A0A093HYT0_STRCA Loading...

Lysophosphatidic acid receptor 4

AlphaFold DB , UniProt , Accession A0A093HYT0, Species STRCA (Struthio camelus australis), Gene n/a, Length 348 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
1M36.1Very low49.1Very low249 Ų249129.2 Ų129.2100%1.22772%0.718SS**  091.70-81.7161.616100108.2
2G34.1Very low51.3Low75 Ų75121 Ų12177%0.77367%0.674SS**  trans-81.9116.9179.900000110H4G2-H4 PolarHBondContact O-N 3.43Å; G2-H4 VanDerWaalsContact O-N 3.13Å
3N39Very low53.3Low160 Ų160121 Ų12186%0.85667%0.672SS**  trans-78.192.1-179.8-149.314.2000108.7S5N3-S5 PolarHBondContact O-N 3.39Å
4H38.6Very low55.3Low169 Ų169116.7 Ų116.778%0.78265%0.647SS**  trans-7393.7171-99.2-68.2000109.2G2 N6G2-H4 PolarHBondContact O-N 3.43Å; G2-H4 VanDerWaalsContact O-N 3.13Å; H4-N6 PolarHBondContact O-N 3.18Å
5S43.6Very low57.3Low106 Ų106111.2 Ų111.274%0.74162%0.62SS**  trans-66.886161.230.70000108.9N3 N7N3-S5 PolarHBondContact O-N 3.39Å; S5-N7 PolarHBondContact O-N 3.45Å
6N41.5Very low59.4Low103 Ų103108.6 Ų108.655%0.55160%0.6SS**  trans-63.696.8170.5-77.5-17.9000108.9H4 H8H4-N6 PolarHBondContact O-N 3.18Å; N6-H8 WeakPolarHBondContact CB-NE2 3.45Å; N6-H8 PolarHBondContact O-CD2 2.9Å; N6-H8 PolarHBondContact O-N 2.94Å
7N43.5Very low61.3Low149 Ų149103.3 Ų103.380%0.79757%0.57SS**  trans-61.583.2159.8-90.7-23000108S5 T9S5-N7 PolarHBondContact O-N 3.45Å; N7-T9 PolarHBondContact O-N 3.01Å
8H54.2Low63Low156 Ų15699.2 Ų99.272%0.72255%0.545SS*.  trans-68.380.8176.6-76.6-72.5000109.7N6 C10N6-H8 WeakPolarHBondContact CB-NE2 3.45Å; N6-H8 PolarHBondContact O-CD2 2.9Å; N6-H8 PolarHBondContact O-N 2.94Å; H8-C10 PolarHBondContact O-N 3.14Å
9T64.1Low64.6Low99 Ų9999.4 Ų99.461%0.60755%0.545SS*.  trans-81.3109.2166.743.30000108N7 L11N7-T9 PolarHBondContact O-N 3.01Å; T9-L11 PolarHBondContact O-N 3.33Å
10C72.9Confident66.1Low20 Ų2096.9 Ų96.914%0.13553%0.53CS..  trans-73.391.1175.8-70.20000110H8 T12 C262H8-C10 PolarHBondContact O-N 3.14Å; C10-T12 PolarHBondContact O-N 2.94Å; C10-C262 HydrophobicContact CB-CB 4.37Å; C10-C262 WeakPolarHBondContact CB-SG 3.22Å; C10-C262 WeakPolarHBondContact SG-CA 3.33Å; C10-C262 WeakPolarHBondContact SG-CB 3.09Å; C10-C262 CovalentContact SG-SG 2.04Å; C10-C262 PolarHBondContact SG-SG 2.72Å
11L72.9Confident67.5Low135 Ų13593 Ų9371%0.70751%0.508SS*.  trans-69124.9176.9-62.6174.9000109.9T9 R266T9-L11 PolarHBondContact O-N 3.33Å; L11-R266 PolarHBondContact O-NH2 3.45Å
12T74.7Confident70.3Confident31 Ų3181.2 Ų81.219%0.1945%0.45CS..  trans-141.2122.4173.5-54.10000106.7C10 D14 R266 R269C10-T12 PolarHBondContact O-N 2.94Å; T12-D14 PolarHBondContact O-N 2.79Å; T12-R266 HydrophobicContact CG2-CG 4.1Å; T12-R269 HydrophobicContact CG2-CB 4.4Å
13D78.3Confident73.3Confident121 Ų12180.1 Ų80.165%0.64743%0.434SS*.  trans-75.5114.1171.4179.611.5000108.8S15D13-S15 WeakPolarHBondContact OD1-CB 3.42Å; D13-S15 PolarHBondContact OD1-N 3.29Å; D13-S15 PolarHBondContact OD1-OG 2.94Å; D13-S15 PolarHBondContact OD2-OG 3.1Å
14D81.3Confident76.1Confident61 Ų6174 Ų7433%0.32640%0.402SS..  trans-104.610.9179.469.2-25.4000112.3T12 F16 K17T12-D14 PolarHBondContact O-N 2.79Å; D14-F16 PolarHBondContact O-N 3.49Å; D14-K17 HydrophobicContact CB-CD 4.23Å; D14-K17 WeakPolarHBondContact O-CB 3.41Å; D14-K17 VanDerWaalsContact O-CD 3.27Å; D14-K17 WeakPolarHBondContact O-CD 3.44Å; D14-K17 WeakPolarHBondContact O-CG 3.43Å; D14-K17 PolarHBondContact O-N 2.9Å; D14-K17 VanDerWaalsContact O-N 3.11Å; D14-K17 WeakPolarHBondContact OD2-CE 3.35Å; D14-K17 IonicContact OD2-NZ 2.7Å; D14-K17 PolarHBondContact OD2-NZ 3.42Å
15S85.2Confident78.9Confident34 Ų3466.6 Ų66.624%0.23837%0.367CS..THydrogen-bonded Turntrans-63.4-24.5-176.567.60000114D13 K17 Y18D13-S15 WeakPolarHBondContact OD1-CB 3.42Å; D13-S15 PolarHBondContact OD1-N 3.29Å; D13-S15 PolarHBondContact OD1-OG 2.94Å; D13-S15 PolarHBondContact OD2-OG 3.1Å; S15-K17 PolarHBondContact O-N 3.22Å; S15-Y18 WeakPolarHBondContact O-CD2 3.49Å; S15-Y18 PolarHBondContact O-N 3.49Å
16F91.4Very high81.4Confident69 Ų6963.3 Ų63.330%0.30334%0.344SS..Hα-helixtrans-59.9-27.5175.479.8-88.5000112.7D14 Y18 N19 L20 T270 P273 I274D14-F16 PolarHBondContact O-N 3.49Å; F16-Y18 PolarHBondContact O-N 2.86Å; F16-N19 PolarHBondContact O-N 3.36Å; F16-L20 HydrophobicContact CD2-CD2 4.48Å; F16-L20 HydrophobicContact CE2-CD2 4.14Å; F16-L20 PolarHBondContact O-N 3.25Å; F16-T270 HydrophobicContact CE1-CG2 4.38Å; F16-T270 HydrophobicContact CZ-CG2 4.15Å; F16-P273 HydrophobicContact CE2-CB 4.35Å; F16-P273 HydrophobicContact CZ-CB 4.43Å; F16-P273 HydrophobicContact CZ-CG 4.21Å; F16-I274 HydrophobicContact CE2-CG1 4.37Å
17K91.5Very high84.1Confident19 Ų1962 Ų628%0.08334%0.339CS..Hα-helixtrans-58.6-34.3-177.579.2-166.9169.4177.70112D14 S15 L20 Y21 E169 P273D14-K17 HydrophobicContact CB-CD 4.23Å; D14-K17 WeakPolarHBondContact O-CB 3.41Å; D14-K17 VanDerWaalsContact O-CD 3.27Å; D14-K17 WeakPolarHBondContact O-CD 3.44Å; D14-K17 WeakPolarHBondContact O-CG 3.43Å; D14-K17 PolarHBondContact O-N 2.9Å; D14-K17 VanDerWaalsContact O-N 3.11Å; D14-K17 WeakPolarHBondContact OD2-CE 3.35Å; D14-K17 IonicContact OD2-NZ 2.7Å; D14-K17 PolarHBondContact OD2-NZ 3.42Å; S15-K17 PolarHBondContact O-N 3.22Å; K17-L20 PolarHBondContact O-N 3.41Å; K17-Y21 HydrophobicContact CB-CD2 4.37Å; K17-Y21 HydrophobicContact CB-CE2 3.99Å; K17-Y21 HydrophobicContact CD-CE2 4.36Å; K17-Y21 HydrophobicContact CG-CD2 4.35Å; K17-Y21 HydrophobicContact CG-CE2 4Å; K17-Y21 VanDerWaalsContact O-CB 3.29Å; K17-Y21 WeakPolarHBondContact O-CB 3.41Å; K17-Y21 VanDerWaalsContact O-CD2 3.25Å; K17-Y21 WeakPolarHBondContact O-CD2 3.48Å; K17-Y21 PolarHBondContact O-N 2.92Å; K17-E169 IonicContact NZ-OE2 3.87Å; K17-E169 PolarHBondContact NZ-OE2 3.5Å; K17-P273 HydrophobicContact CB-CB 3.83Å; K17-P273 HydrophobicContact CB-CG 3.76Å
18Y91.1Very high86.7Confident30 Ų3054.9 Ų54.912%0.11830%0.302CS..Hα-helixtrans-65.9-46.6-178.5-66.7-67.3000111.4S15 F16 G22 Y77 R81 E169S15-Y18 WeakPolarHBondContact O-CD2 3.49Å; S15-Y18 PolarHBondContact O-N 3.49Å; F16-Y18 PolarHBondContact O-N 2.86Å; Y18-G22 PolarHBondContact O-N 3.45Å; Y18-Y77 HydrophobicContact CE1-CE1 4.46Å; Y18-R81 HydrophobicContact CG-CG 4.42Å; Y18-E169 PolarHBondContact OH-OE2 2.95Å
19N93.6Very high88.7Confident102 Ų10250.2 Ų50.255%0.54528%0.279SS..Hα-helixtrans-66.2-41.7176.6-67.8-18000111.2F16 G22 A23F16-N19 PolarHBondContact O-N 3.36Å; N19-G22 PolarHBondContact O-N 2.92Å; N19-A23 WeakPolarHBondContact O-CB 3.47Å; N19-A23 PolarHBondContact O-N 3.16Å
20L94.9Very high90.3Very high50 Ų5050 Ų5026%0.26227%0.274SS..Hα-helixtrans-60.9-51.8177.3178.265000111.7F16 K17 A23 V24 P273 I274F16-L20 HydrophobicContact CD2-CD2 4.48Å; F16-L20 HydrophobicContact CE2-CD2 4.14Å; F16-L20 PolarHBondContact O-N 3.25Å; K17-L20 PolarHBondContact O-N 3.41Å; L20-A23 PolarHBondContact O-N 3.24Å; L20-V24 HydrophobicContact CD1-CG2 3.97Å; L20-V24 WeakPolarHBondContact O-CB 3.19Å; L20-V24 WeakPolarHBondContact O-CG2 3.47Å; L20-V24 PolarHBondContact O-N 3.02Å; L20-P273 HydrophobicContact CD2-CB 4.18Å; L20-I274 HydrophobicContact CD2-CG1 3.98Å
21Y94.9Very high91.4Very high16 Ų1652.9 Ų52.96%0.06329%0.287CS..Hα-helixtrans-60.8-45.4177.3-67.6-25000111.5K17 A23 Y25 N78 P273 L276K17-Y21 HydrophobicContact CB-CD2 4.37Å; K17-Y21 HydrophobicContact CB-CE2 3.99Å; K17-Y21 HydrophobicContact CD-CE2 4.36Å; K17-Y21 HydrophobicContact CG-CD2 4.35Å; K17-Y21 HydrophobicContact CG-CE2 4Å; K17-Y21 VanDerWaalsContact O-CB 3.29Å; K17-Y21 WeakPolarHBondContact O-CB 3.41Å; K17-Y21 VanDerWaalsContact O-CD2 3.25Å; K17-Y21 WeakPolarHBondContact O-CD2 3.48Å; K17-Y21 PolarHBondContact O-N 2.92Å; Y21-A23 PolarHBondContact O-N 3.32Å; Y21-Y25 HydrophobicContact CG-CE2 4.21Å; Y21-Y25 WeakPolarHBondContact O-CB 3.21Å; Y21-Y25 WeakPolarHBondContact O-CD2 3.48Å; Y21-Y25 PolarHBondContact O-N 3.47Å; Y21-N78 VanDerWaalsContact CB-CG 3.5Å; Y21-N78 WeakPolarHBondContact CB-OD1 3.46Å; Y21-N78 WeakPolarHBondContact CD2-OD1 3.43Å; Y21-P273 HydrophobicContact CE1-CB 3.73Å; Y21-P273 VanDerWaalsContact OH-CA 3.28Å; Y21-P273 WeakPolarHBondContact OH-CA 3.46Å; Y21-P273 WeakPolarHBondContact OH-CB 3Å; Y21-L276 HydrophobicContact CE1-CD2 3.77Å; Y21-L276 HydrophobicContact CE1-CG 4.35Å; Y21-L276 WeakPolarHBondContact OH-CD2 3.45Å
22G95.5Very high92.5Very high0 Ų046.5 Ų46.50%025%0.254CS..Hα-helixtrans-56.4-48.2177.500000112.4Y18 N19 S26Y18-G22 PolarHBondContact O-N 3.45Å; N19-G22 PolarHBondContact O-N 2.92Å; G22-S26 WeakPolarHBondContact O-CB 3.43Å; G22-S26 PolarHBondContact O-N 3.17Å; G22-S26 PolarHBondContact O-OG 3.38Å
23A96.8Very high93.5Very high53 Ų5347.1 Ų47.144%0.43826%0.256SS..Hα-helixtrans-66.8-52.4179.300000112.5N19 L20 Y21 S26 V27N19-A23 WeakPolarHBondContact O-CB 3.47Å; N19-A23 PolarHBondContact O-N 3.16Å; L20-A23 PolarHBondContact O-N 3.24Å; Y21-A23 PolarHBondContact O-N 3.32Å; A23-S26 WeakPolarHBondContact O-CB 3.39Å; A23-S26 PolarHBondContact O-N 3.15Å; A23-V27 PolarHBondContact O-N 2.91Å
24V97.1Very high94.3Very high30 Ų3046.7 Ų46.718%0.18225%0.252CS..Hα-helixtrans-66.3-44.2-176.3174.90000111.2L20 S26 V27 V28 C277 M281L20-V24 HydrophobicContact CD1-CG2 3.97Å; L20-V24 WeakPolarHBondContact O-CB 3.19Å; L20-V24 WeakPolarHBondContact O-CG2 3.47Å; L20-V24 PolarHBondContact O-N 3.02Å; V24-S26 PolarHBondContact O-N 3.38Å; V24-V27 PolarHBondContact O-N 2.87Å; V24-V27 VanDerWaalsContact O-N 3.14Å; V24-V28 HydrophobicContact CG1-CG2 4.04Å; V24-V28 WeakPolarHBondContact O-CG2 3.27Å; V24-V28 PolarHBondContact O-N 3.21Å; V24-C277 HydrophobicContact CB-CB 4.23Å; V24-C277 HydrophobicContact CG1-CB 3.87Å; V24-C277 HydrophobicContact CG2-CB 4.08Å; V24-M281 HydrophobicContact CG1-CG 4.38Å
25Y97.3Very high94.9Very high15 Ų1545.4 Ų45.46%0.05925%0.247CC..Hα-helixtrans-64-31178-66.2-14.5000112.4Y21 F29 L71 K74 T280Y21-Y25 HydrophobicContact CG-CE2 4.21Å; Y21-Y25 WeakPolarHBondContact O-CB 3.21Å; Y21-Y25 WeakPolarHBondContact O-CD2 3.48Å; Y21-Y25 PolarHBondContact O-N 3.47Å; Y25-F29 WeakPolarHBondContact O-CB 3.48Å; Y25-F29 PolarHBondContact O-N 3.21Å; Y25-L71 HydrophobicContact CD1-CD2 4.08Å; Y25-L71 HydrophobicContact CD2-CD2 4.19Å; Y25-L71 HydrophobicContact CG-CD2 3.85Å; Y25-K74 HydrophobicContact CD2-CB 3.98Å; Y25-K74 HydrophobicContact CE2-CB 4.19Å; Y25-T280 HydrophobicContact CE1-CG2 3.95Å
26S97.7Very high95.4Very high36 Ų3643.8 Ų43.825%0.25224%0.235SC..Hα-helixtrans-64.9-43.8173.3-600000111.7G22 A23 V24 F29 I30G22-S26 WeakPolarHBondContact O-CB 3.43Å; G22-S26 PolarHBondContact O-N 3.17Å; G22-S26 PolarHBondContact O-OG 3.38Å; A23-S26 WeakPolarHBondContact O-CB 3.39Å; A23-S26 PolarHBondContact O-N 3.15Å; V24-S26 PolarHBondContact O-N 3.38Å; S26-F29 PolarHBondContact O-N 3.14Å; S26-I30 WeakPolarHBondContact O-CG1 3.49Å; S26-I30 PolarHBondContact O-N 3.12Å; S26-I30 VanDerWaalsContact O-N 3.16Å
27V97.3Very high95.5Very high75 Ų7543.2 Ų43.246%0.45524%0.239SC..Hα-helixtrans-64.3-47.8175.4174.50000111A23 V24 F29 I30 L31A23-V27 PolarHBondContact O-N 2.91Å; V24-V27 PolarHBondContact O-N 2.87Å; V24-V27 VanDerWaalsContact O-N 3.14Å; V27-F29 VanDerWaalsContact C-N 3.29Å; V27-F29 PolarHBondContact O-N 2.62Å; V27-I30 PolarHBondContact O-N 3.31Å; V27-L31 HydrophobicContact CG1-CD1 3.7Å; V27-L31 HydrophobicContact CG1-CG 4.23Å; V27-L31 WeakPolarHBondContact O-CB 3.29Å; V27-L31 WeakPolarHBondContact O-CG 3.41Å; V27-L31 PolarHBondContact O-N 3.15Å
28V97.2Very high95.5Very high1 Ų144.2 Ų44.21%0.00625%0.251CS..Hα-helixtrans-62.8-37.3179175.20000111.2V24 G32 F67 L71 T280 M281 C283V24-V28 HydrophobicContact CG1-CG2 4.04Å; V24-V28 WeakPolarHBondContact O-CG2 3.27Å; V24-V28 PolarHBondContact O-N 3.21Å; V28-G32 WeakPolarHBondContact O-CA 3.05Å; V28-G32 PolarHBondContact O-N 2.7Å; V28-F67 HydrophobicContact CG1-CE1 4.41Å; V28-L71 HydrophobicContact CB-CD1 4.05Å; V28-L71 HydrophobicContact CG1-CD1 3.71Å; V28-T280 WeakPolarHBondContact CG1-O 3.46Å; V28-M281 HydrophobicContact CG2-CG 4.13Å; V28-C283 HydrophobicContact CG1-CB 4.36Å
29F97.9Very high95.5Very high57 Ų5742.9 Ų42.925%0.2525%0.246CC..Hα-helixtrans-61-52.6175.8173.6-108.9000111.4Y25 S26 V27 L33 V68 L71 P72 I75Y25-F29 WeakPolarHBondContact O-CB 3.48Å; Y25-F29 PolarHBondContact O-N 3.21Å; S26-F29 PolarHBondContact O-N 3.14Å; V27-F29 VanDerWaalsContact C-N 3.29Å; V27-F29 PolarHBondContact O-N 2.62Å; F29-L33 HydrophobicContact CE2-CD2 4.26Å; F29-L33 HydrophobicContact CZ-CD2 4.1Å; F29-L33 WeakPolarHBondContact O-CB 3.41Å; F29-L33 PolarHBondContact O-N 3.26Å; F29-V68 HydrophobicContact CD2-CG1 3.78Å; F29-V68 WeakPolarHBondContact CD2-O 3.08Å; F29-V68 HydrophobicContact CE2-CG1 4.3Å; F29-L71 HydrophobicContact CB-CB 4.17Å; F29-L71 HydrophobicContact CB-CD1 4.1Å; F29-L71 HydrophobicContact CD2-CB 4.34Å; F29-P72 HydrophobicContact CD2-CG 3.89Å; F29-P72 HydrophobicContact CE2-CG 3.53Å; F29-P72 HydrophobicContact CZ-CG 3.89Å; F29-I75 HydrophobicContact CB-CD1 4.19Å
30I96.9Very high95.4Very high95 Ų9540.1 Ų40.149%0.48723%0.231SC..Hα-helixtrans-64.6-54.5-177.7-64.7168.6000110.6S26 V27 I34S26-I30 WeakPolarHBondContact O-CG1 3.49Å; S26-I30 PolarHBondContact O-N 3.12Å; S26-I30 VanDerWaalsContact O-N 3.16Å; V27-I30 PolarHBondContact O-N 3.31Å; I30-I34 HydrophobicContact CG2-CD1 3.91Å; I30-I34 WeakPolarHBondContact O-CD1 3.35Å; I30-I34 VanDerWaalsContact O-CG1 3.23Å; I30-I34 WeakPolarHBondContact O-CG1 3.45Å; I30-I34 PolarHBondContact O-N 3.15Å
31L96.4Very high95.1Very high81 Ų8142.9 Ų42.942%0.42424%0.241SC..Hα-helixtrans-67.2-50.6-176-65.4-177000110.9V27 L33 I34 T35 C284V27-L31 HydrophobicContact CG1-CD1 3.7Å; V27-L31 HydrophobicContact CG1-CG 4.23Å; V27-L31 WeakPolarHBondContact O-CB 3.29Å; V27-L31 WeakPolarHBondContact O-CG 3.41Å; V27-L31 PolarHBondContact O-N 3.15Å; L31-L33 VanDerWaalsContact C-N 3.33Å; L31-L33 PolarHBondContact O-N 3.46Å; L31-I34 PolarHBondContact O-N 3.45Å; L31-T35 WeakPolarHBondContact O-CB 3.24Å; L31-T35 VanDerWaalsContact O-CG2 3.27Å; L31-T35 WeakPolarHBondContact O-CG2 3.2Å; L31-T35 PolarHBondContact O-N 2.94Å; L31-T35 PolarHBondContact O-OG1 2.75Å; L31-C284 HydrophobicContact CB-CB 4.45Å
32G96.1Very high94.7Very high0 Ų042.6 Ų42.60%024%0.241CC..Hα-helixtrans-60.3-39.3-178.600000112.8V28 T35 N36V28-G32 WeakPolarHBondContact O-CA 3.05Å; V28-G32 PolarHBondContact O-N 2.7Å; G32-T35 PolarHBondContact O-OG1 3.19Å; G32-N36 WeakPolarHBondContact O-CB 3.49Å; G32-N36 PolarHBondContact O-N 3.4Å; G32-N36 PolarHBondContact O-ND2 3.1Å
33L96.1Very high94.3Very high45 Ų4542.6 Ų42.624%0.23624%0.241CC..Hα-helixtrans-65.1-52.4176.7-174.865.5000110.9F29 L31 T35 C37 L65 V68 F69F29-L33 HydrophobicContact CE2-CD2 4.26Å; F29-L33 HydrophobicContact CZ-CD2 4.1Å; F29-L33 WeakPolarHBondContact O-CB 3.41Å; F29-L33 PolarHBondContact O-N 3.26Å; L31-L33 VanDerWaalsContact C-N 3.33Å; L31-L33 PolarHBondContact O-N 3.46Å; L33-T35 PolarHBondContact O-N 3.07Å; L33-C37 WeakPolarHBondContact O-CB 3.49Å; L33-C37 PolarHBondContact O-N 3.39Å; L33-C37 PolarHBondContact O-SG 3.41Å; L33-L65 HydrophobicContact CD1-CD2 4Å; L33-V68 HydrophobicContact CB-CG1 3.83Å; L33-V68 HydrophobicContact CD1-CG1 4.28Å; L33-F69 HydrophobicContact CD1-CE1 3.8Å; L33-F69 HydrophobicContact CD1-CZ 3.94Å
34I95Very high93.6Very high111 Ų11142.8 Ų42.857%0.56924%0.238SC*.Hα-helixtrans-59.7-49.6-177.8-67.5168.6000110.3I30 L31 A38I30-I34 HydrophobicContact CG2-CD1 3.91Å; I30-I34 WeakPolarHBondContact O-CD1 3.35Å; I30-I34 VanDerWaalsContact O-CG1 3.23Å; I30-I34 WeakPolarHBondContact O-CG1 3.45Å; I30-I34 PolarHBondContact O-N 3.15Å; L31-I34 PolarHBondContact O-N 3.45Å; I34-A38 VanDerWaalsContact O-CB 3.24Å; I34-A38 WeakPolarHBondContact O-CB 3.42Å; I34-A38 PolarHBondContact O-N 3.03Å
35T93Very high92.8Very high35 Ų3544.7 Ų44.722%0.21525%0.252CS..Hα-helixtrans-73-40.9-172.561.30000112.8L31 G32 L33 S39 P287L31-T35 WeakPolarHBondContact O-CB 3.24Å; L31-T35 VanDerWaalsContact O-CG2 3.27Å; L31-T35 WeakPolarHBondContact O-CG2 3.2Å; L31-T35 PolarHBondContact O-N 2.94Å; L31-T35 PolarHBondContact O-OG1 2.75Å; G32-T35 PolarHBondContact O-OG1 3.19Å; L33-T35 PolarHBondContact O-N 3.07Å; T35-S39 WeakPolarHBondContact O-CB 3.4Å; T35-S39 PolarHBondContact O-N 3.47Å; T35-S39 PolarHBondContact O-OG 3.1Å; T35-P287 VanDerWaalsContact CB-CG 3.41Å; T35-P287 HydrophobicContact CG2-CG 3.89Å
36N94.8Very high91.8Very high0 Ų051 Ų510%028%0.276CS..Hα-helixtrans-75.8-36.2-179.9-70.8-69.5000112.3G32 S39 L40 L65 C283G32-N36 WeakPolarHBondContact O-CB 3.49Å; G32-N36 PolarHBondContact O-N 3.4Å; G32-N36 PolarHBondContact O-ND2 3.1Å; N36-S39 PolarHBondContact O-N 3.02Å; N36-L40 WeakPolarHBondContact O-CB 3.47Å; N36-L40 PolarHBondContact O-N 3.45Å; N36-L65 HydrophobicContact CB-CD1 4.37Å; N36-L65 HydrophobicContact CB-CD2 3.79Å; N36-L65 HydrophobicContact CB-CG 3.77Å; N36-C283 PolarHBondContact ND2-O 2.92Å
37C94.6Very high90.8Very high57 Ų5750 Ų5039%0.38527%0.267SS..Hα-helixtrans-61.9-45170.9-73.30000111.6L33 S39 L40 F41 L65L33-C37 WeakPolarHBondContact O-CB 3.49Å; L33-C37 PolarHBondContact O-N 3.39Å; L33-C37 PolarHBondContact O-SG 3.41Å; C37-S39 VanDerWaalsContact C-N 3.3Å; C37-S39 PolarHBondContact O-N 3.07Å; C37-L40 PolarHBondContact O-N 2.9Å; C37-F41 WeakPolarHBondContact O-CB 3.44Å; C37-F41 PolarHBondContact O-N 2.87Å; C37-L65 VanDerWaalsContact SG-CD2 3.6Å
38A91.1Very high89.7Confident39 Ų3952.7 Ų52.732%0.32227%0.273SS..Hα-helixtrans-61.1-4117600000111.7I34 F41 V42I34-A38 VanDerWaalsContact O-CB 3.24Å; I34-A38 WeakPolarHBondContact O-CB 3.42Å; I34-A38 PolarHBondContact O-N 3.03Å; A38-F41 PolarHBondContact O-N 3.28Å; A38-V42 WeakPolarHBondContact O-CG2 3.46Å; A38-V42 PolarHBondContact O-N 2.9Å; A38-V42 VanDerWaalsContact O-N 3.1Å
39S91.1Very high88.5Confident2 Ų255.7 Ų55.71%0.01429%0.288CS..Hα-helixtrans-66-45.6178.8-59.50000111.9T35 N36 C37 F41 V42 F43 Y290T35-S39 WeakPolarHBondContact O-CB 3.4Å; T35-S39 PolarHBondContact O-N 3.47Å; T35-S39 PolarHBondContact O-OG 3.1Å; N36-S39 PolarHBondContact O-N 3.02Å; C37-S39 VanDerWaalsContact C-N 3.3Å; C37-S39 PolarHBondContact O-N 3.07Å; S39-F41 VanDerWaalsContact C-N 3.32Å; S39-F41 PolarHBondContact O-N 3.09Å; S39-V42 PolarHBondContact O-N 2.96Å; S39-V42 VanDerWaalsContact O-N 3.1Å; S39-F43 WeakPolarHBondContact O-CD2 3.34Å; S39-F43 VanDerWaalsContact O-CG 3.27Å; S39-F43 WeakPolarHBondContact O-CG 3.43Å; S39-F43 PolarHBondContact O-N 3.46Å; S39-Y290 WeakPolarHBondContact OG-CD2 3.35Å
40L91.3Very high87.3Confident44 Ų4460.8 Ų60.823%0.2331%0.305CS..Hα-helixtrans-60.7-41.9177.3-165.968.9000111.6N36 C37 V42 F43 C44 T58 V62 L65N36-L40 WeakPolarHBondContact O-CB 3.47Å; N36-L40 PolarHBondContact O-N 3.45Å; C37-L40 PolarHBondContact O-N 2.9Å; L40-V42 PolarHBondContact O-N 3.37Å; L40-F43 PolarHBondContact O-N 2.89Å; L40-C44 VanDerWaalsContact O-CB 3.31Å; L40-C44 WeakPolarHBondContact O-CB 3.49Å; L40-C44 PolarHBondContact O-N 3.07Å; L40-C44 PolarHBondContact O-SG 3.42Å; L40-C44 VanDerWaalsContact O-SG 3.39Å; L40-T58 HydrophobicContact CD1-CG2 3.73Å; L40-V62 HydrophobicContact CD1-CG2 4Å; L40-L65 HydrophobicContact CD2-CD1 4Å
41F89.2Confident86.5Confident108 Ų10858 Ų5847%0.47430%0.295SS..Hα-helixtrans-58.4-45.4173174.4-96000112C37 A38 S39 C45 R46C37-F41 WeakPolarHBondContact O-CB 3.44Å; C37-F41 PolarHBondContact O-N 2.87Å; A38-F41 PolarHBondContact O-N 3.28Å; S39-F41 VanDerWaalsContact C-N 3.32Å; S39-F41 PolarHBondContact O-N 3.09Å; F41-C45 HydrophobicContact CD2-CB 4.21Å; F41-C45 HydrophobicContact CE2-CB 4.03Å; F41-C45 HydrophobicContact CZ-CB 4.36Å; F41-C45 WeakPolarHBondContact O-CB 3.42Å; F41-C45 PolarHBondContact O-N 3.18Å; F41-R46 HydrophobicContact CE1-CG 4.42Å
42V86.8Confident86Confident11 Ų1156.4 Ų56.47%0.06729%0.285CS..Iπ-helixtrans-63.3-44.5177.2173.60000110.9A38 S39 L40 R46 M47 F297A38-V42 WeakPolarHBondContact O-CG2 3.46Å; A38-V42 PolarHBondContact O-N 2.9Å; A38-V42 VanDerWaalsContact O-N 3.1Å; S39-V42 PolarHBondContact O-N 2.96Å; S39-V42 VanDerWaalsContact O-N 3.1Å; L40-V42 PolarHBondContact O-N 3.37Å; V42-R46 HydrophobicContact CG1-CB 4.39Å; V42-R46 CarbonylContact O-C 3.58Å; V42-R46 WeakPolarHBondContact O-CA 3.14Å; V42-R46 VanDerWaalsContact O-CB 3.29Å; V42-R46 WeakPolarHBondContact O-CB 3.29Å; V42-R46 PolarHBondContact O-N 3.27Å; V42-M47 HydrophobicContact CG1-CG 4.35Å; V42-M47 HydrophobicContact CG1-SD 4.29Å; V42-M47 PolarHBondContact O-N 3.08Å; V42-F297 HydrophobicContact CB-CD2 4.08Å; V42-F297 HydrophobicContact CB-CE2 4.13Å; V42-F297 HydrophobicContact CG1-CD2 3.58Å; V42-F297 HydrophobicContact CG1-CE2 4.14Å; V42-F297 HydrophobicContact CG1-CG 4.36Å
43F86.3Confident85.5Confident0 Ų056.6 Ų56.60%029%0.286CS..Iπ-helixtrans-67-46.9-178.2-61.7-37.9000113.3S39 L40 M47 K48 M49 M57 Y290 F297S39-F43 WeakPolarHBondContact O-CD2 3.34Å; S39-F43 VanDerWaalsContact O-CG 3.27Å; S39-F43 WeakPolarHBondContact O-CG 3.43Å; S39-F43 PolarHBondContact O-N 3.46Å; L40-F43 PolarHBondContact O-N 2.89Å; F43-M47 HydrophobicContact CD1-CE 4.38Å; F43-M47 HydrophobicContact CD1-SD 3.65Å; F43-M47 HydrophobicContact CE1-SD 3.99Å; F43-M47 CarbonylContact O-C 3.53Å; F43-K48 PolarHBondContact O-N 2.92Å; F43-M49 PolarHBondContact O-N 3.32Å; F43-M49 VanDerWaalsContact O-N 3.08Å; F43-M57 HydrophobicContact CD2-CB 4.41Å; F43-M57 HydrophobicContact CE1-CB 4.37Å; F43-M57 HydrophobicContact CE1-SD 3.91Å; F43-M57 HydrophobicContact CE2-CB 3.76Å; F43-M57 HydrophobicContact CZ-CB 3.74Å; F43-M57 HydrophobicContact CZ-CG 4.33Å; F43-M57 HydrophobicContact CZ-SD 3.82Å; F43-Y290 HydrophobicContact CE2-CD1 4.3Å; F43-Y290 AromaticContact CE2-CD2 3.8Å; F43-Y290 HydrophobicContact CE2-CD2 3.8Å; F43-Y290 HydrophobicContact CE2-CE1 4.34Å; F43-Y290 AromaticContact CE2-CE2 3.82Å; F43-Y290 HydrophobicContact CE2-CE2 3.82Å; F43-Y290 HydrophobicContact CE2-CG 4.05Å; F43-Y290 AromaticContact CZ-CD1 3.85Å; F43-Y290 HydrophobicContact CZ-CD1 3.85Å; F43-Y290 AromaticContact CZ-CD2 3.63Å; F43-Y290 HydrophobicContact CZ-CD2 3.63Å; F43-Y290 HydrophobicContact CZ-CE1 4.34Å; F43-Y290 HydrophobicContact CZ-CE2 4.11Å; F43-Y290 AromaticContact CZ-CG 3.48Å; F43-Y290 HydrophobicContact CZ-CG 3.48Å; F43-Y290 VanDerWaalsContact CZ-CG 3.48Å; F43-F297 HydrophobicContact CD1-CD2 4.19Å; F43-F297 AromaticContact CE1-CD2 3.43Å; F43-F297 HydrophobicContact CE1-CD2 3.43Å; F43-F297 VanDerWaalsContact CE1-CD2 3.43Å; F43-F297 AromaticContact CE1-CE2 3.84Å; F43-F297 HydrophobicContact CE1-CE2 3.84Å; F43-F297 HydrophobicContact CE1-CG 4.39Å; F43-F297 AromaticContact CZ-CD2 3.84Å; F43-F297 HydrophobicContact CZ-CD2 3.84Å; F43-F297 AromaticContact CZ-CE2 3.79Å; F43-F297 HydrophobicContact CZ-CE2 3.79Å
44C83.4Confident85.1Confident56 Ų5654.5 Ų54.538%0.37828%0.275SS..Iπ-helixtrans-75.9-47.7-177.1-65.30000111.7L40 K48L40-C44 VanDerWaalsContact O-CB 3.31Å; L40-C44 WeakPolarHBondContact O-CB 3.49Å; L40-C44 PolarHBondContact O-N 3.07Å; L40-C44 PolarHBondContact O-SG 3.42Å; L40-C44 VanDerWaalsContact O-SG 3.39Å; C44-K48 WeakPolarHBondContact O-CA 3.43Å
45C79.5Confident85.1Confident70 Ų7049.9 Ų49.947%0.47325%0.252SS..Iπ-helixtrans-91.5-38.1-170.6-550000113.2F41F41-C45 HydrophobicContact CD2-CB 4.21Å; F41-C45 HydrophobicContact CE2-CB 4.03Å; F41-C45 HydrophobicContact CZ-CB 4.36Å; F41-C45 WeakPolarHBondContact O-CB 3.42Å; F41-C45 PolarHBondContact O-N 3.18Å
46R76.6Confident85.1Confident147 Ų14748.8 Ų48.856%0.55524%0.244SC*.Iπ-helixtrans-95.1-44.5-174.8-51.9-65.5-75.5-165.9-5112.3F41 V42F41-R46 HydrophobicContact CE1-CG 4.42Å; V42-R46 HydrophobicContact CG1-CB 4.39Å; V42-R46 CarbonylContact O-C 3.58Å; V42-R46 WeakPolarHBondContact O-CA 3.14Å; V42-R46 VanDerWaalsContact O-CB 3.29Å; V42-R46 WeakPolarHBondContact O-CB 3.29Å; V42-R46 PolarHBondContact O-N 3.27Å
47M76.2Confident85Confident15 Ų1548.8 Ų48.87%0.07424%0.244CC..SBendtrans-89.2-15.7-179.7-63.5-178.550.800113.3V42 F43 M49 R50 A54 S294 F297V42-M47 HydrophobicContact CG1-CG 4.35Å; V42-M47 HydrophobicContact CG1-SD 4.29Å; V42-M47 PolarHBondContact O-N 3.08Å; F43-M47 HydrophobicContact CD1-CE 4.38Å; F43-M47 HydrophobicContact CD1-SD 3.65Å; F43-M47 HydrophobicContact CE1-SD 3.99Å; F43-M47 CarbonylContact O-C 3.53Å; M47-M49 PolarHBondContact O-N 3.38Å; M47-R50 WeakPolarHBondContact O-CB 3.27Å; M47-R50 WeakPolarHBondContact O-CG 3.38Å; M47-R50 PolarHBondContact O-N 3.26Å; M47-R50 VanDerWaalsContact O-N 3.07Å; M47-A54 HydrophobicContact CE-CB 3.91Å; M47-S294 WeakPolarHBondContact CE-OG 3.39Å; M47-S294 PolarHBondContact SD-OG 3.41Å; M47-S294 VanDerWaalsContact SD-OG 3.4Å; M47-F297 HydrophobicContact SD-CB 4.36Å
48K74.1Confident85Confident133 Ų13346.6 Ų46.658%0.57823%0.228SC*.THydrogen-bonded Turntrans48.833.5-177.4-59-174.8178.7-173.80112.7F43 C44 R50F43-K48 PolarHBondContact O-N 2.92Å; C44-K48 WeakPolarHBondContact O-CA 3.43Å; K48-R50 HydrophobicContact CB-CG 4.16Å; K48-R50 PolarHBondContact O-N 3.49Å
49M72.1Confident85.2Confident64 Ų6446.1 Ų46.132%0.31522%0.221SC..THydrogen-bonded Turntrans46.536-176.6-56.9177.968.600113.9F43 M47 S51 I55 T58F43-M49 PolarHBondContact O-N 3.32Å; F43-M49 VanDerWaalsContact O-N 3.08Å; M47-M49 PolarHBondContact O-N 3.38Å; M49-S51 VanDerWaalsContact C-N 3.31Å; M49-S51 PolarHBondContact O-N 2.98Å; M49-I55 HydrophobicContact CE-CG1 4.3Å; M49-T58 HydrophobicContact CE-CG2 3.76Å; M49-T58 HydrophobicContact SD-CG2 4.15Å
50R72.5Confident85.4Confident163 Ų16346 Ų4662%0.61522%0.22SC*.  trans-74.8-14.8-171.2-78.2-178.5168.6170.5-6.2114.7M47 K48 R131M47-R50 WeakPolarHBondContact O-CB 3.27Å; M47-R50 WeakPolarHBondContact O-CG 3.38Å; M47-R50 PolarHBondContact O-N 3.26Å; M47-R50 VanDerWaalsContact O-N 3.07Å; K48-R50 HydrophobicContact CB-CG 4.16Å; K48-R50 PolarHBondContact O-N 3.49Å; R50-R131 VanDerWaalsContact CA-NH2 3.33Å; R50-R131 PolarHBondContact O-NE 3.27Å; R50-R131 PolarHBondContact O-NH2 3.05Å
