A0A061HTK0_CRIGR Loading...

C5a anaphylatoxin chemotactic receptor 2

Receptor for the chemotactic and inflammatory C3a, C4a and C5a anaphylatoxin peptides and also for their dearginated forms ASP/C3adesArg, C4adesArg and C5adesArg respectively. Couples weakly to G(i)-mediated signaling pathways.

AlphaFold DB , UniProt , Accession A0A061HTK0, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene C5ar2, Length 342 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
1M37.2Very low40.5Very low244 Ų244159.1 Ų159.1100%1.20284%0.839SS**  0117.40-78.7171.4175.600106.2
2M34Very low40.9Very low159 Ų159162.6 Ų162.678%0.78383%0.834SS**  cis-136.2140.631.4-66.8170.6-168.100111.8Y4M2-Y4 HydrophobicContact CB-CE2 4.43Å
3N37.1Very low41Very low154 Ų154164.8 Ų164.882%0.82484%0.839SS**  trans-68.5138.7160-95.6-13.1000109.1
4Y40.3Very low41.5Very low210 Ų210165.5 Ų165.582%0.82483%0.828SS**  trans-113.6119.4156.5-84.6-85.2000109.2M2M2-Y4 HydrophobicContact CB-CE2 4.43Å
5T42.2Very low41.7Very low130 Ų130163.1 Ų163.180%0.79882%0.819SS**  trans-77.1151.8-176.917.30000112.4
6T44.9Very low42.5Very low137 Ų137163.1 Ų163.184%0.8481%0.808SS**  trans-65.5146.7177.144.20000115.1
7G42.3Very low42.8Very low66 Ų66163.2 Ų163.268%0.6881%0.806SS**  trans77.5113.2130.600000119.3
8Y38.7Very low43.1Very low238 Ų238164.2 Ų164.293%0.93381%0.805SS**  trans-151.394147.9-105.2-83.8000108.5
9E44.9Very low43.5Very low192 Ų192164.1 Ų164.190%0.89780%0.796SS**  trans-83.8114.7156.3-88.1175150.600106.3
10G43Very low43.8Very low54 Ų54164.9 Ų164.956%0.55780%0.798SS**  trans-88.2104170.100000109Y12G10-Y12 PolarHBondContact O-N 2.74Å
11D40.6Very low44Very low166 Ų166164.4 Ų164.489%0.88880%0.8SS**  trans-69.8115.6163.9-87.5-28.1000108.4E13D11-E13 PolarHBondContact O-N 3.37Å
12Y45.3Very low44.6Very low201 Ų201158.5 Ų158.579%0.78877%0.77SS**  trans-85.6100.9168.2-64.8-83.2000107.9G10 Y14G10-Y12 PolarHBondContact O-N 2.74Å; Y12-Y14 PolarHBondContact O-N 3.39Å
13E43.1Very low45.4Very low191 Ų191155.6 Ų155.689%0.89377%0.766SS**  trans-76109.9171.4-164.8164.5-165.500108.4D11 D15D11-E13 PolarHBondContact O-N 3.37Å; E13-D15 PolarHBondContact O-N 3.27Å
14Y47.7Very low46.1Very low175 Ų175156.4 Ų156.469%0.68677%0.77SS**  trans-75.5114.4175-72.3-87000108.7Y12 Y16Y12-Y14 PolarHBondContact O-N 3.39Å; Y14-Y16 WeakPolarHBondContact O-CD2 3.39Å; Y14-Y16 PolarHBondContact O-N 3.46Å; Y14-Y16 VanDerWaalsContact O-N 3.1Å
15D44.2Very low46.4Very low130 Ų130150.8 Ų150.870%0.69576%0.757SS**  trans-75.696.5179.3-153.6-10.6000109.9E13 E17E13-D15 PolarHBondContact O-N 3.27Å; D15-E17 VanDerWaalsContact C-N 3.31Å
