7 Ų56.70%032%0.316CS..Hα-helixtrans-60-46.5177.300000112.2T109 A114 L115 L116T109-G112 PolarHBondContact O-N 3.44Å; T109-G112 WeakPolarHBondContact OG1-CA 3.44Å; T109-G112 PolarHBondContact OG1-N 3.02Å; G112-A114 PolarHBondContact O-N 3.49Å; G112-L115 PolarHBondContact O-N 2.89Å; G112-L116 WeakPolarHBondContact O-CG 3.39Å; G112-L116 PolarHBondContact O-N 3.11Å
113S96.6Very high96.8Very high29 Ų2958.9 Ų58.920%0.20333%0.328CS..Hα-helixtrans-61.3-40.8175-169.60000112.9P107 T109 Y111 K117 H263P107-S113 WeakPolarHBondContact O-CB 3.43Å; T109-S113 WeakPolarHBondContact O-CB 3.19Å; T109-S113 PolarHBondContact O-N 3.08Å; Y111-S113 PolarHBondContact O-N 3.39Å; S113-K117 PolarHBondContact O-N 2.9Å; S113-H263 PolarHBondContact OG-CE1 3.13Å; S113-H263 VanDerWaalsContact OG-CE1 3.26Å
114A97.4Very high96.8Very high25 Ų2560.2 Ų60.221%0.20733%0.33CS..Hα-helixtrans-64.9-45.8176.400000111.7L110 Y111 G112 L116 K117 V118 L260L110-A114 VanDerWaalsContact O-CB 3.27Å; L110-A114 WeakPolarHBondContact O-CB 3.38Å; L110-A114 PolarHBondContact O-N 2.95Å; Y111-A114 PolarHBondContact O-N 3.13Å; G112-A114 PolarHBondContact O-N 3.49Å; A114-L116 VanDerWaalsContact C-N 3.31Å; A114-L116 PolarHBondContact O-N 3.2Å; A114-K117 PolarHBondContact O-N 3.48Å; A114-V118 VanDerWaalsContact O-CG2 3.29Å; A114-V118 WeakPolarHBondContact O-CG2 3.48Å; A114-V118 PolarHBondContact O-N 2.99Å; A114-L260 HydrophobicContact CB-CD2 3.9Å
115L98.2Very high96.8Very high17 Ų1753.3 Ų53.39%0.08930%0.298CS..Hα-helixtrans-58-42.1177.2-77.6171.9000112.1M98 A101 F105 Y111 G112 V118 G119M98-L115 HydrophobicContact CB-CD2 4.37Å; M98-L115 HydrophobicContact CG-CD2 4.18Å; A101-L115 HydrophobicContact CB-CD1 4.07Å; F105-L115 HydrophobicContact CD2-CD1 3.58Å; F105-L115 HydrophobicContact CE2-CD1 3.91Å; Y111-L115 HydrophobicContact CD1-CD1 3.87Å; Y111-L115 HydrophobicContact CD2-CD1 4.37Å; Y111-L115 HydrophobicContact CD2-CG 4.21Å; Y111-L115 HydrophobicContact CE1-CD1 3.56Å; Y111-L115 HydrophobicContact CE1-CG 4.3Å; Y111-L115 HydrophobicContact CE2-CD1 4.08Å; Y111-L115 HydrophobicContact CE2-CD2 4.07Å; Y111-L115 HydrophobicContact CE2-CG 3.89Å; Y111-L115 HydrophobicContact CG-CD1 4.27Å; Y111-L115 WeakPolarHBondContact O-CB 3.4Å; Y111-L115 WeakPolarHBondContact O-CG 3.33Å; Y111-L115 PolarHBondContact O-N 3.43Å; G112-L115 PolarHBondContact O-N 2.89Å; L115-V118 PolarHBondContact O-N 3.28Å; L115-G119 PolarHBondContact O-N 3.13Å
116L98.3Very high96.8Very high31 Ų3147.8 Ų47.816%0.16227%0.274CS..Hα-helixtrans-60.6-48.1176.3-68.1170.6000111.5I99 P107 G112 A114 V118 G119 D120I99-L116 HydrophobicContact CB-CD2 4.45Å; I99-L116 HydrophobicContact CG2-CD2 4.1Å; P107-L116 HydrophobicContact CB-CD1 3.76Å; G112-L116 WeakPolarHBondContact O-CG 3.39Å; G112-L116 PolarHBondContact O-N 3.11Å; A114-L116 VanDerWaalsContact C-N 3.31Å; A114-L116 PolarHBondContact O-N 3.2Å; L116-V118 PolarHBondContact O-N 3.38Å; L116-G119 PolarHBondContact O-N 3.3Å; L116-D120 WeakPolarHBondContact O-CB 3.41Å; L116-D120 PolarHBondContact O-N 2.94Å
117K97.8Very high97Very high66 Ų6649.3 Ų49.329%0.28728%0.28SS..Hα-helixtrans-62.8-43.8178.7-69.4-179.3179.1-176.20112.7S113 A114 T121 L256 A259 L260 H263S113-K117 PolarHBondContact O-N 2.9Å; A114-K117 PolarHBondContact O-N 3.48Å; K117-T121 PolarHBondContact O-N 3.28Å; K117-T121 VanDerWaalsContact O-N 3.17Å; K117-T121 PolarHBondContact O-OG1 2.86Å; K117-L256 HydrophobicContact CB-CD1 4.03Å; K117-A259 HydrophobicContact CD-CB 4.33Å; K117-A259 PolarHBondContact NZ-O 2.96Å; K117-L260 HydrophobicContact CB-CD2 4.44Å; K117-L260 HydrophobicContact CD-CD2 4.39Å; K117-H263 WeakPolarHBondContact CE-CE1 3.49Å; K117-H263 PolarHBondContact NZ-CE1 2.96Å; K117-H263 PolarHBondContact NZ-NE2 3.32Å
118V98.5Very high97.2Very high32 Ų3245.8 Ų45.819%0.19426%0.257CS..Hα-helixtrans-65.5-46177.7-179.60000109.5M98 A114 L115 L116 D120 T121 Q122 L256 L260M98-V118 HydrophobicContact CE-CG1 3.96Å; M98-V118 HydrophobicContact SD-CB 4.09Å; M98-V118 HydrophobicContact SD-CG1 3.48Å; M98-V118 WeakPolarHBondContact SD-CG1 3.24Å; A114-V118 VanDerWaalsContact O-CG2 3.29Å; A114-V118 WeakPolarHBondContact O-CG2 3.48Å; A114-V118 PolarHBondContact O-N 2.99Å; L115-V118 PolarHBondContact O-N 3.28Å; L116-V118 PolarHBondContact O-N 3.38Å; V118-D120 PolarHBondContact O-N 3.46Å; V118-T121 WeakPolarHBondContact O-CB 3.49Å; V118-T121 PolarHBondContact O-N 3.36Å; V118-T121 VanDerWaalsContact O-N 3.12Å; V118-Q122 HydrophobicContact CG1-CG 4.33Å; V118-Q122 WeakPolarHBondContact O-CG 3.11Å; V118-Q122 PolarHBondContact O-N 3.43Å; V118-L256 HydrophobicContact CB-CD2 4.44Å; V118-L256 HydrophobicContact CG1-CD2 4.35Å; V118-L256 HydrophobicContact CG2-CD1 4.14Å; V118-L256 HydrophobicContact CG2-CD2 4.19Å; V118-L260 HydrophobicContact CG2-CD1 3.92Å; V118-L260 HydrophobicContact CG2-CD2 4.45Å
119G98.6Very high97.4Very high0 Ų044.6 Ų44.60%023%0.229CC..Hα-helixtrans-60.1-46.5179.900000112.8G95 L115 L116 T121 Q122 L123G95-G119 WeakPolarHBondContact CA-O 3.41Å; L115-G119 PolarHBondContact O-N 3.13Å; L116-G119 PolarHBondContact O-N 3.3Å; G119-T121 VanDerWaalsContact C-N 3.26Å; G119-T121 PolarHBondContact O-N 3.42Å; G119-Q122 PolarHBondContact O-N 3.13Å; G119-Q122 VanDerWaalsContact O-N 3.15Å; G119-L123 PolarHBondContact O-N 3.46Å
120D98.4Very high97.5Very high80 Ų8044.9 Ų44.943%0.42822%0.224SC..Hα-helixtrans-59.4-37.7174.4-78.5-13000112.4I99 L116 V118 K124I99-D120 WeakPolarHBondContact CD1-OD1 3.3Å; L116-D120 WeakPolarHBondContact O-CB 3.41Å; L116-D120 PolarHBondContact O-N 2.94Å; V118-D120 PolarHBondContact O-N 3.46Å; D120-K124 WeakPolarHBondContact O-CG 3.34Å; D120-K124 PolarHBondContact O-N 3.35Å
121T98.6Very high97.5Very high14 Ų1445.6 Ų45.69%0.08622%0.224CC..Hα-helixtrans-70.9-38.5177.5-53.40000111K117 V118 G119 K124 L125 L252 L256K117-T121 PolarHBondContact O-N 3.28Å; K117-T121 VanDerWaalsContact O-N 3.17Å; K117-T121 PolarHBondContact O-OG1 2.86Å; V118-T121 WeakPolarHBondContact O-CB 3.49Å; V118-T121 PolarHBondContact O-N 3.36Å; V118-T121 VanDerWaalsContact O-N 3.12Å; G119-T121 VanDerWaalsContact C-N 3.26Å; G119-T121 PolarHBondContact O-N 3.42Å; T121-K124 PolarHBondContact O-N 3.27Å; T121-L125 HydrophobicContact CG2-CD1 4.09Å; T121-L125 WeakPolarHBondContact O-CG 3.25Å; T121-L125 PolarHBondContact O-N 3.39Å; T121-L252 HydrophobicContact CG2-CB 4.21Å; T121-L256 HydrophobicContact CG2-CB 4.02Å; T121-L256 HydrophobicContact CG2-CD2 3.94Å
122Q98.6Very high97.6Very high35 Ų3539.4 Ų39.416%0.16420%0.2CC..Hα-helixtrans-65.1-38175.5-68.3-58.463.600112.5L94 M98 V118 G119 K124 L125 G126L94-Q122 HydrophobicContact CD2-CG 4.31Å; M98-Q122 HydrophobicContact SD-CG 4.33Å; V118-Q122 HydrophobicContact CG1-CG 4.33Å; V118-Q122 WeakPolarHBondContact O-CG 3.11Å; V118-Q122 PolarHBondContact O-N 3.43Å; G119-Q122 PolarHBondContact O-N 3.13Å; G119-Q122 VanDerWaalsContact O-N 3.15Å; Q122-K124 VanDerWaalsContact C-N 3.32Å; Q122-K124 PolarHBondContact O-N 2.97Å; Q122-L125 PolarHBondContact O-N 2.9Å; Q122-G126 PolarHBondContact O-N 3.49Å
123L98.4Very high97.5Very high47 Ų4741.3 Ų41.325%0.24621%0.21CC..Hα-helixtrans-58.6-44.8171.2-67.3-173.6000111.4E92 I99 G119 G126 C127E92-L123 HydrophobicContact CB-CD2 4.15Å; E92-L123 HydrophobicContact CG-CD2 4.24Å; E92-L123 WeakPolarHBondContact O-CD2 3.35Å; I99-L123 HydrophobicContact CD1-CD1 3.44Å; I99-L123 VanDerWaalsContact CD1-CD1 3.44Å; I99-L123 HydrophobicContact CD1-CG 4.05Å; G119-L123 PolarHBondContact O-N 3.46Å; L123-G126 PolarHBondContact O-N 2.84Å; L123-C127 PolarHBondContact O-N 3.37Å; L123-C127 PolarHBondContact O-SG 2.99Å; L123-C127 VanDerWaalsContact O-SG 3.33Å
124K98.5Very high97.3Very high120 Ų12043.2 Ų43.252%0.52222%0.223SC..Hα-helixtrans-64.9-39.8178-68.1170.3-172172.90112.5D120 T121 Q122 C127 A128 L252D120-K124 WeakPolarHBondContact O-CG 3.34Å; D120-K124 PolarHBondContact O-N 3.35Å; T121-K124 PolarHBondContact O-N 3.27Å; Q122-K124 VanDerWaalsContact C-N 3.32Å; Q122-K124 PolarHBondContact O-N 2.97Å; K124-C127 WeakPolarHBondContact O-CB 3.41Å; K124-C127 PolarHBondContact O-N 3.44Å; K124-A128 PolarHBondContact O-N 3.31Å; K124-L252 HydrophobicContact CB-CD1 4.01Å; K124-L252 HydrophobicContact CB-CD2 4.07Å; K124-L252 HydrophobicContact CD-CD2 3.99Å
125L98.6Very high97.2Very high16 Ų1643.8 Ų43.88%0.08422%0.224CC..Hα-helixtrans-64.6-42.1175.5-74.5164.9000111.3L91 T121 Q122 C127 A128 E129 C249 L252L91-L125 HydrophobicContact CD1-CB 4.31Å; T121-L125 HydrophobicContact CG2-CD1 4.09Å; T121-L125 WeakPolarHBondContact O-CG 3.25Å; T121-L125 PolarHBondContact O-N 3.39Å; Q122-L125 PolarHBondContact O-N 2.9Å; L125-C127 PolarHBondContact O-N 3.07Å; L125-A128 PolarHBondContact O-N 2.85Å; L125-E129 PolarHBondContact O-N 3.42Å; L125-C249 HydrophobicContact CD2-CB 3.67Å; L125-C249 WeakPolarHBondContact CD2-SG 3.44Å; L125-L252 HydrophobicContact CD2-CB 4.12Å; L125-L252 HydrophobicContact CD2-CD1 3.8Å; L125-L252 HydrophobicContact CG-CB 4.4Å; L125-L252 HydrophobicContact CG-CD1 4.05Å
126G97.7Very high97.1Very high0 Ų043 Ų430%022%0.22CC..Hα-helixtrans-64.3-38.3174.800000113N89 Q122 L123 E129 R130N89-G126 WeakPolarHBondContact ND2-CA 3.28Å; N89-G126 PolarHBondContact ND2-O 3.24Å; N89-G126 WeakPolarHBondContact OD1-CA 3.28Å; Q122-G126 PolarHBondContact O-N 3.49Å; L123-G126 PolarHBondContact O-N 2.84Å; G126-E129 PolarHBondContact O-N 3.15Å; G126-R130 PolarHBondContact O-N 2.88Å
127C96.7Very high96.8Very high53 Ų5342.9 Ų42.936%0.35822%0.223SC..Hα-helixtrans-59.5-46.9170.7-71.20000112.5L123 K124 L125 E129 R130 E131L123-C127 PolarHBondContact O-N 3.37Å; L123-C127 PolarHBondContact O-SG 2.99Å; L123-C127 VanDerWaalsContact O-SG 3.33Å; K124-C127 WeakPolarHBondContact O-CB 3.41Å; K124-C127 PolarHBondContact O-N 3.44Å; L125-C127 PolarHBondContact O-N 3.07Å; C127-E129 VanDerWaalsContact C-N 3.33Å; C127-E129 PolarHBondContact O-N 2.63Å; C127-R130 PolarHBondContact O-N 3.23Å; C127-R130 PolarHBondContact SG-NH2 3.21Å; C127-E131 PolarHBondContact O-N 3.43Å
128A97.6Very high96.6Very high3 Ų343.9 Ų43.93%0.02524%0.235CC..Hα-helixtrans-62.2-40.3178.700000112K124 L125 E131 F132 F245K124-A128 PolarHBondContact O-N 3.31Å; L125-A128 PolarHBondContact O-N 2.85Å; A128-E131 PolarHBondContact O-N 3.24Å; A128-F132 WeakPolarHBondContact O-CB 3.49Å; A128-F132 PolarHBondContact O-N 3.45Å; A128-F245 HydrophobicContact CB-CD2 4.18Å; A128-F245 HydrophobicContact CB-CE2 4.11Å
129E97Very high96.4Very high58 Ų5845.9 Ų45.927%0.27124%0.241SC..Hα-helixtrans-64.3-45.2177.2-178.3-172.4-111.400111.4N89 L91 L125 G126 C127 E131 F132 I133 F245N89-E129 PolarHBondContact ND2-OE2 3.49Å; L91-E129 HydrophobicContact CD1-CB 4.16Å; L125-E129 PolarHBondContact O-N 3.42Å; G126-E129 PolarHBondContact O-N 3.15Å; C127-E129 VanDerWaalsContact C-N 3.33Å; C127-E129 PolarHBondContact O-N 2.63Å; E129-E131 VanDerWaalsContact C-N 3.31Å; E129-E131 PolarHBondContact O-N 2.86Å; E129-F132 PolarHBondContact O-N 3.43Å; E129-I133 HydrophobicContact CG-CD1 3.84Å; E129-I133 HydrophobicContact CG-CG1 4.45Å; E129-I133 WeakPolarHBondContact O-CG1 3.41Å; E129-I133 PolarHBondContact O-N 3.26Å; E129-F245 VanDerWaalsContact CA-CE2 3.44Å; E129-F245 HydrophobicContact CB-CE2 3.94Å; E129-F245 HydrophobicContact CB-CZ 4.05Å; E129-F245 HydrophobicContact CG-CZ 4.37Å
130R94.3Very high96.2Very high69 Ų6945.9 Ų45.926%0.2624%0.241SC..Hα-helixtrans-60.7-43.1177.4176.9-179.651.2-102.41.8111.7Q86 E92 G126 C127 I133 S134Q86-R130 VanDerWaalsContact NE2-NH2 3.18Å; E92-R130 IonicContact OE1-CZ 2.72Å; E92-R130 IonicContact OE1-NH1 3.49Å; E92-R130 PolarHBondContact OE1-NH1 3.47Å; E92-R130 IonicContact OE1-NH2 3.12Å; E92-R130 PolarHBondContact OE1-NH2 3.31Å; E92-R130 VanDerWaalsContact OE1-NH2 3.12Å; E92-R130 IonicContact OE2-NH1 3.35Å; E92-R130 PolarHBondContact OE2-NH1 2.96Å; G126-R130 PolarHBondContact O-N 2.88Å; C127-R130 PolarHBondContact O-N 3.23Å; C127-R130 PolarHBondContact SG-NH2 3.21Å; R130-I133 PolarHBondContact O-N 3.34Å; R130-S134 WeakPolarHBondContact O-CB 3.49Å; R130-S134 PolarHBondContact O-N 2.94Å