51S80.7Confident85.6Confident38 Ų3844 Ų4427%0.26621%0.209SC..SBendtrans-108.3151.1176.763.20000112.2M49 T53 A54 I55M49-S51 VanDerWaalsContact C-N 3.31Å; M49-S51 PolarHBondContact O-N 2.98Å; S51-T53 VanDerWaalsContact C-N 3.32Å; S51-T53 PolarHBondContact O-N 3.48Å; S51-A54 WeakPolarHBondContact O-CB 3.23Å; S51-A54 PolarHBondContact O-N 3.3Å; S51-A54 VanDerWaalsContact O-N 3.09Å; S51-A54 WeakPolarHBondContact OG-CB 3.44Å; S51-A54 PolarHBondContact OG-N 2.93Å; S51-I55 PolarHBondContact O-N 2.98Å
52E85.6Confident86Confident47 Ų4741.2 Ų41.222%0.2220%0.201CC..Hα-helixtrans-58-45.4177.5-62.870.4-147.300110.6A54 I55 R129E52-A54 VanDerWaalsContact C-N 3.28Å; E52-A54 PolarHBondContact O-N 3.42Å; E52-I55 WeakPolarHBondContact O-CB 3.19Å; E52-I55 PolarHBondContact O-N 2.88Å; E52-I55 VanDerWaalsContact O-N 3.16Å; E52-R129 HydrophobicContact CG-CB 4.46Å; E52-R129 WeakPolarHBondContact CG-O 3.41Å
53T85.9Confident86.5Confident4 Ų440.8 Ų40.83%0.02520%0.198CC..Hα-helixtrans-63.9-32.4176.8-30.80000112.5S51 I55 F56 M57 I111 D114 R115 T293S51-T53 VanDerWaalsContact C-N 3.32Å; S51-T53 PolarHBondContact O-N 3.48Å; T53-I55 PolarHBondContact O-N 3.42Å; T53-F56 PolarHBondContact O-N 3.4Å; T53-M57 HydrophobicContact CG2-CE 3.94Å; T53-M57 WeakPolarHBondContact O-CG 3.35Å; T53-M57 PolarHBondContact O-N 3.41Å; T53-I111 HydrophobicContact CG2-CG1 4.24Å; T53-I111 HydrophobicContact CG2-CG2 4.02Å; T53-D114 PolarHBondContact OG1-OD2 3.2Å; T53-R115 PolarHBondContact OG1-NH2 2.99Å; T53-T293 HydrophobicContact CG2-CG2 3.85Å
54A88.4Confident87Confident0 Ų040.8 Ų40.80%020%0.198CC..Hα-helixtrans-66.7-26.9177.900000112.2M47 S51 E52 T58M47-A54 HydrophobicContact CE-CB 3.91Å; S51-A54 WeakPolarHBondContact O-CB 3.23Å; S51-A54 PolarHBondContact O-N 3.3Å; S51-A54 VanDerWaalsContact O-N 3.09Å; S51-A54 WeakPolarHBondContact OG-CB 3.44Å; S51-A54 PolarHBondContact OG-N 2.93Å; E52-A54 VanDerWaalsContact C-N 3.28Å; E52-A54 PolarHBondContact O-N 3.42Å; A54-T58 VanDerWaalsContact O-CB 3.29Å; A54-T58 WeakPolarHBondContact O-CB 3.39Å; A54-T58 PolarHBondContact O-N 3.01Å; A54-T58 PolarHBondContact O-OG1 3.01Å
55I93.1Very high87.6Confident15 Ų1538.8 Ų38.88%0.07718%0.184CC..Hα-helixtrans-64.8-48173.7-60.7171.5000109.7M49 S51 E52 T53 T58 N59 R131M49-I55 HydrophobicContact CE-CG1 4.3Å; S51-I55 PolarHBondContact O-N 2.98Å; E52-I55 WeakPolarHBondContact O-CB 3.19Å; E52-I55 PolarHBondContact O-N 2.88Å; E52-I55 VanDerWaalsContact O-N 3.16Å; T53-I55 PolarHBondContact O-N 3.42Å; I55-T58 PolarHBondContact O-N 3.2Å; I55-N59 PolarHBondContact O-N 3.44Å; I55-N59 VanDerWaalsContact O-N 3.08Å; I55-N59 PolarHBondContact O-ND2 2.94Å; I55-R131 HydrophobicContact CD1-CB 3.76Å; I55-R131 HydrophobicContact CD1-CG 3.98Å
56F94.4Very high88.4Confident11 Ų1139.6 Ų39.65%0.04818%0.183CC..Hα-helixtrans-62.2-44.5176.8-61.3-54.8000112.1T53 T58 N59 L60 F107 C110 I111 D114 V137 C138T53-F56 PolarHBondContact O-N 3.4Å; F56-T58 VanDerWaalsContact C-N 3.33Å; F56-T58 PolarHBondContact O-N 3.27Å; F56-N59 PolarHBondContact O-N 3.07Å; F56-L60 WeakPolarHBondContact O-CB 3.2Å; F56-L60 PolarHBondContact O-N 2.72Å; F56-F107 HydrophobicContact CD1-CD1 4.42Å; F56-C110 HydrophobicContact CD1-CB 3.65Å; F56-C110 HydrophobicContact CD2-CB 4.21Å; F56-C110 HydrophobicContact CE1-CB 3.71Å; F56-C110 HydrophobicContact CE2-CB 4.24Å; F56-C110 HydrophobicContact CG-CB 3.94Å; F56-C110 HydrophobicContact CZ-CB 4Å; F56-I111 HydrophobicContact CB-CD1 4.28Å; F56-I111 HydrophobicContact CB-CG1 3.68Å; F56-I111 HydrophobicContact CG-CG1 4.49Å; F56-D114 HydrophobicContact CD2-CB 4.45Å; F56-D114 HydrophobicContact CE2-CB 4.15Å; F56-V137 HydrophobicContact CE1-CB 4.15Å; F56-V137 HydrophobicContact CE1-CG1 3.9Å; F56-V137 HydrophobicContact CZ-CB 4.48Å; F56-V137 HydrophobicContact CZ-CG1 4.36Å; F56-C138 WeakPolarHBondContact CD1-SG 3.5Å
57M93.1Very high89.4Confident1 Ų132.8 Ų32.81%0.00516%0.158CC..Hα-helixtrans-62.3-38.4176.6-67.2172.5174.600113.2F43 T53 L60 A61 I111 Y290 T293F43-M57 HydrophobicContact CD2-CB 4.41Å; F43-M57 HydrophobicContact CE1-CB 4.37Å; F43-M57 HydrophobicContact CE1-SD 3.91Å; F43-M57 HydrophobicContact CE2-CB 3.76Å; F43-M57 HydrophobicContact CZ-CB 3.74Å; F43-M57 HydrophobicContact CZ-CG 4.33Å; F43-M57 HydrophobicContact CZ-SD 3.82Å; T53-M57 HydrophobicContact CG2-CE 3.94Å; T53-M57 WeakPolarHBondContact O-CG 3.35Å; T53-M57 PolarHBondContact O-N 3.41Å; M57-L60 PolarHBondContact O-N 2.81Å; M57-A61 PolarHBondContact O-N 2.94Å; M57-I111 HydrophobicContact CG-CD1 4.08Å; M57-Y290 HydrophobicContact CB-CD1 3.97Å; M57-Y290 HydrophobicContact CB-CE1 3.78Å; M57-Y290 HydrophobicContact CE-CD1 4.37Å; M57-Y290 HydrophobicContact CG-CD1 3.71Å; M57-Y290 HydrophobicContact CG-CE1 3.86Å; M57-Y290 PolarHBondContact O-OH 3.15Å; M57-Y290 HydrophobicContact SD-CD1 3.98Å; M57-T293 HydrophobicContact CE-CG2 3.06Å
58T93.6Very high90.4Very high10 Ų1032.1 Ų32.16%0.06115%0.154CC..Hα-helixtrans-64.6-44.3177.6-59.40000110.2L40 M49 A54 I55 F56 L60 A61 V62L40-T58 HydrophobicContact CD1-CG2 3.73Å; M49-T58 HydrophobicContact CE-CG2 3.76Å; M49-T58 HydrophobicContact SD-CG2 4.15Å; A54-T58 VanDerWaalsContact O-CB 3.29Å; A54-T58 WeakPolarHBondContact O-CB 3.39Å; A54-T58 PolarHBondContact O-N 3.01Å; A54-T58 PolarHBondContact O-OG1 3.01Å; I55-T58 PolarHBondContact O-N 3.2Å; F56-T58 VanDerWaalsContact C-N 3.33Å; F56-T58 PolarHBondContact O-N 3.27Å; T58-L60 VanDerWaalsContact C-N 3.34Å; T58-A61 PolarHBondContact O-N 3.43Å; T58-V62 VanDerWaalsContact O-CG2 3.28Å; T58-V62 WeakPolarHBondContact O-CG2 3.16Å; T58-V62 PolarHBondContact O-N 2.99Å
59N95.9Very high91.5Very high30 Ų3031.3 Ų31.316%0.1615%0.151CC..Hα-helixtrans-67.2-35.6178.1-76.9-88.6000112.4I55 F56 V62 S63 F107 C138 W142I55-N59 PolarHBondContact O-N 3.44Å; I55-N59 VanDerWaalsContact O-N 3.08Å; I55-N59 PolarHBondContact O-ND2 2.94Å; F56-N59 PolarHBondContact O-N 3.07Å; N59-V62 PolarHBondContact O-N 3.41Å; N59-S63 WeakPolarHBondContact O-CB 3.16Å; N59-S63 PolarHBondContact O-N 3.41Å; N59-F107 HydrophobicContact CB-CD1 4.15Å; N59-F107 HydrophobicContact CB-CD2 4.45Å; N59-F107 HydrophobicContact CB-CE1 3.6Å; N59-F107 HydrophobicContact CB-CE2 3.94Å; N59-F107 HydrophobicContact CB-CZ 3.51Å; N59-C138 PolarHBondContact ND2-SG 3.02Å; N59-W142 PolarHBondContact OD1-NE1 3.47Å
60L95.3Very high92.6Very high0 Ų028.8 Ų28.80%014%0.139CC..Hα-helixtrans-58.3-56.3171.2-176.955.6000110.6F56 M57 T58 V62 S63 D64 F107 L108 I111 Y290F56-L60 WeakPolarHBondContact O-CB 3.2Å; F56-L60 PolarHBondContact O-N 2.72Å; M57-L60 PolarHBondContact O-N 2.81Å; T58-L60 VanDerWaalsContact C-N 3.34Å; L60-V62 VanDerWaalsContact C-N 3.26Å; L60-V62 PolarHBondContact O-N 2.86Å; L60-S63 WeakPolarHBondContact O-CA 3.31Å; L60-S63 VanDerWaalsContact O-CB 3.3Å; L60-S63 WeakPolarHBondContact O-CB 3.27Å; L60-S63 PolarHBondContact O-N 3.39Å; L60-D64 PolarHBondContact O-N 2.88Å; L60-F107 HydrophobicContact CB-CB 4.16Å; L60-F107 HydrophobicContact CB-CD2 4.47Å; L60-F107 HydrophobicContact CD1-CB 4.25Å; L60-L108 HydrophobicContact CD2-CD2 3.83Å; L60-L108 HydrophobicContact CD2-CG 4.27Å; L60-I111 HydrophobicContact CD2-CD1 4.37Å; L60-Y290 HydrophobicContact CD2-CE1 4.08Å
61A95.7Very high93.8Very high0 Ų021 Ų210%011%0.11CC..Hα-helixtrans-58-36.1178.400000113.3M57 T58 D64 L65 Y290M57-A61 PolarHBondContact O-N 2.94Å; T58-A61 PolarHBondContact O-N 3.43Å; A61-D64 PolarHBondContact O-N 3.28Å; A61-L65 VanDerWaalsContact O-CG 3.3Å; A61-L65 WeakPolarHBondContact O-CG 3.44Å; A61-L65 PolarHBondContact O-N 3.3Å; A61-Y290 HydrophobicContact CB-CE2 4.47Å; A61-Y290 PolarHBondContact N-OH 3.3Å
62V96.4Very high94.5Very high51 Ų5121.7 Ų21.731%0.30911%0.113SC..Hα-helixtrans-64.9-44.8174.1168.70000110.9L40 T58 N59 L60 D64 L65 L66 W142L40-V62 HydrophobicContact CD1-CG2 4Å; T58-V62 VanDerWaalsContact O-CG2 3.28Å; T58-V62 WeakPolarHBondContact O-CG2 3.16Å; T58-V62 PolarHBondContact O-N 2.99Å; N59-V62 PolarHBondContact O-N 3.41Å; L60-V62 VanDerWaalsContact C-N 3.26Å; L60-V62 PolarHBondContact O-N 2.86Å; V62-D64 VanDerWaalsContact C-N 3.33Å; V62-D64 PolarHBondContact O-N 3.08Å; V62-L65 PolarHBondContact O-N 3.01Å; V62-L66 HydrophobicContact CG1-CD1 4.34Å; V62-L66 WeakPolarHBondContact O-CG 3.34Å; V62-L66 PolarHBondContact O-N 2.71Å; V62-W142 HydrophobicContact CB-CZ2 4.47Å; V62-W142 HydrophobicContact CG1-CH2 4.28Å; V62-W142 HydrophobicContact CG1-CZ2 4.03Å
63S96.9Very high95Very high1 Ų122.7 Ų22.71%0.00712%0.117CC..Hα-helixtrans-61-41.1176.2-167.60000112.4N59 L60 L66 F67 N100N59-S63 WeakPolarHBondContact O-CB 3.16Å; N59-S63 PolarHBondContact O-N 3.41Å; L60-S63 WeakPolarHBondContact O-CA 3.31Å; L60-S63 VanDerWaalsContact O-CB 3.3Å; L60-S63 WeakPolarHBondContact O-CB 3.27Å; L60-S63 PolarHBondContact O-N 3.39Å; S63-L66 PolarHBondContact O-N 2.95Å; S63-F67 PolarHBondContact O-N 3.38Å; S63-N100 PolarHBondContact O-ND2 3.5Å; S63-N100 WeakPolarHBondContact OG-CA 3.29Å
64D96.8Very high95.4Very high0 Ų023.9 Ų23.90%012%0.122CC..Hα-helixtrans-63.6-45.4175.7-62.6-46.9000111.9L60 A61 V62 L66 F67 V68 N100 C283L60-D64 PolarHBondContact O-N 2.88Å; A61-D64 PolarHBondContact O-N 3.28Å; V62-D64 VanDerWaalsContact C-N 3.33Å; V62-D64 PolarHBondContact O-N 3.08Å; D64-L66 PolarHBondContact O-N 3.4Å; D64-F67 PolarHBondContact O-N 3.27Å; D64-V68 WeakPolarHBondContact O-CB 3.33Å; D64-V68 VanDerWaalsContact O-CG2 3.23Å; D64-V68 WeakPolarHBondContact O-CG2 3.43Å; D64-V68 PolarHBondContact O-N 3.04Å; D64-N100 WeakPolarHBondContact CA-ND2 3.42Å; D64-N100 PolarHBondContact OD1-ND2 3.39Å; D64-C283 HydrophobicContact CB-CB 4.11Å; D64-C283 PolarHBondContact OD1-SG 3.46Å
65L96.9Very high95.8Very high14 Ų1425 Ų257%0.07313%0.128CC..Hα-helixtrans-62.8-42.7177.3-73.3172.2000112.2L33 N36 C37 L40 A61 V62 F67 V68 F69L33-L65 HydrophobicContact CD1-CD2 4Å; N36-L65 HydrophobicContact CB-CD1 4.37Å; N36-L65 HydrophobicContact CB-CD2 3.79Å; N36-L65 HydrophobicContact CB-CG 3.77Å; C37-L65 VanDerWaalsContact SG-CD2 3.6Å; L40-L65 HydrophobicContact CD2-CD1 4Å; A61-L65 VanDerWaalsContact O-CG 3.3Å; A61-L65 WeakPolarHBondContact O-CG 3.44Å; A61-L65 PolarHBondContact O-N 3.3Å; V62-L65 PolarHBondContact O-N 3.01Å; L65-F67 VanDerWaalsContact C-N 3.27Å; L65-F67 PolarHBondContact O-N 3.35Å; L65-V68 PolarHBondContact O-N 3.43Å; L65-F69 HydrophobicContact CB-CD2 4.37Å; L65-F69 HydrophobicContact CB-CE2 4.1Å; L65-F69 WeakPolarHBondContact O-CD2 3.28Å; L65-F69 WeakPolarHBondContact O-CG 3.3Å; L65-F69 PolarHBondContact O-N 3.41Å
66L96.5Very high95.9Very high87 Ų8728.4 Ų28.446%0.45514%0.142SC..Hα-helixtrans-57.4-41.5176.6-72.6176.9000111.7V62 S63 D64 W142V62-L66 HydrophobicContact CG1-CD1 4.34Å; V62-L66 WeakPolarHBondContact O-CG 3.34Å; V62-L66 PolarHBondContact O-N 2.71Å; S63-L66 PolarHBondContact O-N 2.95Å; D64-L66 PolarHBondContact O-N 3.4Å; L66-W142 HydrophobicContact CD1-CH2 3.77Å; L66-W142 HydrophobicContact CD1-CZ3 4.03Å
67F96.7Very high95.9Very high5 Ų528 Ų282%0.02214%0.14CC..Hα-helixtrans-70-48.3175.1166.9-117000112.5V28 S63 D64 L65 F69 T70 L71 F97 N100 T280V28-F67 HydrophobicContact CG1-CE1 4.41Å; S63-F67 PolarHBondContact O-N 3.38Å; D64-F67 PolarHBondContact O-N 3.27Å; L65-F67 VanDerWaalsContact C-N 3.27Å; L65-F67 PolarHBondContact O-N 3.35Å; F67-F69 VanDerWaalsContact C-N 3.26Å; F67-F69 PolarHBondContact O-N 2.94Å; F67-T70 WeakPolarHBondContact O-CA 3.34Å; F67-T70 PolarHBondContact O-N 3.39Å; F67-T70 PolarHBondContact O-OG1 3.17Å; F67-L71 HydrophobicContact CD2-CD2 4.43Å; F67-L71 HydrophobicContact CE1-CD1 4.2Å; F67-L71 HydrophobicContact CE1-CD2 4.05Å; F67-L71 HydrophobicContact CE1-CG 4.37Å; F67-L71 HydrophobicContact CE2-CD2 3.67Å; F67-L71 HydrophobicContact CE2-CG 4.45Å; F67-L71 HydrophobicContact CZ-CD1 4.44Å; F67-L71 HydrophobicContact CZ-CD2 3.46Å; F67-L71 VanDerWaalsContact CZ-CD2 3.46Å; F67-L71 HydrophobicContact CZ-CG 4.23Å; F67-L71 PolarHBondContact O-N 3.37Å; F67-F97 HydrophobicContact CD2-CB 4.18Å; F67-F97 HydrophobicContact CD2-CD2 4.43Å; F67-F97 HydrophobicContact CE2-CB 4.11Å; F67-F97 AromaticContact CE2-CD2 3.77Å; F67-F97 HydrophobicContact CE2-CD2 3.77Å; F67-F97 HydrophobicContact CE2-CG 4.44Å; F67-F97 HydrophobicContact CZ-CD2 4.23Å; F67-N100 HydrophobicContact CB-CB 3.52Å; F67-N100 HydrophobicContact CD1-CB 4.42Å; F67-N100 HydrophobicContact CG-CB 3.96Å; F67-T280 HydrophobicContact CE1-CG2 4.06Å; F67-T280 HydrophobicContact CZ-CG2 3.65Å
68V97.3Very high95.8Very high0 Ų028 Ų280%014%0.14CC..Hα-helixtrans-56-39.8179.9164.90000111.6F29 L33 D64 L65 T70 L71 P72F29-V68 HydrophobicContact CD2-CG1 3.78Å; F29-V68 WeakPolarHBondContact CD2-O 3.08Å; F29-V68 HydrophobicContact CE2-CG1 4.3Å; L33-V68 HydrophobicContact CB-CG1 3.83Å; L33-V68 HydrophobicContact CD1-CG1 4.28Å; D64-V68 WeakPolarHBondContact O-CB 3.33Å; D64-V68 VanDerWaalsContact O-CG2 3.23Å; D64-V68 WeakPolarHBondContact O-CG2 3.43Å; D64-V68 PolarHBondContact O-N 3.04Å; L65-V68 PolarHBondContact O-N 3.43Å; V68-T70 PolarHBondContact O-N 3.4Å; V68-L71 HydrophobicContact CG2-CD1 4.33Å; V68-L71 WeakPolarHBondContact O-CB 3.42Å; V68-L71 PolarHBondContact O-N 3.49Å; V68-P72 WeakPolarHBondContact O-CD 3.49Å
69F97.1Very high95.8Very high117 Ų11733 Ų3351%0.51316%0.162SC..THydrogen-bonded Turntrans-64-21176-76.3-55.5000114.2L33 L65 F67L33-F69 HydrophobicContact CD1-CE1 3.8Å; L33-F69 HydrophobicContact CD1-CZ 3.94Å; L65-F69 HydrophobicContact CB-CD2 4.37Å; L65-F69 HydrophobicContact CB-CE2 4.1Å; L65-F69 WeakPolarHBondContact O-CD2 3.28Å; L65-F69 WeakPolarHBondContact O-CG 3.3Å; L65-F69 PolarHBondContact O-N 3.41Å; F67-F69 VanDerWaalsContact C-N 3.26Å; F67-F69 PolarHBondContact O-N 2.94Å
70T96.1Very high95.6Very high11 Ų1135.9 Ų35.97%0.06718%0.177CC..THydrogen-bonded Turntrans-87.3-15.1174.972.80000113.4F67 V68 F73 K74 A96F67-T70 WeakPolarHBondContact O-CA 3.34Å; F67-T70 PolarHBondContact O-N 3.39Å; F67-T70 PolarHBondContact O-OG1 3.17Å; V68-T70 PolarHBondContact O-N 3.4Å; T70-F73 PolarHBondContact O-N 3.07Å; T70-K74 PolarHBondContact O-N 3.41Å; T70-A96 HydrophobicContact CG2-CB 3.76Å
71L96.4Very high95.3Very high0 Ų041.7 Ų41.70%020%0.199CC..Hα-helixtrans-61.3-38.2-176.4-69.1-178.7000114.5Y25 V28 F29 F67 V68 F73 K74 I75Y25-L71 HydrophobicContact CD1-CD2 4.08Å; Y25-L71 HydrophobicContact CD2-CD2 4.19Å; Y25-L71 HydrophobicContact CG-CD2 3.85Å; V28-L71 HydrophobicContact CB-CD1 4.05Å; V28-L71 HydrophobicContact CG1-CD1 3.71Å; F29-L71 HydrophobicContact CB-CB 4.17Å; F29-L71 HydrophobicContact CB-CD1 4.1Å; F29-L71 HydrophobicContact CD2-CB 4.34Å; F67-L71 HydrophobicContact CD2-CD2 4.43Å; F67-L71 HydrophobicContact CE1-CD1 4.2Å; F67-L71 HydrophobicContact CE1-CD2 4.05Å; F67-L71 HydrophobicContact CE1-CG 4.37Å; F67-L71 HydrophobicContact CE2-CD2 3.67Å; F67-L71 HydrophobicContact CE2-CG 4.45Å; F67-L71 HydrophobicContact CZ-CD1 4.44Å; F67-L71 HydrophobicContact CZ-CD2 3.46Å; F67-L71 VanDerWaalsContact CZ-CD2 3.46Å; F67-L71 HydrophobicContact CZ-CG 4.23Å; F67-L71 PolarHBondContact O-N 3.37Å; V68-L71 HydrophobicContact CG2-CD1 4.33Å; V68-L71 WeakPolarHBondContact O-CB 3.42Å; V68-L71 PolarHBondContact O-N 3.49Å; L71-F73 PolarHBondContact O-N 2.96Å; L71-K74 CarbonylContact O-C 3.53Å; L71-K74 WeakPolarHBondContact O-CA 3.36Å; L71-K74 PolarHBondContact O-N 3.22Å; L71-I75 HydrophobicContact CB-CD1 4.34Å; L71-I75 VanDerWaalsContact O-CG1 3.23Å; L71-I75 WeakPolarHBondContact O-CG1 3.49Å; L71-I75 PolarHBondContact O-N 3.33Å
72P97.3Very high95Very high51 Ų5145.1 Ų45.133%0.33121%0.214SC..Hα-helixtrans-53.8-40.6177.5-29.537.2000113.5F29 V68 I75 F76F29-P72 HydrophobicContact CD2-CG 3.89Å; F29-P72 HydrophobicContact CE2-CG 3.53Å; F29-P72 HydrophobicContact CZ-CG 3.89Å; V68-P72 WeakPolarHBondContact O-CD 3.49Å; P72-I75 PolarHBondContact O-N 2.96Å; P72-F76 PolarHBondContact O-N 3.03Å
73F95.6Very high94.8Very high68 Ų6842.9 Ų42.930%0.29820%0.2SC..Hα-helixtrans-67.5-40.2177-54.6-72.2000111.9T70 L71 F76 Y77 W83 F85 L89T70-F73 PolarHBondContact O-N 3.07Å; L71-F73 PolarHBondContact O-N 2.96Å; F73-F76 PolarHBondContact O-N 3Å; F73-Y77 WeakPolarHBondContact O-CB 3.46Å; F73-Y77 PolarHBondContact O-N 3.32Å; F73-W83 HydrophobicContact CB-CH2 3.65Å; F73-W83 HydrophobicContact CB-CZ3 3.99Å; F73-F85 HydrophobicContact CB-CD2 4.09Å; F73-F85 HydrophobicContact CB-CE2 3.99Å; F73-F85 AromaticContact CD1-CD1 3.82Å; F73-F85 HydrophobicContact CD1-CD1 3.82Å; F73-F85 HydrophobicContact CD1-CD2 4.04Å; F73-F85 AromaticContact CD1-CE1 3.77Å; F73-F85 HydrophobicContact CD1-CE1 3.77Å; F73-F85 AromaticContact CD1-CE2 3.99Å; F73-F85 HydrophobicContact CD1-CE2 3.99Å; F73-F85 AromaticContact CD1-CG 3.96Å; F73-F85 HydrophobicContact CD1-CG 3.96Å; F73-F85 AromaticContact CD1-CZ 3.85Å; F73-F85 HydrophobicContact CD1-CZ 3.85Å; F73-F85 HydrophobicContact CE1-CD1 4.22Å; F73-F85 HydrophobicContact CE1-CE1 4.25Å; F73-L89 HydrophobicContact CB-CD2 4.28Å; F73-L89 HydrophobicContact CD1-CD2 3.41Å; F73-L89 VanDerWaalsContact CD1-CD2 3.41Å; F73-L89 HydrophobicContact CD2-CD2 3.88Å; F73-L89 HydrophobicContact CD2-CG 4.46Å; F73-L89 HydrophobicContact CE1-CD2 3.55Å; F73-L89 HydrophobicContact CE2-CD1 4.37Å; F73-L89 HydrophobicContact CE2-CD2 4.02Å; F73-L89 HydrophobicContact CG-CD2 3.58Å; F73-L89 HydrophobicContact CG-CG 4.45Å; F73-L89 HydrophobicContact CZ-CD2 3.86Å
74K93.6Very high94.6Very high29 Ų2946 Ų4613%0.12622%0.22CC..Hα-helixtrans-67.6-38.2174.9-74.2-72.2-176.1178.60111.8Y25 T70 L71 Y77 N78 W83 S93Y25-K74 HydrophobicContact CD2-CB 3.98Å; Y25-K74 HydrophobicContact CE2-CB 4.19Å; T70-K74 PolarHBondContact O-N 3.41Å; L71-K74 CarbonylContact O-C 3.53Å; L71-K74 WeakPolarHBondContact O-CA 3.36Å; L71-K74 PolarHBondContact O-N 3.22Å; K74-Y77 PolarHBondContact O-N 2.93Å; K74-N78 WeakPolarHBondContact O-CB 3.4Å; K74-N78 PolarHBondContact O-N 2.89Å; K74-N78 PolarHBondContact O-ND2 3.2Å; K74-W83 HydrophobicContact CD-CZ3 4.18Å; K74-S93 WeakPolarHBondContact CE-OG 3.37Å; K74-S93 WeakPolarHBondContact CG-OG 3.26Å
75I96.5Very high94.3Very high24 Ų2449.3 Ų49.312%0.12324%0.235CC..Hα-helixtrans-61.6-49.5175.6-67.8161000109.5F29 L71 P72 Y77 N78 F79F29-I75 HydrophobicContact CB-CD1 4.19Å; L71-I75 HydrophobicContact CB-CD1 4.34Å; L71-I75 VanDerWaalsContact O-CG1 3.23Å; L71-I75 WeakPolarHBondContact O-CG1 3.49Å; L71-I75 PolarHBondContact O-N 3.33Å; P72-I75 PolarHBondContact O-N 2.96Å; I75-Y77 VanDerWaalsContact C-N 3.33Å; I75-Y77 PolarHBondContact O-N 3.45Å; I75-N78 PolarHBondContact O-N 3.21Å; I75-F79 HydrophobicContact CG2-CD2 3.69Å; I75-F79 HydrophobicContact CG2-CE2 3.6Å; I75-F79 WeakPolarHBondContact O-CD2 3.21Å; I75-F79 PolarHBondContact O-N 3.16Å; I75-F79 VanDerWaalsContact O-N 3.09Å
76F96Very high94Very high86 Ų8650.5 Ų50.538%0.37725%0.251SS..Hα-helixtrans-55.9-48175.7-177.9-83.1000111.7P72 F73 N78 F79 N80 P84 F85P72-F76 PolarHBondContact O-N 3.03Å; F73-F76 PolarHBondContact O-N 3Å; F76-N78 VanDerWaalsContact C-N 3.34Å; F76-N78 PolarHBondContact O-N 3.4Å; F76-F79 PolarHBondContact O-N 2.79Å; F76-N80 HydrophobicContact CD1-CB 4.46Å; F76-N80 WeakPolarHBondContact CD2-ND2 3.32Å; F76-N80 HydrophobicContact CE1-CB 4.07Å; F76-N80 VanDerWaalsContact CE2-ND2 3.3Å; F76-N80 WeakPolarHBondContact CE2-ND2 3.36Å; F76-N80 HydrophobicContact CZ-CB 4.37Å; F76-N80 WeakPolarHBondContact CZ-ND2 3.36Å; F76-N80 WeakPolarHBondContact O-CB 3.45Å; F76-N80 PolarHBondContact O-N 3.37Å; F76-N80 PolarHBondContact O-ND2 2.89Å; F76-P84 HydrophobicContact CD1-CG 4.19Å; F76-P84 HydrophobicContact CE1-CG 3.63Å; F76-P84 HydrophobicContact CZ-CG 4.37Å; F76-F85 HydrophobicContact CB-CE2 4.16Å; F76-F85 HydrophobicContact CB-CZ 4Å; F76-F85 AromaticContact CD1-CE2 3.72Å; F76-F85 HydrophobicContact CD1-CE2 3.72Å; F76-F85 AromaticContact CD1-CZ 3.62Å; F76-F85 HydrophobicContact CD1-CZ 3.62Å; F76-F85 HydrophobicContact CE1-CZ 4.26Å; F76-F85 HydrophobicContact CG-CE2 4.15Å; F76-F85 AromaticContact CG-CZ 3.78Å; F76-F85 HydrophobicContact CG-CZ 3.78Å
77Y93.6Very high93.5Very high2 Ų248.7 Ų48.71%0.00824%0.242CC..Hα-helixtrans-59.6-42.9178.2165.3-108.2000112.8Y18 F73 K74 I75 R81 W83 E169Y18-Y77 HydrophobicContact CE1-CE1 4.46Å; F73-Y77 WeakPolarHBondContact O-CB 3.46Å; F73-Y77 PolarHBondContact O-N 3.32Å; K74-Y77 PolarHBondContact O-N 2.93Å; I75-Y77 VanDerWaalsContact C-N 3.33Å; I75-Y77 PolarHBondContact O-N 3.45Å; Y77-R81 WeakPolarHBondContact O-CA 3.22Å; Y77-R81 PolarHBondContact O-N 2.87Å; Y77-W83 HydrophobicContact CD2-CB 3.76Å; Y77-W83 HydrophobicContact CD2-CE3 4.22Å; Y77-W83 HydrophobicContact CE2-CB 4.21Å; Y77-W83 AromaticContact CG-CE3 3.91Å; Y77-W83 HydrophobicContact CG-CE3 3.91Å; Y77-E169 WeakPolarHBondContact CE1-OE1 3.38Å; Y77-E169 VanDerWaalsContact OH-CD 3.27Å; Y77-E169 PolarHBondContact OH-OE1 3.46Å
78N92.4Very high93.2Very high3 Ų352.8 Ų52.82%0.01627%0.271CS..Hα-helixtrans-69.5-36.7-177.3-80.6-64.3000112.6Y21 K74 I75 F76Y21-N78 VanDerWaalsContact CB-CG 3.5Å; Y21-N78 WeakPolarHBondContact CB-OD1 3.46Å; Y21-N78 WeakPolarHBondContact CD2-OD1 3.43Å; K74-N78 WeakPolarHBondContact O-CB 3.4Å; K74-N78 PolarHBondContact O-N 2.89Å; K74-N78 PolarHBondContact O-ND2 3.2Å; I75-N78 PolarHBondContact O-N 3.21Å; F76-N78 VanDerWaalsContact C-N 3.34Å; F76-N78 PolarHBondContact O-N 3.4Å
79F93.5Very high92.9Very high115 Ų11554.6 Ų54.650%0.50428%0.28SS..Hα-helixtrans-76.4-39.5176-74-58.7000113.2I75 F76I75-F79 HydrophobicContact CG2-CD2 3.69Å; I75-F79 HydrophobicContact CG2-CE2 3.6Å; I75-F79 WeakPolarHBondContact O-CD2 3.21Å; I75-F79 PolarHBondContact O-N 3.16Å; I75-F79 VanDerWaalsContact O-N 3.09Å; F76-F79 PolarHBondContact O-N 2.79Å
80N91.3Very high92.6Very high90 Ų9049 Ų4948%0.48126%0.256SS..Hα-helixtrans-90.5-8.2-176.5-64.6-73.3000113.9F76 H82F76-N80 HydrophobicContact CD1-CB 4.46Å; F76-N80 WeakPolarHBondContact CD2-ND2 3.32Å; F76-N80 HydrophobicContact CE1-CB 4.07Å; F76-N80 VanDerWaalsContact CE2-ND2 3.3Å; F76-N80 WeakPolarHBondContact CE2-ND2 3.36Å; F76-N80 HydrophobicContact CZ-CB 4.37Å; F76-N80 WeakPolarHBondContact CZ-ND2 3.36Å; F76-N80 WeakPolarHBondContact O-CB 3.45Å; F76-N80 PolarHBondContact O-N 3.37Å; F76-N80 PolarHBondContact O-ND2 2.89Å; N80-H82 PolarHBondContact O-N 3.31Å; N80-H82 VanDerWaalsContact O-N 3.09Å
81R89.3Confident92.3Very high121 Ų12152 Ų5246%0.45727%0.268SS..THydrogen-bonded Turntrans51.929.3-174.1-57.1-173.8176.6-167.8-1.1113.3Y18 Y77Y18-R81 HydrophobicContact CG-CG 4.42Å; Y77-R81 WeakPolarHBondContact O-CA 3.22Å; Y77-R81 PolarHBondContact O-N 2.87Å
82H89.5Confident92Very high72 Ų7256.5 Ų56.533%0.33329%0.291SS..  trans-147.7131.8-175-18077.4000110.6N80 P84 T165N80-H82 PolarHBondContact O-N 3.31Å; N80-H82 VanDerWaalsContact O-N 3.09Å; H82-P84 WeakPolarHBondContact O-CD 3.16Å; H82-T165 PolarHBondContact ND1-N 3.32Å
83W91.3Very high91.8Very high4 Ų454.1 Ų54.12%0.01528%0.276CS..  trans-103.796.6177.5-176.5-88.6000111.2F73 K74 Y77 F85 G86 L89 C90 T165 C167F73-W83 HydrophobicContact CB-CH2 3.65Å; F73-W83 HydrophobicContact CB-CZ3 3.99Å; K74-W83 HydrophobicContact CD-CZ3 4.18Å; Y77-W83 HydrophobicContact CD2-CB 3.76Å; Y77-W83 HydrophobicContact CD2-CE3 4.22Å; Y77-W83 HydrophobicContact CE2-CB 4.21Å; Y77-W83 AromaticContact CG-CE3 3.91Å; Y77-W83 HydrophobicContact CG-CE3 3.91Å; W83-F85 AromaticContact CD2-CD2 3.94Å; W83-F85 HydrophobicContact CD2-CD2 3.94Å; W83-F85 AromaticContact CE2-CD2 3.87Å; W83-F85 HydrophobicContact CE3-CD2 4.09Å; W83-F85 HydrophobicContact CH2-CD2 4.04Å; W83-F85 HydrophobicContact CZ2-CB 3.93Å; W83-F85 AromaticContact CZ2-CD2 3.92Å; W83-F85 HydrophobicContact CZ2-CD2 3.92Å; W83-F85 HydrophobicContact CZ2-CG 4.38Å; W83-F85 HydrophobicContact CZ3-CD2 4.12Å; W83-G86 PolarHBondContact NE1-O 2.9Å; W83-L89 HydrophobicContact CH2-CG 4.46Å; W83-L89 HydrophobicContact CZ2-CB 3.95Å; W83-L89 HydrophobicContact CZ2-CD2 4.2Å; W83-L89 HydrophobicContact CZ2-CG 3.98Å; W83-C90 HydrophobicContact CZ2-CB 4.17Å; W83-T165 HydrophobicContact CB-CG2 4.37Å; W83-T165 WeakPolarHBondContact CB-O 3.45Å; W83-T165 PolarHBondContact N-O 2.82Å; W83-C167 HydrophobicContact CB-CB 3.96Å; W83-C167 HydrophobicContact CD2-CB 3.45Å; W83-C167 VanDerWaalsContact CD2-CB 3.45Å; W83-C167 HydrophobicContact CE3-CB 3.65Å; W83-C167 HydrophobicContact CG-CB 3.56Å; W83-C167 HydrophobicContact CZ3-CB 4.43Å
84P92.4Very high91.5Very high66 Ų6651 Ų5143%0.42926%0.263SS..  trans-86.4-7.3-178.534.8-37.3000113.9F76 H82 G86F76-P84 HydrophobicContact CD1-CG 4.19Å; F76-P84 HydrophobicContact CE1-CG 3.63Å; F76-P84 HydrophobicContact CZ-CG 4.37Å; H82-P84 WeakPolarHBondContact O-CD 3.16Å; P84-G86 VanDerWaalsContact C-N 3.28Å; P84-G86 PolarHBondContact O-N 3.43Å
85F91.4Very high91.4Very high70 Ų7050.6 Ų50.631%0.30726%0.262SS..SBendtrans-85.48.7-165.7-48.4-73.1000115.3F73 F76 W83 L89F73-F85 HydrophobicContact CB-CD2 4.09Å; F73-F85 HydrophobicContact CB-CE2 3.99Å; F73-F85 AromaticContact CD1-CD1 3.82Å; F73-F85 HydrophobicContact CD1-CD1 3.82Å; F73-F85 HydrophobicContact CD1-CD2 4.04Å; F73-F85 AromaticContact CD1-CE1 3.77Å; F73-F85 HydrophobicContact CD1-CE1 3.77Å; F73-F85 AromaticContact CD1-CE2 3.99Å; F73-F85 HydrophobicContact CD1-CE2 3.99Å; F73-F85 AromaticContact CD1-CG 3.96Å; F73-F85 HydrophobicContact CD1-CG 3.96Å; F73-F85 AromaticContact CD1-CZ 3.85Å; F73-F85 HydrophobicContact CD1-CZ 3.85Å; F73-F85 HydrophobicContact CE1-CD1 4.22Å; F73-F85 HydrophobicContact CE1-CE1 4.25Å; F76-F85 HydrophobicContact CB-CE2 4.16Å; F76-F85 HydrophobicContact CB-CZ 4Å; F76-F85 AromaticContact CD1-CE2 3.72Å; F76-F85 HydrophobicContact CD1-CE2 3.72Å; F76-F85 AromaticContact CD1-CZ 3.62Å; F76-F85 HydrophobicContact CD1-CZ 3.62Å; F76-F85 HydrophobicContact CE1-CZ 4.26Å; F76-F85 HydrophobicContact CG-CE2 4.15Å; F76-F85 AromaticContact CG-CZ 3.78Å; F76-F85 HydrophobicContact CG-CZ 3.78Å; W83-F85 AromaticContact CD2-CD2 3.94Å; W83-F85 HydrophobicContact CD2-CD2 3.94Å; W83-F85 AromaticContact CE2-CD2 3.87Å; W83-F85 HydrophobicContact CE3-CD2 4.09Å; W83-F85 HydrophobicContact CH2-CD2 4.04Å; W83-F85 HydrophobicContact CZ2-CB 3.93Å; W83-F85 AromaticContact CZ2-CD2 3.92Å; W83-F85 HydrophobicContact CZ2-CD2 3.92Å; W83-F85 HydrophobicContact CZ2-CG 4.38Å; W83-F85 HydrophobicContact CZ3-CD2 4.12Å; F85-L89 HydrophobicContact CB-CB 4.09Å; F85-L89 HydrophobicContact CB-CD2 3.44Å; F85-L89 VanDerWaalsContact CB-CD2 3.44Å; F85-L89 HydrophobicContact CB-CG 4.32Å; F85-L89 HydrophobicContact CD1-CD2 4.35Å; F85-L89 HydrophobicContact CD2-CD2 4.48Å; F85-L89 HydrophobicContact CG-CD2 3.87Å