16Y53.9Low46.7Very low163 Ų163148.6 Ų148.664%0.63975%0.745SS**  trans-86.51.1-179.9-74-81000113.1Y14 F18 Y19Y14-Y16 WeakPolarHBondContact O-CD2 3.39Å; Y14-Y16 PolarHBondContact O-N 3.46Å; Y14-Y16 VanDerWaalsContact O-N 3.1Å; Y16-F18 PolarHBondContact O-N 3.29Å; Y16-Y19 PolarHBondContact O-N 3.19Å
17E48.8Very low47.2Very low165 Ų165148.9 Ų148.977%0.77175%0.746SS**G310 helixtrans-64.8-14.4-172.2-70.7-163.415900114D15D15-E17 VanDerWaalsContact C-N 3.31Å
18F48.1Very low47.8Very low180 Ų180152.6 Ų152.679%0.78975%0.751SS**G310 helixtrans-84-9.2-179.1-156.8-99.1000115.3Y16Y16-F18 PolarHBondContact O-N 3.29Å
19Y49.3Very low48.6Very low163 Ų163142.9 Ų142.964%0.63972%0.717SS**G310 helixtrans-92.2-4.7-177.5-74.7-83.4000114.6Y16 D21 M22Y16-Y19 PolarHBondContact O-N 3.19Å; Y19-D21 VanDerWaalsContact C-N 3.32Å; Y19-D21 PolarHBondContact O-N 3.43Å; Y19-M22 HydrophobicContact CD1-CE 3.53Å; Y19-M22 HydrophobicContact CE1-CE 3.78Å
20H49.9Very low48.8Very low179 Ų179139.3 Ų139.383%0.82971%0.711SS**THydrogen-bonded Turntrans-75.8-14.3-176.2-91.8-67.2000115
21D49.3Very low49.4Very low156 Ų156142.1 Ų142.183%0.83472%0.717SS**THydrogen-bonded Turntrans-105.36.4-177.8-15731.7000113.6Y19 S23Y19-D21 VanDerWaalsContact C-N 3.32Å; Y19-D21 PolarHBondContact O-N 3.43Å; D21-S23 PolarHBondContact O-N 3.35Å
22M48.6Very low49.8Very low120 Ų120137.5 Ų137.559%0.59171%0.708SS**SBendtrans-78.2115.9169.1-111.7174-80.900108.5Y19 D24Y19-M22 HydrophobicContact CD1-CE 3.53Å; Y19-M22 HydrophobicContact CE1-CE 3.78Å; M22-D24 PolarHBondContact O-N 3.45Å
23S50.3Low50.1Low98 Ų98134.8 Ų134.869%0.68571%0.708SS**  trans-48.4131166.7-51.50000108.9D21 V25D21-S23 PolarHBondContact O-N 3.35Å; S23-V25 PolarHBondContact O-N 2.73Å
24D51.9Low50.7Low171 Ų171128.7 Ų128.791%0.91469%0.686SS**  trans-63.966.5174.4-78.4-40.8000110.6M22 P26M22-D24 PolarHBondContact O-N 3.45Å; D24-P26 WeakPolarHBondContact O-CD 3.42Å
25V47.3Very low51Low91 Ų91129.2 Ų129.255%0.55269%0.692SS**  trans-89.6115.7172.6-173.20000105.6S23 V27S23-V25 PolarHBondContact O-N 2.73Å; V25-V27 PolarHBondContact O-N 3.4Å
26P49.3Very low51.8Low84 Ų84125.9 Ų125.955%0.54568%0.678SS.*  trans-52.6128.7173-22.732.1000109.1D24 D28 C29D24-P26 WeakPolarHBondContact O-CD 3.42Å; P26-D28 PolarHBondContact O-N 3.16Å; P26-C29 PolarHBondContact O-N 3.3Å
27V55.1Low52.6Low143 Ų143121.2 Ų121.287%0.86767%0.67SS**THydrogen-bonded Turntrans-53.5-20.3-177-173.10000112.3V25V25-V27 PolarHBondContact O-N 3.4Å
28D53.7Low54.3Low145 Ų145116.9 Ų116.978%0.77565%0.652SS**THydrogen-bonded Turntrans-85.8-2.1-178.9-61.2-38.8000115.4P26P26-D28 PolarHBondContact O-N 3.16Å