131E95.2Very high96Very high119 Ų11942.7 Ų42.756%0.55622%0.224SC*.Hα-helixtrans-62.1-48.5176.6-175.5168.7-159.600110.8C127 A128 E129 I133 S134 V135C127-E131 PolarHBondContact O-N 3.43Å; A128-E131 PolarHBondContact O-N 3.24Å; E129-E131 VanDerWaalsContact C-N 3.31Å; E129-E131 PolarHBondContact O-N 2.86Å; E131-I133 PolarHBondContact O-N 2.87Å; E131-S134 PolarHBondContact O-N 3.42Å; E131-V135 HydrophobicContact CG-CG2 4.22Å; E131-V135 WeakPolarHBondContact O-CB 3.38Å; E131-V135 VanDerWaalsContact O-CG2 3.31Å; E131-V135 WeakPolarHBondContact O-CG2 3.49Å; E131-V135 PolarHBondContact O-N 3.02Å
132F96.9Very high95.8Very high14 Ų1445.1 Ų45.16%0.06124%0.239CC..Hα-helixtrans-54.8-48175.5167.8-108000112.6Y63 L64 A128 E129 S136 F238 E241 Q242 F245Y63-F132 HydrophobicContact CE1-CE1 4.12Å; Y63-F132 HydrophobicContact CE1-CZ 4.06Å; L64-F132 HydrophobicContact CD2-CE1 3.88Å; L64-F132 HydrophobicContact CD2-CZ 4.2Å; A128-F132 WeakPolarHBondContact O-CB 3.49Å; A128-F132 PolarHBondContact O-N 3.45Å; E129-F132 PolarHBondContact O-N 3.43Å; F132-S136 VanDerWaalsContact CE2-OG 3.23Å; F132-S136 WeakPolarHBondContact CE2-OG 3.4Å; F132-S136 WeakPolarHBondContact O-CB 3.1Å; F132-S136 PolarHBondContact O-N 3.01Å; F132-S136 PolarHBondContact O-OG 2.88Å; F132-F238 HydrophobicContact CZ-CE2 4.16Å; F132-E241 HydrophobicContact CD2-CB 4.06Å; F132-E241 HydrophobicContact CE2-CB 4.03Å; F132-Q242 HydrophobicContact CE2-CB 4.38Å; F132-Q242 HydrophobicContact CE2-CG 3.73Å; F132-Q242 HydrophobicContact CZ-CG 3.75Å; F132-F245 HydrophobicContact CB-CB 3.97Å; F132-F245 HydrophobicContact CB-CD1 4.47Å; F132-F245 HydrophobicContact CB-CD2 3.77Å; F132-F245 HydrophobicContact CB-CE2 4.42Å; F132-F245 HydrophobicContact CB-CG 3.8Å; F132-F245 HydrophobicContact CD1-CD1 4.09Å; F132-F245 HydrophobicContact CD1-CE1 4.38Å; F132-F245 HydrophobicContact CD1-CG 4.26Å; F132-F245 HydrophobicContact CD2-CB 3.77Å; F132-F245 HydrophobicContact CD2-CD1 4.45Å; F132-F245 HydrophobicContact CD2-CG 4.16Å; F132-F245 HydrophobicContact CG-CB 3.89Å; F132-F245 HydrophobicContact CG-CD1 4.06Å; F132-F245 HydrophobicContact CG-CD2 4.25Å; F132-F245 AromaticContact CG-CG 3.79Å; F132-F245 HydrophobicContact CG-CG 3.79Å
133I95Very high95.6Very high40 Ų4044.8 Ų44.821%0.20524%0.24CC..Hα-helixtrans-60.9-47.7178-71167.6000110.5L64 E129 R130 E131 A137L64-I133 HydrophobicContact CB-CG2 4.36Å; L64-I133 HydrophobicContact CD2-CG1 4.48Å; L64-I133 WeakPolarHBondContact O-CD1 3.4Å; E129-I133 HydrophobicContact CG-CD1 3.84Å; E129-I133 HydrophobicContact CG-CG1 4.45Å; E129-I133 WeakPolarHBondContact O-CG1 3.41Å; E129-I133 PolarHBondContact O-N 3.26Å; R130-I133 PolarHBondContact O-N 3.34Å; E131-I133 PolarHBondContact O-N 2.87Å; I133-A137 VanDerWaalsContact O-CB 3.26Å; I133-A137 WeakPolarHBondContact O-CB 3.03Å; I133-A137 PolarHBondContact O-N 3.09Å
134S92.8Very high95.5Very high69 Ų6943.1 Ų43.148%0.48323%0.231SC..Hα-helixtrans-64.6-45.1-177.7-178.40000112.6R130 E131 A137 T138R130-S134 WeakPolarHBondContact O-CB 3.49Å; R130-S134 PolarHBondContact O-N 2.94Å; E131-S134 PolarHBondContact O-N 3.42Å; S134-A137 PolarHBondContact O-N 3.16Å; S134-T138 PolarHBondContact O-N 2.85Å; S134-T138 VanDerWaalsContact O-N 3.11Å; S134-T138 PolarHBondContact O-OG1 3.02Å
135V95.2Very high95.4Very high36 Ų3639.2 Ų39.222%0.21821%0.214CC..Hα-helixtrans-68.9-43.1179.4178.50000110.5E131 A137 T138 K139 E241E131-V135 HydrophobicContact CG-CG2 4.22Å; E131-V135 WeakPolarHBondContact O-CB 3.38Å; E131-V135 VanDerWaalsContact O-CG2 3.31Å; E131-V135 WeakPolarHBondContact O-CG2 3.49Å; E131-V135 PolarHBondContact O-N 3.02Å; V135-A137 PolarHBondContact O-N 2.96Å; V135-T138 PolarHBondContact O-N 3.29Å; V135-K139 HydrophobicContact CG1-CD 3.75Å; V135-K139 HydrophobicContact CG1-CG 4.1Å; V135-K139 WeakPolarHBondContact O-CB 3.5Å; V135-K139 WeakPolarHBondContact O-CG 3.38Å; V135-K139 PolarHBondContact O-N 3.37Å; V135-E241 VanDerWaalsContact CG1-CD 3.43Å; V135-E241 HydrophobicContact CG1-CG 3.9Å
136S95.9Very high95.2Very high0 Ų047.1 Ų47.10%024%0.243CC..Hα-helixtrans-62.4-41.4176.4-640000112.2F132 T138 V140F132-S136 VanDerWaalsContact CE2-OG 3.23Å; F132-S136 WeakPolarHBondContact CE2-OG 3.4Å; F132-S136 WeakPolarHBondContact O-CB 3.1Å; F132-S136 PolarHBondContact O-N 3.01Å; F132-S136 PolarHBondContact O-OG 2.88Å; S136-T138 VanDerWaalsContact C-N 3.32Å; S136-T138 PolarHBondContact O-N 3.29Å; S136-V140 WeakPolarHBondContact O-CB 3.36Å; S136-V140 WeakPolarHBondContact O-CG2 3.45Å; S136-V140 PolarHBondContact O-N 3.48Å
137A93.2Very high95.2Very high29 Ų2947.3 Ų47.324%0.2424%0.244CC..Iπ-helixtrans-58.8-45.6174.900000111.4L64 I133 S134 V135 L141 T142L64-A137 HydrophobicContact CD1-CB 4.46Å; I133-A137 VanDerWaalsContact O-CB 3.26Å; I133-A137 WeakPolarHBondContact O-CB 3.03Å; I133-A137 PolarHBondContact O-N 3.09Å; S134-A137 PolarHBondContact O-N 3.16Å; V135-A137 PolarHBondContact O-N 2.96Å; A137-L141 HydrophobicContact CB-CD1 4.03Å; A137-L141 HydrophobicContact CB-CG 4.49Å; A137-L141 WeakPolarHBondContact O-CA 3.4Å; A137-L141 VanDerWaalsContact O-CB 3.29Å; A137-L141 WeakPolarHBondContact O-CB 3.27Å; A137-L141 PolarHBondContact O-N 3.16Å; A137-T142 PolarHBondContact O-N 3.44Å; A137-T142 PolarHBondContact O-OG1 3.06Å
138T92.8Very high95.2Very high87 Ų8745.9 Ų45.953%0.53423%0.233SC..Iπ-helixtrans-69.3-46.3-179-55.20000112.4S134 V135 S136 P143S134-T138 PolarHBondContact O-N 2.85Å; S134-T138 VanDerWaalsContact O-N 3.11Å; S134-T138 PolarHBondContact O-OG1 3.02Å; V135-T138 PolarHBondContact O-N 3.29Å; S136-T138 VanDerWaalsContact C-N 3.32Å; S136-T138 PolarHBondContact O-N 3.29Å; T138-P143 WeakPolarHBondContact O-CD 3.23Å
139K94.7Very high95.1Very high74 Ų7450.7 Ų50.732%0.32225%0.254SS..Iπ-helixtrans-77.2-24.9-174.8-69.8-171.9-180178.20113.4V135 D237 E241V135-K139 HydrophobicContact CG1-CD 3.75Å; V135-K139 HydrophobicContact CG1-CG 4.1Å; V135-K139 WeakPolarHBondContact O-CB 3.5Å; V135-K139 WeakPolarHBondContact O-CG 3.38Å; V135-K139 PolarHBondContact O-N 3.37Å; K139-D237 HydrophobicContact CB-CB 4.33Å; K139-D237 HydrophobicContact CD-CB 4.05Å; K139-E241 HydrophobicContact CD-CG 4.35Å; K139-E241 IonicContact NZ-OE1 3.54Å; K139-E241 PolarHBondContact NZ-OE1 2.98Å
140V94.7Very high95Very high1 Ų150.2 Ų50.21%0.00626%0.258CS..Iπ-helixtrans-120.6-55.5-172.8-164.80000112.7M60 S136 T142 P143 L144 C234 F238M60-V140 HydrophobicContact CE-CB 3.99Å; M60-V140 HydrophobicContact CE-CG1 3.46Å; M60-V140 VanDerWaalsContact CE-CG1 3.46Å; M60-V140 HydrophobicContact CE-CG2 4.26Å; M60-V140 HydrophobicContact SD-CG1 3.51Å; M60-V140 VanDerWaalsContact SD-CG1 3.51Å; S136-V140 WeakPolarHBondContact O-CB 3.36Å; S136-V140 WeakPolarHBondContact O-CG2 3.45Å; S136-V140 PolarHBondContact O-N 3.48Å; V140-T142 PolarHBondContact O-N 2.89Å; V140-P143 WeakPolarHBondContact O-CD 3.42Å; V140-L144 HydrophobicContact CG1-CD1 4.16Å; V140-L144 VanDerWaalsContact O-CG 3.3Å; V140-L144 WeakPolarHBondContact O-CG 3.36Å; V140-L144 PolarHBondContact O-N 3.11Å; V140-C234 HydrophobicContact CG1-CB 4.18Å; V140-F238 HydrophobicContact CG2-CB 3.7Å; V140-F238 HydrophobicContact CG2-CD2 4.02Å; V140-F238 HydrophobicContact CG2-CG 4.18Å
141L94.8Very high95.1Very high13 Ų1349.6 Ų49.67%0.06826%0.259CS..Iπ-helixtrans-66.2-43.9-175-54.2-177.6000111.2L57 M60 E61 L64 A137 L144 K145L57-L141 HydrophobicContact CD1-CB 4.07Å; L57-L141 HydrophobicContact CD1-CD2 3.77Å; L57-L141 HydrophobicContact CD1-CG 4.48Å; M60-L141 HydrophobicContact CB-CD2 3.52Å; E61-L141 HydrophobicContact CG-CD1 3.86Å; E61-L141 HydrophobicContact CG-CD2 4.12Å; L64-L141 HydrophobicContact CD1-CD1 3.91Å; L64-L141 HydrophobicContact CD1-CG 4.18Å; A137-L141 HydrophobicContact CB-CD1 4.03Å; A137-L141 HydrophobicContact CB-CG 4.49Å; A137-L141 WeakPolarHBondContact O-CA 3.4Å; A137-L141 VanDerWaalsContact O-CB 3.29Å; A137-L141 WeakPolarHBondContact O-CB 3.27Å; A137-L141 PolarHBondContact O-N 3.16Å; L141-L144 PolarHBondContact O-N 3.48Å; L141-K145 WeakPolarHBondContact O-CB 3.34Å; L141-K145 WeakPolarHBondContact O-CG 3.11Å; L141-K145 PolarHBondContact O-N 3.38Å
142T93.7Very high95.2Very high65 Ų6544.1 Ų44.140%0.39923%0.234SC..Hα-helixtrans-60-48.9-178.2-570000113A137 V140 L144 K145 R146A137-T142 PolarHBondContact O-N 3.44Å; A137-T142 PolarHBondContact O-OG1 3.06Å; V140-T142 PolarHBondContact O-N 2.89Å; T142-L144 PolarHBondContact O-N 3.21Å; T142-K145 PolarHBondContact O-N 3.35Å; T142-R146 WeakPolarHBondContact O-CB 3.35Å; T142-R146 PolarHBondContact O-N 3.03Å
143P94.9Very high95.2Very high28 Ų2850.5 Ų50.518%0.18226%0.261CS..Hα-helixtrans-58.9-41.6174.4-28.836.7000114.4T138 V140 R146 F147T138-P143 WeakPolarHBondContact O-CD 3.23Å; V140-P143 WeakPolarHBondContact O-CD 3.42Å; P143-R146 PolarHBondContact O-N 3.44Å; P143-F147 PolarHBondContact O-N 3.32Å
144L96.3Very high95.3Very high11 Ų1151.3 Ų51.36%0.05827%0.268CS..Hα-helixtrans-68.1-43.3179.2-62.3-178.1000111.6T53 I56 L57 V140 L141 T142 R146 F147 L148 H231T53-L144 HydrophobicContact CG2-CB 4.13Å; T53-L144 HydrophobicContact CG2-CD2 3.93Å; T53-L144 HydrophobicContact CG2-CG 4.47Å; I56-L144 HydrophobicContact CG2-CD1 4.22Å; L57-L144 HydrophobicContact CD1-CB 4.19Å; V140-L144 HydrophobicContact CG1-CD1 4.16Å; V140-L144 VanDerWaalsContact O-CG 3.3Å; V140-L144 WeakPolarHBondContact O-CG 3.36Å; V140-L144 PolarHBondContact O-N 3.11Å; L141-L144 PolarHBondContact O-N 3.48Å; T142-L144 PolarHBondContact O-N 3.21Å; L144-R146 VanDerWaalsContact C-N 3.34Å; L144-R146 PolarHBondContact O-N 3.03Å; L144-F147 PolarHBondContact O-N 3.21Å; L144-L148 WeakPolarHBondContact O-CG 3.19Å; L144-L148 PolarHBondContact O-N 3.33Å; L144-L148 VanDerWaalsContact O-N 3.1Å; L144-H231 HydrophobicContact CD2-CB 4.46Å
145K95.5Very high95.5Very high39 Ų3948.4 Ų48.417%0.1725%0.247CC..Hα-helixtrans-57.2-47.7172.3-76.4176.1175.9179.40110.8L57 E61 E78 L141 T142 F147 L148 E149L57-K145 HydrophobicContact CD1-CG 3.97Å; L57-K145 HydrophobicContact CD2-CG 3.75Å; E61-K145 WeakPolarHBondContact OE1-CE 3.11Å; E61-K145 IonicContact OE1-NZ 2.86Å; E78-K145 IonicContact OE1-NZ 3.44Å; E78-K145 IonicContact OE2-NZ 2.63Å; E78-K145 PolarHBondContact OE2-NZ 3Å; L141-K145 WeakPolarHBondContact O-CB 3.34Å; L141-K145 WeakPolarHBondContact O-CG 3.11Å; L141-K145 PolarHBondContact O-N 3.38Å; T142-K145 PolarHBondContact O-N 3.35Å; K145-F147 PolarHBondContact O-N 3.1Å; K145-L148 PolarHBondContact O-N 3.48Å; K145-E149 WeakPolarHBondContact O-CB 3.23Å; K145-E149 WeakPolarHBondContact O-CG 3.29Å; K145-E149 PolarHBondContact O-N 3.48Å
146R94.5Very high95.6Very high181 Ų18150.6 Ų50.668%0.68326%0.255SS*.Hα-helixtrans-58.9-46.5178.4-178.9-179.9174.7-173.6-1.5111.4T142 P143 L144 L148 E149 S150T142-R146 WeakPolarHBondContact O-CB 3.35Å; T142-R146 PolarHBondContact O-N 3.03Å; P143-R146 PolarHBondContact O-N 3.44Å; L144-R146 VanDerWaalsContact C-N 3.34Å; L144-R146 PolarHBondContact O-N 3.03Å; R146-L148 VanDerWaalsContact C-N 3.31Å; R146-L148 PolarHBondContact O-N 3.41Å; R146-E149 PolarHBondContact O-N 3.38Å; R146-S150 WeakPolarHBondContact O-CA 3.43Å; R146-S150 WeakPolarHBondContact O-CB 3.38Å; R146-S150 PolarHBondContact O-N 2.83Å
147F96.7Very high95.7Very high4 Ų457 Ų572%0.01828%0.283CS..Iπ-helixtrans-56.7-44.8177.2172.7-106.4000112A49 T53 P143 L144 K145 D151 I152 I224 H231A49-F147 HydrophobicContact CB-CZ 4.4Å; T53-F147 HydrophobicContact CG2-CD1 3.91Å; T53-F147 HydrophobicContact CG2-CE1 4.4Å; P143-F147 PolarHBondContact O-N 3.32Å; L144-F147 PolarHBondContact O-N 3.21Å; K145-F147 PolarHBondContact O-N 3.1Å; F147-D151 HydrophobicContact CD2-CB 3.93Å; F147-D151 HydrophobicContact CE2-CB 4.23Å; F147-D151 WeakPolarHBondContact O-CB 3.45Å; F147-D151 PolarHBondContact O-N 2.99Å; F147-I152 HydrophobicContact CD1-CG1 4.06Å; F147-I152 HydrophobicContact CE1-CD1 3.79Å; F147-I152 HydrophobicContact CE1-CG1 3.61Å; F147-I152 HydrophobicContact CE2-CD1 4.27Å; F147-I152 HydrophobicContact CE2-CG1 4.39Å; F147-I152 HydrophobicContact CZ-CD1 3.56Å; F147-I152 HydrophobicContact CZ-CG1 3.8Å; F147-I152 PolarHBondContact O-N 3.44Å; F147-I224 HydrophobicContact CE2-CG2 4.45Å; F147-I224 HydrophobicContact CZ-CG2 4.23Å; F147-H231 AromaticContact CD1-CE1 3.6Å; F147-H231 AromaticContact CD1-NE2 3.96Å; F147-H231 AromaticContact CE1-CE1 3.92Å; F147-H231 AromaticContact CG-CE1 3.71Å; F147-H231 AromaticContact CG-NE2 3.64Å