86G89.5Confident91.2Very high39 Ų3950.1 Ų50.140%0.40226%0.262SS..Hα-helixtrans75.8170.3-179.600000115W83 P84 C90W83-G86 PolarHBondContact NE1-O 2.9Å; P84-G86 VanDerWaalsContact C-N 3.28Å; P84-G86 PolarHBondContact O-N 3.43Å; G86-C90 PolarHBondContact O-N 3.48Å
87D86.8Confident91Very high50 Ų5047.3 Ų47.327%0.26725%0.25SC..Hα-helixtrans-67.7-38.5-174.4-176.568.9000113.1L89 C90 K91 T157 T158D87-L89 PolarHBondContact O-N 2.93Å; D87-C90 WeakPolarHBondContact O-CB 3.41Å; D87-C90 PolarHBondContact O-N 2.85Å; D87-C90 VanDerWaalsContact O-N 3.11Å; D87-K91 WeakPolarHBondContact O-CG 3.05Å; D87-K91 PolarHBondContact O-N 3.29Å; D87-K91 WeakPolarHBondContact OD2-CD 3.25Å; D87-K91 WeakPolarHBondContact OD2-CE 3.46Å; D87-K91 IonicContact OD2-NZ 2.92Å; D87-K91 PolarHBondContact OD2-NZ 3.01Å; D87-T157 PolarHBondContact OD1-OG1 3.07Å; D87-T158 HydrophobicContact CB-CG2 4.13Å; D87-T158 WeakPolarHBondContact OD1-CG2 3.28Å; D87-T158 PolarHBondContact OD1-OG1 3.01Å
88S89.4Confident90.8Very high91 Ų9148.6 Ų48.664%0.63626%0.257SS*.Hα-helixtrans-57.8-47.7179.6-55.60000112.3C90 K91 I92S88-C90 VanDerWaalsContact C-N 3.29Å; S88-C90 PolarHBondContact O-N 3.07Å; S88-K91 PolarHBondContact O-N 3.11Å; S88-I92 VanDerWaalsContact O-CG1 3.3Å; S88-I92 WeakPolarHBondContact O-CG1 3.38Å; S88-I92 PolarHBondContact O-N 2.87Å
89L91.3Very high90.8Very high37 Ų3748.6 Ų48.619%0.19426%0.257CS..Hα-helixtrans-70.9-28.9179.7-164.366.1000111.8F73 W83 F85 D87 I92 S93F73-L89 HydrophobicContact CB-CD2 4.28Å; F73-L89 HydrophobicContact CD1-CD2 3.41Å; F73-L89 VanDerWaalsContact CD1-CD2 3.41Å; F73-L89 HydrophobicContact CD2-CD2 3.88Å; F73-L89 HydrophobicContact CD2-CG 4.46Å; F73-L89 HydrophobicContact CE1-CD2 3.55Å; F73-L89 HydrophobicContact CE2-CD1 4.37Å; F73-L89 HydrophobicContact CE2-CD2 4.02Å; F73-L89 HydrophobicContact CG-CD2 3.58Å; F73-L89 HydrophobicContact CG-CG 4.45Å; F73-L89 HydrophobicContact CZ-CD2 3.86Å; W83-L89 HydrophobicContact CH2-CG 4.46Å; W83-L89 HydrophobicContact CZ2-CB 3.95Å; W83-L89 HydrophobicContact CZ2-CD2 4.2Å; W83-L89 HydrophobicContact CZ2-CG 3.98Å; F85-L89 HydrophobicContact CB-CB 4.09Å; F85-L89 HydrophobicContact CB-CD2 3.44Å; F85-L89 VanDerWaalsContact CB-CD2 3.44Å; F85-L89 HydrophobicContact CB-CG 4.32Å; F85-L89 HydrophobicContact CD1-CD2 4.35Å; F85-L89 HydrophobicContact CD2-CD2 4.48Å; F85-L89 HydrophobicContact CG-CD2 3.87Å; D87-L89 PolarHBondContact O-N 2.93Å; L89-I92 HydrophobicContact CD1-CD1 4.45Å; L89-I92 PolarHBondContact O-N 3.19Å; L89-S93 VanDerWaalsContact O-CB 3.32Å; L89-S93 WeakPolarHBondContact O-CB 3.21Å; L89-S93 PolarHBondContact O-N 2.72Å
90C90.4Very high90.9Very high0 Ų043.2 Ų43.20%023%0.233CC..Hα-helixtrans-63.2-46.4172.9-176.60000111.6W83 G86 D87 S88 S93 G94 T158 C167 F168W83-C90 HydrophobicContact CZ2-CB 4.17Å; G86-C90 PolarHBondContact O-N 3.48Å; D87-C90 WeakPolarHBondContact O-CB 3.41Å; D87-C90 PolarHBondContact O-N 2.85Å; D87-C90 VanDerWaalsContact O-N 3.11Å; S88-C90 VanDerWaalsContact C-N 3.29Å; S88-C90 PolarHBondContact O-N 3.07Å; C90-S93 PolarHBondContact O-N 3.26Å; C90-G94 PolarHBondContact O-N 3.4Å; C90-T158 HydrophobicContact CB-CG2 3.63Å; C90-C167 WeakPolarHBondContact CA-SG 3.3Å; C90-C167 HydrophobicContact CB-CB 3.9Å; C90-C167 WeakPolarHBondContact CB-SG 3.46Å; C90-C167 WeakPolarHBondContact SG-CA 3.31Å; C90-C167 WeakPolarHBondContact SG-CB 3.22Å; C90-C167 CovalentContact SG-SG 2.03Å; C90-C167 PolarHBondContact SG-SG 3.18Å; C90-F168 PolarHBondContact SG-N 3.4Å
91K89.9Confident91Very high73 Ų7339 Ų3932%0.31721%0.211SC..Hα-helixtrans-62.4-44.1175.2-71.6173.9172.3161.20112.2D87 S88 G94 T95 S153 T157D87-K91 WeakPolarHBondContact O-CG 3.05Å; D87-K91 PolarHBondContact O-N 3.29Å; D87-K91 WeakPolarHBondContact OD2-CD 3.25Å; D87-K91 WeakPolarHBondContact OD2-CE 3.46Å; D87-K91 IonicContact OD2-NZ 2.92Å; D87-K91 PolarHBondContact OD2-NZ 3.01Å; S88-K91 PolarHBondContact O-N 3.11Å; K91-G94 PolarHBondContact O-N 2.99Å; K91-T95 VanDerWaalsContact O-CB 3.28Å; K91-T95 WeakPolarHBondContact O-CB 3.05Å; K91-T95 PolarHBondContact O-N 3.09Å; K91-T95 PolarHBondContact O-OG1 3.44Å; K91-S153 WeakPolarHBondContact CE-O 3.28Å; K91-S153 PolarHBondContact O-OG 3.16Å; K91-T157 HydrophobicContact CG-CG2 4.37Å; K91-T157 VanDerWaalsContact CG-OG1 3.3Å; K91-T157 WeakPolarHBondContact CG-OG1 3.23Å
92I91.7Very high91.1Very high96 Ų9634.6 Ų34.649%0.49219%0.194SC..Hα-helixtrans-60.5-48.4176.3-69.5165.3000110.2S88 L89 G94 T95 A96S88-I92 VanDerWaalsContact O-CG1 3.3Å; S88-I92 WeakPolarHBondContact O-CG1 3.38Å; S88-I92 PolarHBondContact O-N 2.87Å; L89-I92 HydrophobicContact CD1-CD1 4.45Å; L89-I92 PolarHBondContact O-N 3.19Å; I92-G94 PolarHBondContact O-N 3.41Å; I92-T95 PolarHBondContact O-N 3.25Å; I92-A96 VanDerWaalsContact O-CB 3.31Å; I92-A96 WeakPolarHBondContact O-CB 3.46Å; I92-A96 PolarHBondContact O-N 2.92Å
93S92.1Very high91.4Very high1 Ų131.1 Ų31.11%0.00718%0.179CC..Hα-helixtrans-63.5-42.7179.8-179.50000112.4K74 L89 C90 A96 F97K74-S93 WeakPolarHBondContact CE-OG 3.37Å; K74-S93 WeakPolarHBondContact CG-OG 3.26Å; L89-S93 VanDerWaalsContact O-CB 3.32Å; L89-S93 WeakPolarHBondContact O-CB 3.21Å; L89-S93 PolarHBondContact O-N 2.72Å; C90-S93 PolarHBondContact O-N 3.26Å; S93-A96 PolarHBondContact O-N 3.28Å; S93-F97 WeakPolarHBondContact O-CB 3.3Å; S93-F97 PolarHBondContact O-N 3.39Å
94G89.4Confident91.6Very high2 Ų231 Ų312%0.02118%0.178CC..Hα-helixtrans-64.7-42.5175.200000113.1C90 K91 I92 F97 L98C90-G94 PolarHBondContact O-N 3.4Å; K91-G94 PolarHBondContact O-N 2.99Å; I92-G94 PolarHBondContact O-N 3.41Å; G94-F97 PolarHBondContact O-N 3.04Å; G94-L98 WeakPolarHBondContact O-CG 3.34Å; G94-L98 PolarHBondContact O-N 3.35Å
95T91.1Very high91.7Very high20 Ų2027.8 Ų27.812%0.12316%0.157CC..Hα-helixtrans-62.9-45.8175.3-60.40000111.1K91 I92 F97 L98 T99 G149 I150 S153K91-T95 VanDerWaalsContact O-CB 3.28Å; K91-T95 WeakPolarHBondContact O-CB 3.05Å; K91-T95 PolarHBondContact O-N 3.09Å; K91-T95 PolarHBondContact O-OG1 3.44Å; I92-T95 PolarHBondContact O-N 3.25Å; T95-F97 VanDerWaalsContact C-N 3.33Å; T95-F97 PolarHBondContact O-N 2.73Å; T95-L98 PolarHBondContact O-N 3.42Å; T95-T99 WeakPolarHBondContact O-CB 3.28Å; T95-T99 PolarHBondContact O-N 3.41Å; T95-T99 PolarHBondContact O-OG1 2.96Å; T95-G149 PolarHBondContact OG1-O 3.36Å; T95-I150 HydrophobicContact CG2-CG1 4.11Å; T95-S153 PolarHBondContact OG1-OG 2.62Å
96A93.8Very high91.9Very high15 Ų1526.2 Ų26.212%0.12415%0.152CC..Hα-helixtrans-61.8-41.4178.300000111.7T70 I92 S93 T99 N100T70-A96 HydrophobicContact CG2-CB 3.76Å; I92-A96 VanDerWaalsContact O-CB 3.31Å; I92-A96 WeakPolarHBondContact O-CB 3.46Å; I92-A96 PolarHBondContact O-N 2.92Å; S93-A96 PolarHBondContact O-N 3.28Å; A96-T99 PolarHBondContact O-N 3Å; A96-N100 VanDerWaalsContact O-CB 3.28Å; A96-N100 WeakPolarHBondContact O-CB 3.4Å; A96-N100 PolarHBondContact O-N 3.2Å
97F91.9Very high92.2Very high26 Ų2624.3 Ų24.311%0.11413%0.133CC..Hα-helixtrans-60.7-50.7174.7168.1-102.6000112.6F67 S93 G94 T95 T99 N100 I101 L276 T280F67-F97 HydrophobicContact CD2-CB 4.18Å; F67-F97 HydrophobicContact CD2-CD2 4.43Å; F67-F97 HydrophobicContact CE2-CB 4.11Å; F67-F97 AromaticContact CE2-CD2 3.77Å; F67-F97 HydrophobicContact CE2-CD2 3.77Å; F67-F97 HydrophobicContact CE2-CG 4.44Å; F67-F97 HydrophobicContact CZ-CD2 4.23Å; S93-F97 WeakPolarHBondContact O-CB 3.3Å; S93-F97 PolarHBondContact O-N 3.39Å; G94-F97 PolarHBondContact O-N 3.04Å; T95-F97 VanDerWaalsContact C-N 3.33Å; T95-F97 PolarHBondContact O-N 2.73Å; F97-T99 PolarHBondContact O-N 3.43Å; F97-N100 PolarHBondContact O-N 3.37Å; F97-I101 HydrophobicContact CE1-CD1 4.4Å; F97-I101 HydrophobicContact CE2-CD1 3.56Å; F97-I101 HydrophobicContact CE2-CG1 3.88Å; F97-I101 HydrophobicContact CZ-CD1 3.4Å; F97-I101 HydrophobicContact CZ-CG1 4.05Å; F97-I101 PolarHBondContact O-N 3.08Å; F97-L276 HydrophobicContact CE1-CD1 4.27Å; F97-L276 HydrophobicContact CE2-CD1 3.42Å; F97-L276 VanDerWaalsContact CE2-CD1 3.42Å; F97-L276 HydrophobicContact CZ-CD1 3.17Å; F97-T280 HydrophobicContact CD2-CG2 4.49Å; F97-T280 HydrophobicContact CE2-CG2 4.04Å
98L89.6Confident92.4Very high29 Ų2922.2 Ų22.215%0.15212%0.121CC..Hα-helixtrans-63.8-42.9178.3-70.5172000111.7G94 T95 N100 I101 Y102 A152 F168G94-L98 WeakPolarHBondContact O-CG 3.34Å; G94-L98 PolarHBondContact O-N 3.35Å; T95-L98 PolarHBondContact O-N 3.42Å; L98-N100 VanDerWaalsContact C-N 3.27Å; L98-N100 PolarHBondContact O-N 3.42Å; L98-I101 PolarHBondContact O-N 3.29Å; L98-Y102 HydrophobicContact CD2-CE2 4.06Å; L98-Y102 WeakPolarHBondContact O-CD2 3.44Å; L98-Y102 PolarHBondContact O-N 2.66Å; L98-Y102 VanDerWaalsContact O-N 3.11Å; L98-A152 HydrophobicContact CD1-CB 3.49Å; L98-A152 VanDerWaalsContact CD1-CB 3.49Å; L98-F168 HydrophobicContact CD1-CZ 4.28Å
99T92.4Very high92.7Very high4 Ų418.2 Ų18.23%0.0259%0.093CC..Hα-helixtrans-57.6-42.8175.2-61.90000111.1T95 A96 F97 G103 W142 V145 L146T95-T99 WeakPolarHBondContact O-CB 3.28Å; T95-T99 PolarHBondContact O-N 3.41Å; T95-T99 PolarHBondContact O-OG1 2.96Å; A96-T99 PolarHBondContact O-N 3Å; F97-T99 PolarHBondContact O-N 3.43Å; T99-G103 WeakPolarHBondContact O-CA 3.37Å; T99-G103 PolarHBondContact O-N 3.32Å; T99-W142 HydrophobicContact CG2-CE3 4.12Å; T99-W142 HydrophobicContact CG2-CH2 4.41Å; T99-W142 HydrophobicContact CG2-CZ3 3.51Å; T99-V145 HydrophobicContact CG2-CG2 3.8Å; T99-L146 HydrophobicContact CG2-CD2 4.13Å
100N94.8Very high92.9Very high1 Ų117.5 Ų17.51%0.0059%0.091CC..Hα-helixtrans-68.2-50.9179.4175.8-99.1000112.8S63 D64 F67 A96 F97 L98 Y102 S104S63-N100 PolarHBondContact O-ND2 3.5Å; S63-N100 WeakPolarHBondContact OG-CA 3.29Å; D64-N100 WeakPolarHBondContact CA-ND2 3.42Å; D64-N100 PolarHBondContact OD1-ND2 3.39Å; F67-N100 HydrophobicContact CB-CB 3.52Å; F67-N100 HydrophobicContact CD1-CB 4.42Å; F67-N100 HydrophobicContact CG-CB 3.96Å; A96-N100 VanDerWaalsContact O-CB 3.28Å; A96-N100 WeakPolarHBondContact O-CB 3.4Å; A96-N100 PolarHBondContact O-N 3.2Å; F97-N100 PolarHBondContact O-N 3.37Å; L98-N100 VanDerWaalsContact C-N 3.27Å; L98-N100 PolarHBondContact O-N 3.42Å; N100-Y102 PolarHBondContact O-N 3.01Å; N100-S104 WeakPolarHBondContact O-CB 3.38Å; N100-S104 PolarHBondContact O-N 3.43Å; N100-S104 PolarHBondContact O-OG 2.9Å
101I92.3Very high92.9Very high1 Ų117.5 Ų17.51%0.0059%0.091CC..Hα-helixtrans-59.1-52.7-178.8-84.6-158000111.2F97 L98 M105 Y244 L276 A279F97-I101 HydrophobicContact CE1-CD1 4.4Å; F97-I101 HydrophobicContact CE2-CD1 3.56Å; F97-I101 HydrophobicContact CE2-CG1 3.88Å; F97-I101 HydrophobicContact CZ-CD1 3.4Å; F97-I101 HydrophobicContact CZ-CG1 4.05Å; F97-I101 PolarHBondContact O-N 3.08Å; L98-I101 PolarHBondContact O-N 3.29Å; I101-M105 HydrophobicContact CG2-CE 3.35Å; I101-M105 WeakPolarHBondContact O-CG 3.44Å; I101-M105 PolarHBondContact O-N 2.8Å; I101-Y244 HydrophobicContact CD1-CD1 3.84Å; I101-Y244 HydrophobicContact CD1-CE1 3.52Å; I101-Y244 HydrophobicContact CG2-CE1 4.21Å; I101-L276 HydrophobicContact CD1-CD1 4.44Å; I101-A279 HydrophobicContact CD1-CB 3.87Å
102Y93Very high93Very high29 Ų2914.3 Ų14.311%0.1148%0.078CC..Hα-helixtrans-76.9-35.4-176.3-69.1-69.8000112.4L98 N100 S104 M105 L106 I187 E188L98-Y102 HydrophobicContact CD2-CE2 4.06Å; L98-Y102 WeakPolarHBondContact O-CD2 3.44Å; L98-Y102 PolarHBondContact O-N 2.66Å; L98-Y102 VanDerWaalsContact O-N 3.11Å; N100-Y102 PolarHBondContact O-N 3.01Å; Y102-S104 VanDerWaalsContact C-N 3.34Å; Y102-M105 HydrophobicContact CD1-CE 4.35Å; Y102-M105 HydrophobicContact CE1-CE 4.48Å; Y102-M105 PolarHBondContact O-N 3.16Å; Y102-L106 WeakPolarHBondContact O-CB 3.4Å; Y102-L106 WeakPolarHBondContact O-CG 3.43Å; Y102-L106 PolarHBondContact O-N 2.92Å; Y102-I187 HydrophobicContact CE1-CG2 3.71Å; Y102-I187 HydrophobicContact CE2-CG2 4Å; Y102-I187 VanDerWaalsContact CZ-CG2 3.41Å; Y102-I187 VanDerWaalsContact OH-CG2 3.28Å; Y102-I187 WeakPolarHBondContact OH-CG2 3.4Å; Y102-E188 PolarHBondContact OH-OE1 2.98Å
103G95.4Very high93.1Very high0 Ų011.9 Ų11.90%07%0.067CC..Hα-helixtrans-60.8-44.9173.900000111.1T99 L106 F107T99-G103 WeakPolarHBondContact O-CA 3.37Å; T99-G103 PolarHBondContact O-N 3.32Å; G103-L106 PolarHBondContact O-N 3.44Å; G103-F107 WeakPolarHBondContact O-CB 3.46Å; G103-F107 WeakPolarHBondContact O-CD2 3.13Å; G103-F107 WeakPolarHBondContact O-CG 3.45Å; G103-F107 PolarHBondContact O-N 3.08Å
104S95.1Very high93.1Very high0 Ų012.1 Ų12.10%07%0.069CC..Hα-helixtrans-61.9-47.9178.5-59.70000112N100 Y102 L106 F107 L108N100-S104 WeakPolarHBondContact O-CB 3.38Å; N100-S104 PolarHBondContact O-N 3.43Å; N100-S104 PolarHBondContact O-OG 2.9Å; Y102-S104 VanDerWaalsContact C-N 3.34Å; S104-L106 VanDerWaalsContact C-N 3.33Å; S104-L106 PolarHBondContact O-N 2.92Å; S104-F107 PolarHBondContact O-N 2.84Å; S104-L108 WeakPolarHBondContact O-CB 3.43Å; S104-L108 WeakPolarHBondContact O-CG 3.29Å; S104-L108 PolarHBondContact O-N 3.47Å
105M94.1Very high93.1Very high0 Ų014.7 Ų14.70%08%0.078CC..Hα-helixtrans-56.8-45.4175.2-73.2-171.8-124.400112.6I101 Y102 T109 F192 F237 F241 N245I101-M105 HydrophobicContact CG2-CE 3.35Å; I101-M105 WeakPolarHBondContact O-CG 3.44Å; I101-M105 PolarHBondContact O-N 2.8Å; Y102-M105 HydrophobicContact CD1-CE 4.35Å; Y102-M105 HydrophobicContact CE1-CE 4.48Å; Y102-M105 PolarHBondContact O-N 3.16Å; M105-T109 WeakPolarHBondContact O-CB 3.23Å; M105-T109 PolarHBondContact O-N 2.93Å; M105-T109 PolarHBondContact O-OG1 3.22Å; M105-F192 HydrophobicContact SD-CD2 4.01Å; M105-F237 HydrophobicContact CB-CE2 4.1Å; M105-F237 HydrophobicContact CG-CE2 4.05Å; M105-F237 HydrophobicContact CG-CZ 4.49Å; M105-F241 HydrophobicContact CE-CB 4.06Å; M105-F241 HydrophobicContact CE-CD1 3.57Å; M105-F241 HydrophobicContact CE-CE1 4.3Å; M105-F241 HydrophobicContact CE-CG 3.99Å; M105-F241 HydrophobicContact CG-CB 4.08Å; M105-F241 HydrophobicContact CG-CD1 3.59Å; M105-F241 HydrophobicContact CG-CD2 3.68Å; M105-F241 HydrophobicContact CG-CE1 3.84Å; M105-F241 HydrophobicContact CG-CE2 4Å; M105-F241 HydrophobicContact CG-CG 3.48Å; M105-F241 VanDerWaalsContact CG-CG 3.48Å; M105-F241 HydrophobicContact CG-CZ 4.04Å; M105-F241 HydrophobicContact SD-CB 3.91Å; M105-F241 HydrophobicContact SD-CD1 4.11Å; M105-F241 HydrophobicContact SD-CG 3.95Å; M105-N245 WeakPolarHBondContact CE-ND2 3.48Å
106L95.5Very high93.1Very high36 Ų3615.1 Ų15.119%0.1888%0.078CC..Hα-helixtrans-69.9-43.5-179-70173.6000112.1Y102 G103 S104 L108 T109 C110 V141 L144 V145 P195Y102-L106 WeakPolarHBondContact O-CB 3.4Å; Y102-L106 WeakPolarHBondContact O-CG 3.43Å; Y102-L106 PolarHBondContact O-N 2.92Å; G103-L106 PolarHBondContact O-N 3.44Å; S104-L106 VanDerWaalsContact C-N 3.33Å; S104-L106 PolarHBondContact O-N 2.92Å; L106-L108 PolarHBondContact O-N 2.96Å; L106-T109 CarbonylContact O-C 3.59Å; L106-T109 WeakPolarHBondContact O-CB 3.37Å; L106-T109 PolarHBondContact O-N 3.49Å; L106-C110 PolarHBondContact O-N 3.35Å; L106-C110 PolarHBondContact O-SG 3.45Å; L106-V141 HydrophobicContact CB-CG1 3.81Å; L106-V141 HydrophobicContact CB-CG2 4.17Å; L106-V141 HydrophobicContact CD1-CG1 4Å; L106-L144 HydrophobicContact CD1-CD2 3.96Å; L106-V145 HydrophobicContact CD1-CG1 3.83Å; L106-P195 HydrophobicContact CD2-CG 3.87Å
107F95.5Very high93Very high0 Ų016 Ų160%08%0.08CC..Hα-helixtrans-65.1-38.7176.8-72.2-52.5000112.3F56 N59 L60 G103 S104 T109 C110 I111 C138 V141 W142F56-F107 HydrophobicContact CD1-CD1 4.42Å; N59-F107 HydrophobicContact CB-CD1 4.15Å; N59-F107 HydrophobicContact CB-CD2 4.45Å; N59-F107 HydrophobicContact CB-CE1 3.6Å; N59-F107 HydrophobicContact CB-CE2 3.94Å; N59-F107 HydrophobicContact CB-CZ 3.51Å; L60-F107 HydrophobicContact CB-CB 4.16Å; L60-F107 HydrophobicContact CB-CD2 4.47Å; L60-F107 HydrophobicContact CD1-CB 4.25Å; G103-F107 WeakPolarHBondContact O-CB 3.46Å; G103-F107 WeakPolarHBondContact O-CD2 3.13Å; G103-F107 WeakPolarHBondContact O-CG 3.45Å; G103-F107 PolarHBondContact O-N 3.08Å; S104-F107 PolarHBondContact O-N 2.84Å; F107-T109 VanDerWaalsContact C-N 3.31Å; F107-T109 PolarHBondContact O-N 3.39Å; F107-C110 WeakPolarHBondContact O-CB 3.24Å; F107-C110 PolarHBondContact O-N 3.42Å; F107-I111 VanDerWaalsContact O-CG1 3.3Å; F107-I111 WeakPolarHBondContact O-CG1 3.43Å; F107-I111 PolarHBondContact O-N 2.92Å; F107-C138 HydrophobicContact CE1-CB 4.08Å; F107-V141 HydrophobicContact CD1-CG1 4.32Å; F107-V141 HydrophobicContact CD2-CG1 4.46Å; F107-V141 HydrophobicContact CE1-CB 4Å; F107-V141 HydrophobicContact CE1-CG1 3.83Å; F107-V141 HydrophobicContact CE1-CG2 4.45Å; F107-V141 HydrophobicContact CE2-CG1 3.99Å; F107-V141 HydrophobicContact CZ-CB 4.08Å; F107-V141 HydrophobicContact CZ-CG1 3.62Å; F107-W142 HydrophobicContact CE2-CZ2 4.38Å; F107-W142 AromaticContact CZ-NE1 3.72Å
108L92.5Very high92.8Very high5 Ų515.9 Ų15.93%0.0268%0.084CC..Hα-helixtrans-62.5-40.2172.1-70174.1000111.8L60 S104 L106 I111 S112 F241 I289L60-L108 HydrophobicContact CD2-CD2 3.83Å; L60-L108 HydrophobicContact CD2-CG 4.27Å; S104-L108 WeakPolarHBondContact O-CB 3.43Å; S104-L108 WeakPolarHBondContact O-CG 3.29Å; S104-L108 PolarHBondContact O-N 3.47Å; L106-L108 PolarHBondContact O-N 2.96Å; L108-I111 HydrophobicContact CD2-CD1 4.46Å; L108-I111 PolarHBondContact O-N 3.32Å; L108-S112 PolarHBondContact O-N 3.08Å; L108-S112 PolarHBondContact O-OG 2.96Å; L108-F241 HydrophobicContact CD1-CE2 3.59Å; L108-F241 HydrophobicContact CD1-CZ 4.2Å; L108-I289 HydrophobicContact CD1-CD1 4.46Å; L108-I289 HydrophobicContact CD2-CD1 3.35Å; L108-I289 HydrophobicContact CD2-CG2 4.1Å
109T94.6Very high92.6Very high8 Ų815.9 Ų15.95%0.0498%0.084CC..Hα-helixtrans-61.5-45.1172.9-53.20000111.3M105 L106 F107 I111 S112 V113 P195 L198 N199M105-T109 WeakPolarHBondContact O-CB 3.23Å; M105-T109 PolarHBondContact O-N 2.93Å; M105-T109 PolarHBondContact O-OG1 3.22Å; L106-T109 CarbonylContact O-C 3.59Å; L106-T109 WeakPolarHBondContact O-CB 3.37Å; L106-T109 PolarHBondContact O-N 3.49Å; F107-T109 VanDerWaalsContact C-N 3.31Å; F107-T109 PolarHBondContact O-N 3.39Å; T109-I111 VanDerWaalsContact C-N 3.31Å; T109-I111 PolarHBondContact O-N 2.93Å; T109-S112 PolarHBondContact O-N 2.75Å; T109-V113 HydrophobicContact CG2-CG2 4.36Å; T109-V113 WeakPolarHBondContact O-CB 3.44Å; T109-V113 VanDerWaalsContact O-CG2 3.31Å; T109-V113 WeakPolarHBondContact O-CG2 3.38Å; T109-V113 PolarHBondContact O-N 2.96Å; T109-P195 WeakPolarHBondContact OG1-CB 3.31Å; T109-L198 HydrophobicContact CG2-CB 3.7Å; T109-L198 HydrophobicContact CG2-CD1 3.88Å; T109-L198 HydrophobicContact CG2-CG 4.47Å; T109-N199 PolarHBondContact OG1-ND2 3.02Å
110C95.1Very high92.4Very high21 Ų2117.2 Ų17.214%0.1429%0.092CC..Hα-helixtrans-59.8-41.2175.7-66.70000111.8F56 L106 F107 V113 D114F56-C110 HydrophobicContact CD1-CB 3.65Å; F56-C110 HydrophobicContact CD2-CB 4.21Å; F56-C110 HydrophobicContact CE1-CB 3.71Å; F56-C110 HydrophobicContact CE2-CB 4.24Å; F56-C110 HydrophobicContact CG-CB 3.94Å; F56-C110 HydrophobicContact CZ-CB 4Å; L106-C110 PolarHBondContact O-N 3.35Å; L106-C110 PolarHBondContact O-SG 3.45Å; F107-C110 WeakPolarHBondContact O-CB 3.24Å; F107-C110 PolarHBondContact O-N 3.42Å; C110-V113 PolarHBondContact O-N 2.99Å; C110-D114 VanDerWaalsContact O-CB 3.23Å; C110-D114 WeakPolarHBondContact O-CB 3.33Å; C110-D114 PolarHBondContact O-N 2.69Å
111I92.1Very high92.1Very high0 Ų022.5 Ų22.50%011%0.113CC..Hα-helixtrans-62.8-46.5174.9-67.8164.5000110.4T53 F56 M57 L60 F107 L108 T109 V113 D114 R115 T293T53-I111 HydrophobicContact CG2-CG1 4.24Å; T53-I111 HydrophobicContact CG2-CG2 4.02Å; F56-I111 HydrophobicContact CB-CD1 4.28Å; F56-I111 HydrophobicContact CB-CG1 3.68Å; F56-I111 HydrophobicContact CG-CG1 4.49Å; M57-I111 HydrophobicContact CG-CD1 4.08Å; L60-I111 HydrophobicContact CD2-CD1 4.37Å; F107-I111 VanDerWaalsContact O-CG1 3.3Å; F107-I111 WeakPolarHBondContact O-CG1 3.43Å; F107-I111 PolarHBondContact O-N 2.92Å; L108-I111 HydrophobicContact CD2-CD1 4.46Å; L108-I111 PolarHBondContact O-N 3.32Å; T109-I111 VanDerWaalsContact C-N 3.31Å; T109-I111 PolarHBondContact O-N 2.93Å; I111-V113 PolarHBondContact O-N 2.95Å; I111-D114 PolarHBondContact O-N 3.42Å; I111-R115 VanDerWaalsContact O-CG 3.25Å; I111-R115 WeakPolarHBondContact O-CG 3.46Å; I111-R115 PolarHBondContact O-N 3.27Å; I111-T293 HydrophobicContact CG2-CG2 4.24Å
112S91.6Very high91.6Very high7 Ų724.4 Ų24.45%0.04913%0.125CC..Hα-helixtrans-61.1-43.4177.4-69.40000112.7L108 T109 R115 F116 N199L108-S112 PolarHBondContact O-N 3.08Å; L108-S112 PolarHBondContact O-OG 2.96Å; T109-S112 PolarHBondContact O-N 2.75Å; S112-R115 PolarHBondContact O-N 2.81Å; S112-F116 WeakPolarHBondContact O-CB 3.34Å; S112-F116 PolarHBondContact O-N 2.91Å; S112-N199 WeakPolarHBondContact CB-OD1 3.03Å; S112-N199 PolarHBondContact OG-OD1 2.93Å
113V93.5Very high91.3Very high45 Ų4530.3 Ų30.327%0.27315%0.152SC..Hα-helixtrans-66.1-44.1176.4171.90000111T109 C110 I111 R115 F116 L117T109-V113 HydrophobicContact CG2-CG2 4.36Å; T109-V113 WeakPolarHBondContact O-CB 3.44Å; T109-V113 VanDerWaalsContact O-CG2 3.31Å; T109-V113 WeakPolarHBondContact O-CG2 3.38Å; T109-V113 PolarHBondContact O-N 2.96Å; C110-V113 PolarHBondContact O-N 2.99Å; I111-V113 PolarHBondContact O-N 2.95Å; V113-R115 VanDerWaalsContact C-N 3.27Å; V113-R115 PolarHBondContact O-N 2.87Å; V113-F116 WeakPolarHBondContact O-CB 3.41Å; V113-F116 PolarHBondContact O-N 3.22Å; V113-L117 HydrophobicContact CG1-CD1 4.04Å; V113-L117 HydrophobicContact CG1-CG 4.33Å; V113-L117 WeakPolarHBondContact O-CB 3.47Å; V113-L117 WeakPolarHBondContact O-CG 3.17Å; V113-L117 PolarHBondContact O-N 2.87Å
114D91.9Very high90.9Very high6 Ų640 Ų403%0.03219%0.188CC..Hα-helixtrans-56.8-43.6176178.766.5000111.2T53 F56 C110 I111 L117 A118 R129T53-D114 PolarHBondContact OG1-OD2 3.2Å; F56-D114 HydrophobicContact CD2-CB 4.45Å; F56-D114 HydrophobicContact CE2-CB 4.15Å; C110-D114 VanDerWaalsContact O-CB 3.23Å; C110-D114 WeakPolarHBondContact O-CB 3.33Å; C110-D114 PolarHBondContact O-N 2.69Å; I111-D114 PolarHBondContact O-N 3.42Å; D114-L117 PolarHBondContact O-N 3.26Å; D114-A118 WeakPolarHBondContact O-CB 3.24Å; D114-A118 PolarHBondContact O-N 3.18Å; D114-R129 VanDerWaalsContact CG-NH2 3.27Å; D114-R129 PolarHBondContact O-NE 3.22Å; D114-R129 IonicContact OD1-CZ 3.2Å; D114-R129 VanDerWaalsContact OD1-CZ 3.29Å; D114-R129 IonicContact OD1-NE 2.91Å; D114-R129 PolarHBondContact OD1-NE 2.86Å; D114-R129 IonicContact OD1-NH2 2.72Å; D114-R129 PolarHBondContact OD1-NH2 3.14Å; D114-R129 IonicContact OD2-CZ 2.76Å; D114-R129 IonicContact OD2-NE 2.65Å; D114-R129 IonicContact OD2-NH2 2.86Å; D114-R129 PolarHBondContact OD2-NH2 3.31Å
115R88.6Confident90.5Very high56 Ų5640.1 Ų40.121%0.21119%0.189CC..Hα-helixtrans-69.1-40.3177.2-66.3-64.4166.7172.90.6112.9T53 I111 S112 V113 A118 I119 M229 T293T53-R115 PolarHBondContact OG1-NH2 2.99Å; I111-R115 VanDerWaalsContact O-CG 3.25Å; I111-R115 WeakPolarHBondContact O-CG 3.46Å; I111-R115 PolarHBondContact O-N 3.27Å; S112-R115 PolarHBondContact O-N 2.81Å; V113-R115 VanDerWaalsContact C-N 3.27Å; V113-R115 PolarHBondContact O-N 2.87Å; R115-A118 WeakPolarHBondContact O-CB 3.4Å; R115-A118 PolarHBondContact O-N 3.28Å; R115-I119 WeakPolarHBondContact O-CD1 3.17Å; R115-I119 WeakPolarHBondContact O-CG1 3.33Å; R115-I119 PolarHBondContact O-N 2.71Å; R115-I119 VanDerWaalsContact O-N 3.11Å; R115-M229 HydrophobicContact CB-CE 3.83Å; R115-M229 HydrophobicContact CG-CE 3.56Å; R115-M229 HydrophobicContact CG-SD 3.93Å; R115-T293 PolarHBondContact NH2-O 2.98Å
116F91.4Very high90.1Very high28 Ų2848.8 Ų48.812%0.12322%0.222CC..Hα-helixtrans-57.2-50.8172.4161.1-104.4000111.8S112 V113 A118 I119 V120 Y121 C202 L205 V206S112-F116 WeakPolarHBondContact O-CB 3.34Å; S112-F116 PolarHBondContact O-N 2.91Å; V113-F116 WeakPolarHBondContact O-CB 3.41Å; V113-F116 PolarHBondContact O-N 3.22Å; F116-A118 VanDerWaalsContact C-N 3.32Å; F116-A118 PolarHBondContact O-N 3.24Å; F116-I119 PolarHBondContact O-N 2.89Å; F116-V120 HydrophobicContact CD2-CB 3.99Å; F116-V120 HydrophobicContact CD2-CG2 3.49Å; F116-V120 VanDerWaalsContact CD2-CG2 3.49Å; F116-V120 HydrophobicContact CE2-CB 3.79Å; F116-V120 HydrophobicContact CE2-CG1 3.93Å; F116-V120 HydrophobicContact CE2-CG2 3.64Å; F116-V120 WeakPolarHBondContact O-CB 3.35Å; F116-V120 WeakPolarHBondContact O-CG2 3.5Å; F116-V120 PolarHBondContact O-N 3.26Å; F116-Y121 HydrophobicContact CE1-CD2 4.34Å; F116-Y121 HydrophobicContact CE1-CE2 4.11Å; F116-Y121 HydrophobicContact CE2-CE2 4.28Å; F116-Y121 HydrophobicContact CZ-CD2 4.15Å; F116-Y121 AromaticContact CZ-CE2 3.59Å; F116-Y121 HydrophobicContact CZ-CE2 3.59Å; F116-C202 HydrophobicContact CB-CB 3.89Å; F116-C202 HydrophobicContact CG-CB 4.29Å; F116-L205 HydrophobicContact CD2-CB 3.95Å; F116-L205 HydrophobicContact CD2-CD1 4.37Å; F116-L205 HydrophobicContact CE2-CB 3.65Å; F116-L205 HydrophobicContact CE2-CD1 3.53Å; F116-L205 HydrophobicContact CE2-CG 4.24Å; F116-L205 HydrophobicContact CZ-CD1 3.89Å; F116-V206 HydrophobicContact CB-CG2 3.93Å; F116-V206 HydrophobicContact CD2-CG2 4.16Å