29C56.5Low56.2Low33 Ų33112.1 Ų112.122%0.22364%0.637CS.*  trans-130.559.5-170.2-67.90000115.8P26 T31 C34P26-C29 PolarHBondContact O-N 3.3Å; C29-T31 VanDerWaalsContact C-N 3.29Å; C29-T31 PolarHBondContact O-N 3.43Å; C29-C34 VanDerWaalsContact CA-SG 3.56Å; C29-C34 HydrophobicContact CB-CB 4.2Å; C29-C34 WeakPolarHBondContact CB-SG 3.38Å; C29-C34 WeakPolarHBondContact SG-CB 3.48Å; C29-C34 CovalentContact SG-SG 2.01Å; C29-C34 PolarHBondContact SG-SG 3.22Å
30P48.4Very low58.1Low118 Ų118106.5 Ų106.577%0.76662%0.615SS**THydrogen-bonded Turntrans-71.6-16-178.426.8-33000114.8
31T57Low60.1Low113 Ų11399 Ų9969%0.69358%0.582SS**THydrogen-bonded Turntrans-115.36.2-172.855.90000115C29 N33C29-T31 VanDerWaalsContact C-N 3.29Å; C29-T31 PolarHBondContact O-N 3.43Å; T31-N33 PolarHBondContact O-N 3.49Å
32G48.3Very low62.2Low68 Ų6896.5 Ų96.570%0.70157%0.567SS**SBendtrans70.8-8176.500000116.4C34G32-C34 VanDerWaalsContact C-N 3.3Å; G32-C34 PolarHBondContact O-N 3.32Å
33N50.7Low64.4Low144 Ų14494.6 Ų94.677%0.7756%0.563SS**  trans-92.542.3178.8-77-9.4000113T31 F35T31-N33 PolarHBondContact O-N 3.49Å; N33-F35 PolarHBondContact O-N 3.45Å
34C57.4Low66.6Low64 Ų6490 Ų9043%0.43253%0.531SS..  trans-77.8112.2173.2-75.40000109.1C29 G32 S36C29-C34 VanDerWaalsContact CA-SG 3.56Å; C29-C34 HydrophobicContact CB-CB 4.2Å; C29-C34 WeakPolarHBondContact CB-SG 3.38Å; C29-C34 WeakPolarHBondContact SG-CB 3.48Å; C29-C34 CovalentContact SG-SG 2.01Å; C29-C34 PolarHBondContact SG-SG 3.22Å; G32-C34 VanDerWaalsContact C-N 3.3Å; G32-C34 PolarHBondContact O-N 3.32Å; C34-S36 PolarHBondContact O-N 2.98Å
35F53.3Low68.7Low186 Ų18684.3 Ų84.382%0.81650%0.5SS*.  trans-49.1119.8157.8-85.3-86.4000106.4N33 S37N33-F35 PolarHBondContact O-N 3.45Å; F35-S37 PolarHBondContact O-N 3.35Å
36S60.4Low71.1Confident59 Ų5986.2 Ų86.241%0.41350%0.504SS..  trans-53.4121.6176.41720000107.6C34 D38 V39 Y40C34-S36 PolarHBondContact O-N 2.98Å; S36-D38 PolarHBondContact O-N 3.16Å; S36-D38 PolarHBondContact OG-N 3.31Å; S36-V39 PolarHBondContact O-N 2.94Å; S36-Y40 PolarHBondContact O-N 2.85Å
37S72.1Confident73.3Confident65 Ų6584.7 Ų84.746%0.45549%0.491SS..Hα-helixtrans-47.9-32.6177.2-177.10000110.7F35 Y40 V41F35-S37 PolarHBondContact O-N 3.35Å; S37-Y40 PolarHBondContact O-N 3.34Å; S37-V41 VanDerWaalsContact O-CG2 3.28Å; S37-V41 WeakPolarHBondContact O-CG2 3.36Å; S37-V41 PolarHBondContact O-N 2.85Å
38D83.3Confident75.3Confident74 Ų7478.3 Ų78.340%0.39645%0.452SS..Hα-helixtrans-68-37178.5-55.2-38.4000112.8S36 Y40 V41 I42 K103S36-D38 PolarHBondContact O-N 3.16Å; S36-D38 PolarHBondContact OG-N 3.31Å; D38-Y40 PolarHBondContact O-N 3.31Å; D38-V41 PolarHBondContact O-N 2.99Å; D38-I42 WeakPolarHBondContact O-CB 3.17Å; D38-I42 WeakPolarHBondContact O-CD1 3.16Å; D38-I42 WeakPolarHBondContact O-CG1 3.35Å; D38-I42 PolarHBondContact O-N 3.44Å; D38-K103 IonicContact OD1-NZ 3.79Å; D38-K103 PolarHBondContact OD1-NZ 3.49Å