148L97.1Very high95.9Very high24 Ų2457.2 Ų57.213%0.12628%0.279CS..Iπ-helixtrans-70.2-45.1179.2-66.2174.7000113E50 T53 K54 L57 L144 K145 R146 I152 K153E50-L148 HydrophobicContact CG-CD2 4.37Å; T53-L148 HydrophobicContact CG2-CD1 4.18Å; T53-L148 HydrophobicContact CG2-CD2 4.08Å; T53-L148 HydrophobicContact CG2-CG 4.02Å; K54-L148 HydrophobicContact CG-CD1 3.71Å; K54-L148 HydrophobicContact CG-CD2 3.79Å; K54-L148 HydrophobicContact CG-CG 4.4Å; L57-L148 HydrophobicContact CD2-CD1 3.7Å; L144-L148 WeakPolarHBondContact O-CG 3.19Å; L144-L148 PolarHBondContact O-N 3.33Å; L144-L148 VanDerWaalsContact O-N 3.1Å; K145-L148 PolarHBondContact O-N 3.48Å; R146-L148 VanDerWaalsContact C-N 3.31Å; R146-L148 PolarHBondContact O-N 3.41Å; L148-I152 HydrophobicContact CD2-CG1 4.18Å; L148-K153 PolarHBondContact O-N 2.96Å
149E95.2Very high96Very high104 Ų10458 Ų5849%0.48627%0.272SS..Iπ-helixtrans-79-23.9-175-68.1-169.5156.400113.4K79 K145 R146 K153K79-E149 IonicContact NZ-OE1 2.63Å; K79-E149 PolarHBondContact NZ-OE1 3.12Å; K79-E149 IonicContact NZ-OE2 2.91Å; K79-E149 PolarHBondContact NZ-OE2 3.41Å; K145-E149 WeakPolarHBondContact O-CB 3.23Å; K145-E149 WeakPolarHBondContact O-CG 3.29Å; K145-E149 PolarHBondContact O-N 3.48Å; R146-E149 PolarHBondContact O-N 3.38Å; E149-K153 VanDerWaalsContact O-CB 3.29Å; E149-K153 WeakPolarHBondContact O-CB 3.5Å; E149-K153 VanDerWaalsContact O-CD 3.23Å; E149-K153 WeakPolarHBondContact O-CD 3.37Å
150S95.1Very high96.1Very high48 Ų4861.5 Ų61.534%0.33629%0.287SS..Iπ-helixtrans-103.3-68.1179.2173.90000111.7R146 T154R146-S150 WeakPolarHBondContact O-CA 3.43Å; R146-S150 WeakPolarHBondContact O-CB 3.38Å; R146-S150 PolarHBondContact O-N 2.83Å; S150-T154 WeakPolarHBondContact O-CB 3.33Å; S150-T154 PolarHBondContact O-N 3.32Å; S150-T154 PolarHBondContact O-OG1 3.41Å
151D95.9Very high96.2Very high55 Ų5563.5 Ų63.529%0.29430%0.3SS..Iπ-helixtrans-76.9-51.5-161.3-54.5-17.9000109.9F147 K153 T154 I155F147-D151 HydrophobicContact CD2-CB 3.93Å; F147-D151 HydrophobicContact CE2-CB 4.23Å; F147-D151 WeakPolarHBondContact O-CB 3.45Å; F147-D151 PolarHBondContact O-N 2.99Å; D151-K153 VanDerWaalsContact C-N 3.32Å; D151-K153 PolarHBondContact O-N 3.28Å; D151-T154 PolarHBondContact O-N 3.15Å; D151-T154 VanDerWaalsContact O-N 3.15Å; D151-I155 WeakPolarHBondContact O-CG1 3.33Å; D151-I155 PolarHBondContact O-N 3.41Å
152I97.7Very high96.2Very high4 Ų463.3 Ų63.32%0.02130%0.299CS..Iπ-helixtrans-60.5-42174.8-66.4-55.3000111.3E50 F147 L148 T154 I155 H156E50-I152 HydrophobicContact CB-CD1 4.03Å; E50-I152 HydrophobicContact CB-CG1 4.26Å; E50-I152 HydrophobicContact CB-CG2 4.15Å; E50-I152 HydrophobicContact CG-CG2 3.76Å; F147-I152 HydrophobicContact CD1-CG1 4.06Å; F147-I152 HydrophobicContact CE1-CD1 3.79Å; F147-I152 HydrophobicContact CE1-CG1 3.61Å; F147-I152 HydrophobicContact CE2-CD1 4.27Å; F147-I152 HydrophobicContact CE2-CG1 4.39Å; F147-I152 HydrophobicContact CZ-CD1 3.56Å; F147-I152 HydrophobicContact CZ-CG1 3.8Å; F147-I152 PolarHBondContact O-N 3.44Å; L148-I152 HydrophobicContact CD2-CG1 4.18Å; I152-T154 VanDerWaalsContact C-N 3.29Å; I152-T154 PolarHBondContact O-N 3.16Å; I152-I155 HydrophobicContact CD1-CD1 4.19Å; I152-I155 PolarHBondContact O-N 3.19Å; I152-H156 PolarHBondContact O-N 3.04Å
153K97Very high96.2Very high148 Ų14862.9 Ų62.964%0.64330%0.296SS*.Hα-helixtrans-61-39.5176.9-169.7177.7-177.2177.30112L148 E149 D151 H156 K157L148-K153 PolarHBondContact O-N 2.96Å; E149-K153 VanDerWaalsContact O-CB 3.29Å; E149-K153 WeakPolarHBondContact O-CB 3.5Å; E149-K153 VanDerWaalsContact O-CD 3.23Å; E149-K153 WeakPolarHBondContact O-CD 3.37Å; D151-K153 VanDerWaalsContact C-N 3.32Å; D151-K153 PolarHBondContact O-N 3.28Å; K153-H156 PolarHBondContact O-N 3.44Å; K153-K157 PolarHBondContact O-N 3.24Å; K153-K157 VanDerWaalsContact O-N 3.11Å
154T97.2Very high96.1Very high57 Ų5763.9 Ų63.935%0.3530%0.3SS..Hα-helixtrans-68.5-44.5176.1-58.40000110.9S150 D151 I152 H156 K157 E158 L220S150-T154 WeakPolarHBondContact O-CB 3.33Å; S150-T154 PolarHBondContact O-N 3.32Å; S150-T154 PolarHBondContact O-OG1 3.41Å; D151-T154 PolarHBondContact O-N 3.15Å; D151-T154 VanDerWaalsContact O-N 3.15Å; I152-T154 VanDerWaalsContact C-N 3.29Å; I152-T154 PolarHBondContact O-N 3.16Å; T154-H156 VanDerWaalsContact C-N 3.3Å; T154-H156 PolarHBondContact O-N 2.9Å; T154-K157 WeakPolarHBondContact O-CB 3.23Å; T154-K157 PolarHBondContact O-N 3.45Å; T154-K157 VanDerWaalsContact O-N 3.1Å; T154-E158 HydrophobicContact CG2-CG 4.39Å; T154-E158 WeakPolarHBondContact O-CG 3.32Å; T154-E158 PolarHBondContact O-N 2.99Å; T154-L220 HydrophobicContact CG2-CD1 4Å; T154-L220 HydrophobicContact CG2-CD2 4.34Å
155I97.2Very high96Very high9 Ų966.2 Ų66.25%0.04631%0.309CS..Hα-helixtrans-55.4-45.3174-73.1160.5000110.9D151 I152 K157 E158 R159 L217 L220 L221 I224D151-I155 WeakPolarHBondContact O-CG1 3.33Å; D151-I155 PolarHBondContact O-N 3.41Å; I152-I155 HydrophobicContact CD1-CD1 4.19Å; I152-I155 PolarHBondContact O-N 3.19Å; I155-K157 PolarHBondContact O-N 3Å; I155-E158 PolarHBondContact O-N 2.88Å; I155-R159 VanDerWaalsContact O-CB 3.24Å; I155-R159 WeakPolarHBondContact O-CB 3.47Å; I155-R159 PolarHBondContact O-N 2.93Å; I155-L217 HydrophobicContact CG2-CD1 4.14Å; I155-L220 HydrophobicContact CG1-CB 3.93Å; I155-L221 HydrophobicContact CG2-CD2 3.88Å; I155-I224 HydrophobicContact CD1-CD1 3.76Å; I155-I224 HydrophobicContact CD1-CG1 3.93Å
156H97.6Very high95.9Very high81 Ų8165 Ų6538%0.37530%0.304SS..Hα-helixtrans-60.8-42.6175.8-78.5167.2000113.5E50 I152 K153 T154 K160E50-H156 VanDerWaalsContact CD-CE1 3.5Å; E50-H156 IonicContact OE1-CE1 3.59Å; E50-H156 PolarHBondContact OE1-CE1 3.31Å; E50-H156 IonicContact OE2-CE1 3.75Å; E50-H156 PolarHBondContact OE2-CE1 3.05Å; E50-H156 IonicContact OE2-NE2 2.68Å; E50-H156 PolarHBondContact OE2-NE2 3.39Å; E50-H156 VanDerWaalsContact OE2-NE2 3.1Å; I152-H156 PolarHBondContact O-N 3.04Å; K153-H156 PolarHBondContact O-N 3.44Å; T154-H156 VanDerWaalsContact C-N 3.3Å; T154-H156 PolarHBondContact O-N 2.9Å; H156-K160 PolarHBondContact O-N 2.88Å
157K97.9Very high95.7Very high136 Ų13656.8 Ų56.859%0.59127%0.273SS*.Hα-helixtrans-61.6-50.7176.3-177.5-174.9171.8-168.10110.7K153 T154 I155 R159 K160 V161K153-K157 PolarHBondContact O-N 3.24Å; K153-K157 VanDerWaalsContact O-N 3.11Å; T154-K157 WeakPolarHBondContact O-CB 3.23Å; T154-K157 PolarHBondContact O-N 3.45Å; T154-K157 VanDerWaalsContact O-N 3.1Å; I155-K157 PolarHBondContact O-N 3Å; K157-R159 PolarHBondContact O-N 3.4Å; K157-K160 WeakPolarHBondContact O-CB 3.39Å; K157-K160 PolarHBondContact O-N 3.2Å; K157-K160 VanDerWaalsContact O-N 3.17Å; K157-V161 WeakPolarHBondContact O-CG2 3.47Å; K157-V161 PolarHBondContact O-N 2.64Å
158E97.4Very high95.5Very high33 Ų3358 Ų5815%0.15428%0.28CS..Hα-helixtrans-68.9-33.2-177.7-62.3-47.3133.900112.4T154 I155 K160 V161 L162 Q213 I216 L217 L220T154-E158 HydrophobicContact CG2-CG 4.39Å; T154-E158 WeakPolarHBondContact O-CG 3.32Å; T154-E158 PolarHBondContact O-N 2.99Å; I155-E158 PolarHBondContact O-N 2.88Å; E158-K160 VanDerWaalsContact C-N 3.34Å; E158-K160 PolarHBondContact O-N 3.32Å; E158-V161 PolarHBondContact O-N 3.38Å; E158-L162 WeakPolarHBondContact O-CB 3.49Å; E158-L162 PolarHBondContact O-N 3.45Å; E158-Q213 PolarHBondContact OE2-NE2 2.76Å; E158-I216 HydrophobicContact CG-CG2 4.22Å; E158-L217 HydrophobicContact CB-CD1 4.19Å; E158-L220 HydrophobicContact CB-CD1 4.02Å; E158-L220 HydrophobicContact CG-CD1 3.58Å
159R95.8Very high95.2Very high103 Ų10356.8 Ų56.839%0.38927%0.274SS..Hα-helixtrans-62-40170.4-173.1179.2-178.2-177.84.7112.2I155 K157 L162 T163 L217I155-R159 VanDerWaalsContact O-CB 3.24Å; I155-R159 WeakPolarHBondContact O-CB 3.47Å; I155-R159 PolarHBondContact O-N 2.93Å; K157-R159 PolarHBondContact O-N 3.4Å; R159-L162 PolarHBondContact O-N 3.01Å; R159-T163 PolarHBondContact O-N 3.27Å; R159-T163 PolarHBondContact O-OG1 3.26Å; R159-L217 HydrophobicContact CB-CD2 3.96Å; R159-L217 HydrophobicContact CG-CD2 4.34Å
160K96.2Very high95.1Very high148 Ų14852.1 Ų52.164%0.64325%0.252SS*.Hα-helixtrans-65.8-41.8174.4-174.7176.3-179176.60111.5H156 K157 E158 T163 N164H156-K160 PolarHBondContact O-N 2.88Å; K157-K160 WeakPolarHBondContact O-CB 3.39Å; K157-K160 PolarHBondContact O-N 3.2Å; K157-K160 VanDerWaalsContact O-N 3.17Å; E158-K160 VanDerWaalsContact C-N 3.34Å; E158-K160 PolarHBondContact O-N 3.32Å; K160-T163 PolarHBondContact O-N 3.46Å; K160-N164 PolarHBondContact O-N 2.86Å; K160-N164 VanDerWaalsContact O-N 3.12Å; K160-N164 PolarHBondContact O-ND2 3.19Å
161V96.6Very high94.8Very high43 Ų4350.2 Ų50.226%0.26124%0.239SC..Hα-helixtrans-62.3-45.7174.8-179.90000110.3K157 E158 T163 N164 K165 Q213K157-V161 WeakPolarHBondContact O-CG2 3.47Å; K157-V161 PolarHBondContact O-N 2.64Å; E158-V161 PolarHBondContact O-N 3.38Å; V161-T163 VanDerWaalsContact C-N 3.3Å; V161-T163 PolarHBondContact O-N 3.15Å; V161-N164 WeakPolarHBondContact O-CB 3.43Å; V161-N164 PolarHBondContact O-N 3.37Å; V161-N164 VanDerWaalsContact O-N 3.11Å; V161-K165 HydrophobicContact CG1-CG 4.33Å; V161-K165 WeakPolarHBondContact O-CG 3.36Å; V161-K165 PolarHBondContact O-N 3.4Å; V161-Q213 HydrophobicContact CB-CG 4.44Å; V161-Q213 HydrophobicContact CG1-CG 4.04Å; V161-Q213 VanDerWaalsContact CG1-OE1 3.28Å
162L95.3Very high94.6Very high9 Ų948.3 Ų48.35%0.04723%0.23CC..Hα-helixtrans-57.6-43.6176.9-177.860.6000111.9L35 F39 E158 R159 N164 K165 R166 F210 Q213 C214 L217L35-L162 HydrophobicContact CD2-CD2 4.42Å; F39-L162 HydrophobicContact CE1-CD2 3.96Å; F39-L162 HydrophobicContact CZ-CD2 3.82Å; E158-L162 WeakPolarHBondContact O-CB 3.49Å; E158-L162 PolarHBondContact O-N 3.45Å; R159-L162 PolarHBondContact O-N 3.01Å; L162-N164 VanDerWaalsContact C-N 3.31Å; L162-N164 PolarHBondContact O-N 3.15Å; L162-K165 PolarHBondContact O-N 3.48Å; L162-K165 VanDerWaalsContact O-N 3.17Å; L162-R166 WeakPolarHBondContact O-CB 3.47Å; L162-R166 PolarHBondContact O-N 3.37Å; L162-F210 HydrophobicContact CD1-CD2 3.67Å; L162-F210 HydrophobicContact CD1-CE2 3.43Å; L162-F210 VanDerWaalsContact CD1-CE2 3.43Å; L162-F210 HydrophobicContact CD1-CZ 4.18Å; L162-F210 HydrophobicContact CG-CE2 4.17Å; L162-Q213 HydrophobicContact CB-CG 3.85Å; L162-Q213 HydrophobicContact CD1-CB 3.99Å; L162-Q213 HydrophobicContact CD1-CG 3.93Å; L162-C214 VanDerWaalsContact CD1-SG 3.53Å; L162-L217 HydrophobicContact CB-CD2 4.38Å; L162-L217 HydrophobicContact CD2-CD2 3.67Å
163T92.9Very high94.3Very high55 Ų5551.1 Ų51.134%0.33724%0.242SC..Hα-helixtrans-59.4-43.3177.1-58.10000111.2R159 K160 V161 R166 L167R159-T163 PolarHBondContact O-N 3.27Å; R159-T163 PolarHBondContact O-OG1 3.26Å; K160-T163 PolarHBondContact O-N 3.46Å; V161-T163 VanDerWaalsContact C-N 3.3Å; V161-T163 PolarHBondContact O-N 3.15Å; T163-R166 WeakPolarHBondContact O-CB 3.17Å; T163-R166 PolarHBondContact O-N 3.47Å; T163-L167 WeakPolarHBondContact O-CG 3.48Å; T163-L167 PolarHBondContact O-N 3.26Å; T163-L167 VanDerWaalsContact O-N 3.12Å
164N92.8Very high93.9Very high50 Ų5046.2 Ų46.227%0.26723%0.229SC..Hα-helixtrans-64.3-41.8175.9-69.4-26.3000112.3K160 V161 L162 R166 L167 D168K160-N164 PolarHBondContact O-N 2.86Å; K160-N164 VanDerWaalsContact O-N 3.12Å; K160-N164 PolarHBondContact O-ND2 3.19Å; V161-N164 WeakPolarHBondContact O-CB 3.43Å; V161-N164 PolarHBondContact O-N 3.37Å; V161-N164 VanDerWaalsContact O-N 3.11Å; L162-N164 VanDerWaalsContact C-N 3.31Å; L162-N164 PolarHBondContact O-N 3.15Å; N164-R166 VanDerWaalsContact C-N 3.34Å; N164-L167 PolarHBondContact O-N 2.92Å; N164-D168 VanDerWaalsContact O-CG 3.28Å; N164-D168 PolarHBondContact O-N 3.35Å
165K93.7Very high93.6Very high59 Ų5949.4 Ų49.426%0.25724%0.235SC..Hα-helixtrans-65.6-36.8177.4-65.5-58.8-177-179.70112.3V161 L162 D168 L169 F210 Q213V161-K165 HydrophobicContact CG1-CG 4.33Å; V161-K165 WeakPolarHBondContact O-CG 3.36Å; V161-K165 PolarHBondContact O-N 3.4Å; L162-K165 PolarHBondContact O-N 3.48Å; L162-K165 VanDerWaalsContact O-N 3.17Å; K165-D168 PolarHBondContact O-N 3.4Å; K165-L169 WeakPolarHBondContact O-CB 3.36Å; K165-L169 PolarHBondContact O-N 2.97Å; K165-F210 HydrophobicContact CB-CB 4.36Å; K165-F210 HydrophobicContact CB-CD2 4.13Å; K165-Q213 HydrophobicContact CG-CB 4.31Å; K165-Q213 HydrophobicContact CG-CG 4.41Å