117L91.4Very high89.8Confident34 Ų3452.3 Ų52.318%0.17825%0.245CC..Hα-helixtrans-62-40.1179-70.2175.8000112V113 D114 I119 Y121 S125 I128 R129V113-L117 HydrophobicContact CG1-CD1 4.04Å; V113-L117 HydrophobicContact CG1-CG 4.33Å; V113-L117 WeakPolarHBondContact O-CB 3.47Å; V113-L117 WeakPolarHBondContact O-CG 3.17Å; V113-L117 PolarHBondContact O-N 2.87Å; D114-L117 PolarHBondContact O-N 3.26Å; L117-I119 VanDerWaalsContact C-N 3.34Å; L117-I119 PolarHBondContact O-N 3.2Å; L117-Y121 HydrophobicContact CD2-CD2 4.41Å; L117-Y121 CarbonylContact O-C 3.2Å; L117-Y121 WeakPolarHBondContact O-CA 3.46Å; L117-Y121 PolarHBondContact O-N 3.22Å; L117-Y121 VanDerWaalsContact O-N 3.16Å; L117-S125 WeakPolarHBondContact O-CB 3.23Å; L117-S125 PolarHBondContact O-OG 3.07Å; L117-S125 VanDerWaalsContact O-OG 3.08Å; L117-I128 HydrophobicContact CD1-CG2 4.4Å; L117-R129 HydrophobicContact CB-CG 4.27Å; L117-R129 HydrophobicContact CD1-CG 4.36Å
118A88.1Confident89.5Confident24 Ų2456.9 Ų56.920%0.19827%0.269CS..Hα-helixtrans-59.1-42.4177.400000113.4D114 R115 F116 R129D114-A118 WeakPolarHBondContact O-CB 3.24Å; D114-A118 PolarHBondContact O-N 3.18Å; R115-A118 WeakPolarHBondContact O-CB 3.4Å; R115-A118 PolarHBondContact O-N 3.28Å; F116-A118 VanDerWaalsContact C-N 3.32Å; F116-A118 PolarHBondContact O-N 3.24Å; A118-R129 VanDerWaalsContact CB-CZ 3.41Å
119I86.3Confident89.5Confident29 Ų2959.1 Ų59.115%0.14928%0.277CS..Hα-helixtrans-93.6-43.3-169.3-64.3162.5000111.3R115 F116 L117 V206 L210 I219 V226R115-I119 WeakPolarHBondContact O-CD1 3.17Å; R115-I119 WeakPolarHBondContact O-CG1 3.33Å; R115-I119 PolarHBondContact O-N 2.71Å; R115-I119 VanDerWaalsContact O-N 3.11Å; F116-I119 PolarHBondContact O-N 2.89Å; L117-I119 VanDerWaalsContact C-N 3.34Å; L117-I119 PolarHBondContact O-N 3.2Å; I119-V206 HydrophobicContact CB-CG1 4.41Å; I119-V206 HydrophobicContact CD1-CG1 3.64Å; I119-V206 HydrophobicContact CG2-CG1 4.14Å; I119-L210 HydrophobicContact CG2-CD2 4.33Å; I119-I219 HydrophobicContact CG2-CD1 4.17Å; I119-V226 HydrophobicContact CD1-CG1 3.52Å
120V87.9Confident89.4Confident31 Ų3161 Ų6119%0.18829%0.288CS..Hα-helixtrans-83.9-32.3-174.3-175.10000111.5F116 V206 T209F116-V120 HydrophobicContact CD2-CB 3.99Å; F116-V120 HydrophobicContact CD2-CG2 3.49Å; F116-V120 VanDerWaalsContact CD2-CG2 3.49Å; F116-V120 HydrophobicContact CE2-CB 3.79Å; F116-V120 HydrophobicContact CE2-CG1 3.93Å; F116-V120 HydrophobicContact CE2-CG2 3.64Å; F116-V120 WeakPolarHBondContact O-CB 3.35Å; F116-V120 WeakPolarHBondContact O-CG2 3.5Å; F116-V120 PolarHBondContact O-N 3.26Å; V120-V206 HydrophobicContact CG2-CG2 4.2Å; V120-T209 HydrophobicContact CG2-CG2 4.4Å
121Y87.4Confident89.2Confident112 Ų11265.8 Ų65.844%0.43930%0.303SS..  trans-130.859.3-178.3-59.2-69.6000112.8F116 L117 F123 R124 S125F116-Y121 HydrophobicContact CE1-CD2 4.34Å; F116-Y121 HydrophobicContact CE1-CE2 4.11Å; F116-Y121 HydrophobicContact CE2-CE2 4.28Å; F116-Y121 HydrophobicContact CZ-CD2 4.15Å; F116-Y121 AromaticContact CZ-CE2 3.59Å; F116-Y121 HydrophobicContact CZ-CE2 3.59Å; L117-Y121 HydrophobicContact CD2-CD2 4.41Å; L117-Y121 CarbonylContact O-C 3.2Å; L117-Y121 WeakPolarHBondContact O-CA 3.46Å; L117-Y121 PolarHBondContact O-N 3.22Å; L117-Y121 VanDerWaalsContact O-N 3.16Å; Y121-F123 VanDerWaalsContact C-N 3.29Å; Y121-F123 PolarHBondContact O-N 2.98Å; Y121-F123 VanDerWaalsContact O-N 3.16Å; Y121-R124 PolarHBondContact O-N 2.9Å; Y121-S125 WeakPolarHBondContact O-CB 3.4Å; Y121-S125 PolarHBondContact O-N 3.36Å; Y121-S125 PolarHBondContact O-OG 3.4Å
122P83.3Confident89.3Confident41 Ų4175.1 Ų75.127%0.26634%0.338SS..THydrogen-bonded Turntrans-61.2-29.5-169.923.4-34.7000115
123F85.6Confident89.5Confident153 Ų15377.6 Ų77.667%0.67135%0.351SS*.THydrogen-bonded Turntrans-89.1-49.2179.1-59.1-70.8000112.4Y121 S125 R126Y121-F123 VanDerWaalsContact C-N 3.29Å; Y121-F123 PolarHBondContact O-N 2.98Å; Y121-F123 VanDerWaalsContact O-N 3.16Å; F123-S125 VanDerWaalsContact C-N 3.31Å; F123-S125 PolarHBondContact O-N 2.88Å; F123-R126 PolarHBondContact O-N 3.4Å
124R86.3Confident89.5Confident204 Ų20475.7 Ų75.777%0.7734%0.34SS*.G310 helixtrans-67.5-30.7-178.7-68.2-175.5-179.5175.8-0.4112.7Y121 R126 T127Y121-R124 PolarHBondContact O-N 2.9Å; R124-R126 VanDerWaalsContact C-N 3.28Å; R124-R126 PolarHBondContact O-N 3.35Å; R124-T127 PolarHBondContact O-OG1 3.48Å
125S88.4Confident89.7Confident3 Ų377.7 Ų77.72%0.02136%0.357CS..G310 helixtrans-74.6-12.9-177.866.30000114.2L117 Y121 F123 T127 I128 R129L117-S125 WeakPolarHBondContact O-CB 3.23Å; L117-S125 PolarHBondContact O-OG 3.07Å; L117-S125 VanDerWaalsContact O-OG 3.08Å; Y121-S125 WeakPolarHBondContact O-CB 3.4Å; Y121-S125 PolarHBondContact O-N 3.36Å; Y121-S125 PolarHBondContact O-OG 3.4Å; F123-S125 VanDerWaalsContact C-N 3.31Å; F123-S125 PolarHBondContact O-N 2.88Å; S125-T127 VanDerWaalsContact C-N 3.26Å; S125-T127 PolarHBondContact O-N 3.47Å; S125-I128 PolarHBondContact O-N 2.85Å; S125-R129 WeakPolarHBondContact O-CB 3.45Å; S125-R129 WeakPolarHBondContact O-CG 3.23Å; S125-R129 PolarHBondContact O-N 3.35Å
126R85.7Confident90.1Very high181 Ų18179.7 Ų79.768%0.68337%0.371SS*.G310 helixtrans-59.3-33.9-178.2-72.2-176177-169.7-2.2113.7F123 R124F123-R126 PolarHBondContact O-N 3.4Å; R124-R126 VanDerWaalsContact C-N 3.28Å; R124-R126 PolarHBondContact O-N 3.35Å
127T88.6Confident90.4Very high111 Ų11181.5 Ų81.568%0.68138%0.384SS*.G310 helixtrans-78.1-25.2178.552.70000112.6R124 S125 T130R124-T127 PolarHBondContact O-OG1 3.48Å; S125-T127 VanDerWaalsContact C-N 3.26Å; S125-T127 PolarHBondContact O-N 3.47Å; T127-T130 WeakPolarHBondContact O-CG2 3.14Å
128I90.1Very high90.7Very high96 Ų9680 Ų8049%0.49238%0.377SS..THydrogen-bonded Turntrans-89.1-45.1-179.3-59.3173.5000110.5L117 S125 T130 N133L117-I128 HydrophobicContact CD1-CG2 4.4Å; S125-I128 PolarHBondContact O-N 2.85Å; I128-T130 PolarHBondContact O-N 3.46Å; I128-N133 VanDerWaalsContact O-CB 3.3Å; I128-N133 WeakPolarHBondContact O-CB 3.48Å; I128-N133 PolarHBondContact O-ND2 2.97Å
129R92.1Very high91.1Very high52 Ų5281.2 Ų81.220%0.19639%0.386CS..SBendtrans-80.869.4-178.2-62.8179.971.5-137.2-0.9110.3E52 D114 L117 A118 S125E52-R129 HydrophobicContact CG-CB 4.46Å; E52-R129 WeakPolarHBondContact CG-O 3.41Å; D114-R129 VanDerWaalsContact CG-NH2 3.27Å; D114-R129 PolarHBondContact O-NE 3.22Å; D114-R129 IonicContact OD1-CZ 3.2Å; D114-R129 VanDerWaalsContact OD1-CZ 3.29Å; D114-R129 IonicContact OD1-NE 2.91Å; D114-R129 PolarHBondContact OD1-NE 2.86Å; D114-R129 IonicContact OD1-NH2 2.72Å; D114-R129 PolarHBondContact OD1-NH2 3.14Å; D114-R129 IonicContact OD2-CZ 2.76Å; D114-R129 IonicContact OD2-NE 2.65Å; D114-R129 IonicContact OD2-NH2 2.86Å; D114-R129 PolarHBondContact OD2-NH2 3.31Å; L117-R129 HydrophobicContact CB-CG 4.27Å; L117-R129 HydrophobicContact CD1-CG 4.36Å; A118-R129 VanDerWaalsContact CB-CZ 3.41Å; S125-R129 WeakPolarHBondContact O-CB 3.45Å; S125-R129 WeakPolarHBondContact O-CG 3.23Å; S125-R129 PolarHBondContact O-N 3.35Å
130T92.4Very high91.7Very high46 Ų4681.6 Ų81.628%0.28240%0.398SS..  trans-113.9151.4173.670.90000109.6T127 I128 R132 N133 S134T127-T130 WeakPolarHBondContact O-CG2 3.14Å; I128-T130 PolarHBondContact O-N 3.46Å; T130-R132 PolarHBondContact O-N 3.16Å; T130-N133 PolarHBondContact O-N 3.25Å; T130-N133 VanDerWaalsContact O-N 3.08Å; T130-N133 WeakPolarHBondContact OG1-CB 3.35Å; T130-N133 PolarHBondContact OG1-N 3.08Å; T130-N133 PolarHBondContact OG1-ND2 2.79Å; T130-S134 PolarHBondContact O-N 2.94Å; T130-S134 PolarHBondContact O-OG 2.84Å
131R91.3Very high92.2Very high123 Ų12380.8 Ų80.846%0.46439%0.393SS..Hα-helixtrans-55.7-38176.8-64.5-169.5-167.5156.98.9113R50 I55 S134 A135R50-R131 VanDerWaalsContact CA-NH2 3.33Å; R50-R131 PolarHBondContact O-NE 3.27Å; R50-R131 PolarHBondContact O-NH2 3.05Å; I55-R131 HydrophobicContact CD1-CB 3.76Å; I55-R131 HydrophobicContact CD1-CG 3.98Å; R131-S134 PolarHBondContact O-N 2.75Å; R131-A135 WeakPolarHBondContact O-CB 3.33Å; R131-A135 PolarHBondContact O-N 3.48Å
132R93.4Very high92.7Very high195 Ų19577.3 Ų77.374%0.73638%0.379SS*.Hα-helixtrans-60.3-49.3176.5-178179.9177.8-178.2-0.3110.6T130 A135 I136T130-R132 PolarHBondContact O-N 3.16Å; R132-A135 PolarHBondContact O-N 3.07Å; R132-I136 HydrophobicContact CG-CD1 3.93Å; R132-I136 VanDerWaalsContact O-CG1 3.28Å; R132-I136 WeakPolarHBondContact O-CG1 3.23Å; R132-I136 PolarHBondContact O-N 3.06Å
133N94.7Very high93.3Very high59 Ų5981 Ų8132%0.31640%0.395SS..Hα-helixtrans-65.8-41.9179.8-67-5.2000111.5I128 T130 A135 I136 V137I128-N133 VanDerWaalsContact O-CB 3.3Å; I128-N133 WeakPolarHBondContact O-CB 3.48Å; I128-N133 PolarHBondContact O-ND2 2.97Å; T130-N133 PolarHBondContact O-N 3.25Å; T130-N133 VanDerWaalsContact O-N 3.08Å; T130-N133 WeakPolarHBondContact OG1-CB 3.35Å; T130-N133 PolarHBondContact OG1-N 3.08Å; T130-N133 PolarHBondContact OG1-ND2 2.79Å; N133-A135 VanDerWaalsContact C-N 3.32Å; N133-A135 PolarHBondContact O-N 3.25Å; N133-I136 PolarHBondContact O-N 3.4Å; N133-V137 VanDerWaalsContact O-CG2 3.31Å; N133-V137 WeakPolarHBondContact O-CG2 3.43Å; N133-V137 PolarHBondContact O-N 3.12Å
134S94.8Very high93.7Very high6 Ų678.9 Ų78.94%0.04239%0.391CS..Hα-helixtrans-59-42174.2-62.20000112.3T130 R131 V137 C138T130-S134 PolarHBondContact O-N 2.94Å; T130-S134 PolarHBondContact O-OG 2.84Å; R131-S134 PolarHBondContact O-N 2.75Å; S134-V137 PolarHBondContact O-N 2.9Å; S134-C138 PolarHBondContact O-N 3.23Å; S134-C138 PolarHBondContact O-SG 2.74Å
135A95.2Very high94.1Very high48 Ų4869.7 Ų69.740%0.39736%0.357SS..Hα-helixtrans-66.3-41.6176.400000112.3R131 R132 N133 C138 A139R131-A135 WeakPolarHBondContact O-CB 3.33Å; R131-A135 PolarHBondContact O-N 3.48Å; R132-A135 PolarHBondContact O-N 3.07Å; N133-A135 VanDerWaalsContact C-N 3.32Å; N133-A135 PolarHBondContact O-N 3.25Å; A135-C138 PolarHBondContact O-N 2.79Å; A135-A139 WeakPolarHBondContact O-CB 3.37Å; A135-A139 PolarHBondContact O-N 3.32Å
136I97.1Very high94.3Very high98 Ų9872.7 Ų72.750%0.50337%0.372SS..Hα-helixtrans-60.8-45.4174.6-69.2166000110.5R132 N133 C138 A139 G140R132-I136 HydrophobicContact CG-CD1 3.93Å; R132-I136 VanDerWaalsContact O-CG1 3.28Å; R132-I136 WeakPolarHBondContact O-CG1 3.23Å; R132-I136 PolarHBondContact O-N 3.06Å; N133-I136 PolarHBondContact O-N 3.4Å; I136-C138 PolarHBondContact O-N 2.9Å; I136-A139 PolarHBondContact O-N 3.34Å; I136-G140 PolarHBondContact O-N 3.22Å
137V97.6Very high94.5Very high66 Ų6667.1 Ų67.140%0.436%0.361SS..Hα-helixtrans-61.3-44.5176.3171.90000110.7F56 N133 S134 A139 G140 V141F56-V137 HydrophobicContact CE1-CB 4.15Å; F56-V137 HydrophobicContact CE1-CG1 3.9Å; F56-V137 HydrophobicContact CZ-CB 4.48Å; F56-V137 HydrophobicContact CZ-CG1 4.36Å; N133-V137 VanDerWaalsContact O-CG2 3.31Å; N133-V137 WeakPolarHBondContact O-CG2 3.43Å; N133-V137 PolarHBondContact O-N 3.12Å; S134-V137 PolarHBondContact O-N 2.9Å; V137-A139 PolarHBondContact O-N 3.2Å; V137-G140 PolarHBondContact O-N 2.89Å; V137-V141 WeakPolarHBondContact O-CG2 3.45Å; V137-V141 PolarHBondContact O-N 3.26Å
138C97.8Very high94.4Very high3 Ų363.1 Ų63.12%0.0234%0.342CS..Hα-helixtrans-60.7-44176.4-67.10000112.1F56 N59 F107 S134 A135 I136 G140 V141 W142F56-C138 WeakPolarHBondContact CD1-SG 3.5Å; N59-C138 PolarHBondContact ND2-SG 3.02Å; F107-C138 HydrophobicContact CE1-CB 4.08Å; S134-C138 PolarHBondContact O-N 3.23Å; S134-C138 PolarHBondContact O-SG 2.74Å; A135-C138 PolarHBondContact O-N 2.79Å; I136-C138 PolarHBondContact O-N 2.9Å; C138-G140 VanDerWaalsContact C-N 3.31Å; C138-G140 PolarHBondContact O-N 3.27Å; C138-V141 PolarHBondContact O-N 2.85Å; C138-W142 PolarHBondContact O-N 2.98Å
139A98.1Very high94.2Very high48 Ų4858.6 Ų58.640%0.39732%0.319SS..Hα-helixtrans-60.2-42.5176.100000111.4A135 I136 V137 W142 I143A135-A139 WeakPolarHBondContact O-CB 3.37Å; A135-A139 PolarHBondContact O-N 3.32Å; I136-A139 PolarHBondContact O-N 3.34Å; V137-A139 PolarHBondContact O-N 3.2Å; A139-W142 PolarHBondContact O-N 3.34Å; A139-I143 VanDerWaalsContact O-CG1 3.26Å; A139-I143 WeakPolarHBondContact O-CG1 3.3Å; A139-I143 PolarHBondContact O-N 3.26Å
140G98.1Very high93.9Very high38 Ų3860.5 Ų60.539%0.39233%0.332SS..Hα-helixtrans-60.4-44.4174.100000113I136 V137 C138 I143 L144I136-G140 PolarHBondContact O-N 3.22Å; V137-G140 PolarHBondContact O-N 2.89Å; C138-G140 VanDerWaalsContact C-N 3.31Å; C138-G140 PolarHBondContact O-N 3.27Å; G140-I143 PolarHBondContact O-N 2.95Å; G140-L144 WeakPolarHBondContact O-CB 3.42Å; G140-L144 PolarHBondContact O-N 2.98Å
141V97.5Very high93.5Very high14 Ų1461 Ų619%0.08534%0.338CS..Hα-helixtrans-59.5-49.4174.9171.20000110.5L106 F107 V137 C138 I143 L144 V145L106-V141 HydrophobicContact CB-CG1 3.81Å; L106-V141 HydrophobicContact CB-CG2 4.17Å; L106-V141 HydrophobicContact CD1-CG1 4Å; F107-V141 HydrophobicContact CD1-CG1 4.32Å; F107-V141 HydrophobicContact CD2-CG1 4.46Å; F107-V141 HydrophobicContact CE1-CB 4Å; F107-V141 HydrophobicContact CE1-CG1 3.83Å; F107-V141 HydrophobicContact CE1-CG2 4.45Å; F107-V141 HydrophobicContact CE2-CG1 3.99Å; F107-V141 HydrophobicContact CZ-CB 4.08Å; F107-V141 HydrophobicContact CZ-CG1 3.62Å; V137-V141 WeakPolarHBondContact O-CG2 3.45Å; V137-V141 PolarHBondContact O-N 3.26Å; C138-V141 PolarHBondContact O-N 2.85Å; V141-I143 PolarHBondContact O-N 3.47Å; V141-L144 WeakPolarHBondContact O-CB 3.47Å; V141-L144 PolarHBondContact O-N 3.46Å; V141-V145 HydrophobicContact CG1-CG1 4.39Å; V141-V145 WeakPolarHBondContact O-CG2 3.49Å; V141-V145 PolarHBondContact O-N 3.49Å
142W97.9Very high92.7Very high38 Ų3856.5 Ų56.514%0.14433%0.327CS..Hα-helixtrans-57.4-47.7177.9-82.2114.3000112.7N59 V62 L66 T99 F107 C138 A139 L144 V145 L146N59-W142 PolarHBondContact OD1-NE1 3.47Å; V62-W142 HydrophobicContact CB-CZ2 4.47Å; V62-W142 HydrophobicContact CG1-CH2 4.28Å; V62-W142 HydrophobicContact CG1-CZ2 4.03Å; L66-W142 HydrophobicContact CD1-CH2 3.77Å; L66-W142 HydrophobicContact CD1-CZ3 4.03Å; T99-W142 HydrophobicContact CG2-CE3 4.12Å; T99-W142 HydrophobicContact CG2-CH2 4.41Å; T99-W142 HydrophobicContact CG2-CZ3 3.51Å; F107-W142 HydrophobicContact CE2-CZ2 4.38Å; F107-W142 AromaticContact CZ-NE1 3.72Å; C138-W142 PolarHBondContact O-N 2.98Å; A139-W142 PolarHBondContact O-N 3.34Å; W142-L144 VanDerWaalsContact C-N 3.29Å; W142-L144 PolarHBondContact O-N 2.94Å; W142-V145 HydrophobicContact CE3-CG2 4.33Å; W142-V145 PolarHBondContact O-N 3.14Å; W142-L146 HydrophobicContact CB-CD1 4.43Å; W142-L146 HydrophobicContact CE3-CD1 3.98Å; W142-L146 HydrophobicContact CE3-CG 4.1Å; W142-L146 WeakPolarHBondContact O-CB 3Å; W142-L146 VanDerWaalsContact O-CG 3.24Å; W142-L146 WeakPolarHBondContact O-CG 3.44Å; W142-L146 PolarHBondContact O-N 3.31Å
143I97.3Very high91.8Very high119 Ų11947.6 Ų47.661%0.6129%0.294SS*.Hα-helixtrans-58.4-45.3177.9-69.7165.3000110.3A139 G140 V141 S147A139-I143 VanDerWaalsContact O-CG1 3.26Å; A139-I143 WeakPolarHBondContact O-CG1 3.3Å; A139-I143 PolarHBondContact O-N 3.26Å; G140-I143 PolarHBondContact O-N 2.95Å; V141-I143 PolarHBondContact O-N 3.47Å; I143-S147 WeakPolarHBondContact O-CB 3.23Å; I143-S147 PolarHBondContact O-N 3.27Å; I143-S147 PolarHBondContact O-OG 2.96Å
144L94Very high90.9Very high109 Ų10951.4 Ų51.457%0.57131%0.314SS*.Hα-helixtrans-62.6-50.5179.9-179.762.9000112L106 G140 V141 W142 S147 G148L106-L144 HydrophobicContact CD1-CD2 3.96Å; G140-L144 WeakPolarHBondContact O-CB 3.42Å; G140-L144 PolarHBondContact O-N 2.98Å; V141-L144 WeakPolarHBondContact O-CB 3.47Å; V141-L144 PolarHBondContact O-N 3.46Å; W142-L144 VanDerWaalsContact C-N 3.29Å; W142-L144 PolarHBondContact O-N 2.94Å; L144-S147 PolarHBondContact O-OG 2.94Å; L144-G148 PolarHBondContact O-N 3.41Å; L144-G148 VanDerWaalsContact O-N 3.1Å
145V93.8Very high89.7Confident10 Ų1054 Ų546%0.06133%0.325CS..Hα-helixtrans-74.7-34.9-174.8-58.30000112.6T99 L106 V141 W142 G148 G149T99-V145 HydrophobicContact CG2-CG2 3.8Å; L106-V145 HydrophobicContact CD1-CG1 3.83Å; V141-V145 HydrophobicContact CG1-CG1 4.39Å; V141-V145 WeakPolarHBondContact O-CG2 3.49Å; V141-V145 PolarHBondContact O-N 3.49Å; W142-V145 HydrophobicContact CE3-CG2 4.33Å; W142-V145 PolarHBondContact O-N 3.14Å; V145-G148 PolarHBondContact O-N 2.93Å; V145-G149 PolarHBondContact O-N 3.43Å
146L93.3Very high88Confident67 Ų6756 Ų5635%0.35134%0.336SS..Hα-helixtrans-69.9-43.5176.2-71.7169.6000111.2T99 W142 G148 G149 I150T99-L146 HydrophobicContact CG2-CD2 4.13Å; W142-L146 HydrophobicContact CB-CD1 4.43Å; W142-L146 HydrophobicContact CE3-CD1 3.98Å; W142-L146 HydrophobicContact CE3-CG 4.1Å; W142-L146 WeakPolarHBondContact O-CB 3Å; W142-L146 VanDerWaalsContact O-CG 3.24Å; W142-L146 WeakPolarHBondContact O-CG 3.44Å; W142-L146 PolarHBondContact O-N 3.31Å; L146-G148 VanDerWaalsContact C-N 3.3Å; L146-G148 PolarHBondContact O-N 2.88Å; L146-G149 PolarHBondContact O-N 2.8Å; L146-I150 HydrophobicContact CB-CD1 4.47Å; L146-I150 VanDerWaalsContact O-CB 3.28Å; L146-I150 WeakPolarHBondContact O-CB 3.33Å; L146-I150 WeakPolarHBondContact O-CD1 3.5Å; L146-I150 WeakPolarHBondContact O-CG1 3.3Å; L146-I150 PolarHBondContact O-N 2.9Å
147S90.6Very high86.7Confident64 Ų6451.4 Ų51.445%0.44831%0.312SS..Hα-helixtrans-61.3-40.6175.660.30000111.6I143 L144 S151I143-S147 WeakPolarHBondContact O-CB 3.23Å; I143-S147 PolarHBondContact O-N 3.27Å; I143-S147 PolarHBondContact O-OG 2.96Å; L144-S147 PolarHBondContact O-OG 2.94Å; S147-S151 VanDerWaalsContact O-CB 3.26Å; S147-S151 WeakPolarHBondContact O-CB 3.35Å; S147-S151 PolarHBondContact O-N 3.41Å; S147-S151 PolarHBondContact O-OG 3.25Å
148G85.9Confident85.6Confident27 Ų2749.4 Ų49.428%0.27830%0.3SS..Hα-helixtrans-61.2-49.9171.900000113.2L144 V145 L146 S151 A152L144-G148 PolarHBondContact O-N 3.41Å; L144-G148 VanDerWaalsContact O-N 3.1Å; V145-G148 PolarHBondContact O-N 2.93Å; L146-G148 VanDerWaalsContact C-N 3.3Å; L146-G148 PolarHBondContact O-N 2.88Å; G148-S151 PolarHBondContact O-N 3.29Å; G148-S151 PolarHBondContact O-OG 2.88Å; G148-A152 PolarHBondContact O-N 3.24Å
149G85.2Confident84.5Confident1 Ų152.9 Ų52.91%0.0132%0.318CS..Hα-helixtrans-65.1-40.9-18000000113.6T95 V145 L146 A152 S153T95-G149 PolarHBondContact OG1-O 3.36Å; V145-G149 PolarHBondContact O-N 3.43Å; L146-G149 PolarHBondContact O-N 2.8Å; G149-A152 PolarHBondContact O-N 3.38Å; G149-S153 PolarHBondContact O-N 2.87Å; G149-S153 VanDerWaalsContact O-N 3.13Å; G149-S153 PolarHBondContact O-OG 2.93Å
150I86.4Confident83.5Confident92 Ų9257 Ų5747%0.47233%0.332SS..Hα-helixtrans-66.9-45.6177.4-67.9166.2000110.1T95 L146 A152 S153 L154T95-I150 HydrophobicContact CG2-CG1 4.11Å; L146-I150 HydrophobicContact CB-CD1 4.47Å; L146-I150 VanDerWaalsContact O-CB 3.28Å; L146-I150 WeakPolarHBondContact O-CB 3.33Å; L146-I150 WeakPolarHBondContact O-CD1 3.5Å; L146-I150 WeakPolarHBondContact O-CG1 3.3Å; L146-I150 PolarHBondContact O-N 2.9Å; I150-A152 VanDerWaalsContact C-N 3.31Å; I150-A152 PolarHBondContact O-N 2.83Å; I150-S153 CarbonylContact O-C 3.52Å; I150-S153 WeakPolarHBondContact O-CA 3.49Å; I150-S153 WeakPolarHBondContact O-CB 3.5Å; I150-S153 PolarHBondContact O-N 3.37Å; I150-L154 PolarHBondContact O-N 3.46Å; I150-L154 VanDerWaalsContact O-N 3.13Å
151S84.1Confident82.4Confident57 Ų5757.5 Ų57.540%0.39933%0.33SS..Hα-helixtrans-62.1-38.4178.660.40000112.4S147 G148 S153 L154S147-S151 VanDerWaalsContact O-CB 3.26Å; S147-S151 WeakPolarHBondContact O-CB 3.35Å; S147-S151 PolarHBondContact O-N 3.41Å; S147-S151 PolarHBondContact O-OG 3.25Å; G148-S151 PolarHBondContact O-N 3.29Å; G148-S151 PolarHBondContact O-OG 2.88Å; S151-S153 PolarHBondContact O-N 2.71Å; S151-L154 WeakPolarHBondContact O-CB 3.3Å; S151-L154 PolarHBondContact O-N 3.41Å
152A74.6Confident81.1Confident28 Ų2865.2 Ų65.223%0.23137%0.371CS..Hα-helixtrans-62.5-33.3171.700000112.6L98 G148 G149 I150 L154 F155L98-A152 HydrophobicContact CD1-CB 3.49Å; L98-A152 VanDerWaalsContact CD1-CB 3.49Å; G148-A152 PolarHBondContact O-N 3.24Å; G149-A152 PolarHBondContact O-N 3.38Å; I150-A152 VanDerWaalsContact C-N 3.31Å; I150-A152 PolarHBondContact O-N 2.83Å; A152-L154 VanDerWaalsContact C-N 3.3Å; A152-L154 PolarHBondContact O-N 3.28Å; A152-F155 PolarHBondContact O-N 3.28Å
153S74.8Confident80Confident7 Ų769.7 Ų69.75%0.04940%0.402CS..Hα-helixtrans-78.5-8.3177.8-61.70000114.4K91 T95 G149 I150 S151 F155K91-S153 WeakPolarHBondContact CE-O 3.28Å; K91-S153 PolarHBondContact O-OG 3.16Å; T95-S153 PolarHBondContact OG1-OG 2.62Å; G149-S153 PolarHBondContact O-N 2.87Å; G149-S153 VanDerWaalsContact O-N 3.13Å; G149-S153 PolarHBondContact O-OG 2.93Å; I150-S153 CarbonylContact O-C 3.52Å; I150-S153 WeakPolarHBondContact O-CA 3.49Å; I150-S153 WeakPolarHBondContact O-CB 3.5Å; I150-S153 PolarHBondContact O-N 3.37Å; S151-S153 PolarHBondContact O-N 2.71Å; S153-F155 VanDerWaalsContact C-N 3.29Å
154L74Confident79.2Confident140 Ų14065.5 Ų65.573%0.73338%0.384SS*.THydrogen-bonded Turntrans-73.3-22.3171.5-64.4176.5000112.3I150 S151 A152I150-L154 PolarHBondContact O-N 3.46Å; I150-L154 VanDerWaalsContact O-N 3.13Å; S151-L154 WeakPolarHBondContact O-CB 3.3Å; S151-L154 PolarHBondContact O-N 3.41Å; A152-L154 VanDerWaalsContact C-N 3.3Å; A152-L154 PolarHBondContact O-N 3.28Å
155F69.7Low78.6Confident61 Ų6161.7 Ų61.727%0.26837%0.365SS..SBendtrans-71.3153.5169.5-62.3-76.4000110.1A152 S153 T157 F171 L180 I183A152-F155 PolarHBondContact O-N 3.28Å; S153-F155 VanDerWaalsContact C-N 3.29Å; F155-T157 WeakPolarHBondContact O-CG2 3.41Å; F155-T157 PolarHBondContact O-N 2.92Å; F155-F171 HydrophobicContact CB-CE1 4.18Å; F155-L180 HydrophobicContact CD1-CD2 4.35Å; F155-L180 HydrophobicContact CD2-CD2 3.72Å; F155-L180 HydrophobicContact CE1-CD2 4.46Å; F155-L180 HydrophobicContact CE2-CD2 3.86Å; F155-L180 HydrophobicContact CG-CD2 3.99Å; F155-L180 HydrophobicContact CZ-CD2 4.23Å; F155-I183 HydrophobicContact CE2-CD1 4.25Å; F155-I183 HydrophobicContact CZ-CD1 4Å
156S61Low78.1Confident90 Ų9062.5 Ų62.563%0.62937%0.37SS*.  trans-61.4106.3177.5179.30000109.7T158 F171S156-T158 PolarHBondContact OG-O 3.41Å; S156-F171 WeakPolarHBondContact O-CD1 3.47Å; S156-F171 WeakPolarHBondContact O-CE1 3.48Å
157T69.8Low77.5Confident1 Ų159.4 Ų59.41%0.00635%0.354CS..  trans-95.4-20.2-174.650.40000112.5D87 K91 F155 F168 F171D87-T157 PolarHBondContact OD1-OG1 3.07Å; K91-T157 HydrophobicContact CG-CG2 4.37Å; K91-T157 VanDerWaalsContact CG-OG1 3.3Å; K91-T157 WeakPolarHBondContact CG-OG1 3.23Å; F155-T157 WeakPolarHBondContact O-CG2 3.41Å; F155-T157 PolarHBondContact O-N 2.92Å; T157-F168 HydrophobicContact CG2-CD2 3.53Å; T157-F168 HydrophobicContact CG2-CE2 3.34Å; T157-F168 HydrophobicContact CG2-CZ 4.24Å; T157-F168 WeakPolarHBondContact O-CA 3.39Å; T157-F168 PolarHBondContact O-N 2.94Å; T157-F171 HydrophobicContact CG2-CZ 4.49Å
158T73.9Confident76.6Confident24 Ų2458.9 Ų58.915%0.14734%0.343CS..EExtended strand (participates in β ladder)trans-102.8136.3170.951.20000111.1D87 C90 S156 T166D87-T158 HydrophobicContact CB-CG2 4.13Å; D87-T158 WeakPolarHBondContact OD1-CG2 3.28Å; D87-T158 PolarHBondContact OD1-OG1 3.01Å; C90-T158 HydrophobicContact CB-CG2 3.63Å; S156-T158 PolarHBondContact OG-O 3.41Å; T158-T166 WeakPolarHBondContact CA-O 3.32Å
159N75.1Confident75.7Confident76 Ų7659.6 Ų59.641%0.40634%0.34SS..EExtended strand (participates in β ladder)trans-122.3117.4172.6-166.5-29.9000108.4T165 T166 G170N159-T165 WeakPolarHBondContact O-CA 3.23Å; N159-T166 PolarHBondContact N-O 3.18Å; N159-T166 PolarHBondContact O-N 2.74Å; N159-G170 PolarHBondContact ND2-O 3.06Å; N159-G170 VanDerWaalsContact ND2-O 3.16Å
160I77.5Confident74.5Confident133 Ų13361.9 Ų61.968%0.68236%0.363SS*.EExtended strand (participates in β ladder)trans-95.1116.2-179.1-57.3173.1000107.4T165I160-T165 HydrophobicContact CG1-CG2 4.23Å
161S75.1Confident73.4Confident50 Ų5058.7 Ų58.735%0.3535%0.346SS..  trans-105.6166.116869.60000110.1T163 S164S161-T163 PolarHBondContact O-N 3.46Å; S161-S164 PolarHBondContact N-O 3.39Å; S161-S164 PolarHBondContact OG-N 3.46Å; S161-S164 PolarHBondContact OG-O 3.09Å; S161-S164 PolarHBondContact OG-OG 3.41Å
162N69.3Low72.5Confident176 Ų17659 Ų5994%0.94135%0.348SS*.SBendtrans-58.9-16.9179.3-68.2-11.2000113.9
163T73.8Confident72.1Confident131 Ų13165.1 Ų65.180%0.80437%0.369SS*.SBendtrans-122-22.1-17349.20000113.7S161S161-T163 PolarHBondContact O-N 3.46Å
164S81.1Confident71.7Confident32 Ų3274.2 Ų74.222%0.22440%0.402CS..  trans-158153.2-179.465.70000113.4S161S161-S164 PolarHBondContact N-O 3.39Å; S161-S164 PolarHBondContact OG-N 3.46Å; S161-S164 PolarHBondContact OG-O 3.09Å; S161-S164 PolarHBondContact OG-OG 3.41Å
165T82.3Confident71.5Confident28 Ų2870.7 Ų70.717%0.17238%0.384CS..EExtended strand (participates in β ladder)trans-102.6121.8168.6-55.70000108.9H82 W83 N159 I160H82-T165 PolarHBondContact ND1-N 3.32Å; W83-T165 HydrophobicContact CB-CG2 4.37Å; W83-T165 WeakPolarHBondContact CB-O 3.45Å; W83-T165 PolarHBondContact N-O 2.82Å; N159-T165 WeakPolarHBondContact O-CA 3.23Å; I160-T165 HydrophobicContact CG1-CG2 4.23Å
166T82.3Confident71.7Confident28 Ų2869.3 Ų69.317%0.17238%0.377CS..EExtended strand (participates in β ladder)trans-99.1144.1174.661.70000110.9T158 N159 E169T158-T166 WeakPolarHBondContact CA-O 3.32Å; N159-T166 PolarHBondContact N-O 3.18Å; N159-T166 PolarHBondContact O-N 2.74Å; T166-E169 PolarHBondContact OG1-O 3.2Å
167C81.8Confident72.2Confident1 Ų170.6 Ų70.61%0.00737%0.371CS..EExtended strand (participates in β ladder)trans-118.5124.1179.2167.50000111.7W83 C90 E169W83-C167 HydrophobicContact CB-CB 3.96Å; W83-C167 HydrophobicContact CD2-CB 3.45Å; W83-C167 VanDerWaalsContact CD2-CB 3.45Å; W83-C167 HydrophobicContact CE3-CB 3.65Å; W83-C167 HydrophobicContact CG-CB 3.56Å; W83-C167 HydrophobicContact CZ3-CB 4.43Å; C90-C167 WeakPolarHBondContact CA-SG 3.3Å; C90-C167 HydrophobicContact CB-CB 3.9Å; C90-C167 WeakPolarHBondContact CB-SG 3.46Å; C90-C167 WeakPolarHBondContact SG-CA 3.31Å; C90-C167 WeakPolarHBondContact SG-CB 3.22Å; C90-C167 CovalentContact SG-SG 2.03Å; C90-C167 PolarHBondContact SG-SG 3.18Å; C167-E169 PolarHBondContact O-N 3.16Å