39V88Confident77.4Confident80 Ų8073.4 Ų73.449%0.48543%0.431SS..Hα-helixtrans-65.3-41.2176.5176.10000110.9S36 T43S36-V39 PolarHBondContact O-N 2.94Å; V39-T43 WeakPolarHBondContact O-CB 3.34Å; V39-T43 PolarHBondContact O-N 3.02Å; V39-T43 PolarHBondContact O-OG1 3.23Å
40Y89.1Confident79.3Confident46 Ų4674.2 Ų74.218%0.1844%0.441CS..Hα-helixtrans-64.1-47.6175.7177.2-114.3000111.3S36 S37 D38 I42 T43 L44 F277 L281S36-Y40 PolarHBondContact O-N 2.85Å; S37-Y40 PolarHBondContact O-N 3.34Å; D38-Y40 PolarHBondContact O-N 3.31Å; Y40-I42 PolarHBondContact O-N 3.48Å; Y40-T43 WeakPolarHBondContact O-CB 3.22Å; Y40-T43 PolarHBondContact O-N 3.08Å; Y40-L44 HydrophobicContact CD1-CD1 3.91Å; Y40-L44 HydrophobicContact CD2-CG 4.5Å; Y40-L44 HydrophobicContact CE1-CD1 3.46Å; Y40-L44 VanDerWaalsContact CE1-CD1 3.46Å; Y40-L44 HydrophobicContact CE1-CG 4.34Å; Y40-L44 HydrophobicContact CE2-CD1 4.14Å; Y40-L44 HydrophobicContact CE2-CD2 4.31Å; Y40-L44 HydrophobicContact CE2-CG 4.16Å; Y40-L44 HydrophobicContact CG-CD1 4.46Å; Y40-L44 WeakPolarHBondContact O-CG 3.26Å; Y40-L44 PolarHBondContact O-N 3.47Å; Y40-F277 HydrophobicContact CD1-CE1 4.06Å; Y40-F277 AromaticContact CD1-CE2 3.95Å; Y40-F277 HydrophobicContact CD1-CE2 3.95Å; Y40-F277 AromaticContact CD1-CZ 3.46Å; Y40-F277 HydrophobicContact CD1-CZ 3.46Å; Y40-F277 VanDerWaalsContact CD1-CZ 3.46Å; Y40-F277 HydrophobicContact CD2-CE1 4.41Å; Y40-F277 HydrophobicContact CD2-CZ 4.43Å; Y40-F277 HydrophobicContact CE1-CD1 4.4Å; Y40-F277 HydrophobicContact CE1-CD2 4.5Å; Y40-F277 AromaticContact CE1-CE1 3.84Å; Y40-F277 HydrophobicContact CE1-CE1 3.84Å; Y40-F277 AromaticContact CE1-CE2 3.96Å; Y40-F277 HydrophobicContact CE1-CE2 3.96Å; Y40-F277 AromaticContact CE1-CZ 3.6Å; Y40-F277 HydrophobicContact CE1-CZ 3.6Å; Y40-F277 HydrophobicContact CE2-CE1 4.25Å; Y40-F277 HydrophobicContact CG-CE1 4.32Å; Y40-F277 AromaticContact CG-CZ 3.89Å; Y40-F277 HydrophobicContact CG-CZ 3.89Å; Y40-F277 AromaticContact CZ-CE1 3.95Å; Y40-F277 PolarHBondContact OH-O 2.89Å; Y40-L281 HydrophobicContact CE2-CB 4.4Å
41V92Very high81.6Confident22 Ų2269 Ų6913%0.13341%0.406CS..Hα-helixtrans-58.2-48.6176168.90000111S37 D38 T43 L44 L45 I100S37-V41 VanDerWaalsContact O-CG2 3.28Å; S37-V41 WeakPolarHBondContact O-CG2 3.36Å; S37-V41 PolarHBondContact O-N 2.85Å; D38-V41 PolarHBondContact O-N 2.99Å; V41-T43 VanDerWaalsContact C-N 3.31Å; V41-T43 PolarHBondContact O-N 3.26Å; V41-L44 PolarHBondContact O-N 3.34Å; V41-L45 HydrophobicContact CG1-CD1 3.97Å; V41-L45 HydrophobicContact CG1-CG 4.37Å; V41-L45 VanDerWaalsContact O-CG 3.29Å; V41-L45 WeakPolarHBondContact O-CG 3.32Å; V41-L45 PolarHBondContact O-N 3.29Å; V41-I100 HydrophobicContact CG1-CG2 4.23Å