166R94.2Very high93.3Very high14 Ų1450 Ų505%0.05324%0.238CC..Hα-helixtrans-60.2-48.1173.3-166.6-169.658.779.9-3.9111.3E25 L162 T163 N164 D168 L169 D170 F210E25-R166 IonicContact OE1-CZ 2.96Å; E25-R166 IonicContact OE1-NH1 3.22Å; E25-R166 PolarHBondContact OE1-NH1 3.15Å; E25-R166 IonicContact OE1-NH2 3.1Å; E25-R166 PolarHBondContact OE1-NH2 3.43Å; E25-R166 IonicContact OE2-CZ 3.69Å; E25-R166 VanDerWaalsContact OE2-CZ 3.32Å; E25-R166 IonicContact OE2-NH1 3.09Å; E25-R166 PolarHBondContact OE2-NH1 2.97Å; E25-R166 VanDerWaalsContact OE2-NH1 3.1Å; E25-R166 IonicContact OE2-NH2 3.29Å; E25-R166 PolarHBondContact OE2-NH2 3.3Å; L162-R166 WeakPolarHBondContact O-CB 3.47Å; L162-R166 PolarHBondContact O-N 3.37Å; T163-R166 WeakPolarHBondContact O-CB 3.17Å; T163-R166 PolarHBondContact O-N 3.47Å; N164-R166 VanDerWaalsContact C-N 3.34Å; R166-D168 VanDerWaalsContact C-N 3.33Å; R166-D168 PolarHBondContact O-N 2.88Å; R166-L169 WeakPolarHBondContact O-CB 3.48Å; R166-L169 PolarHBondContact O-N 3.46Å; R166-D170 IonicContact CZ-OD2 3.39Å; R166-D170 IonicContact NH1-OD2 2.74Å; R166-D170 PolarHBondContact NH1-OD2 2.98Å; R166-D170 WeakPolarHBondContact O-CB 3.33Å; R166-D170 VanDerWaalsContact O-CG 3.28Å; R166-D170 PolarHBondContact O-N 3.23Å; R166-F210 HydrophobicContact CB-CD2 4.06Å; R166-F210 HydrophobicContact CB-CE2 3.63Å; R166-F210 HydrophobicContact CG-CE2 3.92Å; R166-F210 HydrophobicContact CG-CZ 4.41Å
167L89.9Confident92.9Very high8 Ų853 Ų534%0.04225%0.246CC..Hα-helixtrans-62.5-40178.1-67.8170.4000111.9R18 Q21 F22 E25 T163 N164 D170 A171R18-L167 HydrophobicContact CB-CB 4.18Å; R18-L167 HydrophobicContact CB-CD1 4.07Å; R18-L167 HydrophobicContact CG-CB 3.98Å; Q21-L167 HydrophobicContact CB-CD2 4.1Å; Q21-L167 HydrophobicContact CG-CD2 3.93Å; F22-L167 HydrophobicContact CB-CD1 4.27Å; F22-L167 HydrophobicContact CB-CD2 3.99Å; F22-L167 HydrophobicContact CD2-CD1 4.49Å; F22-L167 HydrophobicContact CD2-CD2 4.47Å; E25-L167 WeakPolarHBondContact OE1-CD2 3.27Å; T163-L167 WeakPolarHBondContact O-CG 3.48Å; T163-L167 PolarHBondContact O-N 3.26Å; T163-L167 VanDerWaalsContact O-N 3.12Å; N164-L167 PolarHBondContact O-N 2.92Å; L167-D170 PolarHBondContact O-N 3.42Å; L167-A171 WeakPolarHBondContact O-CB 3.47Å; L167-A171 PolarHBondContact O-N 3.38Å
168D92.1Very high92.4Very high29 Ų2954 Ų5416%0.15525%0.25CC..Hα-helixtrans-62.5-43.4174.6-66.3-23.5000111.4R18 N164 K165 R166 A171 C172R18-D168 VanDerWaalsContact CG-OD1 3.24Å; R18-D168 WeakPolarHBondContact CG-OD1 3.13Å; R18-D168 IonicContact CZ-OD1 2.67Å; R18-D168 IonicContact CZ-OD2 2.67Å; R18-D168 IonicContact NE-OD1 2.77Å; R18-D168 PolarHBondContact NE-OD1 2.95Å; R18-D168 IonicContact NE-OD2 3.33Å; R18-D168 PolarHBondContact NE-OD2 2.93Å; R18-D168 IonicContact NH2-OD1 3.92Å; R18-D168 PolarHBondContact NH2-OD1 3.07Å; R18-D168 IonicContact NH2-OD2 3.1Å; R18-D168 PolarHBondContact NH2-OD2 3.06Å; N164-D168 VanDerWaalsContact O-CG 3.28Å; N164-D168 PolarHBondContact O-N 3.35Å; K165-D168 PolarHBondContact O-N 3.4Å; R166-D168 VanDerWaalsContact C-N 3.33Å; R166-D168 PolarHBondContact O-N 2.88Å; D168-A171 PolarHBondContact O-N 3.49Å; D168-C172 PolarHBondContact O-N 3.48Å; D168-C172 PolarHBondContact O-SG 3Å
169L92.5Very high91.9Very high0 Ų053.5 Ų53.50%025%0.252CS..Hα-helixtrans-61.8-48.4176.9174.459.3000111.5T33 K165 R166 A171 C172 K173 L203 A206 Q207 F210T33-L169 HydrophobicContact CG2-CD2 4.35Å; K165-L169 WeakPolarHBondContact O-CB 3.36Å; K165-L169 PolarHBondContact O-N 2.97Å; R166-L169 WeakPolarHBondContact O-CB 3.48Å; R166-L169 PolarHBondContact O-N 3.46Å; L169-A171 VanDerWaalsContact C-N 3.33Å; L169-A171 PolarHBondContact O-N 2.98Å; L169-C172 PolarHBondContact O-N 3.5Å; L169-C172 VanDerWaalsContact O-N 3.14Å; L169-K173 HydrophobicContact CD1-CG 4.5Å; L169-K173 HydrophobicContact CG-CD 4.5Å; L169-K173 WeakPolarHBondContact O-CG 3.42Å; L169-K173 PolarHBondContact O-N 3.35Å; L169-L203 HydrophobicContact CD1-CD1 3.6Å; L169-A206 HydrophobicContact CB-CB 4.44Å; L169-A206 HydrophobicContact CD1-CB 4.16Å; L169-Q207 HydrophobicContact CD1-CB 3.99Å; L169-F210 HydrophobicContact CD2-CB 4.03Å; L169-F210 HydrophobicContact CD2-CD1 3.76Å; L169-F210 HydrophobicContact CD2-CE1 4.35Å; L169-F210 HydrophobicContact CD2-CG 3.84Å
170D91.5Very high91.5Very high6 Ų653 Ų533%0.03225%0.252CS..Hα-helixtrans-64.1-39.7-179.3-67.4-23.9000111.1Q21 T33 R166 L167 C172 K173 A174Q21-D170 HydrophobicContact CG-CB 3.9Å; T33-D170 WeakPolarHBondContact CB-OD1 3.45Å; T33-D170 PolarHBondContact N-OD2 2.78Å; T33-D170 PolarHBondContact OG1-OD1 3.03Å; R166-D170 IonicContact CZ-OD2 3.39Å; R166-D170 IonicContact NH1-OD2 2.74Å; R166-D170 PolarHBondContact NH1-OD2 2.98Å; R166-D170 WeakPolarHBondContact O-CB 3.33Å; R166-D170 VanDerWaalsContact O-CG 3.28Å; R166-D170 PolarHBondContact O-N 3.23Å; L167-D170 PolarHBondContact O-N 3.42Å; D170-C172 PolarHBondContact O-N 3.5Å; D170-K173 WeakPolarHBondContact O-CB 3.4Å; D170-K173 PolarHBondContact O-N 3.26Å; D170-K173 IonicContact OD1-NZ 2.86Å; D170-A174 PolarHBondContact O-N 3.42Å
171A90.2Very high91Very high7 Ų749.1 Ų49.16%0.05824%0.244CC..Hα-helixtrans-63.4-38.9172.700000112.6T17 L167 D168 L169 A174 R175T17-A171 HydrophobicContact CG2-CB 3.55Å; L167-A171 WeakPolarHBondContact O-CB 3.47Å; L167-A171 PolarHBondContact O-N 3.38Å; D168-A171 PolarHBondContact O-N 3.49Å; L169-A171 VanDerWaalsContact C-N 3.33Å; L169-A171 PolarHBondContact O-N 2.98Å; A171-A174 PolarHBondContact O-N 2.74Å; A171-R175 WeakPolarHBondContact O-CG 3.35Å; A171-R175 PolarHBondContact O-N 2.83Å
172C91.9Very high90.3Very high16 Ų1650.1 Ų50.111%0.10825%0.253CS..Hα-helixtrans-66.7-39.1175.1-67.30000111.8D168 L169 D170 A174 R175 L176 L203 A206D168-C172 PolarHBondContact O-N 3.48Å; D168-C172 PolarHBondContact O-SG 3Å; L169-C172 PolarHBondContact O-N 3.5Å; L169-C172 VanDerWaalsContact O-N 3.14Å; D170-C172 PolarHBondContact O-N 3.5Å; C172-A174 PolarHBondContact O-N 3.11Å; C172-R175 PolarHBondContact O-N 3.08Å; C172-L176 WeakPolarHBondContact O-CB 3.44Å; C172-L176 PolarHBondContact O-N 3.43Å; C172-L203 HydrophobicContact CB-CB 4.32Å; C172-L203 HydrophobicContact CB-CD1 3.95Å; C172-A206 HydrophobicContact CB-CB 4.21Å
173K90.9Very high89.6Confident63 Ų6353.1 Ų53.127%0.27427%0.266SS..Hα-helixtrans-59.8-45.8173.2-70.8174.7179.5173.90110.9T33 L169 D170 L176 R177 L203T33-K173 PolarHBondContact OG1-NZ 3.11Å; L169-K173 HydrophobicContact CD1-CG 4.5Å; L169-K173 HydrophobicContact CG-CD 4.5Å; L169-K173 WeakPolarHBondContact O-CG 3.42Å; L169-K173 PolarHBondContact O-N 3.35Å; D170-K173 WeakPolarHBondContact O-CB 3.4Å; D170-K173 PolarHBondContact O-N 3.26Å; D170-K173 IonicContact OD1-NZ 2.86Å; K173-L176 PolarHBondContact O-N 3.19Å; K173-R177 WeakPolarHBondContact O-CG 3.5Å; K173-R177 PolarHBondContact O-N 3.36Å; K173-L203 HydrophobicContact CB-CD1 4.43Å; K173-L203 HydrophobicContact CG-CD1 3.55Å
174A89.3Confident88.9Confident44 Ų4454.8 Ų54.836%0.36429%0.286SS..Hα-helixtrans-62.6-44.1177.600000112.3D170 A171 C172 L176 R177 K178D170-A174 PolarHBondContact O-N 3.42Å; A171-A174 PolarHBondContact O-N 2.74Å; C172-A174 PolarHBondContact O-N 3.11Å; A174-L176 PolarHBondContact O-N 3.42Å; A174-R177 PolarHBondContact O-N 2.84Å; A174-K178 PolarHBondContact O-N 3.35Å
175R89.2Confident88.2Confident125 Ų12560.6 Ų60.647%0.47231%0.311SS..Hα-helixtrans-61.2-42.8175.5-73.5175.6-168.2166.72.9112.1T17 A171 C172 K178 A179T17-R175 VanDerWaalsContact CG2-NH2 3.34Å; T17-R175 PolarHBondContact OG1-NH2 3.23Å; A171-R175 WeakPolarHBondContact O-CG 3.35Å; A171-R175 PolarHBondContact O-N 2.83Å; C172-R175 PolarHBondContact O-N 3.08Å; R175-K178 PolarHBondContact O-N 2.96Å; R175-A179 WeakPolarHBondContact O-CB 3.24Å; R175-A179 PolarHBondContact O-N 3.22Å
176L90.7Very high86.9Confident21 Ų2160.1 Ų60.111%0.1132%0.319CS..Hα-helixtrans-64.4-45.2177.4-179.160.6000111.8C172 K173 A174 K178 A179 K180 V196 A199 E200 L203C172-L176 WeakPolarHBondContact O-CB 3.44Å; C172-L176 PolarHBondContact O-N 3.43Å; K173-L176 PolarHBondContact O-N 3.19Å; A174-L176 PolarHBondContact O-N 3.42Å; L176-K178 VanDerWaalsContact C-N 3.3Å; L176-K178 PolarHBondContact O-N 2.89Å; L176-A179 PolarHBondContact O-N 2.6Å; L176-K180 HydrophobicContact CD1-CD 4.33Å; L176-K180 HydrophobicContact CD1-CG 4.25Å; L176-K180 HydrophobicContact CG-CD 4.37Å; L176-K180 WeakPolarHBondContact O-CG 3.37Å; L176-K180 PolarHBondContact O-N 3.2Å; L176-V196 HydrophobicContact CD1-CG1 4.2Å; L176-A199 HydrophobicContact CB-CB 4.36Å; L176-A199 HydrophobicContact CD1-CB 3.83Å; L176-E200 HydrophobicContact CD1-CB 4.46Å; L176-E200 HydrophobicContact CD1-CG 3.43Å; L176-E200 VanDerWaalsContact CD1-CG 3.43Å; L176-E200 HydrophobicContact CD2-CG 3.98Å; L176-E200 HydrophobicContact CG-CG 4.37Å; L176-L203 HydrophobicContact CD2-CD2 3.4Å; L176-L203 VanDerWaalsContact CD2-CD2 3.4Å
177R89.4Confident85.2Confident144 Ų14465.2 Ų65.254%0.54336%0.357SS..Hα-helixtrans-55.3-47.3174.7-74.8176.6-179.7174.6-1.2110.6E31 K173 A174 K180 S181E31-R177 IonicContact OE2-CZ 2.6Å; E31-R177 IonicContact OE2-NH1 3.3Å; E31-R177 PolarHBondContact OE2-NH1 3.45Å; E31-R177 IonicContact OE2-NH2 3.44Å; E31-R177 PolarHBondContact OE2-NH2 3.1Å; K173-R177 WeakPolarHBondContact O-CG 3.5Å; K173-R177 PolarHBondContact O-N 3.36Å; A174-R177 PolarHBondContact O-N 2.84Å; R177-K180 PolarHBondContact O-N 3.47Å; R177-S181 PolarHBondContact O-N 3.37Å; R177-S181 PolarHBondContact O-OG 2.92Å; R177-S181 VanDerWaalsContact O-OG 3.11Å
178K88Confident83.7Confident157 Ų15769.6 Ų69.668%0.68339%0.394SS*.Hα-helixtrans-63.3-45.3178-171.3176.4-179.2178.30112.6A174 R175 L176 K180 S181 S182A174-K178 PolarHBondContact O-N 3.35Å; R175-K178 PolarHBondContact O-N 2.96Å; L176-K178 VanDerWaalsContact C-N 3.3Å; L176-K178 PolarHBondContact O-N 2.89Å; K178-K180 PolarHBondContact O-N 2.79Å; K178-S181 PolarHBondContact O-N 3.1Å; K178-S182 PolarHBondContact O-N 3.09Å; K178-S182 PolarHBondContact O-OG 3.04Å
179A87.1Confident82.1Confident23 Ų2371.2 Ų71.219%0.1941%0.407CS..Hα-helixtrans-60.8-43.6179.200000111.8R175 L176 S182 Q183 V196 A199R175-A179 WeakPolarHBondContact O-CB 3.24Å; R175-A179 PolarHBondContact O-N 3.22Å; L176-A179 PolarHBondContact O-N 2.6Å; A179-S182 PolarHBondContact O-N 3.03Å; A179-Q183 PolarHBondContact O-N 3.23Å; A179-V196 HydrophobicContact CB-CG2 4.02Å; A179-A199 HydrophobicContact CB-CB 4.35Å
180K86.8Confident80.5Confident91 Ų9180 Ų8040%0.39645%0.446SS..Hα-helixtrans-63.8-42.4175.9-72.9-173172-179.30112.4L176 R177 K178 S182 Q183 A184 V196 E200L176-K180 HydrophobicContact CD1-CD 4.33Å; L176-K180 HydrophobicContact CD1-CG 4.25Å; L176-K180 HydrophobicContact CG-CD 4.37Å; L176-K180 WeakPolarHBondContact O-CG 3.37Å; L176-K180 PolarHBondContact O-N 3.2Å; R177-K180 PolarHBondContact O-N 3.47Å; K178-K180 PolarHBondContact O-N 2.79Å; K180-S182 PolarHBondContact O-N 2.99Å; K180-Q183 PolarHBondContact O-N 3.05Å; K180-A184 PolarHBondContact O-N 3.21Å; K180-V196 HydrophobicContact CG-CG1 3.98Å; K180-V196 HydrophobicContact CG-CG2 4.43Å; K180-E200 WeakPolarHBondContact CE-OE1 3.44Å; K180-E200 IonicContact NZ-OE1 3.05Å; K180-E200 PolarHBondContact NZ-OE1 3.11Å
181S85.6Confident79.1Confident68 Ų6883.5 Ų83.548%0.47647%0.469SS..Hα-helixtrans-62.8-41.1175.8-62.10000112.6R177 K178 A184 Q185R177-S181 PolarHBondContact O-N 3.37Å; R177-S181 PolarHBondContact O-OG 2.92Å; R177-S181 VanDerWaalsContact O-OG 3.11Å; K178-S181 PolarHBondContact O-N 3.1Å; S181-A184 PolarHBondContact O-N 2.77Å; S181-Q185 WeakPolarHBondContact O-CG 3.44Å; S181-Q185 PolarHBondContact O-N 3.46Å
182S82.5Confident77.9Confident64 Ų6484.1 Ų84.145%0.44848%0.475SS..Hα-helixtrans-67.6-37.3176.1-64.10000112.6K178 A179 K180 A184 Q185 A186K178-S182 PolarHBondContact O-N 3.09Å; K178-S182 PolarHBondContact O-OG 3.04Å; A179-S182 PolarHBondContact O-N 3.03Å; K180-S182 PolarHBondContact O-N 2.99Å; S182-A184 VanDerWaalsContact C-N 3.34Å; S182-Q185 PolarHBondContact O-N 2.96Å; S182-A186 PolarHBondContact O-N 2.82Å; S182-A186 VanDerWaalsContact O-N 3.1Å
183Q80.6Confident77.1Confident71 Ų7185.6 Ų85.633%0.33249%0.486SS..Hα-helixtrans-65.2-36.8174.1-170.5-173.335.900112A179 K180 Q185 V196A179-Q183 PolarHBondContact O-N 3.23Å; K180-Q183 PolarHBondContact O-N 3.05Å; Q183-Q185 VanDerWaalsContact C-N 3.29Å; Q183-Q185 PolarHBondContact O-N 2.98Å; Q183-V196 HydrophobicContact CB-CG2 4.09Å
184A78.3Confident76.6Confident91 Ų9189.2 Ų89.275%0.75250%0.504SS*.Hα-helixtrans-67.7-28.717700000113K180 S181 S182K180-A184 PolarHBondContact O-N 3.21Å; S181-A184 PolarHBondContact O-N 2.77Å; S182-A184 VanDerWaalsContact C-N 3.34Å