168F71.8Confident72.3Confident53 Ų5373.3 Ų73.323%0.23239%0.388CS..SBendtrans60.124.3-176.7-124.8-93.1000113.2C90 L98 T157 F171C90-F168 PolarHBondContact SG-N 3.4Å; L98-F168 HydrophobicContact CD1-CZ 4.28Å; T157-F168 HydrophobicContact CG2-CD2 3.53Å; T157-F168 HydrophobicContact CG2-CE2 3.34Å; T157-F168 HydrophobicContact CG2-CZ 4.24Å; T157-F168 WeakPolarHBondContact O-CA 3.39Å; T157-F168 PolarHBondContact O-N 2.94Å; F168-F171 HydrophobicContact CD1-CE2 4.42Å
169E65.9Low72.3Confident43 Ų4378.7 Ų78.720%0.20141%0.406CS..  trans-133.8158.1178.1-74.1-175.4-119.300109.3K17 Y18 Y77 T166 C167K17-E169 IonicContact NZ-OE2 3.87Å; K17-E169 PolarHBondContact NZ-OE2 3.5Å; Y18-E169 PolarHBondContact OH-OE2 2.95Å; Y77-E169 WeakPolarHBondContact CE1-OE1 3.38Å; Y77-E169 VanDerWaalsContact OH-CD 3.27Å; Y77-E169 PolarHBondContact OH-OE1 3.46Å; T166-E169 PolarHBondContact OG1-O 3.2Å; C167-E169 PolarHBondContact O-N 3.16Å
170G60.5Low72.4Confident48 Ų4876 Ų7650%0.49539%0.391SS..  trans8419.4172.500000115.8N159 S172N159-G170 PolarHBondContact ND2-O 3.06Å; N159-G170 VanDerWaalsContact ND2-O 3.16Å; G170-S172 PolarHBondContact O-N 3.39Å
171F63.9Low72.4Confident26 Ų2669.9 Ų69.911%0.11436%0.361CS..  trans-58.6132.4171-63.1-82.5000111.4F155 S156 T157 F168 W176 L180 R255F155-F171 HydrophobicContact CB-CE1 4.18Å; S156-F171 WeakPolarHBondContact O-CD1 3.47Å; S156-F171 WeakPolarHBondContact O-CE1 3.48Å; T157-F171 HydrophobicContact CG2-CZ 4.49Å; F168-F171 HydrophobicContact CD1-CE2 4.42Å; F171-W176 HydrophobicContact CB-CE3 3.8Å; F171-W176 HydrophobicContact CB-CZ3 4.2Å; F171-W176 HydrophobicContact CD2-CE3 4.16Å; F171-W176 AromaticContact CD2-CZ3 3.67Å; F171-W176 HydrophobicContact CD2-CZ3 3.67Å; F171-W176 HydrophobicContact CE2-CZ3 4.35Å; F171-W176 HydrophobicContact CG-CE3 4.2Å; F171-W176 HydrophobicContact CG-CZ3 4.15Å; F171-L180 HydrophobicContact CB-CD1 4.09Å; F171-L180 HydrophobicContact CD1-CD1 3.83Å; F171-L180 HydrophobicContact CD2-CD1 4.44Å; F171-L180 HydrophobicContact CE1-CD1 4.34Å; F171-L180 HydrophobicContact CG-CD1 3.87Å; F171-R255 PolarHBondContact O-NH2 3.05Å
172S63.5Low72.7Confident64 Ų6474.3 Ų74.345%0.44837%0.374SS..  trans-54.6140.7178.2172.90000111.9G170 R174 I175 W176G170-S172 PolarHBondContact O-N 3.39Å; S172-R174 PolarHBondContact O-N 2.89Å; S172-R174 VanDerWaalsContact O-N 3.11Å; S172-R174 PolarHBondContact OG-N 3.45Å; S172-I175 PolarHBondContact O-N 3.39Å; S172-W176 PolarHBondContact O-N 2.73Å
173K66.2Low73.3Confident156 Ų15669.4 Ų69.468%0.67835%0.347SS*.Hα-helixtrans-52-35.1175.6-68.5-176.7-179.3179.60112.1K177K173-K177 VanDerWaalsContact O-CB 3.31Å; K173-K177 WeakPolarHBondContact O-CB 3.14Å; K173-K177 PolarHBondContact O-N 2.81Å
174R66.6Low73.8Confident197 Ų19764.3 Ų64.374%0.74332%0.315SS*.Hα-helixtrans-66.7-49.2177.7-173.9-175.9-68.6-169.2-0.9111.7S172 W176 K177 T178S172-R174 PolarHBondContact O-N 2.89Å; S172-R174 VanDerWaalsContact O-N 3.11Å; S172-R174 PolarHBondContact OG-N 3.45Å; R174-W176 VanDerWaalsContact C-N 3.27Å; R174-W176 PolarHBondContact O-N 3.43Å; R174-K177 PolarHBondContact O-N 3.28Å; R174-T178 WeakPolarHBondContact O-CB 3.4Å; R174-T178 PolarHBondContact O-N 2.95Å; R174-T178 PolarHBondContact O-OG1 2.91Å
175I70.8Confident73.9Confident66 Ų6664.9 Ų64.934%0.33832%0.315SS..Hα-helixtrans-61.6-41.7178.5-62.8173.1000109.9S172 Y179 L180S172-I175 PolarHBondContact O-N 3.39Å; I175-Y179 PolarHBondContact O-N 3.07Å; I175-Y179 VanDerWaalsContact O-N 3.09Å; I175-L180 HydrophobicContact CG2-CD1 3.84Å; I175-L180 HydrophobicContact CG2-CG 4.03Å; I175-L180 PolarHBondContact O-N 3.12Å; I175-L180 VanDerWaalsContact O-N 3.16Å
176W72.8Confident74Confident33 Ų3370.1 Ų70.113%0.12534%0.336CS..Iπ-helixtrans-62.5-46.8177.9-155.5-83.4000112.5F171 S172 R174 L180 S181 Y251 R255F171-W176 HydrophobicContact CB-CE3 3.8Å; F171-W176 HydrophobicContact CB-CZ3 4.2Å; F171-W176 HydrophobicContact CD2-CE3 4.16Å; F171-W176 AromaticContact CD2-CZ3 3.67Å; F171-W176 HydrophobicContact CD2-CZ3 3.67Å; F171-W176 HydrophobicContact CE2-CZ3 4.35Å; F171-W176 HydrophobicContact CG-CE3 4.2Å; F171-W176 HydrophobicContact CG-CZ3 4.15Å; S172-W176 PolarHBondContact O-N 2.73Å; R174-W176 VanDerWaalsContact C-N 3.27Å; R174-W176 PolarHBondContact O-N 3.43Å; W176-L180 HydrophobicContact CD2-CB 4.25Å; W176-L180 HydrophobicContact CD2-CD1 4.27Å; W176-L180 HydrophobicContact CE3-CB 4.19Å; W176-L180 HydrophobicContact CE3-CD1 3.46Å; W176-L180 VanDerWaalsContact CE3-CD1 3.46Å; W176-L180 HydrophobicContact CE3-CG 4.48Å; W176-L180 HydrophobicContact CZ3-CD1 3.84Å; W176-S181 VanDerWaalsContact O-CB 3.24Å; W176-S181 WeakPolarHBondContact O-CB 3.4Å; W176-S181 PolarHBondContact O-N 3.01Å; W176-S181 PolarHBondContact O-OG 2.93Å; W176-Y251 HydrophobicContact CH2-CE1 4.47Å; W176-Y251 HydrophobicContact CZ2-CD1 4.19Å; W176-Y251 AromaticContact CZ2-CE1 3.78Å; W176-Y251 HydrophobicContact CZ2-CE1 3.78Å; W176-R255 VanDerWaalsContact CD1-CD 3.5Å; W176-R255 HydrophobicContact CG-CG 3.95Å
177K73.1Confident74.1Confident116 Ų11671.4 Ų71.450%0.50434%0.342SS..Iπ-helixtrans-70.9-38.1-178.6-175.6173.5-178.6177.60113.3K173 R174 S181 S256K173-K177 VanDerWaalsContact O-CB 3.31Å; K173-K177 WeakPolarHBondContact O-CB 3.14Å; K173-K177 PolarHBondContact O-N 2.81Å; R174-K177 PolarHBondContact O-N 3.28Å; K177-S181 PolarHBondContact O-OG 2.99Å; K177-S256 WeakPolarHBondContact CE-O 3.33Å
178T70.3Confident74.3Confident58 Ų5871.6 Ų71.636%0.35634%0.342SS..Iπ-helixtrans-83.2-40.1-172.7-55.60000112.6R174R174-T178 WeakPolarHBondContact O-CB 3.4Å; R174-T178 PolarHBondContact O-N 2.95Å; R174-T178 PolarHBondContact O-OG1 2.91Å
179Y75.4Confident74.8Confident138 Ų13872.5 Ų72.554%0.54135%0.352SS..Iπ-helixtrans-122.6-58.7-170.8-60.4-78.7000112.6I175 S181 K182 I183I175-Y179 PolarHBondContact O-N 3.07Å; I175-Y179 VanDerWaalsContact O-N 3.09Å; Y179-S181 PolarHBondContact O-N 2.68Å; Y179-K182 PolarHBondContact O-N 2.82Å; Y179-I183 WeakPolarHBondContact O-CG1 3.21Å; Y179-I183 PolarHBondContact O-N 2.77Å; Y179-I183 VanDerWaalsContact O-N 3.09Å
180L76.7Confident75.7Confident18 Ų1873.3 Ų73.39%0.09436%0.36CS..Iπ-helixtrans-66.2-35.9-167.7-59.6171.7000112.8F155 F171 I175 W176 T184F155-L180 HydrophobicContact CD1-CD2 4.35Å; F155-L180 HydrophobicContact CD2-CD2 3.72Å; F155-L180 HydrophobicContact CE1-CD2 4.46Å; F155-L180 HydrophobicContact CE2-CD2 3.86Å; F155-L180 HydrophobicContact CG-CD2 3.99Å; F155-L180 HydrophobicContact CZ-CD2 4.23Å; F171-L180 HydrophobicContact CB-CD1 4.09Å; F171-L180 HydrophobicContact CD1-CD1 3.83Å; F171-L180 HydrophobicContact CD2-CD1 4.44Å; F171-L180 HydrophobicContact CE1-CD1 4.34Å; F171-L180 HydrophobicContact CG-CD1 3.87Å; I175-L180 HydrophobicContact CG2-CD1 3.84Å; I175-L180 HydrophobicContact CG2-CG 4.03Å; I175-L180 PolarHBondContact O-N 3.12Å; I175-L180 VanDerWaalsContact O-N 3.16Å; W176-L180 HydrophobicContact CD2-CB 4.25Å; W176-L180 HydrophobicContact CD2-CD1 4.27Å; W176-L180 HydrophobicContact CE3-CB 4.19Å; W176-L180 HydrophobicContact CE3-CD1 3.46Å; W176-L180 VanDerWaalsContact CE3-CD1 3.46Å; W176-L180 HydrophobicContact CE3-CG 4.48Å; W176-L180 HydrophobicContact CZ3-CD1 3.84Å; L180-T184 WeakPolarHBondContact O-CB 3.48Å; L180-T184 PolarHBondContact O-N 3.17Å; L180-T184 PolarHBondContact O-OG1 2.98Å
181S77.9Confident76.8Confident5 Ų572 Ų724%0.03535%0.346CS..Hα-helixtrans-64.9-42.2178.565.90000112.1W176 K177 Y179 T184 I185W176-S181 VanDerWaalsContact O-CB 3.24Å; W176-S181 WeakPolarHBondContact O-CB 3.4Å; W176-S181 PolarHBondContact O-N 3.01Å; W176-S181 PolarHBondContact O-OG 2.93Å; K177-S181 PolarHBondContact O-OG 2.99Å; Y179-S181 PolarHBondContact O-N 2.68Å; S181-T184 PolarHBondContact O-N 3.48Å; S181-I185 WeakPolarHBondContact O-CB 3.16Å; S181-I185 WeakPolarHBondContact O-CD1 3.29Å; S181-I185 WeakPolarHBondContact O-CG1 3.18Å; S181-I185 PolarHBondContact O-N 3.45Å
182K81.3Confident78Confident144 Ų14471.3 Ų71.363%0.62634%0.343SS*.Hα-helixtrans-66.7-44.8178.9-64.9-179.6-177.7175.80111.3Y179 I185 F186Y179-K182 PolarHBondContact O-N 2.82Å; K182-I185 PolarHBondContact O-N 3.09Å; K182-F186 WeakPolarHBondContact O-CB 3.49Å; K182-F186 PolarHBondContact O-N 3.39Å
183I81.8Confident79.2Confident72 Ų7271.6 Ų71.637%0.36934%0.339SS..Hα-helixtrans-62.8-47.1176.5-66.5168.6000110F155 Y179 F186 I187F155-I183 HydrophobicContact CE2-CD1 4.25Å; F155-I183 HydrophobicContact CZ-CD1 4Å; Y179-I183 WeakPolarHBondContact O-CG1 3.21Å; Y179-I183 PolarHBondContact O-N 2.77Å; Y179-I183 VanDerWaalsContact O-N 3.09Å; I183-F186 PolarHBondContact O-N 3.41Å; I183-I187 HydrophobicContact CG2-CD1 3.64Å; I183-I187 HydrophobicContact CG2-CG1 4.36Å; I183-I187 VanDerWaalsContact O-CG1 3.27Å; I183-I187 WeakPolarHBondContact O-CG1 3.35Å; I183-I187 PolarHBondContact O-N 3.36Å
184T82.9Confident80.4Confident24 Ų2468.3 Ų68.315%0.14733%0.328CS..Hα-helixtrans-58.8-51.5177.2-57.40000110.1L180 S181 F186 I187 E188 L248 A252L180-T184 WeakPolarHBondContact O-CB 3.48Å; L180-T184 PolarHBondContact O-N 3.17Å; L180-T184 PolarHBondContact O-OG1 2.98Å; S181-T184 PolarHBondContact O-N 3.48Å; T184-F186 VanDerWaalsContact C-N 3.31Å; T184-F186 PolarHBondContact O-N 2.88Å; T184-I187 PolarHBondContact O-N 2.99Å; T184-I187 VanDerWaalsContact O-N 3.14Å; T184-E188 HydrophobicContact CG2-CG 4.06Å; T184-E188 WeakPolarHBondContact O-CB 3.13Å; T184-E188 VanDerWaalsContact O-CG 3.24Å; T184-E188 WeakPolarHBondContact O-CG 3.41Å; T184-E188 PolarHBondContact O-N 3.5Å; T184-L248 HydrophobicContact CG2-CD1 3.94Å; T184-L248 HydrophobicContact CG2-CD2 4.34Å; T184-L248 HydrophobicContact CG2-CG 3.91Å; T184-A252 HydrophobicContact CG2-CB 4.19Å
185I83.6Confident81.6Confident44 Ų4459.1 Ų59.123%0.22629%0.294CS..Hα-helixtrans-56.6-44.5178.5-73.4164.2000111.6S181 K182 E188 V189 F249 A252 L253S181-I185 WeakPolarHBondContact O-CB 3.16Å; S181-I185 WeakPolarHBondContact O-CD1 3.29Å; S181-I185 WeakPolarHBondContact O-CG1 3.18Å; S181-I185 PolarHBondContact O-N 3.45Å; K182-I185 PolarHBondContact O-N 3.09Å; I185-E188 PolarHBondContact O-N 3.44Å; I185-V189 HydrophobicContact CG2-CG2 4.39Å; I185-V189 WeakPolarHBondContact O-CB 3.45Å; I185-V189 VanDerWaalsContact O-CG2 3.23Å; I185-V189 WeakPolarHBondContact O-CG2 3.33Å; I185-V189 PolarHBondContact O-N 3.2Å; I185-F249 HydrophobicContact CG1-CD2 4.36Å; I185-F249 HydrophobicContact CG1-CE2 4.28Å; I185-F249 HydrophobicContact CG2-CE2 4.03Å; I185-A252 HydrophobicContact CG1-CB 4.09Å; I185-L253 HydrophobicContact CD1-CD2 3.95Å
186F85.7Confident82.6Confident138 Ų13857.4 Ų57.461%0.60529%0.285SS*.Hα-helixtrans-62.1-46.5177.4176.5-97000112K182 I183 T184 V189 V190K182-F186 WeakPolarHBondContact O-CB 3.49Å; K182-F186 PolarHBondContact O-N 3.39Å; I183-F186 PolarHBondContact O-N 3.41Å; T184-F186 VanDerWaalsContact C-N 3.31Å; T184-F186 PolarHBondContact O-N 2.88Å; F186-V189 PolarHBondContact O-N 3.38Å; F186-V190 HydrophobicContact CD2-CG2 4.15Å; F186-V190 HydrophobicContact CE1-CG2 4.32Å; F186-V190 HydrophobicContact CE2-CG2 3.77Å; F186-V190 HydrophobicContact CZ-CG2 3.87Å; F186-V190 WeakPolarHBondContact O-CB 3.46Å; F186-V190 WeakPolarHBondContact O-CG2 3.49Å; F186-V190 PolarHBondContact O-N 2.76Å
187I84Confident83.6Confident56 Ų5660.6 Ų60.629%0.28730%0.304SS..Hα-helixtrans-65-39178.3-65.5170.8000110.9Y102 I183 T184 G191Y102-I187 HydrophobicContact CE1-CG2 3.71Å; Y102-I187 HydrophobicContact CE2-CG2 4Å; Y102-I187 VanDerWaalsContact CZ-CG2 3.41Å; Y102-I187 VanDerWaalsContact OH-CG2 3.28Å; Y102-I187 WeakPolarHBondContact OH-CG2 3.4Å; I183-I187 HydrophobicContact CG2-CD1 3.64Å; I183-I187 HydrophobicContact CG2-CG1 4.36Å; I183-I187 VanDerWaalsContact O-CG1 3.27Å; I183-I187 WeakPolarHBondContact O-CG1 3.35Å; I183-I187 PolarHBondContact O-N 3.36Å; T184-I187 PolarHBondContact O-N 2.99Å; T184-I187 VanDerWaalsContact O-N 3.14Å; I187-G191 WeakPolarHBondContact O-CA 3.2Å; I187-G191 PolarHBondContact O-N 2.73Å
188E84.6Confident84.6Confident4 Ų458.5 Ų58.52%0.01930%0.298CS..Hα-helixtrans-64.9-45.6175.8-70-60.7138.800111.2Y102 T184 I185 F192 I193 N245 L248 F249Y102-E188 PolarHBondContact OH-OE1 2.98Å; T184-E188 HydrophobicContact CG2-CG 4.06Å; T184-E188 WeakPolarHBondContact O-CB 3.13Å; T184-E188 VanDerWaalsContact O-CG 3.24Å; T184-E188 WeakPolarHBondContact O-CG 3.41Å; T184-E188 PolarHBondContact O-N 3.5Å; I185-E188 PolarHBondContact O-N 3.44Å; E188-F192 VanDerWaalsContact O-CB 3.28Å; E188-F192 WeakPolarHBondContact O-CB 3.44Å; E188-F192 PolarHBondContact O-N 2.92Å; E188-F192 VanDerWaalsContact O-N 3.08Å; E188-I193 PolarHBondContact O-N 3.21Å; E188-N245 WeakPolarHBondContact OE2-CA 3.19Å; E188-N245 WeakPolarHBondContact OE2-CB 3.21Å; E188-N245 PolarHBondContact OE2-OD1 2.83Å; E188-N245 VanDerWaalsContact OE2-OD1 3.05Å; E188-L248 HydrophobicContact CG-CG 4.44Å; E188-L248 WeakPolarHBondContact OE1-CD2 3.12Å; E188-F249 HydrophobicContact CB-CD2 4.33Å
189V82.5Confident85.6Confident73 Ų7356 Ų5644%0.44228%0.282SS..Iπ-helixtrans-65.1-48.4179.9171.50000110.8I185 F186 I193 F249I185-V189 HydrophobicContact CG2-CG2 4.39Å; I185-V189 WeakPolarHBondContact O-CB 3.45Å; I185-V189 VanDerWaalsContact O-CG2 3.23Å; I185-V189 WeakPolarHBondContact O-CG2 3.33Å; I185-V189 PolarHBondContact O-N 3.2Å; F186-V189 PolarHBondContact O-N 3.38Å; V189-I193 WeakPolarHBondContact O-CB 3.49Å; V189-I193 WeakPolarHBondContact O-CG1 3.31Å; V189-I193 PolarHBondContact O-N 3.01Å; V189-F249 HydrophobicContact CG2-CE2 4.37Å
190V85.6Confident86.4Confident60 Ų6052.8 Ų52.836%0.36427%0.274SS..Iπ-helixtrans-81.1-48.4-176178.60000111.2F186 I194F186-V190 HydrophobicContact CD2-CG2 4.15Å; F186-V190 HydrophobicContact CE1-CG2 4.32Å; F186-V190 HydrophobicContact CE2-CG2 3.77Å; F186-V190 HydrophobicContact CZ-CG2 3.87Å; F186-V190 WeakPolarHBondContact O-CB 3.46Å; F186-V190 WeakPolarHBondContact O-CG2 3.49Å; F186-V190 PolarHBondContact O-N 2.76Å; V190-I194 HydrophobicContact CG1-CD1 3.82Å; V190-I194 VanDerWaalsContact O-CB 3.32Å; V190-I194 WeakPolarHBondContact O-CB 3.33Å; V190-I194 WeakPolarHBondContact O-CD1 3.38Å; V190-I194 WeakPolarHBondContact O-CG1 3.37Å
191G84.3Confident87.2Confident19 Ų1955.2 Ų55.220%0.19629%0.29CS..Iπ-helixtrans-79.1-18-172.400000115.2I187 P195I187-G191 WeakPolarHBondContact O-CA 3.2Å; I187-G191 PolarHBondContact O-N 2.73Å; G191-P195 WeakPolarHBondContact O-CD 3.45Å; G191-P195 VanDerWaalsContact O-CG 3.23Å; G191-P195 WeakPolarHBondContact O-CG 3.48Å
192F88.6Confident87.8Confident12 Ų1255.4 Ų55.45%0.05329%0.291CS..Iπ-helixtrans-112.4-45.6175164.3-106.7000113.4M105 E188 I194 P195 L196 F237 V242 N245M105-F192 HydrophobicContact SD-CD2 4.01Å; E188-F192 VanDerWaalsContact O-CB 3.28Å; E188-F192 WeakPolarHBondContact O-CB 3.44Å; E188-F192 PolarHBondContact O-N 2.92Å; E188-F192 VanDerWaalsContact O-N 3.08Å; F192-I194 PolarHBondContact O-N 3.01Å; F192-P195 WeakPolarHBondContact O-CD 3.28Å; F192-L196 HydrophobicContact CE1-CD2 4.21Å; F192-L196 HydrophobicContact CE2-CB 4.43Å; F192-L196 HydrophobicContact CE2-CD2 4.5Å; F192-L196 HydrophobicContact CZ-CD2 3.89Å; F192-L196 VanDerWaalsContact O-CB 3.29Å; F192-L196 WeakPolarHBondContact O-CB 3.49Å; F192-L196 PolarHBondContact O-N 2.71Å; F192-F237 HydrophobicContact CE2-CE1 4.22Å; F192-V242 HydrophobicContact CE2-CB 4.44Å; F192-V242 HydrophobicContact CE2-CG2 3.94Å; F192-V242 HydrophobicContact CZ-CB 4.13Å; F192-V242 HydrophobicContact CZ-CG1 4.22Å; F192-V242 HydrophobicContact CZ-CG2 3.83Å; F192-N245 HydrophobicContact CB-CB 4.03Å; F192-N245 HydrophobicContact CD1-CB 3.61Å; F192-N245 HydrophobicContact CD2-CB 3.7Å; F192-N245 WeakPolarHBondContact CD2-ND2 3.36Å; F192-N245 HydrophobicContact CE1-CB 3.91Å; F192-N245 HydrophobicContact CE2-CB 3.99Å; F192-N245 HydrophobicContact CG-CB 3.49Å; F192-N245 VanDerWaalsContact CG-CB 3.49Å; F192-N245 HydrophobicContact CZ-CB 4.08Å
193I89.8Confident88.3Confident71 Ų7149 Ų4936%0.36427%0.265SS..Iπ-helixtrans-66-40.8-177-53.9-64.7000111.6E188 V189 L196 L197E188-I193 PolarHBondContact O-N 3.21Å; V189-I193 WeakPolarHBondContact O-CB 3.49Å; V189-I193 WeakPolarHBondContact O-CG1 3.31Å; V189-I193 PolarHBondContact O-N 3.01Å; I193-L196 PolarHBondContact O-N 2.84Å; I193-L197 HydrophobicContact CG2-CD1 3.79Å; I193-L197 HydrophobicContact CG2-CG 4.07Å; I193-L197 WeakPolarHBondContact O-CB 3.15Å; I193-L197 VanDerWaalsContact O-CG 3.3Å; I193-L197 WeakPolarHBondContact O-CG 3.18Å; I193-L197 PolarHBondContact O-N 2.91Å
194I90.9Very high88.7Confident87 Ų8748.3 Ų48.345%0.44627%0.266SS..Hα-helixtrans-63.5-52.2179-60.6174.8000110.7V190 F192 L196 L197 L198V190-I194 HydrophobicContact CG1-CD1 3.82Å; V190-I194 VanDerWaalsContact O-CB 3.32Å; V190-I194 WeakPolarHBondContact O-CB 3.33Å; V190-I194 WeakPolarHBondContact O-CD1 3.38Å; V190-I194 WeakPolarHBondContact O-CG1 3.37Å; F192-I194 PolarHBondContact O-N 3.01Å; I194-L196 VanDerWaalsContact C-N 3.33Å; I194-L196 PolarHBondContact O-N 2.81Å; I194-L197 PolarHBondContact O-N 3.48Å; I194-L198 HydrophobicContact CG2-CD1 3.92Å; I194-L198 HydrophobicContact CG2-CG 4.42Å; I194-L198 WeakPolarHBondContact O-CB 3.39Å; I194-L198 WeakPolarHBondContact O-CG 3.3Å; I194-L198 PolarHBondContact O-N 3.48Å
195P91.9Very high89.1Confident4 Ų450.5 Ų50.53%0.02628%0.276CS..Hα-helixtrans-55-43.4172.2-34.843.7000114.1L106 T109 G191 F192 L198 N199 F237L106-P195 HydrophobicContact CD2-CG 3.87Å; T109-P195 WeakPolarHBondContact OG1-CB 3.31Å; G191-P195 WeakPolarHBondContact O-CD 3.45Å; G191-P195 VanDerWaalsContact O-CG 3.23Å; G191-P195 WeakPolarHBondContact O-CG 3.48Å; F192-P195 WeakPolarHBondContact O-CD 3.28Å; P195-L198 PolarHBondContact O-N 3.38Å; P195-N199 WeakPolarHBondContact O-CB 3.47Å; P195-N199 PolarHBondContact O-N 3.37Å; P195-N199 PolarHBondContact O-ND2 3.46Å; P195-F237 HydrophobicContact CB-CE2 4.21Å; P195-F237 HydrophobicContact CB-CZ 3.99Å
196L92.1Very high89.2Confident30 Ų3048.6 Ų48.616%0.15727%0.266CS..Hα-helixtrans-59.7-51.7178.9176.465.9000111.3F192 I193 I194 L198 N199 L200 F237 V242F192-L196 HydrophobicContact CE1-CD2 4.21Å; F192-L196 HydrophobicContact CE2-CB 4.43Å; F192-L196 HydrophobicContact CE2-CD2 4.5Å; F192-L196 HydrophobicContact CZ-CD2 3.89Å; F192-L196 VanDerWaalsContact O-CB 3.29Å; F192-L196 WeakPolarHBondContact O-CB 3.49Å; F192-L196 PolarHBondContact O-N 2.71Å; I193-L196 PolarHBondContact O-N 2.84Å; I194-L196 VanDerWaalsContact C-N 3.33Å; I194-L196 PolarHBondContact O-N 2.81Å; L196-L198 VanDerWaalsContact C-N 3.34Å; L196-L198 PolarHBondContact O-N 3.48Å; L196-N199 PolarHBondContact O-N 3.29Å; L196-L200 HydrophobicContact CD1-CD1 3.92Å; L196-L200 HydrophobicContact CD1-CG 4.18Å; L196-L200 HydrophobicContact CG-CD1 4.03Å; L196-L200 WeakPolarHBondContact O-CB 3.42Å; L196-L200 VanDerWaalsContact O-CG 3.31Å; L196-L200 WeakPolarHBondContact O-CG 3.31Å; L196-L200 PolarHBondContact O-N 3.22Å; L196-F237 HydrophobicContact CB-CE1 3.9Å; L196-F237 HydrophobicContact CB-CZ 4.29Å; L196-F237 HydrophobicContact CD1-CD1 4.04Å; L196-F237 HydrophobicContact CD1-CE1 3.61Å; L196-F237 HydrophobicContact CG-CE1 4.37Å; L196-V242 HydrophobicContact CD1-CG2 4.07Å
197L93.1Very high89.3Confident99 Ų9944.7 Ų44.752%0.51825%0.252SS..Hα-helixtrans-62.6-41.4180-69.2177.6000111.6I193 I194 L200 T201I193-L197 HydrophobicContact CG2-CD1 3.79Å; I193-L197 HydrophobicContact CG2-CG 4.07Å; I193-L197 WeakPolarHBondContact O-CB 3.15Å; I193-L197 VanDerWaalsContact O-CG 3.3Å; I193-L197 WeakPolarHBondContact O-CG 3.18Å; I193-L197 PolarHBondContact O-N 2.91Å; I194-L197 PolarHBondContact O-N 3.48Å; L197-L200 PolarHBondContact O-N 3.24Å; L197-T201 WeakPolarHBondContact O-CB 3.18Å; L197-T201 VanDerWaalsContact O-CG2 3.23Å; L197-T201 WeakPolarHBondContact O-CG2 3.26Å; L197-T201 PolarHBondContact O-N 2.83Å; L197-T201 PolarHBondContact O-OG1 3.46Å
198L93.3Very high89.5Confident73 Ų7350 Ų5038%0.38227%0.268SS..Hα-helixtrans-62.3-45.6176.1-75.8174.4000111.9T109 I194 P195 L196 T201 C202T109-L198 HydrophobicContact CG2-CB 3.7Å; T109-L198 HydrophobicContact CG2-CD1 3.88Å; T109-L198 HydrophobicContact CG2-CG 4.47Å; I194-L198 HydrophobicContact CG2-CD1 3.92Å; I194-L198 HydrophobicContact CG2-CG 4.42Å; I194-L198 WeakPolarHBondContact O-CB 3.39Å; I194-L198 WeakPolarHBondContact O-CG 3.3Å; I194-L198 PolarHBondContact O-N 3.48Å; P195-L198 PolarHBondContact O-N 3.38Å; L196-L198 VanDerWaalsContact C-N 3.34Å; L196-L198 PolarHBondContact O-N 3.48Å; L198-T201 WeakPolarHBondContact CA-OG1 3.49Å; L198-T201 PolarHBondContact O-OG1 3.4Å; L198-T201 VanDerWaalsContact O-OG1 3.07Å; L198-C202 WeakPolarHBondContact O-CB 3.41Å; L198-C202 PolarHBondContact O-N 3.33Å; L198-C202 PolarHBondContact O-SG 2.83Å
199N91.6Very high89.5Confident4 Ų450.8 Ų50.82%0.02127%0.273CS..Hα-helixtrans-63.1-45.2178.1-81.8-78000111.9T109 S112 P195 L196 S203T109-N199 PolarHBondContact OG1-ND2 3.02Å; S112-N199 WeakPolarHBondContact CB-OD1 3.03Å; S112-N199 PolarHBondContact OG-OD1 2.93Å; P195-N199 WeakPolarHBondContact O-CB 3.47Å; P195-N199 PolarHBondContact O-N 3.37Å; P195-N199 PolarHBondContact O-ND2 3.46Å; L196-N199 PolarHBondContact O-N 3.29Å; N199-S203 WeakPolarHBondContact O-CB 3.1Å; N199-S203 PolarHBondContact O-N 2.87Å; N199-S203 PolarHBondContact O-OG 3.45Å
200L91.8Very high89.5Confident71 Ų7147.7 Ų47.737%0.37225%0.254SS..Hα-helixtrans-65.4-44.8179.9-69.4177.1000111.9L196 L197 S204L196-L200 HydrophobicContact CD1-CD1 3.92Å; L196-L200 HydrophobicContact CD1-CG 4.18Å; L196-L200 HydrophobicContact CG-CD1 4.03Å; L196-L200 WeakPolarHBondContact O-CB 3.42Å; L196-L200 VanDerWaalsContact O-CG 3.31Å; L196-L200 WeakPolarHBondContact O-CG 3.31Å; L196-L200 PolarHBondContact O-N 3.22Å; L197-L200 PolarHBondContact O-N 3.24Å; L200-S204 WeakPolarHBondContact O-CB 3.37Å; L200-S204 PolarHBondContact O-N 3.34Å; L200-S204 PolarHBondContact O-OG 3.24Å
201T93.3Very high89.4Confident70 Ų7054.3 Ų54.343%0.42927%0.272SS..Hα-helixtrans-67-48.3179.152.50000111.6L197 L198 S203 S204 L205L197-T201 WeakPolarHBondContact O-CB 3.18Å; L197-T201 VanDerWaalsContact O-CG2 3.23Å; L197-T201 WeakPolarHBondContact O-CG2 3.26Å; L197-T201 PolarHBondContact O-N 2.83Å; L197-T201 PolarHBondContact O-OG1 3.46Å; L198-T201 WeakPolarHBondContact CA-OG1 3.49Å; L198-T201 PolarHBondContact O-OG1 3.4Å; L198-T201 VanDerWaalsContact O-OG1 3.07Å; T201-S203 PolarHBondContact O-N 3.4Å; T201-S204 PolarHBondContact O-N 2.92Å; T201-L205 WeakPolarHBondContact O-CB 3.42Å; T201-L205 VanDerWaalsContact O-CG 3.29Å; T201-L205 WeakPolarHBondContact O-CG 3.31Å; T201-L205 PolarHBondContact O-N 3.44Å
202C92.3Very high89.3Confident9 Ų959.4 Ų59.46%0.06129%0.289CS..Hα-helixtrans-57.6-50.1176.6-70.80000111F116 L198 S204 L205 V206F116-C202 HydrophobicContact CB-CB 3.89Å; F116-C202 HydrophobicContact CG-CB 4.29Å; L198-C202 WeakPolarHBondContact O-CB 3.41Å; L198-C202 PolarHBondContact O-N 3.33Å; L198-C202 PolarHBondContact O-SG 2.83Å; C202-S204 VanDerWaalsContact C-N 3.34Å; C202-S204 PolarHBondContact O-N 2.94Å; C202-L205 PolarHBondContact O-N 2.94Å; C202-V206 VanDerWaalsContact O-CG2 3.31Å; C202-V206 WeakPolarHBondContact O-CG2 3.31Å; C202-V206 PolarHBondContact O-N 3.33Å
203S90.3Very high88.6Confident10 Ų1063.9 Ų63.97%0.0732%0.319CS..Hα-helixtrans-60.5-43.9179.3-61.10000111.8N199 T201 L205 V206 L207 V234N199-S203 WeakPolarHBondContact O-CB 3.1Å; N199-S203 PolarHBondContact O-N 2.87Å; N199-S203 PolarHBondContact O-OG 3.45Å; T201-S203 PolarHBondContact O-N 3.4Å; S203-L205 PolarHBondContact O-N 3.49Å; S203-V206 PolarHBondContact O-N 2.91Å; S203-L207 WeakPolarHBondContact O-CB 3.5Å; S203-L207 VanDerWaalsContact O-CG 3.23Å; S203-L207 WeakPolarHBondContact O-CG 3.41Å; S203-L207 PolarHBondContact O-N 3.21Å; S203-V234 VanDerWaalsContact OG-CG2 3.31Å; S203-V234 WeakPolarHBondContact OG-CG2 3.41Å
204S90.7Very high87.8Confident56 Ų5664 Ų6439%0.39233%0.331SS..Hα-helixtrans-63.1-42.3178-63.10000112.5L200 T201 C202 L207 R208L200-S204 WeakPolarHBondContact O-CB 3.37Å; L200-S204 PolarHBondContact O-N 3.34Å; L200-S204 PolarHBondContact O-OG 3.24Å; T201-S204 PolarHBondContact O-N 2.92Å; C202-S204 VanDerWaalsContact C-N 3.34Å; C202-S204 PolarHBondContact O-N 2.94Å; S204-L207 PolarHBondContact O-N 3.21Å; S204-R208 WeakPolarHBondContact O-CB 3.36Å; S204-R208 VanDerWaalsContact O-CG 3.3Å; S204-R208 WeakPolarHBondContact O-CG 3.28Å; S204-R208 PolarHBondContact O-N 3.26Å
205L90.5Very high86.8Confident70 Ų7061.1 Ų61.137%0.36632%0.318SS..Hα-helixtrans-68.7-38.5178.7-69.5174.6000112.1F116 T201 C202 S203 R208 T209F116-L205 HydrophobicContact CD2-CB 3.95Å; F116-L205 HydrophobicContact CD2-CD1 4.37Å; F116-L205 HydrophobicContact CE2-CB 3.65Å; F116-L205 HydrophobicContact CE2-CD1 3.53Å; F116-L205 HydrophobicContact CE2-CG 4.24Å; F116-L205 HydrophobicContact CZ-CD1 3.89Å; T201-L205 WeakPolarHBondContact O-CB 3.42Å; T201-L205 VanDerWaalsContact O-CG 3.29Å; T201-L205 WeakPolarHBondContact O-CG 3.31Å; T201-L205 PolarHBondContact O-N 3.44Å; C202-L205 PolarHBondContact O-N 2.94Å; S203-L205 PolarHBondContact O-N 3.49Å; L205-R208 PolarHBondContact O-N 3.11Å; L205-T209 WeakPolarHBondContact O-CB 3.32Å; L205-T209 PolarHBondContact O-N 3.29Å; L205-T209 PolarHBondContact O-OG1 3.49Å