42I94.1Very high83.5Confident102 Ų10266.9 Ų66.952%0.52339%0.387SS..Hα-helixtrans-58.9-44.1177.5-69.8163.3000110.6D38 Y40 L44 L45 M46D38-I42 WeakPolarHBondContact O-CB 3.17Å; D38-I42 WeakPolarHBondContact O-CD1 3.16Å; D38-I42 WeakPolarHBondContact O-CG1 3.35Å; D38-I42 PolarHBondContact O-N 3.44Å; Y40-I42 PolarHBondContact O-N 3.48Å; I42-L44 VanDerWaalsContact C-N 3.34Å; I42-L44 PolarHBondContact O-N 2.94Å; I42-L45 PolarHBondContact O-N 2.96Å; I42-M46 HydrophobicContact CG2-CG 4.29Å; I42-M46 WeakPolarHBondContact O-CB 3.29Å; I42-M46 VanDerWaalsContact O-CG 3.24Å; I42-M46 WeakPolarHBondContact O-CG 3.4Å; I42-M46 PolarHBondContact O-N 3.4Å
43T94.5Very high85.8Confident81 Ų8169.3 Ų69.350%0.49738%0.384SS..Hα-helixtrans-60.7-43.7178.6-580000111.6V39 Y40 V41 M46 L47V39-T43 WeakPolarHBondContact O-CB 3.34Å; V39-T43 PolarHBondContact O-N 3.02Å; V39-T43 PolarHBondContact O-OG1 3.23Å; Y40-T43 WeakPolarHBondContact O-CB 3.22Å; Y40-T43 PolarHBondContact O-N 3.08Å; V41-T43 VanDerWaalsContact C-N 3.31Å; V41-T43 PolarHBondContact O-N 3.26Å; T43-M46 PolarHBondContact O-N 2.78Å; T43-L47 WeakPolarHBondContact O-CB 3.28Å; T43-L47 PolarHBondContact O-N 3.41Å
44L95.6Very high87.9Confident2 Ų265.6 Ų65.61%0.0137%0.366CS..Hα-helixtrans-63.3-44.7175.8-71.2174.5000112.2Y40 V41 I42 M46 L47 Y48 I100 P280 L281Y40-L44 HydrophobicContact CD1-CD1 3.91Å; Y40-L44 HydrophobicContact CD2-CG 4.5Å; Y40-L44 HydrophobicContact CE1-CD1 3.46Å; Y40-L44 VanDerWaalsContact CE1-CD1 3.46Å; Y40-L44 HydrophobicContact CE1-CG 4.34Å; Y40-L44 HydrophobicContact CE2-CD1 4.14Å; Y40-L44 HydrophobicContact CE2-CD2 4.31Å; Y40-L44 HydrophobicContact CE2-CG 4.16Å; Y40-L44 HydrophobicContact CG-CD1 4.46Å; Y40-L44 WeakPolarHBondContact O-CG 3.26Å; Y40-L44 PolarHBondContact O-N 3.47Å; V41-L44 PolarHBondContact O-N 3.34Å; I42-L44 VanDerWaalsContact C-N 3.34Å; I42-L44 PolarHBondContact O-N 2.94Å; L44-M46 VanDerWaalsContact C-N 3.32Å; L44-M46 PolarHBondContact O-N 2.95Å; L44-L47 WeakPolarHBondContact O-CB 3.03Å; L44-L47 PolarHBondContact O-N 2.98Å; L44-Y48 WeakPolarHBondContact O-CD1 3.03Å; L44-Y48 PolarHBondContact O-N 2.72Å; L44-I100 HydrophobicContact CB-CG2 3.96Å; L44-I100 HydrophobicContact CD1-CG2 3.91Å; L44-P280 HydrophobicContact CD1-CB 3.81Å; L44-P280 HydrophobicContact CD2-CB 4.33Å; L44-L281 VanDerWaalsContact CD2-CA 3.46Å; L44-L281 HydrophobicContact CD2-CB 3.83Å; L44-L281 HydrophobicContact CD2-CD1 4.06Å