185Q77.1Confident76.3Confident171 Ų17193.4 Ų93.480%0.79952%0.516SS*.Hα-helixtrans-86.4-27.5179.8-70.1178.1-0.800113.5S181 S182 Q183S181-Q185 WeakPolarHBondContact O-CG 3.44Å; S181-Q185 PolarHBondContact O-N 3.46Å; S182-Q185 PolarHBondContact O-N 2.96Å; Q183-Q185 VanDerWaalsContact C-N 3.29Å; Q183-Q185 PolarHBondContact O-N 2.98Å
186A67.1Low76.3Confident49 Ų4987.9 Ų87.941%0.40550%0.496SS..SBendtrans-94.3116.6174.700000109.3S182 A188S182-A186 PolarHBondContact O-N 2.82Å; S182-A186 VanDerWaalsContact O-N 3.1Å; A186-A188 PolarHBondContact O-N 2.98Å
187S57.6Low76.2Confident122 Ų12292.2 Ų92.285%0.85352%0.516SS*.  trans-50.795178.623.40000112.3S189S187-S189 PolarHBondContact O-N 3.41Å
188A59.4Low76.3Confident100 Ų10091.9 Ų91.983%0.82652%0.518SS*.SBendtrans25.146.217000000117.3A186A186-A188 PolarHBondContact O-N 2.98Å
189S57.9Low76.4Confident62 Ų6285 Ų8543%0.43449%0.491SS..  trans-81.2135.4175.761.60000110.2S187 P191 G192S187-S189 PolarHBondContact O-N 3.41Å; S189-P191 VanDerWaalsContact C-N 3.32Å; S189-P191 WeakPolarHBondContact O-CD 3.49Å; S189-P191 VanDerWaalsContact O-N 3.15Å; S189-G192 PolarHBondContact O-N 3.27Å
190K60.3Low76.7Confident185 Ų18586.9 Ų86.980%0.80450%0.495SS*.Hα-helixtrans-46.1-39.8-178.3-79.3-175.9174.3-177.50115.5G192 S193K190-G192 PolarHBondContact O-N 3.07Å; K190-S193 WeakPolarHBondContact O-CB 3.41Å; K190-S193 PolarHBondContact O-N 3.16Å; K190-S193 VanDerWaalsContact O-N 3.1Å
191P61.5Low77Confident80 Ų8084.3 Ų84.352%0.51949%0.491SS..Hα-helixtrans-61.9-28.7179-2132.1000113.8S189 S193 H195S189-P191 VanDerWaalsContact C-N 3.32Å; S189-P191 WeakPolarHBondContact O-CD 3.49Å; S189-P191 VanDerWaalsContact O-N 3.15Å; P191-S193 VanDerWaalsContact C-N 3.32Å; P191-H195 PolarHBondContact O-CD2 3.08Å; P191-H195 PolarHBondContact O-N 3.47Å
192G65.3Low77.4Confident19 Ų1983.8 Ų83.820%0.19648%0.483CS..Hα-helixtrans-68.5-31.1176.500000113.1S189 K190 V196S189-G192 PolarHBondContact O-N 3.27Å; K190-G192 PolarHBondContact O-N 3.07Å; G192-V196 WeakPolarHBondContact O-CG2 3.42Å; G192-V196 PolarHBondContact O-N 3.35Å
193S74Confident77.9Confident47 Ų4782.4 Ų82.433%0.32947%0.47SS..Hα-helixtrans-68-45.5178.6-161.20000111.7K190 P191 H195 V196 E197K190-S193 WeakPolarHBondContact O-CB 3.41Å; K190-S193 PolarHBondContact O-N 3.16Å; K190-S193 VanDerWaalsContact O-N 3.1Å; P191-S193 VanDerWaalsContact C-N 3.32Å; S193-H195 VanDerWaalsContact C-N 3.29Å; S193-H195 PolarHBondContact O-N 3Å; S193-V196 PolarHBondContact O-N 3.17Å; S193-E197 WeakPolarHBondContact O-CG 3.32Å; S193-E197 PolarHBondContact O-N 3.07Å
194E80.9Confident78.6Confident139 Ų13986.9 Ų86.965%0.6548%0.484SS*.Hα-helixtrans-61.8-37.7179.3-66.1180176.200112.1K198E194-K198 WeakPolarHBondContact O-CB 3.42Å; E194-K198 PolarHBondContact O-N 3.27Å
195H83.6Confident79.4Confident132 Ų13288 Ų8861%0.61148%0.475SS*.Hα-helixtrans-66.1-39176.1-80.9-58.5000113P191 S193 A199P191-H195 PolarHBondContact O-CD2 3.08Å; P191-H195 PolarHBondContact O-N 3.47Å; S193-H195 VanDerWaalsContact C-N 3.29Å; S193-H195 PolarHBondContact O-N 3Å; H195-A199 WeakPolarHBondContact O-CB 3.47Å; H195-A199 PolarHBondContact O-N 3.42Å; H195-A199 VanDerWaalsContact O-N 3.11Å
196V88.2Confident80.2Confident9 Ų980.4 Ų80.46%0.05544%0.441CS..Hα-helixtrans-69.3-46.3175.7175.40000110.4L176 A179 K180 Q183 G192 S193 K198 A199 E200L176-V196 HydrophobicContact CD1-CG1 4.2Å; A179-V196 HydrophobicContact CB-CG2 4.02Å; K180-V196 HydrophobicContact CG-CG1 3.98Å; K180-V196 HydrophobicContact CG-CG2 4.43Å; Q183-V196 HydrophobicContact CB-CG2 4.09Å; G192-V196 WeakPolarHBondContact O-CG2 3.42Å; G192-V196 PolarHBondContact O-N 3.35Å; S193-V196 PolarHBondContact O-N 3.17Å; V196-K198 VanDerWaalsContact C-N 3.29Å; V196-K198 PolarHBondContact O-N 3.26Å; V196-A199 PolarHBondContact O-N 2.94Å; V196-A199 VanDerWaalsContact O-N 3.1Å; V196-E200 HydrophobicContact CG1-CG 4.3Å; V196-E200 WeakPolarHBondContact O-CG 3.48Å; V196-E200 PolarHBondContact O-N 2.85Å
197E89.5Confident81.5Confident113 Ų11380.8 Ų80.853%0.52844%0.435SS..Hα-helixtrans-57.3-42.4177.5-75.8176.8-160.500112.1S193 E200 A201S193-E197 WeakPolarHBondContact O-CG 3.32Å; S193-E197 PolarHBondContact O-N 3.07Å; E197-E200 PolarHBondContact O-N 2.93Å; E197-A201 PolarHBondContact O-N 3.36Å
198K90.1Very high83.3Confident137 Ų13777.8 Ų77.860%0.59642%0.417SS*.Hα-helixtrans-62.9-45.6174.8-175.7174-179.3175.10112.1E194 V196 E200 A201 D202E194-K198 WeakPolarHBondContact O-CB 3.42Å; E194-K198 PolarHBondContact O-N 3.27Å; V196-K198 VanDerWaalsContact C-N 3.29Å; V196-K198 PolarHBondContact O-N 3.26Å; K198-E200 VanDerWaalsContact C-N 3.28Å; K198-E200 PolarHBondContact O-N 2.82Å; K198-A201 PolarHBondContact O-N 3.26Å; K198-D202 PolarHBondContact O-N 2.87Å
199A91Very high85.1Confident13 Ų1375.9 Ų75.911%0.10740%0.395CS..Hα-helixtrans-64-34.2177.500000112.3L176 A179 H195 V196 L203L176-A199 HydrophobicContact CB-CB 4.36Å; L176-A199 HydrophobicContact CD1-CB 3.83Å; A179-A199 HydrophobicContact CB-CB 4.35Å; H195-A199 WeakPolarHBondContact O-CB 3.47Å; H195-A199 PolarHBondContact O-N 3.42Å; H195-A199 VanDerWaalsContact O-N 3.11Å; V196-A199 PolarHBondContact O-N 2.94Å; V196-A199 VanDerWaalsContact O-N 3.1Å; A199-L203 WeakPolarHBondContact O-CB 3.43Å; A199-L203 PolarHBondContact O-N 2.96Å
200E93Very high86.9Confident62 Ų6273.3 Ų73.329%0.2938%0.376SS..Hα-helixtrans-69.7-38174.1-70.8-172.416200112.5L176 K180 V196 E197 K198 R204L176-E200 HydrophobicContact CD1-CB 4.46Å; L176-E200 HydrophobicContact CD1-CG 3.43Å; L176-E200 VanDerWaalsContact CD1-CG 3.43Å; L176-E200 HydrophobicContact CD2-CG 3.98Å; L176-E200 HydrophobicContact CG-CG 4.37Å; K180-E200 WeakPolarHBondContact CE-OE1 3.44Å; K180-E200 IonicContact NZ-OE1 3.05Å; K180-E200 PolarHBondContact NZ-OE1 3.11Å; V196-E200 HydrophobicContact CG1-CG 4.3Å; V196-E200 WeakPolarHBondContact O-CG 3.48Å; V196-E200 PolarHBondContact O-N 2.85Å; E197-E200 PolarHBondContact O-N 2.93Å; K198-E200 VanDerWaalsContact C-N 3.28Å; K198-E200 PolarHBondContact O-N 2.82Å; E200-R204 WeakPolarHBondContact O-CG 3.48Å; E200-R204 PolarHBondContact O-N 2.77Å; E200-R204 PolarHBondContact O-NE 3.46Å
201A93.9Very high88.6Confident37 Ų3768.2 Ų68.231%0.30636%0.358SS..Hα-helixtrans-65.7-45.8173.800000111.4E197 K198 L203 R204 M205E197-A201 PolarHBondContact O-N 3.36Å; K198-A201 PolarHBondContact O-N 3.26Å; A201-L203 VanDerWaalsContact C-N 3.34Å; A201-L203 PolarHBondContact O-N 3.47Å; A201-R204 PolarHBondContact O-N 3.05Å; A201-M205 WeakPolarHBondContact O-CG 3.47Å; A201-M205 PolarHBondContact O-N 3.34Å
202D92.9Very high90.3Very high56 Ų5671.4 Ų71.430%0.29936%0.364SS..Hα-helixtrans-60.7-42.9176.3-73.1-15000111.4K198 M205 A206K198-D202 PolarHBondContact O-N 2.87Å; D202-M205 PolarHBondContact O-N 3.41Å; D202-M205 WeakPolarHBondContact OD1-CE 3.45Å; D202-A206 WeakPolarHBondContact O-CB 3.39Å; D202-A206 PolarHBondContact O-N 3.46Å
203L93.8Very high91.8Very high35 Ų3571.4 Ų71.418%0.18336%0.359CS..Hα-helixtrans-61.6-44.3175.4178.362.1000112.1L169 C172 K173 L176 A199 A201 M205 A206 Q207L169-L203 HydrophobicContact CD1-CD1 3.6Å; C172-L203 HydrophobicContact CB-CB 4.32Å; C172-L203 HydrophobicContact CB-CD1 3.95Å; K173-L203 HydrophobicContact CB-CD1 4.43Å; K173-L203 HydrophobicContact CG-CD1 3.55Å; L176-L203 HydrophobicContact CD2-CD2 3.4Å; L176-L203 VanDerWaalsContact CD2-CD2 3.4Å; A199-L203 WeakPolarHBondContact O-CB 3.43Å; A199-L203 PolarHBondContact O-N 2.96Å; A201-L203 VanDerWaalsContact C-N 3.34Å; A201-L203 PolarHBondContact O-N 3.47Å; L203-M205 VanDerWaalsContact C-N 3.34Å; L203-M205 PolarHBondContact O-N 2.88Å; L203-A206 PolarHBondContact O-N 3.02Å; L203-Q207 WeakPolarHBondContact O-CB 3.42Å; L203-Q207 PolarHBondContact O-N 3.44Å
204R95Very high92.8Very high166 Ų16670.2 Ų70.263%0.62635%0.35SS*.Hα-helixtrans-60.3-43176.9-83.3-178.4-86.3150.5-11.1111.8E200 A201 A208E200-R204 WeakPolarHBondContact O-CG 3.48Å; E200-R204 PolarHBondContact O-N 2.77Å; E200-R204 PolarHBondContact O-NE 3.46Å; A201-R204 PolarHBondContact O-N 3.05Å; R204-A208 WeakPolarHBondContact O-CB 3.41Å; R204-A208 PolarHBondContact O-N 3Å
205M95.6Very high93.5Very high115 Ų11568.2 Ų68.257%0.56734%0.341SS*.Hα-helixtrans-64.5-45.1175.5-69.2-170.2-64.500111.8A201 D202 L203 Q207 A208 T209A201-M205 WeakPolarHBondContact O-CG 3.47Å; A201-M205 PolarHBondContact O-N 3.34Å; D202-M205 PolarHBondContact O-N 3.41Å; D202-M205 WeakPolarHBondContact OD1-CE 3.45Å; L203-M205 VanDerWaalsContact C-N 3.34Å; L203-M205 PolarHBondContact O-N 2.88Å; M205-Q207 PolarHBondContact O-N 2.9Å; M205-A208 PolarHBondContact O-N 3.28Å; M205-T209 WeakPolarHBondContact O-CG2 3.47Å; M205-T209 PolarHBondContact O-N 3.37Å; M205-T209 PolarHBondContact O-OG1 3.49Å
206A93.7Very high94.2Very high10 Ų1065 Ų658%0.08333%0.327CS..Hα-helixtrans-60.1-46.2178.900000111.3L169 C172 D202 L203 T209 F210L169-A206 HydrophobicContact CB-CB 4.44Å; L169-A206 HydrophobicContact CD1-CB 4.16Å; C172-A206 HydrophobicContact CB-CB 4.21Å; D202-A206 WeakPolarHBondContact O-CB 3.39Å; D202-A206 PolarHBondContact O-N 3.46Å; L203-A206 PolarHBondContact O-N 3.02Å; A206-T209 PolarHBondContact O-N 3.3Å; A206-T209 PolarHBondContact O-OG1 3.44Å; A206-F210 WeakPolarHBondContact O-CB 3.43Å; A206-F210 PolarHBondContact O-N 3.06Å
207Q94.7Very high94.6Very high58 Ų5864.6 Ų64.627%0.27133%0.325SS..Hα-helixtrans-58.9-50.2177.2-172.866.461.500111.1L169 L203 M205 T209 F210 D211L169-Q207 HydrophobicContact CD1-CB 3.99Å; L203-Q207 WeakPolarHBondContact O-CB 3.42Å; L203-Q207 PolarHBondContact O-N 3.44Å; M205-Q207 PolarHBondContact O-N 2.9Å; Q207-T209 VanDerWaalsContact C-N 3.29Å; Q207-T209 PolarHBondContact O-N 2.72Å; Q207-F210 WeakPolarHBondContact O-CB 3.42Å; Q207-F210 PolarHBondContact O-N 2.9Å; Q207-F210 VanDerWaalsContact O-N 3.07Å; Q207-D211 PolarHBondContact NE2-OD1 3.17Å; Q207-D211 PolarHBondContact NE2-OD2 3.34Å; Q207-D211 VanDerWaalsContact O-CG 3.23Å; Q207-D211 PolarHBondContact O-N 3.4Å
208A96.3Very high94.9Very high58 Ų5861.7 Ų61.748%0.47931%0.31SS..Hα-helixtrans-59.4-38.5178.800000112.8R204 M205 K212R204-A208 WeakPolarHBondContact O-CB 3.41Å; R204-A208 PolarHBondContact O-N 3Å; M205-A208 PolarHBondContact O-N 3.28Å; A208-K212 WeakPolarHBondContact O-CB 3.45Å; A208-K212 PolarHBondContact O-N 3.02Å; A208-K212 VanDerWaalsContact O-N 3.08Å
209T96.6Very high95.2Very high60 Ų6059.9 Ų59.937%0.36831%0.306SS..Hα-helixtrans-73-30.7176.6640000113.4M205 A206 Q207 Q213M205-T209 WeakPolarHBondContact O-CG2 3.47Å; M205-T209 PolarHBondContact O-N 3.37Å; M205-T209 PolarHBondContact O-OG1 3.49Å; A206-T209 PolarHBondContact O-N 3.3Å; A206-T209 PolarHBondContact O-OG1 3.44Å; Q207-T209 VanDerWaalsContact C-N 3.29Å; Q207-T209 PolarHBondContact O-N 2.72Å; T209-Q213 WeakPolarHBondContact O-CB 3.48Å; T209-Q213 PolarHBondContact O-N 3.12Å
210F95.6Very high95.4Very high8 Ų862 Ų624%0.03532%0.315CS..Hα-helixtrans-69.3-50.1173.5175-100.5000110.6T33 L35 L162 K165 R166 L169 A206 Q207 K212 Q213 C214T33-F210 HydrophobicContact CG2-CE1 3.88Å; T33-F210 HydrophobicContact CG2-CZ 3.92Å; L35-F210 HydrophobicContact CD2-CZ 3.93Å; L162-F210 HydrophobicContact CD1-CD2 3.67Å; L162-F210 HydrophobicContact CD1-CE2 3.43Å; L162-F210 VanDerWaalsContact CD1-CE2 3.43Å; L162-F210 HydrophobicContact CD1-CZ 4.18Å; L162-F210 HydrophobicContact CG-CE2 4.17Å; K165-F210 HydrophobicContact CB-CB 4.36Å; K165-F210 HydrophobicContact CB-CD2 4.13Å; R166-F210 HydrophobicContact CB-CD2 4.06Å; R166-F210 HydrophobicContact CB-CE2 3.63Å; R166-F210 HydrophobicContact CG-CE2 3.92Å; R166-F210 HydrophobicContact CG-CZ 4.41Å; L169-F210 HydrophobicContact CD2-CB 4.03Å; L169-F210 HydrophobicContact CD2-CD1 3.76Å; L169-F210 HydrophobicContact CD2-CE1 4.35Å; L169-F210 HydrophobicContact CD2-CG 3.84Å; A206-F210 WeakPolarHBondContact O-CB 3.43Å; A206-F210 PolarHBondContact O-N 3.06Å; Q207-F210 WeakPolarHBondContact O-CB 3.42Å; Q207-F210 PolarHBondContact O-N 2.9Å; Q207-F210 VanDerWaalsContact O-N 3.07Å; F210-K212 VanDerWaalsContact C-N 3.31Å; F210-K212 PolarHBondContact O-N 3.39Å; F210-Q213 CarbonylContact O-C 3.55Å; F210-Q213 WeakPolarHBondContact O-CA 3.41Å; F210-Q213 WeakPolarHBondContact O-CB 3.41Å; F210-Q213 PolarHBondContact O-N 3.36Å; F210-C214 VanDerWaalsContact CE1-SG 3.51Å; F210-C214 VanDerWaalsContact CZ-SG 3.54Å; F210-C214 PolarHBondContact O-N 3.36Å