206V87.4Confident85.5Confident4 Ų464.3 Ų64.32%0.02433%0.334CS..Hα-helixtrans-62.5-49.2172.9178.30000110.1F116 I119 V120 C202 S203 R208 T209 L210 V226 I230F116-V206 HydrophobicContact CB-CG2 3.93Å; F116-V206 HydrophobicContact CD2-CG2 4.16Å; I119-V206 HydrophobicContact CB-CG1 4.41Å; I119-V206 HydrophobicContact CD1-CG1 3.64Å; I119-V206 HydrophobicContact CG2-CG1 4.14Å; V120-V206 HydrophobicContact CG2-CG2 4.2Å; C202-V206 VanDerWaalsContact O-CG2 3.31Å; C202-V206 WeakPolarHBondContact O-CG2 3.31Å; C202-V206 PolarHBondContact O-N 3.33Å; S203-V206 PolarHBondContact O-N 2.91Å; V206-R208 VanDerWaalsContact C-N 3.33Å; V206-R208 PolarHBondContact O-N 3.22Å; V206-T209 PolarHBondContact O-N 3.35Å; V206-T209 VanDerWaalsContact O-N 3.08Å; V206-L210 HydrophobicContact CG1-CD1 3.95Å; V206-L210 HydrophobicContact CG1-CG 4.21Å; V206-L210 VanDerWaalsContact O-CG 3.3Å; V206-L210 WeakPolarHBondContact O-CG 3.26Å; V206-L210 PolarHBondContact O-N 3.26Å; V206-V226 HydrophobicContact CG1-CG1 4.37Å; V206-I230 HydrophobicContact CB-CD1 3.9Å; V206-I230 HydrophobicContact CG1-CD1 3.33Å; V206-I230 HydrophobicContact CG1-CG1 4.4Å
207L87Confident84.1Confident56 Ų5667.6 Ų67.629%0.29336%0.359SS..Hα-helixtrans-57.9-43177.8-72.1169.4000112.4S203 S204 T209 L210 R211 L227 I230S203-L207 WeakPolarHBondContact O-CB 3.5Å; S203-L207 VanDerWaalsContact O-CG 3.23Å; S203-L207 WeakPolarHBondContact O-CG 3.41Å; S203-L207 PolarHBondContact O-N 3.21Å; S204-L207 PolarHBondContact O-N 3.21Å; L207-T209 VanDerWaalsContact C-N 3.34Å; L207-L210 PolarHBondContact O-N 3.03Å; L207-R211 WeakPolarHBondContact O-CG 3.16Å; L207-R211 PolarHBondContact O-N 3.47Å; L207-L227 HydrophobicContact CD2-CD1 3.33Å; L207-I230 HydrophobicContact CD1-CG2 4.45Å; L207-I230 HydrophobicContact CD2-CD1 4.25Å; L207-I230 HydrophobicContact CG-CD1 4.38Å; L207-I230 HydrophobicContact CG-CG2 4.41Å
208R87.6Confident83.1Confident169 Ų16969.2 Ų69.264%0.63836%0.364SS*.Hα-helixtrans-62.2-41.5175-75.9177.1-178.3-170.81111.9S204 L205 V206 R211S204-R208 WeakPolarHBondContact O-CB 3.36Å; S204-R208 VanDerWaalsContact O-CG 3.3Å; S204-R208 WeakPolarHBondContact O-CG 3.28Å; S204-R208 PolarHBondContact O-N 3.26Å; L205-R208 PolarHBondContact O-N 3.11Å; V206-R208 VanDerWaalsContact C-N 3.33Å; V206-R208 PolarHBondContact O-N 3.22Å; R208-R211 PolarHBondContact O-N 2.92Å
209T84.4Confident81.9Confident19 Ų1967.3 Ų67.312%0.11735%0.354CS..Hα-helixtrans-68.1-38.2179.7-54.20000111.3V120 L205 V206 L207 R211 K212 T215V120-T209 HydrophobicContact CG2-CG2 4.4Å; L205-T209 WeakPolarHBondContact O-CB 3.32Å; L205-T209 PolarHBondContact O-N 3.29Å; L205-T209 PolarHBondContact O-OG1 3.49Å; V206-T209 PolarHBondContact O-N 3.35Å; V206-T209 VanDerWaalsContact O-N 3.08Å; L207-T209 VanDerWaalsContact C-N 3.34Å; T209-R211 PolarHBondContact O-N 2.87Å; T209-K212 WeakPolarHBondContact O-CB 3.29Å; T209-K212 PolarHBondContact O-N 3.36Å; T209-T215 HydrophobicContact CG2-CG2 4.15Å
210L82.5Confident80.9Confident8 Ų869 Ų694%0.04237%0.373CS..THydrogen-bonded Turntrans-66.6-12.9175.3-68.6175.8000114.6I119 V206 L207 I219 K223 V226 I230I119-L210 HydrophobicContact CG2-CD2 4.33Å; V206-L210 HydrophobicContact CG1-CD1 3.95Å; V206-L210 HydrophobicContact CG1-CG 4.21Å; V206-L210 VanDerWaalsContact O-CG 3.3Å; V206-L210 WeakPolarHBondContact O-CG 3.26Å; V206-L210 PolarHBondContact O-N 3.26Å; L207-L210 PolarHBondContact O-N 3.03Å; L210-I219 HydrophobicContact CD2-CD1 3.36Å; L210-K223 PolarHBondContact O-NZ 3.4Å; L210-V226 HydrophobicContact CD1-CB 4.38Å; L210-V226 HydrophobicContact CD1-CG1 3.74Å; L210-V226 HydrophobicContact CD2-CG1 4.38Å; L210-I230 HydrophobicContact CD1-CD1 4.17Å
211R83.4Confident79.6Confident200 Ų20072.1 Ų72.176%0.75540%0.395SS*.THydrogen-bonded Turntrans-85.1-13.5172.8-68.1176.2-174.3-177.70.7112.8L207 R208 T209L207-R211 WeakPolarHBondContact O-CG 3.16Å; L207-R211 PolarHBondContact O-N 3.47Å; R208-R211 PolarHBondContact O-N 2.92Å; T209-R211 PolarHBondContact O-N 2.87Å
212K82.9Confident78.7Confident125 Ų12572.5 Ų72.554%0.54339%0.394SS..SBendtrans-77.7132.1-179.3-64.4-174.7177.7-176.70111.1T209 A214 T215 L216T209-K212 WeakPolarHBondContact O-CB 3.29Å; T209-K212 PolarHBondContact O-N 3.36Å; K212-A214 PolarHBondContact O-N 3.08Å; K212-T215 PolarHBondContact O-N 3.43Å; K212-L216 PolarHBondContact O-N 3.47Å
213P73.4Confident78.1Confident106 Ų10675.6 Ų75.669%0.68841%0.407SS*.Hα-helixtrans-59.5-39.7-176.8-23.632000114.1T215 L216 S217P213-T215 VanDerWaalsContact C-N 3.33Å; P213-T215 PolarHBondContact O-N 3.33Å; P213-L216 WeakPolarHBondContact O-CB 3.46Å; P213-L216 PolarHBondContact O-N 3.04Å; P213-S217 PolarHBondContact O-N 2.73Å; P213-S217 VanDerWaalsContact O-N 3.09Å
214A72.8Confident77.6Confident75 Ų7580.7 Ų80.762%0.6243%0.429SS*.Hα-helixtrans-66.8-31.2179.900000113.4K212 S217K212-A214 PolarHBondContact O-N 3.08Å; A214-S217 PolarHBondContact O-OG 3.3Å
215T70.7Confident77.2Confident25 Ų2580.1 Ų80.115%0.15342%0.42CS..Hα-helixtrans-80.1-30.2174.1-50.40000111T209 K212 P213 Q218 I219T209-T215 HydrophobicContact CG2-CG2 4.15Å; K212-T215 PolarHBondContact O-N 3.43Å; P213-T215 VanDerWaalsContact C-N 3.33Å; P213-T215 PolarHBondContact O-N 3.33Å; T215-Q218 PolarHBondContact O-N 2.92Å; T215-I219 HydrophobicContact CG2-CD1 3.64Å; T215-I219 HydrophobicContact CG2-CG1 4.24Å; T215-I219 PolarHBondContact O-N 2.98Å
216L65.6Low76.8Confident72 Ų7278 Ų7838%0.37741%0.409SS..Hα-helixtrans-64.2-41.2176.9-171.464.9000111.9K212 P213 Q218 G220 K223K212-L216 PolarHBondContact O-N 3.47Å; P213-L216 WeakPolarHBondContact O-CB 3.46Å; P213-L216 PolarHBondContact O-N 3.04Å; L216-Q218 VanDerWaalsContact C-N 3.32Å; L216-Q218 PolarHBondContact O-N 2.92Å; L216-G220 PolarHBondContact O-N 3.38Å; L216-K223 HydrophobicContact CD1-CB 4.37Å; L216-K223 HydrophobicContact CD1-CD 3.21Å; L216-K223 HydrophobicContact CD1-CG 4.39Å
217S62.7Low76.6Confident98 Ų9880.9 Ų80.969%0.68543%0.425SS*.Hα-helixtrans-66.1-33.3174.660.50000112.7P213 A214P213-S217 PolarHBondContact O-N 2.73Å; P213-S217 VanDerWaalsContact O-N 3.09Å; A214-S217 PolarHBondContact O-OG 3.3Å
218Q70.4Confident76.6Confident133 Ų13382.7 Ų82.762%0.62143%0.43SS*.Hα-helixtrans-75.8-37.3178.9-171.6-178.8-16.700113.5T215 L216T215-Q218 PolarHBondContact O-N 2.92Å; L216-Q218 VanDerWaalsContact C-N 3.32Å; L216-Q218 PolarHBondContact O-N 2.92Å
219I69.7Low76.5Confident34 Ų3474.9 Ų74.917%0.17440%0.401CS..Hα-helixtrans-85.4-26.4-179.6-67.2174.8000111.5I119 L210 T215 T221 N222 K223I119-I219 HydrophobicContact CG2-CD1 4.17Å; L210-I219 HydrophobicContact CD2-CD1 3.36Å; T215-I219 HydrophobicContact CG2-CD1 3.64Å; T215-I219 HydrophobicContact CG2-CG1 4.24Å; T215-I219 PolarHBondContact O-N 2.98Å; I219-T221 PolarHBondContact O-N 2.71Å; I219-N222 HydrophobicContact CG2-CB 4Å; I219-N222 WeakPolarHBondContact O-CB 3.23Å; I219-N222 PolarHBondContact O-N 3.39Å; I219-K223 HydrophobicContact CG2-CB 4.3Å
220G70.6Confident76.6Confident39 Ų3974.5 Ų74.540%0.40240%0.398SS..G310 helixtrans56.1-133.8177.100000112.6L216 N222 K223L216-G220 PolarHBondContact O-N 3.38Å; G220-N222 PolarHBondContact O-N 3.35Å; G220-N222 VanDerWaalsContact O-N 3.15Å; G220-K223 PolarHBondContact O-N 3.44Å
221T63.7Low76.9Confident137 Ų13778.7 Ų78.784%0.8442%0.42SS*.G310 helixtrans-65.7-12.9-178.352.20000114.1I219 K223I219-T221 PolarHBondContact O-N 2.71Å; T221-K223 VanDerWaalsContact C-N 3.26Å; T221-K223 PolarHBondContact O-N 2.9Å
222N75Confident77.2Confident78 Ų7870.5 Ų70.542%0.41739%0.391SS..G310 helixtrans-79.2-2.6-179-68.5-40.2000114.2I219 G220 E224 K225 V226I219-N222 HydrophobicContact CG2-CB 4Å; I219-N222 WeakPolarHBondContact O-CB 3.23Å; I219-N222 PolarHBondContact O-N 3.39Å; G220-N222 PolarHBondContact O-N 3.35Å; G220-N222 VanDerWaalsContact O-N 3.15Å; N222-E224 PolarHBondContact O-N 2.97Å; N222-K225 WeakPolarHBondContact O-CB 3.25Å; N222-K225 PolarHBondContact O-N 3.25Å; N222-V226 WeakPolarHBondContact O-CG2 3.32Å; N222-V226 PolarHBondContact O-N 3.03Å; N222-V226 VanDerWaalsContact O-N 3.08Å
223K79.4Confident77.3Confident73 Ų7364.9 Ų64.932%0.31737%0.367SS..Hα-helixtrans-59-45.3-179.4170.7170.8169178.50112.7L210 L216 I219 G220 T221 K225 V226 L227L210-K223 PolarHBondContact O-NZ 3.4Å; L216-K223 HydrophobicContact CD1-CB 4.37Å; L216-K223 HydrophobicContact CD1-CD 3.21Å; L216-K223 HydrophobicContact CD1-CG 4.39Å; I219-K223 HydrophobicContact CG2-CB 4.3Å; G220-K223 PolarHBondContact O-N 3.44Å; T221-K223 VanDerWaalsContact C-N 3.26Å; T221-K223 PolarHBondContact O-N 2.9Å; K223-K225 VanDerWaalsContact C-N 3.26Å; K223-K225 PolarHBondContact O-N 3.11Å; K223-V226 PolarHBondContact O-N 3.4Å; K223-L227 WeakPolarHBondContact O-CB 3.36Å; K223-L227 PolarHBondContact O-N 2.93Å
224E79.7Confident78Confident117 Ų11761.6 Ų61.655%0.54735%0.345SS..Hα-helixtrans-61.3-39.9-179.1-171.1-173.7157.400110.9N222 L227 K228N222-E224 PolarHBondContact O-N 2.97Å; E224-L227 PolarHBondContact O-N 3.09Å; E224-K228 HydrophobicContact CG-CD 4.4Å; E224-K228 WeakPolarHBondContact O-CB 3.49Å; E224-K228 WeakPolarHBondContact O-CG 3.41Å; E224-K228 PolarHBondContact O-N 2.82Å; E224-K228 WeakPolarHBondContact OE1-CE 3.44Å; E224-K228 IonicContact OE1-NZ 2.73Å; E224-K228 PolarHBondContact OE1-NZ 3.49Å
225K81.1Confident78.9Confident45 Ų4560.3 Ų60.320%0.19633%0.334CS..Hα-helixtrans-62.5-47.3176.3-178.4175-176.8158.30112.3N222 K223 L227 K228 M229 E295N222-K225 WeakPolarHBondContact O-CB 3.25Å; N222-K225 PolarHBondContact O-N 3.25Å; K223-K225 VanDerWaalsContact C-N 3.26Å; K223-K225 PolarHBondContact O-N 3.11Å; K225-L227 VanDerWaalsContact C-N 3.31Å; K225-L227 PolarHBondContact O-N 2.92Å; K225-K228 PolarHBondContact O-N 2.03Å; K225-M229 WeakPolarHBondContact O-CB 3.29Å; K225-M229 PolarHBondContact O-N 3.34Å; K225-E295 WeakPolarHBondContact CE-OE1 3.47Å; K225-E295 IonicContact NZ-OE1 2.62Å; K225-E295 PolarHBondContact NZ-OE1 2.84Å
226V82.4Confident79.9Confident24 Ų2459.8 Ų59.815%0.14533%0.331CS..Hα-helixtrans-62.8-40176.9177.30000110.9I119 V206 L210 N222 K223 M229 I230I119-V226 HydrophobicContact CD1-CG1 3.52Å; V206-V226 HydrophobicContact CG1-CG1 4.37Å; L210-V226 HydrophobicContact CD1-CB 4.38Å; L210-V226 HydrophobicContact CD1-CG1 3.74Å; L210-V226 HydrophobicContact CD2-CG1 4.38Å; N222-V226 WeakPolarHBondContact O-CG2 3.32Å; N222-V226 PolarHBondContact O-N 3.03Å; N222-V226 VanDerWaalsContact O-N 3.08Å; K223-V226 PolarHBondContact O-N 3.4Å; V226-M229 HydrophobicContact CG1-CE 4.38Å; V226-M229 WeakPolarHBondContact O-CB 3.48Å; V226-M229 PolarHBondContact O-N 2.7Å; V226-I230 HydrophobicContact CG1-CD1 4.1Å; V226-I230 WeakPolarHBondContact O-CG1 3.17Å; V226-I230 PolarHBondContact O-N 3.49Å; V226-I230 VanDerWaalsContact O-N 3.07Å
227L84.4Confident81.1Confident66 Ų6656.5 Ų56.535%0.34631%0.313SS..Hα-helixtrans-63.4-48.1176.5-179.962.1000111.6L207 K223 E224 K225 M229 I230 I231L207-L227 HydrophobicContact CD2-CD1 3.33Å; K223-L227 WeakPolarHBondContact O-CB 3.36Å; K223-L227 PolarHBondContact O-N 2.93Å; E224-L227 PolarHBondContact O-N 3.09Å; K225-L227 VanDerWaalsContact C-N 3.31Å; K225-L227 PolarHBondContact O-N 2.92Å; L227-M229 VanDerWaalsContact C-N 3.29Å; L227-M229 PolarHBondContact O-N 2.83Å; L227-I230 PolarHBondContact O-N 3.43Å; L227-I231 HydrophobicContact CD1-CD1 4.02Å; L227-I231 HydrophobicContact CD1-CG1 4.32Å; L227-I231 HydrophobicContact CG-CD1 3.85Å; L227-I231 WeakPolarHBondContact O-CG1 3.4Å; L227-I231 PolarHBondContact O-N 2.92Å
228K85.5Confident82.5Confident93 Ų9354.8 Ų54.840%0.40430%0.298SS..Hα-helixtrans-57.4-43.3175.8-74.9178-178.2172.60111.5E224 K225 I230 I231 V232 F292E224-K228 HydrophobicContact CG-CD 4.4Å; E224-K228 WeakPolarHBondContact O-CB 3.49Å; E224-K228 WeakPolarHBondContact O-CG 3.41Å; E224-K228 PolarHBondContact O-N 2.82Å; E224-K228 WeakPolarHBondContact OE1-CE 3.44Å; E224-K228 IonicContact OE1-NZ 2.73Å; E224-K228 PolarHBondContact OE1-NZ 3.49Å; K225-K228 PolarHBondContact O-N 2.03Å; K228-I230 PolarHBondContact O-N 2.99Å; K228-I231 PolarHBondContact O-N 3.46Å; K228-V232 WeakPolarHBondContact O-CB 3.43Å; K228-V232 VanDerWaalsContact O-CG2 3.28Å; K228-V232 WeakPolarHBondContact O-CG2 3.21Å; K228-V232 PolarHBondContact O-N 3.49Å; K228-F292 HydrophobicContact CB-CD1 3.87Å; K228-F292 HydrophobicContact CB-CE1 4.11Å; K228-F292 HydrophobicContact CD-CE1 4.11Å
229M85.8Confident83.6Confident6 Ų652.3 Ų52.33%0.0329%0.292CS..Hα-helixtrans-57.2-49.4175.4-177.2-164.373.300112.3R115 K225 V226 L227 V232 H233 F292 T293R115-M229 HydrophobicContact CB-CE 3.83Å; R115-M229 HydrophobicContact CG-CE 3.56Å; R115-M229 HydrophobicContact CG-SD 3.93Å; K225-M229 WeakPolarHBondContact O-CB 3.29Å; K225-M229 PolarHBondContact O-N 3.34Å; V226-M229 HydrophobicContact CG1-CE 4.38Å; V226-M229 WeakPolarHBondContact O-CB 3.48Å; V226-M229 PolarHBondContact O-N 2.7Å; L227-M229 VanDerWaalsContact C-N 3.29Å; L227-M229 PolarHBondContact O-N 2.83Å; M229-V232 PolarHBondContact O-N 2.94Å; M229-H233 VanDerWaalsContact CG-CE1 3.49Å; M229-H233 WeakPolarHBondContact CG-CE1 3.23Å; M229-H233 VanDerWaalsContact O-CG 3.24Å; M229-H233 PolarHBondContact O-N 3.37Å; M229-F292 HydrophobicContact CB-CB 4.16Å; M229-T293 HydrophobicContact CG-CG2 4.46Å; M229-T293 VanDerWaalsContact CG-OG1 3.26Å; M229-T293 WeakPolarHBondContact CG-OG1 3.38Å; M229-T293 HydrophobicContact SD-CG2 3.87Å
230I86.8Confident84.7Confident10 Ų1050.7 Ų50.75%0.05128%0.284CS..Hα-helixtrans-63.1-45.7179.1-64.3162000111V206 L207 L210 V226 L227 K228 V232 H233 V234V206-I230 HydrophobicContact CB-CD1 3.9Å; V206-I230 HydrophobicContact CG1-CD1 3.33Å; V206-I230 HydrophobicContact CG1-CG1 4.4Å; L207-I230 HydrophobicContact CD1-CG2 4.45Å; L207-I230 HydrophobicContact CD2-CD1 4.25Å; L207-I230 HydrophobicContact CG-CD1 4.38Å; L207-I230 HydrophobicContact CG-CG2 4.41Å; L210-I230 HydrophobicContact CD1-CD1 4.17Å; V226-I230 HydrophobicContact CG1-CD1 4.1Å; V226-I230 WeakPolarHBondContact O-CG1 3.17Å; V226-I230 PolarHBondContact O-N 3.49Å; V226-I230 VanDerWaalsContact O-N 3.07Å; L227-I230 PolarHBondContact O-N 3.43Å; K228-I230 PolarHBondContact O-N 2.99Å; I230-V232 VanDerWaalsContact C-N 3.32Å; I230-V232 PolarHBondContact O-N 3.41Å; I230-H233 PolarHBondContact O-N 3.46Å; I230-V234 HydrophobicContact CG2-CG2 4.3Å; I230-V234 WeakPolarHBondContact O-CG2 3.45Å; I230-V234 PolarHBondContact O-N 2.83Å
231I88.3Confident85.8Confident97 Ų9748.9 Ų48.950%0.49727%0.265SS..Hα-helixtrans-59-46.6179.7-69.6169.3000110.1L227 K228 V234 A235L227-I231 HydrophobicContact CD1-CD1 4.02Å; L227-I231 HydrophobicContact CD1-CG1 4.32Å; L227-I231 HydrophobicContact CG-CD1 3.85Å; L227-I231 WeakPolarHBondContact O-CG1 3.4Å; L227-I231 PolarHBondContact O-N 2.92Å; K228-I231 PolarHBondContact O-N 3.46Å; I231-V234 PolarHBondContact O-N 2.87Å; I231-A235 WeakPolarHBondContact O-CB 3.32Å; I231-A235 PolarHBondContact O-N 2.83Å
232V89.6Confident87.3Confident27 Ų2744.1 Ų44.116%0.16424%0.236CC..Hα-helixtrans-63.8-44.5179.6168.90000111.4K228 M229 I230 A235 I236 F288 I289 F292K228-V232 WeakPolarHBondContact O-CB 3.43Å; K228-V232 VanDerWaalsContact O-CG2 3.28Å; K228-V232 WeakPolarHBondContact O-CG2 3.21Å; K228-V232 PolarHBondContact O-N 3.49Å; M229-V232 PolarHBondContact O-N 2.94Å; I230-V232 VanDerWaalsContact C-N 3.32Å; I230-V232 PolarHBondContact O-N 3.41Å; V232-A235 PolarHBondContact O-N 3.37Å; V232-I236 HydrophobicContact CG1-CD1 3.7Å; V232-I236 WeakPolarHBondContact O-CG1 3.33Å; V232-I236 PolarHBondContact O-N 3.32Å; V232-F288 HydrophobicContact CG1-CB 4.07Å; V232-I289 HydrophobicContact CG1-CG1 4.42Å; V232-F292 HydrophobicContact CB-CD2 4.21Å; V232-F292 HydrophobicContact CG1-CD2 4.16Å; V232-F292 HydrophobicContact CG2-CD2 3.64Å; V232-F292 HydrophobicContact CG2-CE2 3.87Å; V232-F292 HydrophobicContact CG2-CG 4.29Å
233H85.1Confident88.2Confident8 Ų842.5 Ų42.54%0.03723%0.229CC..Hα-helixtrans-60.4-49.1177.1-69.1166.9000112.6M229 I230 F237 I289 T293M229-H233 VanDerWaalsContact CG-CE1 3.49Å; M229-H233 WeakPolarHBondContact CG-CE1 3.23Å; M229-H233 VanDerWaalsContact O-CG 3.24Å; M229-H233 PolarHBondContact O-N 3.37Å; I230-H233 PolarHBondContact O-N 3.46Å; H233-F237 WeakPolarHBondContact O-CB 3.32Å; H233-F237 PolarHBondContact O-N 3.2Å; H233-I289 VanDerWaalsContact CD2-CG2 3.44Å; H233-I289 WeakPolarHBondContact CD2-CG2 3.42Å; H233-I289 WeakPolarHBondContact NE2-CG2 3.46Å; H233-T293 PolarHBondContact CE1-OG1 2.93Å; H233-T293 PolarHBondContact NE2-OG1 3.44Å
234V89.1Confident88.9Confident37 Ų3739.2 Ų39.222%0.22422%0.215CC..Hα-helixtrans-66.1-42.1180174.40000110.5S203 I230 I231 F237 V238S203-V234 VanDerWaalsContact OG-CG2 3.31Å; S203-V234 WeakPolarHBondContact OG-CG2 3.41Å; I230-V234 HydrophobicContact CG2-CG2 4.3Å; I230-V234 WeakPolarHBondContact O-CG2 3.45Å; I230-V234 PolarHBondContact O-N 2.83Å; I231-V234 PolarHBondContact O-N 2.87Å; V234-F237 PolarHBondContact O-N 3.44Å; V234-V238 HydrophobicContact CG1-CG2 4.08Å; V234-V238 WeakPolarHBondContact O-CB 3.33Å; V234-V238 VanDerWaalsContact O-CG2 3.23Å; V234-V238 WeakPolarHBondContact O-CG2 3.05Å; V234-V238 PolarHBondContact O-N 3.24Å
235A91.2Very high89.5Confident47 Ų4733.7 Ų33.739%0.38819%0.189SC..Hα-helixtrans-60.9-48.1179.100000111.6I231 V232 V238 V239I231-A235 WeakPolarHBondContact O-CB 3.32Å; I231-A235 PolarHBondContact O-N 2.83Å; V232-A235 PolarHBondContact O-N 3.37Å; A235-V238 PolarHBondContact O-N 2.96Å; A235-V239 VanDerWaalsContact O-CB 3.28Å; A235-V239 WeakPolarHBondContact O-CB 3.32Å; A235-V239 VanDerWaalsContact O-CG2 3.23Å; A235-V239 WeakPolarHBondContact O-CG2 3.47Å; A235-V239 PolarHBondContact O-N 3.43Å
236I91.5Very high90.1Very high15 Ų1534.3 Ų34.38%0.07720%0.199CC..Hα-helixtrans-64.6-44.4178.4-68.4167.3000110.4V232 V238 V239 C240 N282 F285 I289V232-I236 HydrophobicContact CG1-CD1 3.7Å; V232-I236 WeakPolarHBondContact O-CG1 3.33Å; V232-I236 PolarHBondContact O-N 3.32Å; I236-V238 VanDerWaalsContact C-N 3.33Å; I236-V238 PolarHBondContact O-N 3.39Å; I236-V239 PolarHBondContact O-N 2.9Å; I236-C240 WeakPolarHBondContact O-CB 3.36Å; I236-C240 PolarHBondContact O-N 3.48Å; I236-C240 PolarHBondContact O-SG 2.96Å; I236-C240 VanDerWaalsContact O-SG 3.39Å; I236-N282 VanDerWaalsContact CG2-OD1 3.29Å; I236-N282 WeakPolarHBondContact CG2-OD1 3.22Å; I236-F285 HydrophobicContact CD1-CB 3.77Å; I236-F285 HydrophobicContact CG1-CB 4.01Å; I236-F285 HydrophobicContact CG2-CB 4.29Å; I236-I289 HydrophobicContact CB-CD1 4.43Å; I236-I289 HydrophobicContact CD1-CD1 3.69Å; I236-I289 HydrophobicContact CD1-CG1 3.36Å; I236-I289 HydrophobicContact CG2-CD1 4.09Å
237F90.5Very high90.5Very high3 Ų333.9 Ų33.91%0.01320%0.196CC..Iπ-helixtrans-60.1-45.8178.8-170.6-82.2000111.9M105 F192 P195 L196 H233 V234 F241M105-F237 HydrophobicContact CB-CE2 4.1Å; M105-F237 HydrophobicContact CG-CE2 4.05Å; M105-F237 HydrophobicContact CG-CZ 4.49Å; F192-F237 HydrophobicContact CE2-CE1 4.22Å; P195-F237 HydrophobicContact CB-CE2 4.21Å; P195-F237 HydrophobicContact CB-CZ 3.99Å; L196-F237 HydrophobicContact CB-CE1 3.9Å; L196-F237 HydrophobicContact CB-CZ 4.29Å; L196-F237 HydrophobicContact CD1-CD1 4.04Å; L196-F237 HydrophobicContact CD1-CE1 3.61Å; L196-F237 HydrophobicContact CG-CE1 4.37Å; H233-F237 WeakPolarHBondContact O-CB 3.32Å; H233-F237 PolarHBondContact O-N 3.2Å; V234-F237 PolarHBondContact O-N 3.44Å; F237-F241 HydrophobicContact CB-CD2 4.45Å; F237-F241 AromaticContact CD2-CD2 3.84Å; F237-F241 HydrophobicContact CD2-CD2 3.84Å; F237-F241 HydrophobicContact CD2-CE2 4.33Å; F237-F241 HydrophobicContact CE2-CD2 4.22Å; F237-F241 HydrophobicContact CG-CD2 4.11Å; F237-F241 WeakPolarHBondContact O-CB 3.38Å; F237-F241 WeakPolarHBondContact O-CD2 2.97Å; F237-F241 PolarHBondContact O-N 3.3Å
238V91.8Very high90.8Very high61 Ų6131.3 Ų31.337%0.3718%0.182SC..Iπ-helixtrans-68.4-47.8-179.5171.90000111.2V234 A235 I236 V242 P243V234-V238 HydrophobicContact CG1-CG2 4.08Å; V234-V238 WeakPolarHBondContact O-CB 3.33Å; V234-V238 VanDerWaalsContact O-CG2 3.23Å; V234-V238 WeakPolarHBondContact O-CG2 3.05Å; V234-V238 PolarHBondContact O-N 3.24Å; A235-V238 PolarHBondContact O-N 2.96Å; I236-V238 VanDerWaalsContact C-N 3.33Å; I236-V238 PolarHBondContact O-N 3.39Å; V238-V242 HydrophobicContact CB-CG2 4.39Å; V238-V242 HydrophobicContact CG1-CG2 4.41Å; V238-V242 HydrophobicContact CG2-CG2 4.39Å; V238-V242 VanDerWaalsContact O-CB 3.32Å; V238-V242 WeakPolarHBondContact O-CB 3.28Å; V238-V242 PolarHBondContact O-N 3.11Å; V238-P243 WeakPolarHBondContact O-CD 3.28Å
239V93.4Very high91Very high81 Ų8130.7 Ų30.749%0.49118%0.18SC..Iπ-helixtrans-68.8-45-176.7171.50000111.4A235 I236 P243 I278A235-V239 VanDerWaalsContact O-CB 3.28Å; A235-V239 WeakPolarHBondContact O-CB 3.32Å; A235-V239 VanDerWaalsContact O-CG2 3.23Å; A235-V239 WeakPolarHBondContact O-CG2 3.47Å; A235-V239 PolarHBondContact O-N 3.43Å; I236-V239 PolarHBondContact O-N 2.9Å; V239-P243 WeakPolarHBondContact O-CD 3.45Å; V239-P243 WeakPolarHBondContact O-CG 3.24Å; V239-I278 HydrophobicContact CG1-CG2 4.23Å; V239-I278 WeakPolarHBondContact O-CG2 3.5Å
240C94.1Very high91.2Very high0 Ų032 Ų320%019%0.186CC..Iπ-helixtrans-78.4-44.5-174.6-62.60000112.6I236 A279 N282 F285I236-C240 WeakPolarHBondContact O-CB 3.36Å; I236-C240 PolarHBondContact O-N 3.48Å; I236-C240 PolarHBondContact O-SG 2.96Å; I236-C240 VanDerWaalsContact O-SG 3.39Å; C240-A279 WeakPolarHBondContact O-CA 3.49Å; C240-A279 VanDerWaalsContact O-CB 3.26Å; C240-A279 WeakPolarHBondContact O-CB 3.42Å; C240-N282 HydrophobicContact CB-CB 4.14Å; C240-F285 VanDerWaalsContact SG-CD2 3.59Å
241F93.9Very high91.2Very high1 Ų133 Ų330%0.00419%0.19CC..Iπ-helixtrans-102.6-37.4-167.1-54.6-62.9000113.8M105 L108 F237 Y244 N245 N282M105-F241 HydrophobicContact CE-CB 4.06Å; M105-F241 HydrophobicContact CE-CD1 3.57Å; M105-F241 HydrophobicContact CE-CE1 4.3Å; M105-F241 HydrophobicContact CE-CG 3.99Å; M105-F241 HydrophobicContact CG-CB 4.08Å; M105-F241 HydrophobicContact CG-CD1 3.59Å; M105-F241 HydrophobicContact CG-CD2 3.68Å; M105-F241 HydrophobicContact CG-CE1 3.84Å; M105-F241 HydrophobicContact CG-CE2 4Å; M105-F241 HydrophobicContact CG-CG 3.48Å; M105-F241 VanDerWaalsContact CG-CG 3.48Å; M105-F241 HydrophobicContact CG-CZ 4.04Å; M105-F241 HydrophobicContact SD-CB 3.91Å; M105-F241 HydrophobicContact SD-CD1 4.11Å; M105-F241 HydrophobicContact SD-CG 3.95Å; L108-F241 HydrophobicContact CD1-CE2 3.59Å; L108-F241 HydrophobicContact CD1-CZ 4.2Å; F237-F241 HydrophobicContact CB-CD2 4.45Å; F237-F241 AromaticContact CD2-CD2 3.84Å; F237-F241 HydrophobicContact CD2-CD2 3.84Å; F237-F241 HydrophobicContact CD2-CE2 4.33Å; F237-F241 HydrophobicContact CE2-CD2 4.22Å; F237-F241 HydrophobicContact CG-CD2 4.11Å; F237-F241 WeakPolarHBondContact O-CB 3.38Å; F237-F241 WeakPolarHBondContact O-CD2 2.97Å; F237-F241 PolarHBondContact O-N 3.3Å; F241-Y244 PolarHBondContact O-N 2.8Å; F241-N245 PolarHBondContact O-N 2.83Å; F241-N245 PolarHBondContact O-ND2 3.33Å; F241-N282 HydrophobicContact CE1-CB 4.26Å; F241-N282 HydrophobicContact CZ-CB 3.88Å; F241-N282 VanDerWaalsContact CZ-CG 3.44Å; F241-N282 WeakPolarHBondContact CZ-OD1 3.26Å
242V93.9Very high91Very high38 Ų3828.4 Ų28.423%0.2317%0.166CC..Hα-helixtrans-61.7-46.5-174.8177.50000112.4F192 L196 V238 Y244 S246F192-V242 HydrophobicContact CE2-CB 4.44Å; F192-V242 HydrophobicContact CE2-CG2 3.94Å; F192-V242 HydrophobicContact CZ-CB 4.13Å; F192-V242 HydrophobicContact CZ-CG1 4.22Å; F192-V242 HydrophobicContact CZ-CG2 3.83Å; L196-V242 HydrophobicContact CD1-CG2 4.07Å; V238-V242 HydrophobicContact CB-CG2 4.39Å; V238-V242 HydrophobicContact CG1-CG2 4.41Å; V238-V242 HydrophobicContact CG2-CG2 4.39Å; V238-V242 VanDerWaalsContact O-CB 3.32Å; V238-V242 WeakPolarHBondContact O-CB 3.28Å; V238-V242 PolarHBondContact O-N 3.11Å; V242-Y244 PolarHBondContact O-N 2.99Å; V242-S246 WeakPolarHBondContact O-CB 3.38Å; V242-S246 PolarHBondContact O-N 2.89Å; V242-S246 PolarHBondContact O-OG 3.4Å
243P95.2Very high90.8Very high43 Ų4329 Ų2928%0.27917%0.168SC..Hα-helixtrans-60.5-43.4177.9-25.233.7000112.8V238 V239 I247 T275V238-P243 WeakPolarHBondContact O-CD 3.28Å; V239-P243 WeakPolarHBondContact O-CD 3.45Å; V239-P243 WeakPolarHBondContact O-CG 3.24Å; P243-I247 WeakPolarHBondContact O-CB 3.39Å; P243-I247 VanDerWaalsContact O-CG1 3.24Å; P243-I247 WeakPolarHBondContact O-CG1 3.24Å; P243-I247 PolarHBondContact O-N 3.01Å; P243-I247 VanDerWaalsContact O-N 3.09Å; P243-T275 HydrophobicContact CB-CG2 3.62Å
244Y94Very high90.8Very high5 Ų528.7 Ų28.72%0.0217%0.167CC..Hα-helixtrans-65.3-55-177.7172.2-107000112I101 F241 V242 S246 I247 L248 Y272 L276 A279I101-Y244 HydrophobicContact CD1-CD1 3.84Å; I101-Y244 HydrophobicContact CD1-CE1 3.52Å; I101-Y244 HydrophobicContact CG2-CE1 4.21Å; F241-Y244 PolarHBondContact O-N 2.8Å; V242-Y244 PolarHBondContact O-N 2.99Å; Y244-S246 VanDerWaalsContact C-N 3.32Å; Y244-S246 PolarHBondContact O-N 3.29Å; Y244-I247 PolarHBondContact O-N 2.75Å; Y244-L248 HydrophobicContact CE1-CD2 3.86Å; Y244-L248 HydrophobicContact CE2-CD2 4.39Å; Y244-L248 WeakPolarHBondContact O-CB 3.16Å; Y244-L248 PolarHBondContact O-N 3.23Å; Y244-L248 WeakPolarHBondContact OH-CD2 3.34Å; Y244-Y272 HydrophobicContact CD2-CE2 4.45Å; Y244-Y272 HydrophobicContact CE2-CD2 4.32Å; Y244-Y272 AromaticContact CE2-CE2 3.63Å; Y244-Y272 HydrophobicContact CE2-CE2 3.63Å; Y244-L276 HydrophobicContact CD2-CB 3.97Å; Y244-L276 HydrophobicContact CD2-CD1 4.11Å; Y244-L276 HydrophobicContact CE2-CB 3.94Å; Y244-L276 HydrophobicContact CE2-CD1 3.53Å; Y244-L276 HydrophobicContact CE2-CG 4.3Å; Y244-A279 HydrophobicContact CD1-CB 4.34Å; Y244-A279 HydrophobicContact CG-CB 3.97Å
245N92.1Very high90.3Very high1 Ų129.7 Ų29.71%0.00517%0.167CC..Hα-helixtrans-63.8-38.5-177.6-68.9-76.9000111.4M105 E188 F192 F241 I247 L248 F249M105-N245 WeakPolarHBondContact CE-ND2 3.48Å; E188-N245 WeakPolarHBondContact OE2-CA 3.19Å; E188-N245 WeakPolarHBondContact OE2-CB 3.21Å; E188-N245 PolarHBondContact OE2-OD1 2.83Å; E188-N245 VanDerWaalsContact OE2-OD1 3.05Å; F192-N245 HydrophobicContact CB-CB 4.03Å; F192-N245 HydrophobicContact CD1-CB 3.61Å; F192-N245 HydrophobicContact CD2-CB 3.7Å; F192-N245 WeakPolarHBondContact CD2-ND2 3.36Å; F192-N245 HydrophobicContact CE1-CB 3.91Å; F192-N245 HydrophobicContact CE2-CB 3.99Å; F192-N245 HydrophobicContact CG-CB 3.49Å; F192-N245 VanDerWaalsContact CG-CB 3.49Å; F192-N245 HydrophobicContact CZ-CB 4.08Å; F241-N245 PolarHBondContact O-N 2.83Å; F241-N245 PolarHBondContact O-ND2 3.33Å; N245-I247 PolarHBondContact O-N 3.42Å; N245-L248 PolarHBondContact O-N 2.87Å; N245-F249 WeakPolarHBondContact O-CB 3.3Å; N245-F249 PolarHBondContact O-N 3.42Å