211D95Very high95.6Very high78 Ų7859.2 Ų59.242%0.41730%0.302SS..Hα-helixtrans-59.6-42.9179.8-62.3-20.8000111.4Q207 Q213 C214 E215Q207-D211 PolarHBondContact NE2-OD1 3.17Å; Q207-D211 PolarHBondContact NE2-OD2 3.34Å; Q207-D211 VanDerWaalsContact O-CG 3.23Å; Q207-D211 PolarHBondContact O-N 3.4Å; D211-Q213 VanDerWaalsContact C-N 3.28Å; D211-Q213 PolarHBondContact O-N 2.85Å; D211-C214 WeakPolarHBondContact O-CB 3.42Å; D211-C214 PolarHBondContact O-N 2.94Å; D211-E215 PolarHBondContact O-N 3.37Å
212K97Very high95.6Very high148 Ų14860.6 Ų60.664%0.64330%0.303SS*.Hα-helixtrans-58.7-40.8173.5-175.2178.8-178.4178.20112A208 F210 E215 I216A208-K212 WeakPolarHBondContact O-CB 3.45Å; A208-K212 PolarHBondContact O-N 3.02Å; A208-K212 VanDerWaalsContact O-N 3.08Å; F210-K212 VanDerWaalsContact C-N 3.31Å; F210-K212 PolarHBondContact O-N 3.39Å; K212-E215 PolarHBondContact O-N 3.12Å; K212-I216 HydrophobicContact CG-CD1 4.33Å; K212-I216 WeakPolarHBondContact O-CG1 3.36Å; K212-I216 PolarHBondContact O-N 3.43Å; K212-I216 VanDerWaalsContact O-N 3.11Å
213Q97.3Very high95.6Very high19 Ų1959.3 Ų59.39%0.08930%0.303CS..Hα-helixtrans-73.5-34.1-180-170.563.153.200112.2E158 V161 L162 K165 T209 F210 D211 E215 L217E158-Q213 PolarHBondContact OE2-NE2 2.76Å; V161-Q213 HydrophobicContact CB-CG 4.44Å; V161-Q213 HydrophobicContact CG1-CG 4.04Å; V161-Q213 VanDerWaalsContact CG1-OE1 3.28Å; L162-Q213 HydrophobicContact CB-CG 3.85Å; L162-Q213 HydrophobicContact CD1-CB 3.99Å; L162-Q213 HydrophobicContact CD1-CG 3.93Å; K165-Q213 HydrophobicContact CG-CB 4.31Å; K165-Q213 HydrophobicContact CG-CG 4.41Å; T209-Q213 WeakPolarHBondContact O-CB 3.48Å; T209-Q213 PolarHBondContact O-N 3.12Å; F210-Q213 CarbonylContact O-C 3.55Å; F210-Q213 WeakPolarHBondContact O-CA 3.41Å; F210-Q213 WeakPolarHBondContact O-CB 3.41Å; F210-Q213 PolarHBondContact O-N 3.36Å; D211-Q213 VanDerWaalsContact C-N 3.28Å; D211-Q213 PolarHBondContact O-N 2.85Å; Q213-E215 VanDerWaalsContact C-N 3.33Å; Q213-L217 PolarHBondContact O-N 3.07Å; Q213-L217 VanDerWaalsContact O-N 3.08Å
214C95.2Very high95.6Very high21 Ų2158.1 Ų58.114%0.14230%0.296CS..Hα-helixtrans-56.6-50.4169.1-73.40000109.7F39 L162 F210 D211 I216 L217 K218F39-C214 HydrophobicContact CE2-CB 4.46Å; F39-C214 WeakPolarHBondContact CE2-O 3.43Å; L162-C214 VanDerWaalsContact CD1-SG 3.53Å; F210-C214 VanDerWaalsContact CE1-SG 3.51Å; F210-C214 VanDerWaalsContact CZ-SG 3.54Å; F210-C214 PolarHBondContact O-N 3.36Å; D211-C214 WeakPolarHBondContact O-CB 3.42Å; D211-C214 PolarHBondContact O-N 2.94Å; C214-I216 PolarHBondContact O-N 2.99Å; C214-L217 PolarHBondContact O-N 2.9Å; C214-K218 WeakPolarHBondContact O-CB 3.46Å; C214-K218 PolarHBondContact O-N 3.31Å
215E96Very high95.2Very high98 Ų9856 Ų5646%0.45829%0.293SS..Hα-helixtrans-62.2-43-178-17059.2-160.900112.6D211 K212 Q213 L217 K218 I219D211-E215 PolarHBondContact O-N 3.37Å; K212-E215 PolarHBondContact O-N 3.12Å; Q213-E215 VanDerWaalsContact C-N 3.33Å; E215-L217 VanDerWaalsContact C-N 3.34Å; E215-L217 PolarHBondContact O-N 3.4Å; E215-K218 WeakPolarHBondContact O-CB 3.48Å; E215-K218 PolarHBondContact O-N 3.39Å; E215-I219 HydrophobicContact CG-CD1 4.19Å; E215-I219 WeakPolarHBondContact O-CG1 3.3Å; E215-I219 PolarHBondContact O-N 3.16Å
216I97.2Very high94.8Very high64 Ų6454.5 Ų54.533%0.32829%0.294SS..Hα-helixtrans-57-49174.8-70166.3000110.9E158 K212 C214 L220E158-I216 HydrophobicContact CG-CG2 4.22Å; K212-I216 HydrophobicContact CG-CD1 4.33Å; K212-I216 WeakPolarHBondContact O-CG1 3.36Å; K212-I216 PolarHBondContact O-N 3.43Å; K212-I216 VanDerWaalsContact O-N 3.11Å; C214-I216 PolarHBondContact O-N 2.99Å; I216-L220 HydrophobicContact CG2-CD1 4.44Å; I216-L220 WeakPolarHBondContact O-CG 3.48Å; I216-L220 PolarHBondContact O-N 3.28Å
217L97.1Very high94.6Very high0 Ų054.9 Ų54.90%030%0.296CS..Hα-helixtrans-68.3-37.9-179.2-17955.7000111.3F39 L43 I155 E158 R159 L162 Q213 C214 E215 I219 L220 L221F39-L217 HydrophobicContact CE1-CD2 4.15Å; F39-L217 HydrophobicContact CZ-CB 3.98Å; F39-L217 HydrophobicContact CZ-CD2 3.77Å; F39-L217 HydrophobicContact CZ-CG 3.8Å; L43-L217 HydrophobicContact CD2-CD2 4.26Å; I155-L217 HydrophobicContact CG2-CD1 4.14Å; E158-L217 HydrophobicContact CB-CD1 4.19Å; R159-L217 HydrophobicContact CB-CD2 3.96Å; R159-L217 HydrophobicContact CG-CD2 4.34Å; L162-L217 HydrophobicContact CB-CD2 4.38Å; L162-L217 HydrophobicContact CD2-CD2 3.67Å; Q213-L217 PolarHBondContact O-N 3.07Å; Q213-L217 VanDerWaalsContact O-N 3.08Å; C214-L217 PolarHBondContact O-N 2.9Å; E215-L217 VanDerWaalsContact C-N 3.34Å; E215-L217 PolarHBondContact O-N 3.4Å; L217-I219 PolarHBondContact O-N 3.39Å; L217-L220 WeakPolarHBondContact O-CB 3.38Å; L217-L220 PolarHBondContact O-N 2.96Å; L217-L221 HydrophobicContact CD1-CD1 4.24Å; L217-L221 HydrophobicContact CD1-CD2 4.38Å; L217-L221 HydrophobicContact CD1-CG 4.03Å; L217-L221 HydrophobicContact CG-CD1 3.88Å; L217-L221 HydrophobicContact CG-CG 4.19Å; L217-L221 VanDerWaalsContact O-CG 3.23Å; L217-L221 WeakPolarHBondContact O-CG 3.35Å; L217-L221 PolarHBondContact O-N 2.91Å
218K95.6Very high94.5Very high53 Ų5356.1 Ų56.123%0.2330%0.302CS..Hα-helixtrans-57.1-49.4176.9-168.3179177.5-1750111.4Y38 F39 L42 C214 E215 L220 L221 E222Y38-K218 VanDerWaalsContact CE1-CE 3.45Å; F39-K218 HydrophobicContact CD2-CB 4.16Å; F39-K218 HydrophobicContact CD2-CG 4.31Å; F39-K218 HydrophobicContact CE2-CB 3.83Å; F39-K218 HydrophobicContact CE2-CG 4.45Å; L42-K218 HydrophobicContact CD1-CG 4.03Å; C214-K218 WeakPolarHBondContact O-CB 3.46Å; C214-K218 PolarHBondContact O-N 3.31Å; E215-K218 WeakPolarHBondContact O-CB 3.48Å; E215-K218 PolarHBondContact O-N 3.39Å; K218-L220 VanDerWaalsContact C-N 3.3Å; K218-L220 PolarHBondContact O-N 3.35Å; K218-L221 PolarHBondContact O-N 2.99Å; K218-L221 VanDerWaalsContact O-N 3.15Å; K218-E222 WeakPolarHBondContact CE-OE1 3.24Å; K218-E222 WeakPolarHBondContact O-CB 3.34Å; K218-E222 WeakPolarHBondContact O-CG 3.48Å; K218-E222 PolarHBondContact O-N 2.99Å
219I96Very high94.3Very high98 Ų9856.5 Ų56.550%0.50331%0.305SS..Hα-helixtrans-58-43.1177.4-68.4165.8000111.1E215 L217 G223E215-I219 HydrophobicContact CG-CD1 4.19Å; E215-I219 WeakPolarHBondContact O-CG1 3.3Å; E215-I219 PolarHBondContact O-N 3.16Å; L217-I219 PolarHBondContact O-N 3.39Å; I219-G223 PolarHBondContact O-N 3.24Å
220L96.7Very high94.1Very high57 Ų5757.1 Ų57.130%0.29831%0.306SS..Hα-helixtrans-64.4-42.5177.5-69.4171.4000112.2T154 I155 E158 I216 L217 K218 G223T154-L220 HydrophobicContact CG2-CD1 4Å; T154-L220 HydrophobicContact CG2-CD2 4.34Å; I155-L220 HydrophobicContact CG1-CB 3.93Å; E158-L220 HydrophobicContact CB-CD1 4.02Å; E158-L220 HydrophobicContact CG-CD1 3.58Å; I216-L220 HydrophobicContact CG2-CD1 4.44Å; I216-L220 WeakPolarHBondContact O-CG 3.48Å; I216-L220 PolarHBondContact O-N 3.28Å; L217-L220 WeakPolarHBondContact O-CB 3.38Å; L217-L220 PolarHBondContact O-N 2.96Å; K218-L220 VanDerWaalsContact C-N 3.3Å; K218-L220 PolarHBondContact O-N 3.35Å; L220-G223 PolarHBondContact O-N 2.91Å
221L96.1Very high94.1Very high4 Ų457.7 Ų57.72%0.02131%0.309CS..Hα-helixtrans-68.2-40.6179.6-64.7168.1000111.7F39 L42 L43 A46 I155 L217 K218 G223 I224F39-L221 HydrophobicContact CE1-CD1 4.33Å; F39-L221 HydrophobicContact CE2-CD1 4.5Å; F39-L221 HydrophobicContact CZ-CD1 4.18Å; L42-L221 HydrophobicContact CB-CB 3.91Å; L42-L221 HydrophobicContact CB-CD1 3.91Å; L42-L221 HydrophobicContact CB-CG 4.48Å; L42-L221 HydrophobicContact CD1-CB 4.29Å; L43-L221 HydrophobicContact CD2-CD1 3.75Å; L43-L221 HydrophobicContact CD2-CD2 4.19Å; L43-L221 HydrophobicContact CG-CD1 4Å; A46-L221 HydrophobicContact CB-CD2 3.42Å; A46-L221 VanDerWaalsContact CB-CD2 3.42Å; I155-L221 HydrophobicContact CG2-CD2 3.88Å; L217-L221 HydrophobicContact CD1-CD1 4.24Å; L217-L221 HydrophobicContact CD1-CD2 4.38Å; L217-L221 HydrophobicContact CD1-CG 4.03Å; L217-L221 HydrophobicContact CG-CD1 3.88Å; L217-L221 HydrophobicContact CG-CG 4.19Å; L217-L221 VanDerWaalsContact O-CG 3.23Å; L217-L221 WeakPolarHBondContact O-CG 3.35Å; L217-L221 PolarHBondContact O-N 2.91Å; K218-L221 PolarHBondContact O-N 2.99Å; K218-L221 VanDerWaalsContact O-N 3.15Å; L221-G223 VanDerWaalsContact C-N 3.25Å; L221-G223 PolarHBondContact O-N 3.24Å; L221-I224 HydrophobicContact CD2-CD1 4.41Å; L221-I224 WeakPolarHBondContact O-CB 3.35Å; L221-I224 WeakPolarHBondContact O-CG1 3.34Å; L221-I224 PolarHBondContact O-N 2.76Å
222E93.5Very high94.2Very high67 Ų6758.6 Ų58.631%0.31331%0.313SS..Hα-helixtrans-63.3-34.9173.2-71.8174.2-179.800111.4Y38 L42 K218 I224 Q225Y38-E222 WeakPolarHBondContact CE1-OE1 3.43Å; Y38-E222 PolarHBondContact OH-OE1 2.93Å; L42-E222 HydrophobicContact CD1-CG 3.81Å; L42-E222 HydrophobicContact CD2-CG 4.19Å; K218-E222 WeakPolarHBondContact CE-OE1 3.24Å; K218-E222 WeakPolarHBondContact O-CB 3.34Å; K218-E222 WeakPolarHBondContact O-CG 3.48Å; K218-E222 PolarHBondContact O-N 2.99Å; E222-I224 PolarHBondContact O-N 3.35Å; E222-I224 VanDerWaalsContact O-N 3.15Å; E222-Q225 PolarHBondContact O-N 3.39Å
223G93.4Very high94.1Very high29 Ų2956 Ų5630%0.29930%0.301SS..Hα-helixtrans-57.3-24.8174.900000114.5I219 L220 L221 Q225 S226 S227I219-G223 PolarHBondContact O-N 3.24Å; L220-G223 PolarHBondContact O-N 2.91Å; L221-G223 VanDerWaalsContact C-N 3.25Å; L221-G223 PolarHBondContact O-N 3.24Å; G223-Q225 PolarHBondContact O-N 3.46Å; G223-Q225 VanDerWaalsContact O-N 3.16Å; G223-S226 WeakPolarHBondContact O-CB 3.44Å; G223-S226 PolarHBondContact O-N 3.17Å; G223-S226 PolarHBondContact O-OG 3.2Å; G223-S227 PolarHBondContact O-N 3.49Å
224I93.3Very high94.1Very high9 Ų955.2 Ų55.25%0.04630%0.298CS..Hα-helixtrans-58.3-31.7178.1-62.9178000112A46 A49 F147 I155 L221 E222 S226 S227 H228A46-I224 HydrophobicContact CB-CD1 3.26Å; A49-I224 HydrophobicContact CB-CG2 4.03Å; F147-I224 HydrophobicContact CE2-CG2 4.45Å; F147-I224 HydrophobicContact CZ-CG2 4.23Å; I155-I224 HydrophobicContact CD1-CD1 3.76Å; I155-I224 HydrophobicContact CD1-CG1 3.93Å; L221-I224 HydrophobicContact CD2-CD1 4.41Å; L221-I224 WeakPolarHBondContact O-CB 3.35Å; L221-I224 WeakPolarHBondContact O-CG1 3.34Å; L221-I224 PolarHBondContact O-N 2.76Å; E222-I224 PolarHBondContact O-N 3.35Å; E222-I224 VanDerWaalsContact O-N 3.15Å; I224-S226 PolarHBondContact O-N 2.91Å; I224-S227 WeakPolarHBondContact O-CB 3.45Å; I224-S227 PolarHBondContact O-N 3Å; I224-S227 VanDerWaalsContact O-N 3.07Å; I224-H228 PolarHBondContact O-N 3.48Å
225Q87Confident94.1Very high122 Ų12258.5 Ų58.557%0.5731%0.314SS*.Hα-helixtrans-61.5-35.3177.6-63-17822.600111.8E222 G223 H228 A229E222-Q225 PolarHBondContact O-N 3.39Å; G223-Q225 PolarHBondContact O-N 3.46Å; G223-Q225 VanDerWaalsContact O-N 3.16Å; Q225-H228 PolarHBondContact O-N 3.03Å; Q225-A229 PolarHBondContact O-N 2.96Å
226S87.7Confident94.2Very high84 Ų8459.8 Ų59.859%0.58732%0.315SS*.Hα-helixtrans-68-38.3174.6750000111.7G223 I224 H228 A229 N230G223-S226 WeakPolarHBondContact O-CB 3.44Å; G223-S226 PolarHBondContact O-N 3.17Å; G223-S226 PolarHBondContact O-OG 3.2Å; I224-S226 PolarHBondContact O-N 2.91Å; S226-H228 VanDerWaalsContact C-N 3.31Å; S226-H228 PolarHBondContact O-N 3.14Å; S226-A229 WeakPolarHBondContact O-CB 3.35Å; S226-A229 PolarHBondContact O-N 3.45Å; S226-N230 PolarHBondContact O-N 2.82Å
227S90.3Very high94.2Very high17 Ų1757.8 Ų57.812%0.11931%0.305CS..Hα-helixtrans-63.3-36.8173.7-51.10000111.6G223 I224 A229 N230 H231G223-S227 PolarHBondContact O-N 3.49Å; I224-S227 WeakPolarHBondContact O-CB 3.45Å; I224-S227 PolarHBondContact O-N 3Å; I224-S227 VanDerWaalsContact O-N 3.07Å; S227-A229 PolarHBondContact O-N 3.44Å; S227-N230 CarbonylContact O-C 3.59Å; S227-N230 WeakPolarHBondContact O-CA 3.5Å; S227-N230 WeakPolarHBondContact O-CB 3.46Å; S227-N230 PolarHBondContact O-N 3.42Å; S227-N230 VanDerWaalsContact O-N 3.13Å; S227-H231 PolarHBondContact O-CD2 2.98Å; S227-H231 VanDerWaalsContact O-CG 3.26Å; S227-H231 PolarHBondContact O-N 3.1Å
228H91.5Very high94.2Very high85 Ų8559 Ų5939%0.39431%0.31SS..Hα-helixtrans-63.8-36.9174.8-72-179.3000113.3I224 Q225 S226 N230 H231 L232I224-H228 PolarHBondContact O-N 3.48Å; Q225-H228 PolarHBondContact O-N 3.03Å; S226-H228 VanDerWaalsContact C-N 3.31Å; S226-H228 PolarHBondContact O-N 3.14Å; H228-N230 VanDerWaalsContact C-N 3.27Å; H228-N230 PolarHBondContact O-N 2.74Å; H228-H231 PolarHBondContact O-N 2.67Å; H228-L232 WeakPolarHBondContact O-CB 3.37Å; H228-L232 PolarHBondContact O-N 3.32Å
229A92.8Very high94.3Very high65 Ų6560 Ų6054%0.53732%0.32SS..Hα-helixtrans-61.9-38.9173.300000111.3Q225 S226 S227 K233Q225-A229 PolarHBondContact O-N 2.96Å; S226-A229 WeakPolarHBondContact O-CB 3.35Å; S226-A229 PolarHBondContact O-N 3.45Å; S227-A229 PolarHBondContact O-N 3.44Å; A229-K233 PolarHBondContact O-N 3.01Å
230N92.5Very high94.4Very high73 Ų7360.8 Ų60.839%0.3932%0.322SS..Hα-helixtrans-66.7-42.9173.2-173.352.8000112.1S226 S227 H228 L232 K233 C234S226-N230 PolarHBondContact O-N 2.82Å; S227-N230 CarbonylContact O-C 3.59Å; S227-N230 WeakPolarHBondContact O-CA 3.5Å; S227-N230 WeakPolarHBondContact O-CB 3.46Å; S227-N230 PolarHBondContact O-N 3.42Å; S227-N230 VanDerWaalsContact O-N 3.13Å; H228-N230 VanDerWaalsContact C-N 3.27Å; H228-N230 PolarHBondContact O-N 2.74Å; N230-L232 VanDerWaalsContact C-N 3.3Å; N230-L232 PolarHBondContact O-N 2.56Å; N230-K233 WeakPolarHBondContact O-CA 3.37Å; N230-K233 WeakPolarHBondContact O-CB 3.35Å; N230-K233 PolarHBondContact O-N 2.87Å; N230-K233 VanDerWaalsContact O-N 3.08Å; N230-C234 PolarHBondContact O-N 2.67Å; N230-C234 PolarHBondContact O-SG 3.33Å
231H95.2Very high94.4Very high21 Ų2159.9 Ų59.910%0.09732%0.316CS..Hα-helixtrans-61.1-40.1176.6-63177.5000111.7L144 F147 S227 H228 K233 C234 L235L144-H231 HydrophobicContact CD2-CB 4.46Å; F147-H231 AromaticContact CD1-CE1 3.6Å; F147-H231 AromaticContact CD1-NE2 3.96Å; F147-H231 AromaticContact CE1-CE1 3.92Å; F147-H231 AromaticContact CG-CE1 3.71Å; F147-H231 AromaticContact CG-NE2 3.64Å; S227-H231 PolarHBondContact O-CD2 2.98Å; S227-H231 VanDerWaalsContact O-CG 3.26Å; S227-H231 PolarHBondContact O-N 3.1Å; H228-H231 PolarHBondContact O-N 2.67Å; H231-K233 VanDerWaalsContact C-N 3.28Å; H231-K233 PolarHBondContact O-N 3.43Å; H231-C234 WeakPolarHBondContact O-CB 3.34Å; H231-C234 PolarHBondContact O-N 3.16Å; H231-C234 VanDerWaalsContact O-N 3.11Å; H231-L235 WeakPolarHBondContact O-CG 3.47Å; H231-L235 PolarHBondContact O-N 2.88Å
232L96.6Very high94.5Very high97 Ų9762 Ų6251%0.50833%0.326SS..Hα-helixtrans-61.7-37.4175.2-174.368.1000111.8H228 N230 L235 R236H228-L232 WeakPolarHBondContact O-CB 3.37Å; H228-L232 PolarHBondContact O-N 3.32Å; N230-L232 VanDerWaalsContact C-N 3.3Å; N230-L232 PolarHBondContact O-N 2.56Å; L232-L235 PolarHBondContact O-N 2.92Å; L232-R236 PolarHBondContact O-N 3.47Å
233K95.7Very high94.7Very high92 Ų9265 Ų6540%0.434%0.342SS..Hα-helixtrans-63.5-46.5171.6-173.4-168.3-179.8-54.50111.1A229 N230 H231 L235 R236 D237A229-K233 PolarHBondContact O-N 3.01Å; N230-K233 WeakPolarHBondContact O-CA 3.37Å; N230-K233 WeakPolarHBondContact O-CB 3.35Å; N230-K233 PolarHBondContact O-N 2.87Å; N230-K233 VanDerWaalsContact O-N 3.08Å; H231-K233 VanDerWaalsContact C-N 3.28Å; H231-K233 PolarHBondContact O-N 3.43Å; K233-L235 PolarHBondContact O-N 2.8Å; K233-R236 PolarHBondContact O-N 2.95Å; K233-R236 VanDerWaalsContact O-N 3.08Å; K233-D237 IonicContact NZ-OD1 4Å; K233-D237 PolarHBondContact NZ-OD1 3.33Å; K233-D237 IonicContact NZ-OD2 2.76Å; K233-D237 PolarHBondContact NZ-OD2 2.92Å; K233-D237 PolarHBondContact O-N 2.99Å
234C96Very high94.9Very high4 Ų466.3 Ų66.33%0.02735%0.35CS..Hα-helixtrans-56.6-40.5178.4-57.80000111.6V140 N230 H231 D237 F238V140-C234 HydrophobicContact CG1-CB 4.18Å; N230-C234 PolarHBondContact O-N 2.67Å; N230-C234 PolarHBondContact O-SG 3.33Å; H231-C234 WeakPolarHBondContact O-CB 3.34Å; H231-C234 PolarHBondContact O-N 3.16Å; H231-C234 VanDerWaalsContact O-N 3.11Å; C234-D237 PolarHBondContact O-N 2.8Å; C234-F238 WeakPolarHBondContact O-CB 3.39Å; C234-F238 PolarHBondContact O-N 3.11Å
235L97.1Very high95.2Very high90 Ų9067.3 Ų67.347%0.47135%0.353SS..Hα-helixtrans-64.1-41.8176.2-68.4175.1000112.7H231 L232 K233 F238 V239H231-L235 WeakPolarHBondContact O-CG 3.47Å; H231-L235 PolarHBondContact O-N 2.88Å; L232-L235 PolarHBondContact O-N 2.92Å; K233-L235 PolarHBondContact O-N 2.8Å; L235-F238 PolarHBondContact O-N 3.1Å; L235-V239 WeakPolarHBondContact O-CG2 3.47Å; L235-V239 PolarHBondContact O-N 3.36Å
236R97.4Very high95.7Very high125 Ų12566.5 Ų66.547%0.47235%0.349SS..Hα-helixtrans-64.3-48.5175.5-71.4-170.7-62-93.6-2.7111.4L232 K233 F238 V239 E240L232-R236 PolarHBondContact O-N 3.47Å; K233-R236 PolarHBondContact O-N 2.95Å; K233-R236 VanDerWaalsContact O-N 3.08Å; R236-F238 PolarHBondContact O-N 3.41Å; R236-V239 PolarHBondContact O-N 3.4Å; R236-V239 VanDerWaalsContact O-N 3.15Å; R236-E240 WeakPolarHBondContact O-CG 3.49Å; R236-E240 PolarHBondContact O-N 2.93Å
237D96.3Very high96.2Very high22 Ų2265.4 Ų65.412%0.11835%0.346CS..Hα-helixtrans-55.8-42.3177.5-69.33.1000110.4K139 K233 C234 V239 E240 E241K139-D237 HydrophobicContact CB-CB 4.33Å; K139-D237 HydrophobicContact CD-CB 4.05Å; K233-D237 IonicContact NZ-OD1 4Å; K233-D237 PolarHBondContact NZ-OD1 3.33Å; K233-D237 IonicContact NZ-OD2 2.76Å; K233-D237 PolarHBondContact NZ-OD2 2.92Å; K233-D237 PolarHBondContact O-N 2.99Å; C234-D237 PolarHBondContact O-N 2.8Å; D237-V239 PolarHBondContact O-N 2.9Å; D237-E240 PolarHBondContact O-N 2.98Å; D237-E241 WeakPolarHBondContact O-CG 3.47Å; D237-E241 PolarHBondContact O-N 3.33Å
238F97.3Very high96.6Very high26 Ų2668.9 Ų68.911%0.11436%0.36CS..Hα-helixtrans-60.2-46.1177.7-175.3-120.7000113.1M60 Y63 F132 V140 C234 L235 R236 E240 E241 Q242M60-F238 HydrophobicContact CE-CD1 3.87Å; M60-F238 HydrophobicContact CE-CD2 3.63Å; M60-F238 HydrophobicContact CE-CE1 3.87Å; M60-F238 HydrophobicContact CE-CE2 3.63Å; M60-F238 HydrophobicContact CE-CG 3.75Å; M60-F238 HydrophobicContact CE-CZ 3.75Å; Y63-F238 HydrophobicContact CD1-CE2 4.5Å; Y63-F238 AromaticContact CD1-CZ 3.99Å; Y63-F238 HydrophobicContact CD1-CZ 3.99Å; Y63-F238 HydrophobicContact CE1-CE2 4.12Å; Y63-F238 AromaticContact CE1-CZ 3.62Å; Y63-F238 HydrophobicContact CE1-CZ 3.62Å; F132-F238 HydrophobicContact CZ-CE2 4.16Å; V140-F238 HydrophobicContact CG2-CB 3.7Å; V140-F238 HydrophobicContact CG2-CD2 4.02Å; V140-F238 HydrophobicContact CG2-CG 4.18Å; C234-F238 WeakPolarHBondContact O-CB 3.39Å; C234-F238 PolarHBondContact O-N 3.11Å; L235-F238 PolarHBondContact O-N 3.1Å; R236-F238 PolarHBondContact O-N 3.41Å; F238-E240 VanDerWaalsContact C-N 3.32Å; F238-E240 PolarHBondContact O-N 3.37Å; F238-E241 PolarHBondContact O-N 3.26Å; F238-Q242 VanDerWaalsContact CE1-CD 3.49Å; F238-Q242 HydrophobicContact CE1-CG 4.24Å; F238-Q242 HydrophobicContact CE2-CG 4.24Å; F238-Q242 HydrophobicContact CZ-CG 4.05Å; F238-Q242 WeakPolarHBondContact O-CG 3.39Å; F238-Q242 PolarHBondContact O-N 2.77Å
239V98Very high97Very high73 Ų7365.9 Ų65.944%0.44235%0.348SS..Hα-helixtrans-65.1-39.5179.2173.70000110.7L235 R236 D237 Q242 M243L235-V239 WeakPolarHBondContact O-CG2 3.47Å; L235-V239 PolarHBondContact O-N 3.36Å; R236-V239 PolarHBondContact O-N 3.4Å; R236-V239 VanDerWaalsContact O-N 3.15Å; D237-V239 PolarHBondContact O-N 2.9Å; V239-Q242 PolarHBondContact O-N 2.86Å; V239-M243 HydrophobicContact CG1-SD 4.26Å; V239-M243 VanDerWaalsContact O-CG 3.31Å; V239-M243 WeakPolarHBondContact O-CG 3.42Å; V239-M243 PolarHBondContact O-N 2.94Å
240E97.6Very high97.3Very high115 Ų11568.4 Ų68.454%0.53735%0.349SS..Hα-helixtrans-61.5-43.9175.1-71.8174.8-174.200111.8R236 D237 F238 M243 A244R236-E240 WeakPolarHBondContact O-CG 3.49Å; R236-E240 PolarHBondContact O-N 2.93Å; D237-E240 PolarHBondContact O-N 2.98Å; F238-E240 VanDerWaalsContact C-N 3.32Å; F238-E240 PolarHBondContact O-N 3.37Å; E240-M243 PolarHBondContact O-N 3.36Å; E240-A244 WeakPolarHBondContact O-CB 3.5Å; E240-A244 PolarHBondContact O-N 3.26Å
241E97.2Very high97.6Very high38 Ų3869 Ų6918%0.17835%0.349CS..Hα-helixtrans-63.7-41.8175.6-68.1-53.6145.200112.3F132 V135 K139 D237 F238 M243 A244 F245F132-E241 HydrophobicContact CD2-CB 4.06Å; F132-E241 HydrophobicContact CE2-CB 4.03Å; V135-E241 VanDerWaalsContact CG1-CD 3.43Å; V135-E241 HydrophobicContact CG1-CG 3.9Å; K139-E241 HydrophobicContact CD-CG 4.35Å; K139-E241 IonicContact NZ-OE1 3.54Å; K139-E241 PolarHBondContact NZ-OE1 2.98Å; D237-E241 WeakPolarHBondContact O-CG 3.47Å; D237-E241 PolarHBondContact O-N 3.33Å; F238-E241 PolarHBondContact O-N 3.26Å; E241-M243 VanDerWaalsContact C-N 3.34Å; E241-M243 PolarHBondContact O-N 2.94Å; E241-A244 PolarHBondContact O-N 3.15Å; E241-F245 WeakPolarHBondContact O-CB 3.12Å; E241-F245 PolarHBondContact O-N 3.45Å
242Q97.9Very high97.7Very high48 Ų4869.7 Ų69.722%0.22435%0.354CS..Hα-helixtrans-61-44.9175.3-75.3-173.6-48.700111.3Y63 F132 F238 V239 F245 H246Y63-Q242 PolarHBondContact OH-NE2 3.35Å; F132-Q242 HydrophobicContact CE2-CB 4.38Å; F132-Q242 HydrophobicContact CE2-CG 3.73Å; F132-Q242 HydrophobicContact CZ-CG 3.75Å; F238-Q242 VanDerWaalsContact CE1-CD 3.49Å; F238-Q242 HydrophobicContact CE1-CG 4.24Å; F238-Q242 HydrophobicContact CE2-CG 4.24Å; F238-Q242 HydrophobicContact CZ-CG 4.05Å; F238-Q242 WeakPolarHBondContact O-CG 3.39Å; F238-Q242 PolarHBondContact O-N 2.77Å; V239-Q242 PolarHBondContact O-N 2.86Å; Q242-F245 PolarHBondContact O-N 3.5Å; Q242-H246 WeakPolarHBondContact O-CB 3.47Å; Q242-H246 PolarHBondContact O-CD2 3.48Å; Q242-H246 PolarHBondContact O-N 3.45Å
243M98.5Very high97.8Very high131 Ų13168.5 Ų68.565%0.64535%0.35SS*.Hα-helixtrans-60.8-47.1177.6-74.9179.159.400111.6V239 E240 E241 A247V239-M243 HydrophobicContact CG1-SD 4.26Å; V239-M243 VanDerWaalsContact O-CG 3.31Å; V239-M243 WeakPolarHBondContact O-CG 3.42Å; V239-M243 PolarHBondContact O-N 2.94Å; E240-M243 PolarHBondContact O-N 3.36Å; E241-M243 VanDerWaalsContact C-N 3.34Å; E241-M243 PolarHBondContact O-N 2.94Å; M243-A247 VanDerWaalsContact O-CB 3.27Å; M243-A247 WeakPolarHBondContact O-CB 3.4Å; M243-A247 PolarHBondContact O-N 2.96Å
244A98Very high97.9Very high56 Ų5667.9 Ų67.946%0.46335%0.348SS..Hα-helixtrans-61.3-48.3179.300000111.6E240 E241 A247 Q248E240-A244 WeakPolarHBondContact O-CB 3.5Å; E240-A244 PolarHBondContact O-N 3.26Å; E241-A244 PolarHBondContact O-N 3.15Å; A244-A247 PolarHBondContact O-N 3.4Å; A244-Q248 WeakPolarHBondContact O-CB 3.46Å; A244-Q248 PolarHBondContact O-N 3.43Å
245F98.3Very high97.9Very high29 Ų2971 Ų7113%0.12736%0.364CS..Hα-helixtrans-58.8-51.3178.4171.5-116.6000112.1A128 E129 F132 E241 Q242 A247 Q248 C249A128-F245 HydrophobicContact CB-CD2 4.18Å; A128-F245 HydrophobicContact CB-CE2 4.11Å; E129-F245 VanDerWaalsContact CA-CE2 3.44Å; E129-F245 HydrophobicContact CB-CE2 3.94Å; E129-F245 HydrophobicContact CB-CZ 4.05Å; E129-F245 HydrophobicContact CG-CZ 4.37Å; F132-F245 HydrophobicContact CB-CB 3.97Å; F132-F245 HydrophobicContact CB-CD1 4.47Å; F132-F245 HydrophobicContact CB-CD2 3.77Å; F132-F245 HydrophobicContact CB-CE2 4.42Å; F132-F245 HydrophobicContact CB-CG 3.8Å; F132-F245 HydrophobicContact CD1-CD1 4.09Å; F132-F245 HydrophobicContact CD1-CE1 4.38Å; F132-F245 HydrophobicContact CD1-CG 4.26Å; F132-F245 HydrophobicContact CD2-CB 3.77Å; F132-F245 HydrophobicContact CD2-CD1 4.45Å; F132-F245 HydrophobicContact CD2-CG 4.16Å; F132-F245 HydrophobicContact CG-CB 3.89Å; F132-F245 HydrophobicContact CG-CD1 4.06Å; F132-F245 HydrophobicContact CG-CD2 4.25Å; F132-F245 AromaticContact CG-CG 3.79Å; F132-F245 HydrophobicContact CG-CG 3.79Å; E241-F245 WeakPolarHBondContact O-CB 3.12Å; E241-F245 PolarHBondContact O-N 3.45Å; Q242-F245 PolarHBondContact O-N 3.5Å; F245-A247 VanDerWaalsContact C-N 3.34Å; F245-A247 PolarHBondContact O-N 3.38Å; F245-Q248 PolarHBondContact O-N 3.01Å; F245-C249 WeakPolarHBondContact CE2-SG 3.44Å; F245-C249 WeakPolarHBondContact O-CB 3.33Å; F245-C249 PolarHBondContact O-N 2.91Å; F245-C249 PolarHBondContact O-SG 3.13Å; F245-C249 VanDerWaalsContact O-SG 3.33Å
246H98.5Very high98Very high105 Ų10567.7 Ų67.749%0.48635%0.347SS..Hα-helixtrans-66.1-36.2-178.7-73.7-57000112.7Q242 C249 H250Q242-H246 WeakPolarHBondContact O-CB 3.47Å; Q242-H246 PolarHBondContact O-CD2 3.48Å; Q242-H246 PolarHBondContact O-N 3.45Å; H246-C249 PolarHBondContact O-N 3.15Å; H246-H250 WeakPolarHBondContact O-CB 3.37Å; H246-H250 PolarHBondContact O-N 2.99Å
247A98.7Very high97.9Very high62 Ų6268 Ų6851%0.51235%0.354SS..Hα-helixtrans-63.9-43.6174.600000111.8M243 A244 F245 H250 Q251M243-A247 VanDerWaalsContact O-CB 3.27Å; M243-A247 WeakPolarHBondContact O-CB 3.4Å; M243-A247 PolarHBondContact O-N 2.96Å; A244-A247 PolarHBondContact O-N 3.4Å; F245-A247 VanDerWaalsContact C-N 3.34Å; F245-A247 PolarHBondContact O-N 3.38Å; A247-H250 PolarHBondContact O-N 2.94Å; A247-Q251 PolarHBondContact O-N 3.33Å