246S92.4Very high89.6Confident57 Ų5728.1 Ų28.140%0.39915%0.153SC..Hα-helixtrans-62.5-44.4176-57.20000112.2V242 Y244 L250V242-S246 WeakPolarHBondContact O-CB 3.38Å; V242-S246 PolarHBondContact O-N 2.89Å; V242-S246 PolarHBondContact O-OG 3.4Å; Y244-S246 VanDerWaalsContact C-N 3.32Å; Y244-S246 PolarHBondContact O-N 3.29Å; S246-L250 WeakPolarHBondContact O-CB 3.06Å; S246-L250 PolarHBondContact O-N 2.93Å; S246-L250 VanDerWaalsContact O-N 3.09Å
247I92.8Very high88.8Confident16 Ų1632.8 Ų32.88%0.08218%0.175CC..Hα-helixtrans-72.3-35.7177.9-66.9-62.3000111.5P243 Y244 N245 L250 Y251 F267 M271 T275P243-I247 WeakPolarHBondContact O-CB 3.39Å; P243-I247 VanDerWaalsContact O-CG1 3.24Å; P243-I247 WeakPolarHBondContact O-CG1 3.24Å; P243-I247 PolarHBondContact O-N 3.01Å; P243-I247 VanDerWaalsContact O-N 3.09Å; Y244-I247 PolarHBondContact O-N 2.75Å; N245-I247 PolarHBondContact O-N 3.42Å; I247-L250 HydrophobicContact CD1-CD2 4.46Å; I247-L250 PolarHBondContact O-N 3.19Å; I247-Y251 WeakPolarHBondContact O-CB 3.18Å; I247-Y251 PolarHBondContact O-N 3.14Å; I247-F267 HydrophobicContact CD1-CD1 4.44Å; I247-F267 HydrophobicContact CD1-CE1 3.65Å; I247-F267 HydrophobicContact CD1-CZ 4.24Å; I247-M271 HydrophobicContact CD1-CB 3.9Å; I247-M271 HydrophobicContact CD1-CG 4.48Å; I247-M271 HydrophobicContact CG1-CB 4.09Å; I247-M271 HydrophobicContact CG2-CB 4.08Å; I247-T275 HydrophobicContact CG1-CG2 3.92Å
248L90Very high88Confident12 Ų1236 Ų366%0.06320%0.202CC..Hα-helixtrans-65.9-43176.4178.550.5000111.5T184 E188 Y244 N245 Y251 A252 Y272T184-L248 HydrophobicContact CG2-CD1 3.94Å; T184-L248 HydrophobicContact CG2-CD2 4.34Å; T184-L248 HydrophobicContact CG2-CG 3.91Å; E188-L248 HydrophobicContact CG-CG 4.44Å; E188-L248 WeakPolarHBondContact OE1-CD2 3.12Å; Y244-L248 HydrophobicContact CE1-CD2 3.86Å; Y244-L248 HydrophobicContact CE2-CD2 4.39Å; Y244-L248 WeakPolarHBondContact O-CB 3.16Å; Y244-L248 PolarHBondContact O-N 3.23Å; Y244-L248 WeakPolarHBondContact OH-CD2 3.34Å; N245-L248 PolarHBondContact O-N 2.87Å; L248-Y251 PolarHBondContact O-N 2.98Å; L248-A252 WeakPolarHBondContact O-CB 3.21Å; L248-A252 PolarHBondContact O-N 2.69Å; L248-Y272 HydrophobicContact CB-CE2 4.45Å; L248-Y272 HydrophobicContact CD1-CE2 3.91Å
249F89.6Confident87.3Confident79 Ų7936.1 Ų36.135%0.34620%0.2SC..Hα-helixtrans-58.3-49.4172.1179.6-98.3000111.5I185 E188 V189 N245 Y251 A252 L253I185-F249 HydrophobicContact CG1-CD2 4.36Å; I185-F249 HydrophobicContact CG1-CE2 4.28Å; I185-F249 HydrophobicContact CG2-CE2 4.03Å; E188-F249 HydrophobicContact CB-CD2 4.33Å; V189-F249 HydrophobicContact CG2-CE2 4.37Å; N245-F249 WeakPolarHBondContact O-CB 3.3Å; N245-F249 PolarHBondContact O-N 3.42Å; F249-Y251 VanDerWaalsContact C-N 3.34Å; F249-Y251 PolarHBondContact O-N 2.8Å; F249-A252 PolarHBondContact O-N 2.76Å; F249-L253 HydrophobicContact CD1-CD1 3.94Å; F249-L253 HydrophobicContact CE1-CD1 3.4Å; F249-L253 VanDerWaalsContact CE1-CD1 3.4Å; F249-L253 HydrophobicContact CE1-CG 4.2Å; F249-L253 HydrophobicContact CZ-CD1 3.88Å; F249-L253 HydrophobicContact CZ-CG 4.37Å; F249-L253 WeakPolarHBondContact O-CG 3.27Å; F249-L253 PolarHBondContact O-N 3.46Å; F249-L253 VanDerWaalsContact O-N 3.07Å
250L89.9Confident86.5Confident33 Ų3336.7 Ų36.717%0.17321%0.213CC..Hα-helixtrans-59.8-44.5176.3177.863.2000112S246 I247 A252 L253 V254 L264 F267 A268S246-L250 WeakPolarHBondContact O-CB 3.06Å; S246-L250 PolarHBondContact O-N 2.93Å; S246-L250 VanDerWaalsContact O-N 3.09Å; I247-L250 HydrophobicContact CD1-CD2 4.46Å; I247-L250 PolarHBondContact O-N 3.19Å; L250-A252 VanDerWaalsContact C-N 3.31Å; L250-A252 PolarHBondContact O-N 3.35Å; L250-L253 PolarHBondContact O-N 3.39Å; L250-V254 HydrophobicContact CD1-CG2 4.14Å; L250-V254 HydrophobicContact CG-CG2 4.5Å; L250-V254 WeakPolarHBondContact O-CG2 3.39Å; L250-V254 PolarHBondContact O-N 2.88Å; L250-L264 HydrophobicContact CD1-CD1 3.94Å; L250-L264 HydrophobicContact CD1-CD2 3.79Å; L250-L264 HydrophobicContact CD1-CG 3.85Å; L250-L264 HydrophobicContact CD2-CD1 3.78Å; L250-L264 HydrophobicContact CD2-CG 4.31Å; L250-L264 HydrophobicContact CG-CD1 4.38Å; L250-L264 HydrophobicContact CG-CG 4.45Å; L250-F267 HydrophobicContact CD2-CD1 4.04Å; L250-F267 HydrophobicContact CD2-CE1 4.27Å; L250-A268 HydrophobicContact CD2-CB 4.11Å; L250-A268 HydrophobicContact CG-CB 4.14Å
251Y86.2Confident86Confident33 Ų3340.5 Ų40.513%0.12923%0.233CC..Hα-helixtrans-61.5-39.7178.5-178.1-103.9000111.5W176 I247 L248 F249 R255 A268 R269W176-Y251 HydrophobicContact CH2-CE1 4.47Å; W176-Y251 HydrophobicContact CZ2-CD1 4.19Å; W176-Y251 AromaticContact CZ2-CE1 3.78Å; W176-Y251 HydrophobicContact CZ2-CE1 3.78Å; I247-Y251 WeakPolarHBondContact O-CB 3.18Å; I247-Y251 PolarHBondContact O-N 3.14Å; L248-Y251 PolarHBondContact O-N 2.98Å; F249-Y251 VanDerWaalsContact C-N 3.34Å; F249-Y251 PolarHBondContact O-N 2.8Å; Y251-R255 WeakPolarHBondContact O-CB 3.13Å; Y251-R255 PolarHBondContact O-N 2.86Å; Y251-R255 PolarHBondContact OH-NH1 3.35Å; Y251-A268 HydrophobicContact CD2-CB 4.27Å; Y251-R269 HydrophobicContact CD2-CG 4.46Å; Y251-R269 HydrophobicContact CE2-CG 3.87Å
252A85.5Confident85.6Confident0 Ų043.4 Ų43.40%025%0.253CS..Hα-helixtrans-64.2-40.4174.300000112.4T184 I185 L248 F249 L250 S256T184-A252 HydrophobicContact CG2-CB 4.19Å; I185-A252 HydrophobicContact CG1-CB 4.09Å; L248-A252 WeakPolarHBondContact O-CB 3.21Å; L248-A252 PolarHBondContact O-N 2.69Å; F249-A252 PolarHBondContact O-N 2.76Å; L250-A252 VanDerWaalsContact C-N 3.31Å; L250-A252 PolarHBondContact O-N 3.35Å; A252-S256 VanDerWaalsContact O-CB 3.27Å; A252-S256 WeakPolarHBondContact O-CB 3.2Å; A252-S256 PolarHBondContact O-N 3.22Å; A252-S256 PolarHBondContact O-OG 3.09Å
253L85Confident85.3Confident38 Ų3846 Ų4620%0.19927%0.273CS..Hα-helixtrans-65.6-46.7176.9-70.3178.4000112.6I185 F249 L250 S256 A258 I259I185-L253 HydrophobicContact CD1-CD2 3.95Å; F249-L253 HydrophobicContact CD1-CD1 3.94Å; F249-L253 HydrophobicContact CE1-CD1 3.4Å; F249-L253 VanDerWaalsContact CE1-CD1 3.4Å; F249-L253 HydrophobicContact CE1-CG 4.2Å; F249-L253 HydrophobicContact CZ-CD1 3.88Å; F249-L253 HydrophobicContact CZ-CG 4.37Å; F249-L253 WeakPolarHBondContact O-CG 3.27Å; F249-L253 PolarHBondContact O-N 3.46Å; F249-L253 VanDerWaalsContact O-N 3.07Å; L250-L253 PolarHBondContact O-N 3.39Å; L253-S256 PolarHBondContact O-OG 3.04Å; L253-A258 HydrophobicContact CD2-CB 4.41Å; L253-A258 PolarHBondContact O-N 3.41Å; L253-A258 VanDerWaalsContact O-N 3.15Å; L253-I259 HydrophobicContact CB-CD1 4.14Å; L253-I259 HydrophobicContact CD1-CD1 4.11Å
254V84.3Confident85Confident2 Ų246.4 Ų46.41%0.01227%0.272CS..Hα-helixtrans-71.2-40.8-178.9-177.80000111.1L250 S256 Q257 L264 E265L250-V254 HydrophobicContact CD1-CG2 4.14Å; L250-V254 HydrophobicContact CG-CG2 4.5Å; L250-V254 WeakPolarHBondContact O-CG2 3.39Å; L250-V254 PolarHBondContact O-N 2.88Å; V254-S256 VanDerWaalsContact C-N 3.31Å; V254-S256 PolarHBondContact O-N 3.14Å; V254-Q257 PolarHBondContact O-N 2.76Å; V254-Q257 PolarHBondContact O-NE2 3.45Å; V254-L264 HydrophobicContact CG2-CD2 4.04Å; V254-L264 HydrophobicContact CG2-CG 4Å; V254-E265 HydrophobicContact CG1-CB 3.44Å; V254-E265 VanDerWaalsContact CG1-CB 3.44Å; V254-E265 HydrophobicContact CG1-CG 3.67Å
255R78.5Confident84.7Confident58 Ų5847.4 Ų47.422%0.21928%0.277CS..Hα-helixtrans-71.2-24.7180-166.7165.5170.2119.42.6113.4F171 W176 Y251 Q257F171-R255 PolarHBondContact O-NH2 3.05Å; W176-R255 VanDerWaalsContact CD1-CD 3.5Å; W176-R255 HydrophobicContact CG-CG 3.95Å; Y251-R255 WeakPolarHBondContact O-CB 3.13Å; Y251-R255 PolarHBondContact O-N 2.86Å; Y251-R255 PolarHBondContact OH-NH1 3.35Å; R255-Q257 PolarHBondContact O-N 3.03Å
256S77.3Confident84.5Confident15 Ų1554 Ų5411%0.10530%0.302CS..THydrogen-bonded Turntrans-77.9-4170.960.60000113.7K177 A252 L253 V254 A258K177-S256 WeakPolarHBondContact CE-O 3.33Å; A252-S256 VanDerWaalsContact O-CB 3.27Å; A252-S256 WeakPolarHBondContact O-CB 3.2Å; A252-S256 PolarHBondContact O-N 3.22Å; A252-S256 PolarHBondContact O-OG 3.09Å; L253-S256 PolarHBondContact O-OG 3.04Å; V254-S256 VanDerWaalsContact C-N 3.31Å; V254-S256 PolarHBondContact O-N 3.14Å; S256-A258 PolarHBondContact O-N 3.44Å
257Q75.2Confident84.5Confident113 Ų11356.2 Ų56.253%0.52831%0.305SS..THydrogen-bonded Turntrans6123.4-172.5-57-75.2-66.600112.7V254 R255 I259V254-Q257 PolarHBondContact O-N 2.76Å; V254-Q257 PolarHBondContact O-NE2 3.45Å; R255-Q257 PolarHBondContact O-N 3.03Å; Q257-I259 VanDerWaalsContact C-N 3.25Å
258A73.4Confident84.4Confident71 Ų7155.5 Ų55.559%0.58730%0.301SS*.SBendtrans-69.4-29.6169.300000111L253 S256L253-A258 HydrophobicContact CD2-CB 4.41Å; L253-A258 PolarHBondContact O-N 3.41Å; L253-A258 VanDerWaalsContact O-N 3.15Å; S256-A258 PolarHBondContact O-N 3.44Å
259I76.4Confident84.3Confident63 Ų6358 Ų5832%0.32331%0.309SS..SBendtrans-125.1116.4172.2-57.1173.9000108.3L253 Q257 N261 L264L253-I259 HydrophobicContact CB-CD1 4.14Å; L253-I259 HydrophobicContact CD1-CD1 4.11Å; Q257-I259 VanDerWaalsContact C-N 3.25Å; I259-N261 HydrophobicContact CG2-CB 4.24Å; I259-N261 PolarHBondContact O-N 3.08Å; I259-L264 HydrophobicContact CG2-CD2 3.91Å
260A76.7Confident84.3Confident92 Ų9256.5 Ų56.576%0.7631%0.307SS*.  trans-96.681.617700000110.3
261N84.4Confident84.5Confident81 Ų8157.7 Ų57.743%0.43331%0.312SS..  trans-138.8115.8175.3-174-47.3000110.8I259 S263 L264 E265I259-N261 HydrophobicContact CG2-CB 4.24Å; I259-N261 PolarHBondContact O-N 3.08Å; N261-S263 PolarHBondContact O-N 3.31Å; N261-S263 WeakPolarHBondContact OD1-CB 3.3Å; N261-S263 PolarHBondContact OD1-N 2.67Å; N261-L264 HydrophobicContact CB-CB 3.96Å; N261-L264 PolarHBondContact O-N 3.03Å; N261-L264 PolarHBondContact OD1-N 2.95Å; N261-L264 VanDerWaalsContact OD1-N 3.15Å; N261-E265 PolarHBondContact O-N 2.72Å
262C85.1Confident84.8Confident62 Ų6258.6 Ų58.642%0.41932%0.316SS..Hα-helixtrans-67.4-34.8-174-157.10000113.5C10 E265 R266C10-C262 HydrophobicContact CB-CB 4.37Å; C10-C262 WeakPolarHBondContact CB-SG 3.22Å; C10-C262 WeakPolarHBondContact SG-CA 3.33Å; C10-C262 WeakPolarHBondContact SG-CB 3.09Å; C10-C262 CovalentContact SG-SG 2.04Å; C10-C262 PolarHBondContact SG-SG 2.72Å; C262-E265 PolarHBondContact O-N 3.28Å; C262-R266 WeakPolarHBondContact O-CB 3.28Å; C262-R266 PolarHBondContact O-N 2.86Å
263S88Confident85.1Confident92 Ų9258.8 Ų58.864%0.64332%0.317SS*.Hα-helixtrans-66-43176.6-1710000110.7N261 R266 F267N261-S263 PolarHBondContact O-N 3.31Å; N261-S263 WeakPolarHBondContact OD1-CB 3.3Å; N261-S263 PolarHBondContact OD1-N 2.67Å; S263-R266 PolarHBondContact O-N 3.06Å; S263-F267 WeakPolarHBondContact O-CB 3.45Å; S263-F267 PolarHBondContact O-N 3.48Å
264L88.1Confident85.6Confident51 Ų5159.9 Ų59.927%0.26732%0.322SS..Hα-helixtrans-68.7-37178.1-166.261.7000111.8L250 V254 I259 N261 F267 A268L250-L264 HydrophobicContact CD1-CD1 3.94Å; L250-L264 HydrophobicContact CD1-CD2 3.79Å; L250-L264 HydrophobicContact CD1-CG 3.85Å; L250-L264 HydrophobicContact CD2-CD1 3.78Å; L250-L264 HydrophobicContact CD2-CG 4.31Å; L250-L264 HydrophobicContact CG-CD1 4.38Å; L250-L264 HydrophobicContact CG-CG 4.45Å; V254-L264 HydrophobicContact CG2-CD2 4.04Å; V254-L264 HydrophobicContact CG2-CG 4Å; I259-L264 HydrophobicContact CG2-CD2 3.91Å; N261-L264 HydrophobicContact CB-CB 3.96Å; N261-L264 PolarHBondContact O-N 3.03Å; N261-L264 PolarHBondContact OD1-N 2.95Å; N261-L264 VanDerWaalsContact OD1-N 3.15Å; L264-F267 PolarHBondContact O-N 2.69Å; L264-A268 WeakPolarHBondContact O-CB 3.46Å; L264-A268 PolarHBondContact O-N 3Å
265E87.5Confident86.2Confident27 Ų2760 Ų6013%0.12632%0.323CS..Hα-helixtrans-61.3-48.5173.1-169.6170.9165.700111.9V254 N261 C262 F267 A268 R269V254-E265 HydrophobicContact CG1-CB 3.44Å; V254-E265 VanDerWaalsContact CG1-CB 3.44Å; V254-E265 HydrophobicContact CG1-CG 3.67Å; N261-E265 PolarHBondContact O-N 2.72Å; C262-E265 PolarHBondContact O-N 3.28Å; E265-F267 VanDerWaalsContact C-N 3.34Å; E265-F267 PolarHBondContact O-N 3.48Å; E265-A268 PolarHBondContact O-N 2.97Å; E265-R269 HydrophobicContact CG-CG 4.46Å; E265-R269 WeakPolarHBondContact O-CB 3.4Å; E265-R269 WeakPolarHBondContact O-CG 3.04Å; E265-R269 PolarHBondContact O-N 3.46Å; E265-R269 IonicContact OE1-CZ 3.98Å; E265-R269 IonicContact OE1-NE 3Å; E265-R269 PolarHBondContact OE1-NE 3.13Å; E265-R269 IonicContact OE1-NH2 3.29Å; E265-R269 PolarHBondContact OE1-NH2 3.38Å
266R88.4Confident87Confident138 Ų13857.6 Ų57.652%0.52132%0.315SS..Hα-helixtrans-60.9-44.4177.5-178.9176.7-74.3176.2-4.2111.1L11 T12 C262 S263 R269 T270L11-R266 PolarHBondContact O-NH2 3.45Å; T12-R266 HydrophobicContact CG2-CG 4.1Å; C262-R266 WeakPolarHBondContact O-CB 3.28Å; C262-R266 PolarHBondContact O-N 2.86Å; S263-R266 PolarHBondContact O-N 3.06Å; R266-R269 PolarHBondContact O-N 3.06Å; R266-T270 WeakPolarHBondContact O-CB 3.39Å; R266-T270 PolarHBondContact O-N 2.96Å; R266-T270 PolarHBondContact O-OG1 3.49Å
267F91.3Very high87.9Confident105 Ų10557.1 Ų57.146%0.46131%0.311SS..Hα-helixtrans-59.2-51.8176.3176.8-100.8000111.6I247 L250 S263 L264 E265 R269 T270 M271I247-F267 HydrophobicContact CD1-CD1 4.44Å; I247-F267 HydrophobicContact CD1-CE1 3.65Å; I247-F267 HydrophobicContact CD1-CZ 4.24Å; L250-F267 HydrophobicContact CD2-CD1 4.04Å; L250-F267 HydrophobicContact CD2-CE1 4.27Å; S263-F267 WeakPolarHBondContact O-CB 3.45Å; S263-F267 PolarHBondContact O-N 3.48Å; L264-F267 PolarHBondContact O-N 2.69Å; E265-F267 VanDerWaalsContact C-N 3.34Å; E265-F267 PolarHBondContact O-N 3.48Å; F267-R269 PolarHBondContact O-N 3.39Å; F267-T270 PolarHBondContact O-N 3.4Å; F267-M271 HydrophobicContact CD1-CG 4.45Å; F267-M271 HydrophobicContact CD2-CG 3.9Å; F267-M271 HydrophobicContact CE1-CG 4.14Å; F267-M271 HydrophobicContact CE2-CG 3.54Å; F267-M271 HydrophobicContact CE2-SD 4.28Å; F267-M271 HydrophobicContact CG-CG 4.35Å; F267-M271 HydrophobicContact CZ-CG 3.68Å; F267-M271 WeakPolarHBondContact O-CB 3.17Å; F267-M271 WeakPolarHBondContact O-CG 3.28Å; F267-M271 PolarHBondContact O-N 3.1Å
268A90.9Very high88.9Confident0 Ų054.4 Ų54.40%030%0.299CS..Hα-helixtrans-62.2-42.7-179.600000112.3L250 Y251 L264 E265 T270 Y272L250-A268 HydrophobicContact CD2-CB 4.11Å; L250-A268 HydrophobicContact CG-CB 4.14Å; Y251-A268 HydrophobicContact CD2-CB 4.27Å; L264-A268 WeakPolarHBondContact O-CB 3.46Å; L264-A268 PolarHBondContact O-N 3Å; E265-A268 PolarHBondContact O-N 2.97Å; A268-T270 VanDerWaalsContact C-N 3.32Å; A268-T270 PolarHBondContact O-N 3.13Å; A268-Y272 WeakPolarHBondContact O-CB 3.08Å; A268-Y272 PolarHBondContact O-N 2.89Å
269R87.8Confident89.9Confident65 Ų6551 Ų5125%0.24527%0.272CS..Hα-helixtrans-62.5-37176.3-77.8175.1178.6-119.29.6113T12 Y251 E265 R266 F267 P273T12-R269 HydrophobicContact CG2-CB 4.4Å; Y251-R269 HydrophobicContact CD2-CG 4.46Å; Y251-R269 HydrophobicContact CE2-CG 3.87Å; E265-R269 HydrophobicContact CG-CG 4.46Å; E265-R269 WeakPolarHBondContact O-CB 3.4Å; E265-R269 WeakPolarHBondContact O-CG 3.04Å; E265-R269 PolarHBondContact O-N 3.46Å; E265-R269 IonicContact OE1-CZ 3.98Å; E265-R269 IonicContact OE1-NE 3Å; E265-R269 PolarHBondContact OE1-NE 3.13Å; E265-R269 IonicContact OE1-NH2 3.29Å; E265-R269 PolarHBondContact OE1-NH2 3.38Å; R266-R269 PolarHBondContact O-N 3.06Å; F267-R269 PolarHBondContact O-N 3.39Å; R269-P273 WeakPolarHBondContact O-CD 3.35Å
270T90.8Very high90.8Very high48 Ų4848 Ų4829%0.29426%0.256SS..Hα-helixtrans-77.7-42.2-179.5-53.30000111.6F16 R266 F267 A268 P273F16-T270 HydrophobicContact CE1-CG2 4.38Å; F16-T270 HydrophobicContact CZ-CG2 4.15Å; R266-T270 WeakPolarHBondContact O-CB 3.39Å; R266-T270 PolarHBondContact O-N 2.96Å; R266-T270 PolarHBondContact O-OG1 3.49Å; F267-T270 PolarHBondContact O-N 3.4Å; A268-T270 VanDerWaalsContact C-N 3.32Å; A268-T270 PolarHBondContact O-N 3.13Å; T270-P273 WeakPolarHBondContact O-CD 3.32Å
271M94Very high91.6Very high57 Ų5746.7 Ų46.728%0.28124%0.235SC..Hα-helixtrans-76.4-28.7-177.3-69.9-58.4-65.200112.9I247 F267 I274 T275I247-M271 HydrophobicContact CD1-CB 3.9Å; I247-M271 HydrophobicContact CD1-CG 4.48Å; I247-M271 HydrophobicContact CG1-CB 4.09Å; I247-M271 HydrophobicContact CG2-CB 4.08Å; F267-M271 HydrophobicContact CD1-CG 4.45Å; F267-M271 HydrophobicContact CD2-CG 3.9Å; F267-M271 HydrophobicContact CE1-CG 4.14Å; F267-M271 HydrophobicContact CE2-CG 3.54Å; F267-M271 HydrophobicContact CE2-SD 4.28Å; F267-M271 HydrophobicContact CG-CG 4.35Å; F267-M271 HydrophobicContact CZ-CG 3.68Å; F267-M271 WeakPolarHBondContact O-CB 3.17Å; F267-M271 WeakPolarHBondContact O-CG 3.28Å; F267-M271 PolarHBondContact O-N 3.1Å; M271-I274 WeakPolarHBondContact O-CB 3.35Å; M271-I274 PolarHBondContact O-N 2.93Å; M271-I274 VanDerWaalsContact O-N 3.08Å; M271-I274 HydrophobicContact SD-CD1 4.2Å; M271-T275 HydrophobicContact CE-CG2 4.24Å; M271-T275 PolarHBondContact O-N 2.72Å; M271-T275 PolarHBondContact O-OG1 3Å
272Y92.2Very high92.1Very high53 Ų5342.9 Ų42.921%0.20822%0.215CC..Hα-helixtrans-56.4-49.6-176172.6-97.7000113.4Y244 L248 A268 I274 T275 L276Y244-Y272 HydrophobicContact CD2-CE2 4.45Å; Y244-Y272 HydrophobicContact CE2-CD2 4.32Å; Y244-Y272 AromaticContact CE2-CE2 3.63Å; Y244-Y272 HydrophobicContact CE2-CE2 3.63Å; L248-Y272 HydrophobicContact CB-CE2 4.45Å; L248-Y272 HydrophobicContact CD1-CE2 3.91Å; A268-Y272 WeakPolarHBondContact O-CB 3.08Å; A268-Y272 PolarHBondContact O-N 2.89Å; Y272-I274 VanDerWaalsContact C-N 3.3Å; Y272-I274 PolarHBondContact O-N 2.65Å; Y272-T275 PolarHBondContact O-OG1 3.44Å; Y272-L276 HydrophobicContact CE1-CD2 4.33Å; Y272-L276 WeakPolarHBondContact O-CB 3.5Å; Y272-L276 PolarHBondContact O-N 3.23Å
273P92.4Very high92.4Very high4 Ų439.9 Ų39.93%0.02620%0.195CC..Hα-helixtrans-59.4-38.3174.1-2635.1000114.1F16 K17 L20 Y21 R269 T270 C277F16-P273 HydrophobicContact CE2-CB 4.35Å; F16-P273 HydrophobicContact CZ-CB 4.43Å; F16-P273 HydrophobicContact CZ-CG 4.21Å; K17-P273 HydrophobicContact CB-CB 3.83Å; K17-P273 HydrophobicContact CB-CG 3.76Å; L20-P273 HydrophobicContact CD2-CB 4.18Å; Y21-P273 HydrophobicContact CE1-CB 3.73Å; Y21-P273 VanDerWaalsContact OH-CA 3.28Å; Y21-P273 WeakPolarHBondContact OH-CA 3.46Å; Y21-P273 WeakPolarHBondContact OH-CB 3Å; R269-P273 WeakPolarHBondContact O-CD 3.35Å; T270-P273 WeakPolarHBondContact O-CD 3.32Å; P273-C277 PolarHBondContact O-N 3.44Å; P273-C277 PolarHBondContact O-SG 2.76Å
274I95.4Very high92.6Very high61 Ų6136.2 Ų36.231%0.31317%0.168SC..Hα-helixtrans-68.1-50.7-177.7-59.8171.6000110.2F16 L20 M271 Y272 L276 C277 I278F16-I274 HydrophobicContact CE2-CG1 4.37Å; L20-I274 HydrophobicContact CD2-CG1 3.98Å; M271-I274 WeakPolarHBondContact O-CB 3.35Å; M271-I274 PolarHBondContact O-N 2.93Å; M271-I274 VanDerWaalsContact O-N 3.08Å; M271-I274 HydrophobicContact SD-CD1 4.2Å; Y272-I274 VanDerWaalsContact C-N 3.3Å; Y272-I274 PolarHBondContact O-N 2.65Å; I274-L276 VanDerWaalsContact C-N 3.31Å; I274-L276 PolarHBondContact O-N 3.49Å; I274-C277 WeakPolarHBondContact O-CB 3.3Å; I274-C277 PolarHBondContact O-N 3.5Å; I274-I278 HydrophobicContact CG2-CD1 4.31Å; I274-I278 WeakPolarHBondContact O-CG1 3.33Å; I274-I278 PolarHBondContact O-N 3.43Å; I274-I278 VanDerWaalsContact O-N 3.09Å
275T96.4Very high92.7Very high3 Ų336.6 Ų36.62%0.01817%0.168CC..Hα-helixtrans-70-30.9-179.858.90000112.1P243 I247 M271 Y272 I278 A279P243-T275 HydrophobicContact CB-CG2 3.62Å; I247-T275 HydrophobicContact CG1-CG2 3.92Å; M271-T275 HydrophobicContact CE-CG2 4.24Å; M271-T275 PolarHBondContact O-N 2.72Å; M271-T275 PolarHBondContact O-OG1 3Å; Y272-T275 PolarHBondContact O-OG1 3.44Å; T275-I278 PolarHBondContact O-N 3.3Å; T275-A279 PolarHBondContact O-N 2.87Å
276L94.6Very high92.8Very high9 Ų935.3 Ų35.35%0.04716%0.162CC..Hα-helixtrans-59.8-48.2169.9175.462.3000111.5Y21 F97 I101 Y244 Y272 I274 I278 A279 T280Y21-L276 HydrophobicContact CE1-CD2 3.77Å; Y21-L276 HydrophobicContact CE1-CG 4.35Å; Y21-L276 WeakPolarHBondContact OH-CD2 3.45Å; F97-L276 HydrophobicContact CE1-CD1 4.27Å; F97-L276 HydrophobicContact CE2-CD1 3.42Å; F97-L276 VanDerWaalsContact CE2-CD1 3.42Å; F97-L276 HydrophobicContact CZ-CD1 3.17Å; I101-L276 HydrophobicContact CD1-CD1 4.44Å; Y244-L276 HydrophobicContact CD2-CB 3.97Å; Y244-L276 HydrophobicContact CD2-CD1 4.11Å; Y244-L276 HydrophobicContact CE2-CB 3.94Å; Y244-L276 HydrophobicContact CE2-CD1 3.53Å; Y244-L276 HydrophobicContact CE2-CG 4.3Å; Y272-L276 HydrophobicContact CE1-CD2 4.33Å; Y272-L276 WeakPolarHBondContact O-CB 3.5Å; Y272-L276 PolarHBondContact O-N 3.23Å; I274-L276 VanDerWaalsContact C-N 3.31Å; I274-L276 PolarHBondContact O-N 3.49Å; L276-I278 VanDerWaalsContact C-N 3.32Å; L276-I278 PolarHBondContact O-N 3.38Å; L276-A279 WeakPolarHBondContact O-CB 3.48Å; L276-A279 PolarHBondContact O-N 2.91Å; L276-A279 VanDerWaalsContact O-N 3.16Å; L276-T280 HydrophobicContact CD1-CG2 4.48Å; L276-T280 WeakPolarHBondContact O-CG2 3.4Å; L276-T280 PolarHBondContact O-N 3.37Å
277C96Very high92.5Very high5 Ų529.7 Ų29.73%0.03414%0.144CC..Hα-helixtrans-56.3-46.4174.4-82.10000112V24 P273 I274 A279 T280 M281V24-C277 HydrophobicContact CB-CB 4.23Å; V24-C277 HydrophobicContact CG1-CB 3.87Å; V24-C277 HydrophobicContact CG2-CB 4.08Å; P273-C277 PolarHBondContact O-N 3.44Å; P273-C277 PolarHBondContact O-SG 2.76Å; I274-C277 WeakPolarHBondContact O-CB 3.3Å; I274-C277 PolarHBondContact O-N 3.5Å; C277-A279 VanDerWaalsContact C-N 3.31Å; C277-A279 PolarHBondContact O-N 2.91Å; C277-T280 PolarHBondContact O-N 3.39Å; C277-T280 PolarHBondContact O-OG1 3.44Å; C277-M281 WeakPolarHBondContact O-CG 3.38Å; C277-M281 PolarHBondContact O-N 3.41Å
278I96.4Very high92.2Very high55 Ų5530.2 Ų30.228%0.28215%0.146SC..Hα-helixtrans-58.7-43176.7-65.5168.1000111.1V239 I274 T275 L276 T280 M281V239-I278 HydrophobicContact CG1-CG2 4.23Å; V239-I278 WeakPolarHBondContact O-CG2 3.5Å; I274-I278 HydrophobicContact CG2-CD1 4.31Å; I274-I278 WeakPolarHBondContact O-CG1 3.33Å; I274-I278 PolarHBondContact O-N 3.43Å; I274-I278 VanDerWaalsContact O-N 3.09Å; T275-I278 PolarHBondContact O-N 3.3Å; L276-I278 VanDerWaalsContact C-N 3.32Å; L276-I278 PolarHBondContact O-N 3.38Å; I278-T280 PolarHBondContact O-N 3.09Å; I278-M281 WeakPolarHBondContact O-CB 3.2Å; I278-M281 PolarHBondContact O-N 2.81Å
279A95.6Very high91.9Very high0 Ų030.2 Ų30.20%015%0.146CC..Hα-helixtrans-62-41.8176.700000112.7I101 C240 Y244 T275 L276 C277 M281 N282I101-A279 HydrophobicContact CD1-CB 3.87Å; C240-A279 WeakPolarHBondContact O-CA 3.49Å; C240-A279 VanDerWaalsContact O-CB 3.26Å; C240-A279 WeakPolarHBondContact O-CB 3.42Å; Y244-A279 HydrophobicContact CD1-CB 4.34Å; Y244-A279 HydrophobicContact CG-CB 3.97Å; T275-A279 PolarHBondContact O-N 2.87Å; L276-A279 WeakPolarHBondContact O-CB 3.48Å; L276-A279 PolarHBondContact O-N 2.91Å; L276-A279 VanDerWaalsContact O-N 3.16Å; C277-A279 VanDerWaalsContact C-N 3.31Å; C277-A279 PolarHBondContact O-N 2.91Å; A279-M281 PolarHBondContact O-N 3.4Å; A279-N282 VanDerWaalsContact O-CB 3.24Å; A279-N282 WeakPolarHBondContact O-CB 3.4Å; A279-N282 PolarHBondContact O-N 2.65Å
280T94.4Very high91.8Very high0 Ų027.1 Ų27.10%013%0.134CC..Hα-helixtrans-67.7-19.917861.10000113.7Y25 V28 F67 F97 L276 C277 I278 N282Y25-T280 HydrophobicContact CE1-CG2 3.95Å; V28-T280 WeakPolarHBondContact CG1-O 3.46Å; F67-T280 HydrophobicContact CE1-CG2 4.06Å; F67-T280 HydrophobicContact CZ-CG2 3.65Å; F97-T280 HydrophobicContact CD2-CG2 4.49Å; F97-T280 HydrophobicContact CE2-CG2 4.04Å; L276-T280 HydrophobicContact CD1-CG2 4.48Å; L276-T280 WeakPolarHBondContact O-CG2 3.4Å; L276-T280 PolarHBondContact O-N 3.37Å; C277-T280 PolarHBondContact O-N 3.39Å; C277-T280 PolarHBondContact O-OG1 3.44Å; I278-T280 PolarHBondContact O-N 3.09Å; T280-N282 PolarHBondContact O-N 2.8Å
281M94.4Very high91.5Very high65 Ų6528.9 Ų28.932%0.3214%0.136SC..THydrogen-bonded Turntrans-70.1-9.4172.6-65.9-179.674.700112.9V24 V28 C277 I278 A279 C283 C284 F285V24-M281 HydrophobicContact CG1-CG 4.38Å; V28-M281 HydrophobicContact CG2-CG 4.13Å; C277-M281 WeakPolarHBondContact O-CG 3.38Å; C277-M281 PolarHBondContact O-N 3.41Å; I278-M281 WeakPolarHBondContact O-CB 3.2Å; I278-M281 PolarHBondContact O-N 2.81Å; A279-M281 PolarHBondContact O-N 3.4Å; M281-C283 PolarHBondContact O-N 3.14Å; M281-C284 VanDerWaalsContact O-CB 3.32Å; M281-C284 WeakPolarHBondContact O-CB 3.49Å; M281-C284 PolarHBondContact O-N 2.86Å; M281-F285 HydrophobicContact CB-CD2 4.39Å; M281-F285 HydrophobicContact CB-CE2 3.7Å; M281-F285 HydrophobicContact CB-CZ 4.11Å; M281-F285 HydrophobicContact CE-CZ 3.94Å; M281-F285 VanDerWaalsContact O-CD2 3.24Å; M281-F285 WeakPolarHBondContact O-CD2 3.45Å; M281-F285 PolarHBondContact O-N 3.48Å
282N93.7Very high91Very high0 Ų028.4 Ų28.40%013%0.132CC..Hα-helixtrans-48.8-46.2173.3-177.178.5000111.8I236 C240 F241 A279 T280 C284 F285 D286I236-N282 VanDerWaalsContact CG2-OD1 3.29Å; I236-N282 WeakPolarHBondContact CG2-OD1 3.22Å; C240-N282 HydrophobicContact CB-CB 4.14Å; F241-N282 HydrophobicContact CE1-CB 4.26Å; F241-N282 HydrophobicContact CZ-CB 3.88Å; F241-N282 VanDerWaalsContact CZ-CG 3.44Å; F241-N282 WeakPolarHBondContact CZ-OD1 3.26Å; A279-N282 VanDerWaalsContact O-CB 3.24Å; A279-N282 WeakPolarHBondContact O-CB 3.4Å; A279-N282 PolarHBondContact O-N 2.65Å; T280-N282 PolarHBondContact O-N 2.8Å; N282-C284 PolarHBondContact O-N 3.3Å; N282-F285 PolarHBondContact O-N 2.8Å; N282-D286 PolarHBondContact ND2-OD1 2.99Å; N282-D286 PolarHBondContact ND2-OD2 2.65Å; N282-D286 PolarHBondContact O-N 3.28Å