248Q98.5Very high97.9Very high89 Ų8974 Ų7442%0.41638%0.375SS..Hα-helixtrans-62.3-47.1176.4-173-179.316.700111.4A244 F245 H250 Q251 L252A244-Q248 WeakPolarHBondContact O-CB 3.46Å; A244-Q248 PolarHBondContact O-N 3.43Å; F245-Q248 PolarHBondContact O-N 3.01Å; Q248-H250 VanDerWaalsContact C-N 3.34Å; Q248-H250 PolarHBondContact O-N 2.96Å; Q248-Q251 PolarHBondContact O-N 3.45Å; Q248-L252 HydrophobicContact CG-CD1 4.27Å; Q248-L252 WeakPolarHBondContact O-CG 3.47Å; Q248-L252 PolarHBondContact O-N 3Å
249C98.5Very high97.7Very high22 Ų2274.7 Ų74.715%0.14939%0.385CS..Hα-helixtrans-60.7-42.2177.5-72.40000112.5L125 F245 H246 Q251 L252 T253L125-C249 HydrophobicContact CD2-CB 3.67Å; L125-C249 WeakPolarHBondContact CD2-SG 3.44Å; F245-C249 WeakPolarHBondContact CE2-SG 3.44Å; F245-C249 WeakPolarHBondContact O-CB 3.33Å; F245-C249 PolarHBondContact O-N 2.91Å; F245-C249 PolarHBondContact O-SG 3.13Å; F245-C249 VanDerWaalsContact O-SG 3.33Å; H246-C249 PolarHBondContact O-N 3.15Å; C249-Q251 VanDerWaalsContact C-N 3.35Å; C249-Q251 PolarHBondContact O-N 3.25Å; C249-L252 PolarHBondContact O-N 3.28Å; C249-T253 WeakPolarHBondContact O-CB 3.44Å; C249-T253 PolarHBondContact O-N 3.37Å; C249-T253 PolarHBondContact O-OG1 3.45Å
250H98.7Very high97.5Very high119 Ų11973.6 Ų73.655%0.55138%0.376SS*.Hα-helixtrans-60.3-46.3175.3179.778.7000111.1H246 A247 Q248 T253 K254H246-H250 WeakPolarHBondContact O-CB 3.37Å; H246-H250 PolarHBondContact O-N 2.99Å; A247-H250 PolarHBondContact O-N 2.94Å; Q248-H250 VanDerWaalsContact C-N 3.34Å; Q248-H250 PolarHBondContact O-N 2.96Å; H250-T253 PolarHBondContact O-N 2.97Å; H250-K254 WeakPolarHBondContact O-CB 3.49Å; H250-K254 PolarHBondContact O-N 3.04Å
251Q98.6Very high97Very high85 Ų8571.5 Ų71.540%0.39738%0.375SS..Hα-helixtrans-63.7-46.3-179-172.854.745.300111.8A247 Q248 C249 T253 K254 D255A247-Q251 PolarHBondContact O-N 3.33Å; Q248-Q251 PolarHBondContact O-N 3.45Å; C249-Q251 VanDerWaalsContact C-N 3.35Å; C249-Q251 PolarHBondContact O-N 3.25Å; Q251-T253 VanDerWaalsContact C-N 3.34Å; Q251-T253 PolarHBondContact O-N 3.42Å; Q251-K254 PolarHBondContact O-N 3.18Å; Q251-D255 PolarHBondContact NE2-OD1 3.05Å; Q251-D255 PolarHBondContact NE2-OD2 3.28Å; Q251-D255 PolarHBondContact O-N 2.74Å
252L98.6Very high95.8Very high36 Ų3671.6 Ų71.619%0.18839%0.386CS..Hα-helixtrans-56.7-46.7175.8-72.9171.1000111.9T121 K124 L125 Q248 C249 D255 L256T121-L252 HydrophobicContact CG2-CB 4.21Å; K124-L252 HydrophobicContact CB-CD1 4.01Å; K124-L252 HydrophobicContact CB-CD2 4.07Å; K124-L252 HydrophobicContact CD-CD2 3.99Å; L125-L252 HydrophobicContact CD2-CB 4.12Å; L125-L252 HydrophobicContact CD2-CD1 3.8Å; L125-L252 HydrophobicContact CG-CB 4.4Å; L125-L252 HydrophobicContact CG-CD1 4.05Å; Q248-L252 HydrophobicContact CG-CD1 4.27Å; Q248-L252 WeakPolarHBondContact O-CG 3.47Å; Q248-L252 PolarHBondContact O-N 3Å; C249-L252 PolarHBondContact O-N 3.28Å; L252-D255 PolarHBondContact O-N 3.1Å; L252-L256 PolarHBondContact O-N 3.46Å
253T97.9Very high94Very high72 Ų7271.6 Ų71.644%0.44239%0.386SS..Hα-helixtrans-70.1-36.3-178.1-50.80000112C249 H250 Q251 L256 Q257C249-T253 WeakPolarHBondContact O-CB 3.44Å; C249-T253 PolarHBondContact O-N 3.37Å; C249-T253 PolarHBondContact O-OG1 3.45Å; H250-T253 PolarHBondContact O-N 2.97Å; Q251-T253 VanDerWaalsContact C-N 3.34Å; Q251-T253 PolarHBondContact O-N 3.42Å; T253-L256 PolarHBondContact O-N 2.89Å; T253-Q257 PolarHBondContact O-N 3.34Å
254K97.9Very high91.9Very high78 Ų7869.7 Ų69.734%0.33938%0.381SS..Hα-helixtrans-65.6-41.9176-175.9179.6-174.7175.60111.9H250 Q251 Q257 R258H250-K254 WeakPolarHBondContact O-CB 3.49Å; H250-K254 PolarHBondContact O-N 3.04Å; Q251-K254 PolarHBondContact O-N 3.18Å; K254-Q257 PolarHBondContact O-N 3.18Å; K254-R258 WeakPolarHBondContact O-CG 3.42Å; K254-R258 PolarHBondContact O-N 3.35Å; K254-R258 VanDerWaalsContact O-N 3.16Å
255D97.2Very high89.5Confident69 Ų6970.9 Ų70.937%0.36939%0.385SS..Hα-helixtrans-68.5-37.4177.2-69.2-25.6000111.5Q251 L252 R258 A259Q251-D255 PolarHBondContact NE2-OD1 3.05Å; Q251-D255 PolarHBondContact NE2-OD2 3.28Å; Q251-D255 PolarHBondContact O-N 2.74Å; L252-D255 PolarHBondContact O-N 3.1Å; D255-R258 PolarHBondContact O-N 2.99Å; D255-R258 IonicContact OD1-NH1 3.38Å; D255-R258 PolarHBondContact OD1-NH1 3.26Å; D255-A259 WeakPolarHBondContact O-CB 3.29Å; D255-A259 PolarHBondContact O-N 3.49Å
256L97.3Very high87.2Confident22 Ų2273.6 Ų73.612%0.11541%0.407CS..Hα-helixtrans-60.3-46.9171175.762.5000112K117 V118 T121 L252 T253 R258 A259 L260K117-L256 HydrophobicContact CB-CD1 4.03Å; V118-L256 HydrophobicContact CB-CD2 4.44Å; V118-L256 HydrophobicContact CG1-CD2 4.35Å; V118-L256 HydrophobicContact CG2-CD1 4.14Å; V118-L256 HydrophobicContact CG2-CD2 4.19Å; T121-L256 HydrophobicContact CG2-CB 4.02Å; T121-L256 HydrophobicContact CG2-CD2 3.94Å; L252-L256 PolarHBondContact O-N 3.46Å; T253-L256 PolarHBondContact O-N 2.89Å; L256-R258 VanDerWaalsContact C-N 3.3Å; L256-R258 PolarHBondContact O-N 3.11Å; L256-A259 PolarHBondContact O-N 2.93Å; L256-A259 VanDerWaalsContact O-N 3.11Å; L256-L260 HydrophobicContact CD1-CD1 3.87Å; L256-L260 HydrophobicContact CD1-CD2 4.42Å; L256-L260 HydrophobicContact CD1-CG 3.89Å; L256-L260 HydrophobicContact CG-CD1 3.95Å; L256-L260 HydrophobicContact CG-CG 4.36Å; L256-L260 WeakPolarHBondContact O-CG 3.49Å; L256-L260 PolarHBondContact O-N 3.27Å
257Q96.6Very high84.9Confident132 Ų13269.8 Ų69.862%0.61739%0.394SS*.Hα-helixtrans-54.7-48.3177.9-175.7-172.452.100110.9T253 K254 A259 L260 S261T253-Q257 PolarHBondContact O-N 3.34Å; K254-Q257 PolarHBondContact O-N 3.18Å; Q257-A259 PolarHBondContact O-N 3.35Å; Q257-L260 PolarHBondContact O-N 3.46Å; Q257-S261 PolarHBondContact O-N 2.97Å; Q257-S261 PolarHBondContact O-OG 3.4Å; Q257-S261 VanDerWaalsContact O-OG 3.07Å
258R95.3Very high82.4Confident147 Ų14772 Ų7256%0.55540%0.396SS*.Hα-helixtrans-59.9-44.8176.4-69.3168.5173.5175-10.1111.9K254 D255 L256 L260 S261 G262K254-R258 WeakPolarHBondContact O-CG 3.42Å; K254-R258 PolarHBondContact O-N 3.35Å; K254-R258 VanDerWaalsContact O-N 3.16Å; D255-R258 PolarHBondContact O-N 2.99Å; D255-R258 IonicContact OD1-NH1 3.38Å; D255-R258 PolarHBondContact OD1-NH1 3.26Å; L256-R258 VanDerWaalsContact C-N 3.3Å; L256-R258 PolarHBondContact O-N 3.11Å; R258-L260 VanDerWaalsContact C-N 3.26Å; R258-L260 PolarHBondContact O-N 3.06Å; R258-S261 PolarHBondContact O-N 3.36Å; R258-G262 PolarHBondContact O-N 3.02Å
259A93.4Very high79.9Confident41 Ų4177 Ų7734%0.33941%0.411SS..Hα-helixtrans-66.9-25-17900000113.8K117 D255 L256 Q257K117-A259 HydrophobicContact CD-CB 4.33Å; K117-A259 PolarHBondContact NZ-O 2.96Å; D255-A259 WeakPolarHBondContact O-CB 3.29Å; D255-A259 PolarHBondContact O-N 3.49Å; L256-A259 PolarHBondContact O-N 2.93Å; L256-A259 VanDerWaalsContact O-N 3.11Å; Q257-A259 PolarHBondContact O-N 3.35Å
260L93.6Very high77.6Confident49 Ų4979.3 Ų79.326%0.25743%0.432SS..Hα-helixtrans-85.8-37.3175-68176.5000112.4A114 K117 V118 L256 Q257 R258 G262 H263A114-L260 HydrophobicContact CB-CD2 3.9Å; K117-L260 HydrophobicContact CB-CD2 4.44Å; K117-L260 HydrophobicContact CD-CD2 4.39Å; V118-L260 HydrophobicContact CG2-CD1 3.92Å; V118-L260 HydrophobicContact CG2-CD2 4.45Å; L256-L260 HydrophobicContact CD1-CD1 3.87Å; L256-L260 HydrophobicContact CD1-CD2 4.42Å; L256-L260 HydrophobicContact CD1-CG 3.89Å; L256-L260 HydrophobicContact CG-CD1 3.95Å; L256-L260 HydrophobicContact CG-CG 4.36Å; L256-L260 WeakPolarHBondContact O-CG 3.49Å; L256-L260 PolarHBondContact O-N 3.27Å; Q257-L260 PolarHBondContact O-N 3.46Å; R258-L260 VanDerWaalsContact C-N 3.26Å; R258-L260 PolarHBondContact O-N 3.06Å; L260-G262 PolarHBondContact O-N 3.38Å; L260-H263 PolarHBondContact O-N 3.24Å
261S87.5Confident75.5Confident72 Ų7278.3 Ų78.350%0.50344%0.438SS..Hα-helixtrans-59.3-31.8176.1-61.50000112.9Q257 R258 H263 V264 C265Q257-S261 PolarHBondContact O-N 2.97Å; Q257-S261 PolarHBondContact O-OG 3.4Å; Q257-S261 VanDerWaalsContact O-OG 3.07Å; R258-S261 PolarHBondContact O-N 3.36Å; S261-H263 VanDerWaalsContact C-N 3.27Å; S261-H263 PolarHBondContact O-N 2.99Å; S261-V264 PolarHBondContact O-N 3.1Å; S261-C265 PolarHBondContact O-N 3.23Å
262G72.7Confident73Confident39 Ų3982.6 Ų82.640%0.40246%0.456SS..Hα-helixtrans-61.1-30.6174.700000114.3R258 L260R258-G262 PolarHBondContact O-N 3.02Å; L260-G262 PolarHBondContact O-N 3.38Å
263H60.2Low70.2Confident49 Ų4992.9 Ų92.923%0.22750%0.5CS..Hα-helixtrans-77.4-34.9179.2-68.9157.6000113S113 K117 L260 S261 C265 C266 A267S113-H263 PolarHBondContact OG-CE1 3.13Å; S113-H263 VanDerWaalsContact OG-CE1 3.26Å; K117-H263 WeakPolarHBondContact CE-CE1 3.49Å; K117-H263 PolarHBondContact NZ-CE1 2.96Å; K117-H263 PolarHBondContact NZ-NE2 3.32Å; L260-H263 PolarHBondContact O-N 3.24Å; S261-H263 VanDerWaalsContact C-N 3.27Å; S261-H263 PolarHBondContact O-N 2.99Å; H263-C265 VanDerWaalsContact C-N 3.28Å; H263-C265 PolarHBondContact O-N 3.21Å; H263-C266 PolarHBondContact O-N 3.27Å; H263-A267 PolarHBondContact O-N 2.81Å
264V53.8Low68.9Low91 Ų9194 Ų9455%0.55250%0.502SS*.Hα-helixtrans-64.2-37.5177.3-177.50000110.5S261 A267 L268S261-V264 PolarHBondContact O-N 3.1Å; V264-A267 PolarHBondContact O-N 3.3Å; V264-L268 HydrophobicContact CG1-CD1 4.12Å; V264-L268 PolarHBondContact O-N 3.33Å; V264-L268 VanDerWaalsContact O-N 3.15Å
265C47.5Very low67.3Low80 Ų8094.8 Ų94.854%0.54151%0.511SS..Hα-helixtrans-68.4-35.2179-159.20000112.9S261 H263 R269S261-C265 PolarHBondContact O-N 3.23Å; H263-C265 VanDerWaalsContact C-N 3.28Å; H263-C265 PolarHBondContact O-N 3.21Å; C265-R269 PolarHBondContact O-N 3.37Å
266C49.5Very low65.7Low86 Ų8696.2 Ų96.258%0.58152%0.519SS*.Hα-helixtrans-74.5-38.5176.4-65.80000112.4H263 R269 A270H263-C266 PolarHBondContact O-N 3.27Å; C266-R269 PolarHBondContact O-N 2.98Å; C266-A270 PolarHBondContact O-N 3.44Å
267A50.2Low63.8Low26 Ų26100.6 Ų100.622%0.21554%0.543CS..Hα-helixtrans-62.9-43177.700000112.1L110 H263 V264 R269 A270 S271L110-A267 HydrophobicContact CD1-CB 3.54Å; L110-A267 HydrophobicContact CD2-CB 4.35Å; H263-A267 PolarHBondContact O-N 2.81Å; V264-A267 PolarHBondContact O-N 3.3Å; A267-R269 VanDerWaalsContact C-N 3.27Å; A267-R269 PolarHBondContact O-N 3.47Å; A267-A270 PolarHBondContact O-N 3.49Å; A267-S271 PolarHBondContact O-N 2.75Å; A267-S271 VanDerWaalsContact O-N 3.16Å; A267-S271 PolarHBondContact O-OG 2.98Å
268L45.9Very low61.8Low108 Ų10898.6 Ų98.657%0.56554%0.538SS*.Hα-helixtrans-64.4-29.7175.3-81.5161.2000112.9V264 F272V264-L268 HydrophobicContact CG1-CD1 4.12Å; V264-L268 PolarHBondContact O-N 3.33Å; V264-L268 VanDerWaalsContact O-N 3.15Å; L268-F272 WeakPolarHBondContact O-CD2 3.46Å
269R47.1Very low59.5Low195 Ų19595.4 Ų95.474%0.73654%0.537SS*.Hα-helixtrans-75-34.8173.9-85.3-176.9172.3-177.4-1.6113C265 C266 A267 S271 F272C265-R269 PolarHBondContact O-N 3.37Å; C266-R269 PolarHBondContact O-N 2.98Å; A267-R269 VanDerWaalsContact C-N 3.27Å; A267-R269 PolarHBondContact O-N 3.47Å; R269-S271 VanDerWaalsContact C-N 3.34Å; R269-F272 PolarHBondContact O-N 3.37Å
270A51.2Low57.1Low70 Ų7099.3 Ų99.358%0.57955%0.551SS**Hα-helixtrans-74.7-22.5179.400000113.2C266 A267 F272C266-A270 PolarHBondContact O-N 3.44Å; A267-A270 PolarHBondContact O-N 3.49Å; A270-F272 VanDerWaalsContact C-N 3.26Å; A270-F272 PolarHBondContact O-N 3.27Å
271S52.8Low54.3Low98 Ų98103.2 Ų103.269%0.68557%0.574SS**THydrogen-bonded Turntrans-80.6-2.9174.5-51.90000114.3A267 R269A267-S271 PolarHBondContact O-N 2.75Å; A267-S271 VanDerWaalsContact O-N 3.16Å; A267-S271 PolarHBondContact O-OG 2.98Å; R269-S271 VanDerWaalsContact C-N 3.34Å
272F46.9Very low51.5Low175 Ų175105.8 Ų105.877%0.76858%0.58SS**THydrogen-bonded Turntrans-113.38.3-178.4-91.8-84.8000114L268 R269 A270L268-F272 WeakPolarHBondContact O-CD2 3.46Å; R269-F272 PolarHBondContact O-N 3.37Å; A270-F272 VanDerWaalsContact C-N 3.26Å; A270-F272 PolarHBondContact O-N 3.27Å
273F40.5Very low49.6Very low252 Ų252111.8 Ų111.8100%1.10560%0.596SS**  trans-127.90171.6-87.2-85.8000109.7

Retrieved 273 of 273 residues in 65.6 ms (Link to these results)

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