283C92.4Very high90.4Very high0 Ų026.2 Ų26.20%013%0.125CC..Hα-helixtrans-55-25.7179.2-53.50000113.5V28 N36 D64 M281 D286V28-C283 HydrophobicContact CG1-CB 4.36Å; N36-C283 PolarHBondContact ND2-O 2.92Å; D64-C283 HydrophobicContact CB-CB 4.11Å; D64-C283 PolarHBondContact OD1-SG 3.46Å; M281-C283 PolarHBondContact O-N 3.14Å; C283-D286 VanDerWaalsContact CA-OD2 3.23Å; C283-D286 WeakPolarHBondContact CA-OD2 2.98Å
284C92.4Very high89.7Confident14 Ų1426.4 Ų26.410%0.09513%0.126CC..Hα-helixtrans-85.7-23178.7-58.20000112.4L31 M281 N282 P287L31-C284 HydrophobicContact CB-CB 4.45Å; M281-C284 VanDerWaalsContact O-CB 3.32Å; M281-C284 WeakPolarHBondContact O-CB 3.49Å; M281-C284 PolarHBondContact O-N 2.86Å; N282-C284 PolarHBondContact O-N 3.3Å; C284-P287 WeakPolarHBondContact O-CD 3.15Å
285F90.6Very high88.6Confident59 Ų5927.7 Ų27.726%0.25913%0.131SC..Hα-helixtrans-95.3-17.2-175.4-57.5-45.7000113.7I236 C240 M281 N282 P287 F288I236-F285 HydrophobicContact CD1-CB 3.77Å; I236-F285 HydrophobicContact CG1-CB 4.01Å; I236-F285 HydrophobicContact CG2-CB 4.29Å; C240-F285 VanDerWaalsContact SG-CD2 3.59Å; M281-F285 HydrophobicContact CB-CD2 4.39Å; M281-F285 HydrophobicContact CB-CE2 3.7Å; M281-F285 HydrophobicContact CB-CZ 4.11Å; M281-F285 HydrophobicContact CE-CZ 3.94Å; M281-F285 VanDerWaalsContact O-CD2 3.24Å; M281-F285 WeakPolarHBondContact O-CD2 3.45Å; M281-F285 PolarHBondContact O-N 3.48Å; N282-F285 PolarHBondContact O-N 2.8Å; F285-P287 VanDerWaalsContact C-N 3.3Å; F285-F288 WeakPolarHBondContact O-CB 3.43Å; F285-F288 WeakPolarHBondContact O-CD2 3.18Å; F285-F288 PolarHBondContact O-N 3.3Å
286D87.8Confident87.3Confident0 Ų030.5 Ų30.50%015%0.151CC..Hα-helixtrans-53.5-32.9177.8-62.5-52.2000115.3N282 C283 F288 I289 Y290N282-D286 PolarHBondContact ND2-OD1 2.99Å; N282-D286 PolarHBondContact ND2-OD2 2.65Å; N282-D286 PolarHBondContact O-N 3.28Å; C283-D286 VanDerWaalsContact CA-OD2 3.23Å; C283-D286 WeakPolarHBondContact CA-OD2 2.98Å; D286-F288 PolarHBondContact O-N 2.93Å; D286-I289 WeakPolarHBondContact O-CA 3.41Å; D286-I289 WeakPolarHBondContact O-CB 3.45Å; D286-I289 PolarHBondContact O-N 3.2Å; D286-I289 WeakPolarHBondContact OD1-CD1 3.23Å; D286-Y290 HydrophobicContact CB-CE1 4.23Å; D286-Y290 HydrophobicContact CB-CE2 3.97Å; D286-Y290 WeakPolarHBondContact O-CD1 3.24Å; D286-Y290 WeakPolarHBondContact O-CD2 3.45Å; D286-Y290 PolarHBondContact O-N 2.91Å
287P83.9Confident86.2Confident21 Ų2130.2 Ų30.214%0.13615%0.149CC..Hα-helixtrans-59.1-31.7173.1-25.935.6000114.2T35 C284 F285 Y290 Y291T35-P287 VanDerWaalsContact CB-CG 3.41Å; T35-P287 HydrophobicContact CG2-CG 3.89Å; C284-P287 WeakPolarHBondContact O-CD 3.15Å; F285-P287 VanDerWaalsContact C-N 3.3Å; P287-Y290 PolarHBondContact O-N 2.92Å; P287-Y291 VanDerWaalsContact O-CB 3.29Å; P287-Y291 WeakPolarHBondContact O-CB 3.5Å; P287-Y291 PolarHBondContact O-N 3.34Å
288F85.3Confident85.2Confident116 Ų11631.5 Ų31.551%0.50916%0.155SC..Hα-helixtrans-67.1-42.9174.2-66.3-83000110.4V232 F285 D286 Y290 Y291 F292V232-F288 HydrophobicContact CG1-CB 4.07Å; F285-F288 WeakPolarHBondContact O-CB 3.43Å; F285-F288 WeakPolarHBondContact O-CD2 3.18Å; F285-F288 PolarHBondContact O-N 3.3Å; D286-F288 PolarHBondContact O-N 2.93Å; F288-Y290 VanDerWaalsContact C-N 3.29Å; F288-Y290 PolarHBondContact O-N 3.46Å; F288-Y291 PolarHBondContact O-N 3.46Å; F288-F292 HydrophobicContact CD1-CE2 4.42Å; F288-F292 WeakPolarHBondContact O-CD2 3.02Å; F288-F292 PolarHBondContact O-N 2.95Å
289I83.9Confident84.2Confident0 Ų035.2 Ų35.20%017%0.169CC..Hα-helixtrans-55.8-49174.2-56.1-179.9000109.3L108 V232 H233 I236 D286 F292 T293L108-I289 HydrophobicContact CD1-CD1 4.46Å; L108-I289 HydrophobicContact CD2-CD1 3.35Å; L108-I289 HydrophobicContact CD2-CG2 4.1Å; V232-I289 HydrophobicContact CG1-CG1 4.42Å; H233-I289 VanDerWaalsContact CD2-CG2 3.44Å; H233-I289 WeakPolarHBondContact CD2-CG2 3.42Å; H233-I289 WeakPolarHBondContact NE2-CG2 3.46Å; I236-I289 HydrophobicContact CB-CD1 4.43Å; I236-I289 HydrophobicContact CD1-CD1 3.69Å; I236-I289 HydrophobicContact CD1-CG1 3.36Å; I236-I289 HydrophobicContact CG2-CD1 4.09Å; D286-I289 WeakPolarHBondContact O-CA 3.41Å; D286-I289 WeakPolarHBondContact O-CB 3.45Å; D286-I289 PolarHBondContact O-N 3.2Å; D286-I289 WeakPolarHBondContact OD1-CD1 3.23Å; I289-F292 PolarHBondContact O-N 3.41Å; I289-T293 WeakPolarHBondContact O-CB 3.27Å; I289-T293 PolarHBondContact O-N 2.98Å; I289-T293 PolarHBondContact O-OG1 3.06Å
290Y86.1Confident83Confident0 Ų036.1 Ų36.10%018%0.175CC..Hα-helixtrans-64.4-44-179.3-55.3-22.2000112.4S39 F43 M57 L60 A61 D286 P287 F288 T293 S294 F297S39-Y290 WeakPolarHBondContact OG-CD2 3.35Å; F43-Y290 HydrophobicContact CE2-CD1 4.3Å; F43-Y290 AromaticContact CE2-CD2 3.8Å; F43-Y290 HydrophobicContact CE2-CD2 3.8Å; F43-Y290 HydrophobicContact CE2-CE1 4.34Å; F43-Y290 AromaticContact CE2-CE2 3.82Å; F43-Y290 HydrophobicContact CE2-CE2 3.82Å; F43-Y290 HydrophobicContact CE2-CG 4.05Å; F43-Y290 AromaticContact CZ-CD1 3.85Å; F43-Y290 HydrophobicContact CZ-CD1 3.85Å; F43-Y290 AromaticContact CZ-CD2 3.63Å; F43-Y290 HydrophobicContact CZ-CD2 3.63Å; F43-Y290 HydrophobicContact CZ-CE1 4.34Å; F43-Y290 HydrophobicContact CZ-CE2 4.11Å; F43-Y290 AromaticContact CZ-CG 3.48Å; F43-Y290 HydrophobicContact CZ-CG 3.48Å; F43-Y290 VanDerWaalsContact CZ-CG 3.48Å; M57-Y290 HydrophobicContact CB-CD1 3.97Å; M57-Y290 HydrophobicContact CB-CE1 3.78Å; M57-Y290 HydrophobicContact CE-CD1 4.37Å; M57-Y290 HydrophobicContact CG-CD1 3.71Å; M57-Y290 HydrophobicContact CG-CE1 3.86Å; M57-Y290 PolarHBondContact O-OH 3.15Å; M57-Y290 HydrophobicContact SD-CD1 3.98Å; L60-Y290 HydrophobicContact CD2-CE1 4.08Å; A61-Y290 HydrophobicContact CB-CE2 4.47Å; A61-Y290 PolarHBondContact N-OH 3.3Å; D286-Y290 HydrophobicContact CB-CE1 4.23Å; D286-Y290 HydrophobicContact CB-CE2 3.97Å; D286-Y290 WeakPolarHBondContact O-CD1 3.24Å; D286-Y290 WeakPolarHBondContact O-CD2 3.45Å; D286-Y290 PolarHBondContact O-N 2.91Å; P287-Y290 PolarHBondContact O-N 2.92Å; F288-Y290 VanDerWaalsContact C-N 3.29Å; F288-Y290 PolarHBondContact O-N 3.46Å; Y290-T293 PolarHBondContact O-N 3Å; Y290-S294 WeakPolarHBondContact O-CB 3.44Å; Y290-S294 PolarHBondContact O-N 3.44Å; Y290-F297 HydrophobicContact CD2-CE2 4.21Å; Y290-F297 HydrophobicContact CD2-CZ 4.04Å; Y290-F297 HydrophobicContact CG-CE2 4.48Å; Y290-F297 HydrophobicContact CG-CZ 4.37Å
291Y84.4Confident81.8Confident84 Ų8440.3 Ų40.333%0.32919%0.194SC..Hα-helixtrans-60.9-49.3177.5-177.8-90.4000111.9P287 F288 T293 Q298P287-Y291 VanDerWaalsContact O-CB 3.29Å; P287-Y291 WeakPolarHBondContact O-CB 3.5Å; P287-Y291 PolarHBondContact O-N 3.34Å; F288-Y291 PolarHBondContact O-N 3.46Å; Y291-T293 VanDerWaalsContact C-N 3.3Å; Y291-T293 PolarHBondContact O-N 3.43Å; Y291-Q298 HydrophobicContact CD1-CG 4.35Å; Y291-Q298 HydrophobicContact CD2-CB 4.46Å; Y291-Q298 HydrophobicContact CD2-CG 3.88Å; Y291-Q298 HydrophobicContact CE1-CG 4.26Å; Y291-Q298 HydrophobicContact CE2-CB 4.14Å; Y291-Q298 HydrophobicContact CE2-CG 3.79Å; Y291-Q298 HydrophobicContact CG-CG 4.16Å; Y291-Q298 WeakPolarHBondContact O-CG 3.45Å; Y291-Q298 PolarHBondContact O-NE2 3.07Å
292F82.8Confident80.3Confident47 Ų4741.5 Ų41.521%0.20620%0.201CC..Hα-helixtrans-76.1-19.2-177.7-70.8-70.5000113.5K228 M229 V232 F288 I289K228-F292 HydrophobicContact CB-CD1 3.87Å; K228-F292 HydrophobicContact CB-CE1 4.11Å; K228-F292 HydrophobicContact CD-CE1 4.11Å; M229-F292 HydrophobicContact CB-CB 4.16Å; V232-F292 HydrophobicContact CB-CD2 4.21Å; V232-F292 HydrophobicContact CG1-CD2 4.16Å; V232-F292 HydrophobicContact CG2-CD2 3.64Å; V232-F292 HydrophobicContact CG2-CE2 3.87Å; V232-F292 HydrophobicContact CG2-CG 4.29Å; F288-F292 HydrophobicContact CD1-CE2 4.42Å; F288-F292 WeakPolarHBondContact O-CD2 3.02Å; F288-F292 PolarHBondContact O-N 2.95Å; I289-F292 PolarHBondContact O-N 3.41Å
293T79.6Confident78.7Confident7 Ų744.6 Ų44.64%0.04322%0.217CC..Hα-helixtrans-96.9-27.2-176.3-580000114.1T53 M57 I111 R115 M229 H233 I289 Y290 Y291T53-T293 HydrophobicContact CG2-CG2 3.85Å; M57-T293 HydrophobicContact CE-CG2 3.06Å; I111-T293 HydrophobicContact CG2-CG2 4.24Å; R115-T293 PolarHBondContact NH2-O 2.98Å; M229-T293 HydrophobicContact CG-CG2 4.46Å; M229-T293 VanDerWaalsContact CG-OG1 3.26Å; M229-T293 WeakPolarHBondContact CG-OG1 3.38Å; M229-T293 HydrophobicContact SD-CG2 3.87Å; H233-T293 PolarHBondContact CE1-OG1 2.93Å; H233-T293 PolarHBondContact NE2-OG1 3.44Å; I289-T293 WeakPolarHBondContact O-CB 3.27Å; I289-T293 PolarHBondContact O-N 2.98Å; I289-T293 PolarHBondContact O-OG1 3.06Å; Y290-T293 PolarHBondContact O-N 3Å; Y291-T293 VanDerWaalsContact C-N 3.3Å; Y291-T293 PolarHBondContact O-N 3.43Å
294S78.1Confident76.9Confident9 Ų951.1 Ų51.16%0.06325%0.246CC..  trans-121.2113.9-175.31770000112.6M47 Y290 S296 F297 Q298M47-S294 WeakPolarHBondContact CE-OG 3.39Å; M47-S294 PolarHBondContact SD-OG 3.41Å; M47-S294 VanDerWaalsContact SD-OG 3.4Å; Y290-S294 WeakPolarHBondContact O-CB 3.44Å; Y290-S294 PolarHBondContact O-N 3.44Å; S294-S296 VanDerWaalsContact C-N 3.28Å; S294-S296 PolarHBondContact O-N 2.91Å; S294-F297 WeakPolarHBondContact O-CB 3.4Å; S294-F297 PolarHBondContact O-N 2.93Å; S294-F297 VanDerWaalsContact O-N 3.15Å; S294-F297 PolarHBondContact OG-N 2.93Å; S294-Q298 WeakPolarHBondContact O-CG 3.34Å; S294-Q298 PolarHBondContact O-N 2.98Å; S294-Q298 VanDerWaalsContact O-N 3.07Å
295E72.9Confident75Confident87 Ų8754.7 Ų54.741%0.40727%0.267SS..Hα-helixtrans-63.9-35.5175-36.1-151.6123.700112.4K225 F297 Q298 K299K225-E295 WeakPolarHBondContact CE-OE1 3.47Å; K225-E295 IonicContact NZ-OE1 2.62Å; K225-E295 PolarHBondContact NZ-OE1 2.84Å; E295-F297 PolarHBondContact O-N 2.72Å; E295-Q298 WeakPolarHBondContact O-CB 3.4Å; E295-Q298 PolarHBondContact O-N 3.18Å; E295-K299 WeakPolarHBondContact O-CG 3.38Å; E295-K299 PolarHBondContact O-N 3.42Å
296S68Low73.1Confident63 Ų6357.9 Ų57.944%0.44128%0.282SS..Hα-helixtrans-65.9-31.2176.9-56.10000111.8S294 S300S294-S296 VanDerWaalsContact C-N 3.28Å; S294-S296 PolarHBondContact O-N 2.91Å; S296-S300 PolarHBondContact O-N 2.85Å; S296-S300 VanDerWaalsContact O-N 3.12Å; S296-S300 PolarHBondContact O-OG 3.11Å
297F72Confident71.7Confident2 Ų262.9 Ų62.91%0.00931%0.308CS..Hα-helixtrans-69.7-46.6172.6-165.7-91.7000110.6V42 F43 M47 Y290 S294 E295 K299 S300 F301V42-F297 HydrophobicContact CB-CD2 4.08Å; V42-F297 HydrophobicContact CB-CE2 4.13Å; V42-F297 HydrophobicContact CG1-CD2 3.58Å; V42-F297 HydrophobicContact CG1-CE2 4.14Å; V42-F297 HydrophobicContact CG1-CG 4.36Å; F43-F297 HydrophobicContact CD1-CD2 4.19Å; F43-F297 AromaticContact CE1-CD2 3.43Å; F43-F297 HydrophobicContact CE1-CD2 3.43Å; F43-F297 VanDerWaalsContact CE1-CD2 3.43Å; F43-F297 AromaticContact CE1-CE2 3.84Å; F43-F297 HydrophobicContact CE1-CE2 3.84Å; F43-F297 HydrophobicContact CE1-CG 4.39Å; F43-F297 AromaticContact CZ-CD2 3.84Å; F43-F297 HydrophobicContact CZ-CD2 3.84Å; F43-F297 AromaticContact CZ-CE2 3.79Å; F43-F297 HydrophobicContact CZ-CE2 3.79Å; M47-F297 HydrophobicContact SD-CB 4.36Å; Y290-F297 HydrophobicContact CD2-CE2 4.21Å; Y290-F297 HydrophobicContact CD2-CZ 4.04Å; Y290-F297 HydrophobicContact CG-CE2 4.48Å; Y290-F297 HydrophobicContact CG-CZ 4.37Å; S294-F297 WeakPolarHBondContact O-CB 3.4Å; S294-F297 PolarHBondContact O-N 2.93Å; S294-F297 VanDerWaalsContact O-N 3.15Å; S294-F297 PolarHBondContact OG-N 2.93Å; E295-F297 PolarHBondContact O-N 2.72Å; F297-K299 VanDerWaalsContact C-N 3.34Å; F297-K299 PolarHBondContact O-N 3.25Å; F297-S300 PolarHBondContact O-N 3.04Å; F297-S300 VanDerWaalsContact O-N 3.14Å; F297-F301 AromaticContact CD1-CD2 3.85Å; F297-F301 HydrophobicContact CD1-CD2 3.85Å; F297-F301 AromaticContact CD1-CE2 3.79Å; F297-F301 HydrophobicContact CD1-CE2 3.79Å; F297-F301 AromaticContact CE1-CD2 3.73Å; F297-F301 HydrophobicContact CE1-CD2 3.73Å; F297-F301 AromaticContact CE1-CE2 3.19Å; F297-F301 HydrophobicContact CE1-CE2 3.19Å; F297-F301 HydrophobicContact CE1-CZ 4.06Å; F297-F301 HydrophobicContact CE2-CE2 4.22Å; F297-F301 HydrophobicContact CZ-CD2 4.33Å; F297-F301 AromaticContact CZ-CE2 3.45Å; F297-F301 HydrophobicContact CZ-CE2 3.45Å; F297-F301 VanDerWaalsContact CZ-CE2 3.45Å; F297-F301 HydrophobicContact CZ-CZ 4.21Å; F297-F301 WeakPolarHBondContact O-CD2 3.43Å; F297-F301 PolarHBondContact O-N 3.07Å; F297-F301 VanDerWaalsContact O-N 3.15Å
298Q75.2Confident70.1Confident33 Ų3368.9 Ų68.915%0.15433%0.332CS..Hα-helixtrans-54.7-48.2173.6-62.8178.1-4.800112Y291 S294 E295 S300 F301 N302Y291-Q298 HydrophobicContact CD1-CG 4.35Å; Y291-Q298 HydrophobicContact CD2-CB 4.46Å; Y291-Q298 HydrophobicContact CD2-CG 3.88Å; Y291-Q298 HydrophobicContact CE1-CG 4.26Å; Y291-Q298 HydrophobicContact CE2-CB 4.14Å; Y291-Q298 HydrophobicContact CE2-CG 3.79Å; Y291-Q298 HydrophobicContact CG-CG 4.16Å; Y291-Q298 WeakPolarHBondContact O-CG 3.45Å; Y291-Q298 PolarHBondContact O-NE2 3.07Å; S294-Q298 WeakPolarHBondContact O-CG 3.34Å; S294-Q298 PolarHBondContact O-N 2.98Å; S294-Q298 VanDerWaalsContact O-N 3.07Å; E295-Q298 WeakPolarHBondContact O-CB 3.4Å; E295-Q298 PolarHBondContact O-N 3.18Å; Q298-S300 VanDerWaalsContact C-N 3.31Å; Q298-S300 PolarHBondContact O-N 3.33Å; Q298-F301 PolarHBondContact O-N 2.96Å; Q298-N302 PolarHBondContact O-N 3.26Å
299K74.9Confident68.4Low132 Ų13268.4 Ų68.457%0.57433%0.333SS*.Hα-helixtrans-61.6-37.9178.6-72.4177.7-178.5179.90112.2E295 F297 F301 N302 I303E295-K299 WeakPolarHBondContact O-CG 3.38Å; E295-K299 PolarHBondContact O-N 3.42Å; F297-K299 VanDerWaalsContact C-N 3.34Å; F297-K299 PolarHBondContact O-N 3.25Å; K299-F301 VanDerWaalsContact C-N 3.33Å; K299-F301 PolarHBondContact O-N 3.41Å; K299-N302 PolarHBondContact O-N 2.82Å; K299-I303 WeakPolarHBondContact O-CB 3.11Å; K299-I303 WeakPolarHBondContact O-CD1 3.36Å; K299-I303 WeakPolarHBondContact O-CG1 3.39Å; K299-I303 PolarHBondContact O-N 3.32Å
300S70.3Confident67Low19 Ų1973.1 Ų73.113%0.13336%0.358CS..Hα-helixtrans-67.1-32.9178.2-61.90000112.9S296 F297 Q298S296-S300 PolarHBondContact O-N 2.85Å; S296-S300 VanDerWaalsContact O-N 3.12Å; S296-S300 PolarHBondContact O-OG 3.11Å; F297-S300 PolarHBondContact O-N 3.04Å; F297-S300 VanDerWaalsContact O-N 3.14Å; Q298-S300 VanDerWaalsContact C-N 3.31Å; Q298-S300 PolarHBondContact O-N 3.33Å
301F68.6Low65.5Low89 Ų8976 Ų7639%0.3938%0.378SS..Hα-helixtrans-69.6-45.7171.3-89.8-95000111.6F297 Q298 K299 I303 K304 T305F297-F301 AromaticContact CD1-CD2 3.85Å; F297-F301 HydrophobicContact CD1-CD2 3.85Å; F297-F301 AromaticContact CD1-CE2 3.79Å; F297-F301 HydrophobicContact CD1-CE2 3.79Å; F297-F301 AromaticContact CE1-CD2 3.73Å; F297-F301 HydrophobicContact CE1-CD2 3.73Å; F297-F301 AromaticContact CE1-CE2 3.19Å; F297-F301 HydrophobicContact CE1-CE2 3.19Å; F297-F301 HydrophobicContact CE1-CZ 4.06Å; F297-F301 HydrophobicContact CE2-CE2 4.22Å; F297-F301 HydrophobicContact CZ-CD2 4.33Å; F297-F301 AromaticContact CZ-CE2 3.45Å; F297-F301 HydrophobicContact CZ-CE2 3.45Å; F297-F301 VanDerWaalsContact CZ-CE2 3.45Å; F297-F301 HydrophobicContact CZ-CZ 4.21Å; F297-F301 WeakPolarHBondContact O-CD2 3.43Å; F297-F301 PolarHBondContact O-N 3.07Å; F297-F301 VanDerWaalsContact O-N 3.15Å; Q298-F301 PolarHBondContact O-N 2.96Å; K299-F301 VanDerWaalsContact C-N 3.33Å; K299-F301 PolarHBondContact O-N 3.41Å; F301-I303 PolarHBondContact O-N 3.19Å; F301-K304 PolarHBondContact O-N 2.97Å; F301-T305 PolarHBondContact O-N 3.16Å; F301-T305 PolarHBondContact O-OG1 3.16Å
302N63.8Low64.1Low89 Ų8977.2 Ų77.248%0.47639%0.39SS..Hα-helixtrans-66-36.6-179.2-70.5-14.2000112.9Q298 K299 K304 T305 Q306Q298-N302 PolarHBondContact O-N 3.26Å; K299-N302 PolarHBondContact O-N 2.82Å; N302-K304 VanDerWaalsContact C-N 3.31Å; N302-K304 PolarHBondContact O-N 3.09Å; N302-T305 WeakPolarHBondContact O-CB 3.17Å; N302-T305 PolarHBondContact O-N 3.41Å; N302-T305 VanDerWaalsContact O-N 3.16Å; N302-Q306 PolarHBondContact O-N 3.44Å
303I59.1Low62.8Low65 Ų6581.6 Ų81.633%0.33341%0.409SS..Hα-helixtrans-61.5-38.1175.5-71.7163.2000111.4K299 F301 Q306 I307K299-I303 WeakPolarHBondContact O-CB 3.11Å; K299-I303 WeakPolarHBondContact O-CD1 3.36Å; K299-I303 WeakPolarHBondContact O-CG1 3.39Å; K299-I303 PolarHBondContact O-N 3.32Å; F301-I303 PolarHBondContact O-N 3.19Å; I303-Q306 PolarHBondContact O-N 2.04Å; I303-I307 HydrophobicContact CG2-CD1 3.62Å; I303-I307 HydrophobicContact CG2-CG1 4.28Å; I303-I307 WeakPolarHBondContact O-CB 3.49Å; I303-I307 VanDerWaalsContact O-CG1 3.27Å; I303-I307 WeakPolarHBondContact O-CG1 3.27Å; I303-I307 PolarHBondContact O-N 2.77Å
304K55.4Low61.6Low138 Ų13889.5 Ų89.560%0.644%0.443SS*.Hα-helixtrans-66.4-38.3174.8-81.7-174175.7-176.70111.8F301 N302 Q306 K308F301-K304 PolarHBondContact O-N 2.97Å; N302-K304 VanDerWaalsContact C-N 3.31Å; N302-K304 PolarHBondContact O-N 3.09Å; K304-Q306 VanDerWaalsContact C-N 3.33Å; K304-K308 WeakPolarHBondContact O-CB 3.34Å; K304-K308 PolarHBondContact O-N 3.43Å
305T53.3Low60.4Low88 Ų8894.8 Ų94.854%0.5448%0.475SS..Hα-helixtrans-64.9-39175.1-430000111.4F301 N302 K308 M309F301-T305 PolarHBondContact O-N 3.16Å; F301-T305 PolarHBondContact O-OG1 3.16Å; N302-T305 WeakPolarHBondContact O-CB 3.17Å; N302-T305 PolarHBondContact O-N 3.41Å; N302-T305 VanDerWaalsContact O-N 3.16Å; T305-K308 PolarHBondContact O-N 3.09Å; T305-M309 WeakPolarHBondContact O-CB 3.24Å; T305-M309 WeakPolarHBondContact O-CG 3.45Å; T305-M309 PolarHBondContact O-N 3.04Å
306Q49.7Very low59.2Low126 Ų12698 Ų9859%0.58949%0.49SS*.Hα-helixtrans-69.6-46.1178.6-135.4165.62.100112N302 I303 K304 K308 M309 D310N302-Q306 PolarHBondContact O-N 3.44Å; I303-Q306 PolarHBondContact O-N 2.04Å; K304-Q306 VanDerWaalsContact C-N 3.33Å; Q306-K308 VanDerWaalsContact C-N 3.32Å; Q306-K308 PolarHBondContact O-N 3.46Å; Q306-M309 PolarHBondContact O-N 3.39Å; Q306-D310 WeakPolarHBondContact O-CB 3.4Å; Q306-D310 PolarHBondContact O-N 2.92Å
307I57.6Low58.1Low105 Ų105100.7 Ų100.754%0.53850%0.503SS..Hα-helixtrans-63.9-37.7174.9-66.6168.6000111.3I303 D310 S311I303-I307 HydrophobicContact CG2-CD1 3.62Å; I303-I307 HydrophobicContact CG2-CG1 4.28Å; I303-I307 WeakPolarHBondContact O-CB 3.49Å; I303-I307 VanDerWaalsContact O-CG1 3.27Å; I303-I307 WeakPolarHBondContact O-CG1 3.27Å; I303-I307 PolarHBondContact O-N 2.77Å; I307-D310 PolarHBondContact O-N 3.45Å; I307-S311 WeakPolarHBondContact O-CB 3.02Å; I307-S311 PolarHBondContact O-N 3.36Å; I307-S311 PolarHBondContact O-OG 2.97Å
308K51.7Low56.7Low148 Ų148106.4 Ų106.464%0.64354%0.541SS*.Hα-helixtrans-67.1-41.3176.8-166.1173.7-177.4-177.60111.5K304 T305 Q306 S311 L312K304-K308 WeakPolarHBondContact O-CB 3.34Å; K304-K308 PolarHBondContact O-N 3.43Å; T305-K308 PolarHBondContact O-N 3.09Å; Q306-K308 VanDerWaalsContact C-N 3.32Å; Q306-K308 PolarHBondContact O-N 3.46Å; K308-S311 WeakPolarHBondContact CA-OG 2.97Å; K308-S311 PolarHBondContact O-N 3.32Å; K308-S311 PolarHBondContact O-OG 3.03Å; K308-L312 HydrophobicContact CG-CD1 4.49Å; K308-L312 PolarHBondContact O-N 2.93Å; K308-L312 VanDerWaalsContact O-N 3.1Å
309M49.5Very low55.5Low106 Ų106113 Ų11352%0.52258%0.576SS.*Hα-helixtrans-62.9-47.5172.1-82.4-80.2-108.100112T305 Q306 S311 L312 F313T305-M309 WeakPolarHBondContact O-CB 3.24Å; T305-M309 WeakPolarHBondContact O-CG 3.45Å; T305-M309 PolarHBondContact O-N 3.04Å; Q306-M309 PolarHBondContact O-N 3.39Å; M309-S311 VanDerWaalsContact C-N 3.28Å; M309-S311 PolarHBondContact O-N 3.15Å; M309-L312 WeakPolarHBondContact O-CB 3.37Å; M309-L312 PolarHBondContact O-N 3.36Å; M309-L312 VanDerWaalsContact O-N 3.14Å; M309-F313 WeakPolarHBondContact O-CD2 3.32Å; M309-F313 PolarHBondContact O-N 3.36Å; M309-F313 HydrophobicContact SD-CE2 4.42Å
310D54.9Low53.8Low99 Ų99112.3 Ų112.353%0.52958%0.583SS.*Hα-helixtrans-63.9-33.5179.1-71.5-14.5000112.3Q306 I307 K314Q306-D310 WeakPolarHBondContact O-CB 3.4Å; Q306-D310 PolarHBondContact O-N 2.92Å; I307-D310 PolarHBondContact O-N 3.45Å; D310-K314 WeakPolarHBondContact O-CB 3.31Å; D310-K314 WeakPolarHBondContact O-CG 3.38Å; D310-K314 PolarHBondContact O-N 2.89Å
311S54.2Low52.2Low61 Ų61121.2 Ų121.243%0.42762%0.62SS.*Hα-helixtrans-71.9-33.1174.968.90000113.2I307 K308 M309 T315I307-S311 WeakPolarHBondContact O-CB 3.02Å; I307-S311 PolarHBondContact O-N 3.36Å; I307-S311 PolarHBondContact O-OG 2.97Å; K308-S311 WeakPolarHBondContact CA-OG 2.97Å; K308-S311 PolarHBondContact O-N 3.32Å; K308-S311 PolarHBondContact O-OG 3.03Å; M309-S311 VanDerWaalsContact C-N 3.28Å; M309-S311 PolarHBondContact O-N 3.15Å; S311-T315 PolarHBondContact O-OG1 3.06Å
312L54.6Low50.8Low108 Ų108123.2 Ų123.257%0.56564%0.639SS**Hα-helixtrans-69.3-44.1173.3-90.6152.8000110.8K308 M309 K314 T315K308-L312 HydrophobicContact CG-CD1 4.49Å; K308-L312 PolarHBondContact O-N 2.93Å; K308-L312 VanDerWaalsContact O-N 3.1Å; M309-L312 WeakPolarHBondContact O-CB 3.37Å; M309-L312 PolarHBondContact O-N 3.36Å; M309-L312 VanDerWaalsContact O-N 3.14Å; L312-K314 PolarHBondContact O-N 3.29Å; L312-T315 PolarHBondContact O-N 2.79Å
313F54.8Low49.8Very low140 Ų140123.3 Ų123.361%0.61465%0.653SS**Hα-helixtrans-68.6-28.7177-89.7-82.2000113.9M309 T315M309-F313 WeakPolarHBondContact O-CD2 3.32Å; M309-F313 PolarHBondContact O-N 3.36Å; M309-F313 HydrophobicContact SD-CE2 4.42Å; F313-T315 PolarHBondContact O-N 2.92Å
314K54.3Low48.7Very low173 Ų173128.4 Ų128.475%0.75268%0.679SS**THydrogen-bonded Turntrans-72.5-12.6172.7-84.4-177178.2-178.10114.4D310 L312 E316D310-K314 WeakPolarHBondContact O-CB 3.31Å; D310-K314 WeakPolarHBondContact O-CG 3.38Å; D310-K314 PolarHBondContact O-N 2.89Å; L312-K314 PolarHBondContact O-N 3.29Å; K314-E316 VanDerWaalsContact C-N 3.33Å
315T53.1Low48.1Very low119 Ų119127.7 Ų127.773%0.7369%0.689SS**THydrogen-bonded Turntrans-85.7-7.6179.2-47.70000112.1S311 L312 F313S311-T315 PolarHBondContact O-OG1 3.06Å; L312-T315 PolarHBondContact O-N 2.79Å; F313-T315 PolarHBondContact O-N 2.92Å
316E49.2Very low47.6Very low156 Ų156127.8 Ų127.873%0.72970%0.699SS**SBendtrans-111.721.8-175.1-73.4-171.1160.400115.7K314 P318K314-E316 VanDerWaalsContact C-N 3.33Å; E316-P318 WeakPolarHBondContact O-CD 3.38Å
317T44.6Very low47.2Very low118 Ų118128 Ų12872%0.72471%0.711SS**  trans-102.9110.2173.4-6.70000111.8
318P42.9Very low46.2Very low122 Ų122134.5 Ų134.579%0.79273%0.729SS**  trans-75.6140.3176.3-9.325.8000111.9E316 T320E316-P318 WeakPolarHBondContact O-CD 3.38Å; P318-T320 PolarHBondContact O-N 3.13Å
319L48.6Very low45.6Very low172 Ų172135.1 Ų135.190%0.90174%0.739SS**  trans-78.2106.8179.9-137.8152000109.7
320T40.7Very low44.9Very low117 Ų117139.6 Ų139.672%0.71876%0.758SS**  trans-155.697.9155.6-38.80000112P318P318-T320 PolarHBondContact O-N 3.13Å
321K36.7Very low44.3Very low207 Ų207142.8 Ų142.890%0.977%0.774SS**  trans-141.9100.5141.7-78.5-163.3178.8178.20108.5
322T38.3Very low43.3Very low131 Ų131144.9 Ų144.980%0.80479%0.789SS**  trans-61.4132.5170.9-44.20000109.6
323A43.1Very low42.4Very low91 Ų91146.6 Ų146.675%0.75280%0.798SS**  trans-72.1150.2175.500000111.9
324L36.5Very low41.4Very low171 Ų171148.8 Ų148.890%0.89581%0.81SS**  trans-118.3146.3157.5-124.190.7000109
325P42.8Very low40.4Very low123 Ų123144 Ų14480%0.79980%0.804SS**PPolyproline II helixtrans-91.5158.8-162.135.4-32.5000114.5
326A41.4Very low39.6Very low91 Ų91145.3 Ų145.375%0.75281%0.805SS**PPolyproline II helixtrans-70.8153.8177.500000113.4
327P42.7Very low38.9Very low129 Ų129143 Ų14384%0.83880%0.801SS**PPolyproline II helixtrans-83146.4177.332.7-30.3000112.3
328R35.6Very low38.3Very low243 Ų243144.8 Ų144.892%0.91781%0.806SS**PPolyproline II helixtrans-83.1146.8172.7-79.1-177-179.1-164.4-0.6111.1
329D39.6Very low37.8Very low160 Ų160142.9 Ų142.986%0.85681%0.809SS**PPolyproline II helixtrans-60141.6172.9-58.5-59.5000113.4
330E34.1Very low37Very low200 Ų200138.6 Ų138.694%0.93581%0.807SS**  trans-135.1135.4150.3-97.9-175.5178.300110.2
331I42.7Very low36.7Very low166 Ų166140.3 Ų140.385%0.85181%0.811SS**  trans-83.1136-179-65.6160.9000109.1
332S32.8Very low37.6Very low106 Ų106134.5 Ų134.574%0.74179%0.794SS**  trans-172.8110.3143.8178.20000111.5
333D35.3Very low37.5Very low143 Ų143134.3 Ų134.377%0.76579%0.794SS**  37.7144.2129.2-89-18.6000123.8
334Q33.8Very low37.2Very low186 Ų186134.3 Ų134.387%0.86979%0.788SS**  trans78.4143.5161.9-65.1174.412.200116.8
335A34.8Very low37.3Very low74 Ų74134.5 Ų134.561%0.61278%0.784SS**  cis-176.2162.8-15.800000105
336I36Very low37Very low146 Ų146132.7 Ų132.775%0.74978%0.775SS**  trans80.8103.6143.7-71.8160.2000118.3
337T33.1Very low36.8Very low106 Ų106136.2 Ų136.265%0.6578%0.775SS**  94.3119.612757.50000122.5
338N33.3Very low36.8Very low156 Ų156142.9 Ų142.983%0.83479%0.791SS**  72.5114.6125.2-65.1-10.1000119.3
339G31.7Very low36.8Very low82 Ų82137.9 Ų137.985%0.84579%0.785SS**  129.8121.110800000114.7
340G31.3Very low36.7Very low83 Ų83136.7 Ų136.786%0.85678%0.782SS**  trans108.382.8149.500000116.4
341D34.7Very low36.8Very low152 Ų152133.2 Ų133.281%0.81377%0.773SS**  trans-65.8-179.3142.4-149.922.5000109.4
342P55.3Low36.5Very low85 Ų85131.3 Ų131.355%0.55277%0.768SS**  cis-130.2-162.4-32.415.79.8000111
343T36.8Very low36.7Very low128 Ų128132.9 Ų132.979%0.78577%0.77SS**  trans91.1143152.671.80000116.6
344S36.8Very low36.8Very low91 Ų91132.2 Ų132.264%0.63677%0.77SS**  cis-175.8150.3-10.447.90000106.5
345E38.1Very low37Very low175 Ų175128.4 Ų128.482%0.81876%0.763SS**  trans51128.4137.4-68.3-173.3139.900123.5
346S36.4Very low37.2Very low85 Ų85132.5 Ų132.559%0.59478%0.775SS**  60.9122.3129.470.20000120.7
347H37.3Very low37.3Very low164 Ų164131.4 Ų131.476%0.75978%0.777SS**  173.914099-99.5-79.5000111.9
348F43.1Very low37.7Very low270 Ų270133.7 Ų133.7100%1.18479%0.789SS**  trans780167.8-81.6-81.9000120.6

Retrieved 348 of 348 residues in 479.1 ms (Link to these results)

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