45L97Very high89.7Confident51 Ų5162.5 Ų62.527%0.26735%0.345SS..Hα-helixtrans-62.1-42.1178.1-67.7175.7000111.2V41 I42 Y48 A49 A97 I100 A101V41-L45 HydrophobicContact CG1-CD1 3.97Å; V41-L45 HydrophobicContact CG1-CG 4.37Å; V41-L45 VanDerWaalsContact O-CG 3.29Å; V41-L45 WeakPolarHBondContact O-CG 3.32Å; V41-L45 PolarHBondContact O-N 3.29Å; I42-L45 PolarHBondContact O-N 2.96Å; L45-Y48 PolarHBondContact O-N 2.84Å; L45-A49 WeakPolarHBondContact O-CB 3.41Å; L45-A49 PolarHBondContact O-N 2.88Å; L45-A97 HydrophobicContact CD2-CB 3.87Å; L45-A97 WeakPolarHBondContact CD2-O 3.31Å; L45-I100 HydrophobicContact CD2-CB 4.27Å; L45-I100 HydrophobicContact CD2-CG2 4.17Å; L45-I100 HydrophobicContact CG-CG2 4.38Å; L45-A101 HydrophobicContact CD1-CB 4.06Å; L45-A101 HydrophobicContact CD2-CB 4.1Å
46M97Very high91.8Very high131 Ų13155.4 Ų55.465%0.64532%0.317SS*.Hα-helixtrans-63.3-41.8175-69.8-63-72.800111.8I42 T43 L44 A49 A50I42-M46 HydrophobicContact CG2-CG 4.29Å; I42-M46 WeakPolarHBondContact O-CB 3.29Å; I42-M46 VanDerWaalsContact O-CG 3.24Å; I42-M46 WeakPolarHBondContact O-CG 3.4Å; I42-M46 PolarHBondContact O-N 3.4Å; T43-M46 PolarHBondContact O-N 2.78Å; L44-M46 VanDerWaalsContact C-N 3.32Å; L44-M46 PolarHBondContact O-N 2.95Å; M46-A49 PolarHBondContact O-N 3.47Å; M46-A50 VanDerWaalsContact O-CB 3.3Å; M46-A50 WeakPolarHBondContact O-CB 3.39Å; M46-A50 PolarHBondContact O-N 2.9Å
47L96.3Very high93.4Very high52 Ų5256.2 Ų56.227%0.27232%0.321SS..Hα-helixtrans-59.3-51.4174.4174.264.7000111.1T43 L44 A49 A50 I51 L281T43-L47 WeakPolarHBondContact O-CB 3.28Å; T43-L47 PolarHBondContact O-N 3.41Å; L44-L47 WeakPolarHBondContact O-CB 3.03Å; L44-L47 PolarHBondContact O-N 2.98Å; L47-A49 VanDerWaalsContact C-N 3.34Å; L47-A49 PolarHBondContact O-N 3.26Å; L47-A50 PolarHBondContact O-N 3.36Å; L47-I51 HydrophobicContact CD1-CD1 3.83Å; L47-I51 HydrophobicContact CD1-CG1 4.25Å; L47-I51 HydrophobicContact CG-CD1 3.87Å; L47-I51 WeakPolarHBondContact O-CD1 3.37Å; L47-I51 VanDerWaalsContact O-CG1 3.22Å; L47-I51 WeakPolarHBondContact O-CG1 3.46Å; L47-I51 PolarHBondContact O-N 3.47Å; L47-L281 HydrophobicContact CD2-CD1 4.13Å
48Y97.3Very high94.3Very high8 Ų853.6 Ų53.63%0.03131%0.305CS..Hα-helixtrans-64.7-40.5-177.9-8147000111.2L44 L45 I51 F52 L93 L96 A97 I100 P280 G284L44-Y48 WeakPolarHBondContact O-CD1 3.03Å; L44-Y48 PolarHBondContact O-N 2.72Å; L45-Y48 PolarHBondContact O-N 2.84Å; Y48-I51 PolarHBondContact O-N 3.41Å; Y48-F52 WeakPolarHBondContact O-CB 3.1Å; Y48-F52 PolarHBondContact O-N 3.31Å; Y48-L93 HydrophobicContact CD2-CB 4.5Å; Y48-L93 HydrophobicContact CD2-CD2 3.63Å; Y48-L93 HydrophobicContact CE2-CD2 4.03Å; Y48-L93 HydrophobicContact CG-CD2 3.96Å; Y48-L96 HydrophobicContact CD2-CB 4.21Å; Y48-L96 HydrophobicContact CE2-CB 3.73Å; Y48-A97 HydrophobicContact CD2-CB 4.23Å; Y48-I100 HydrophobicContact CD2-CD1 4.22Å; Y48-I100 HydrophobicContact CE1-CD1 4.12Å; Y48-I100 HydrophobicContact CE2-CD1 3.69Å; Y48-P280 PolarHBondContact OH-O 3.2Å; Y48-G284 VanDerWaalsContact CE1-CA 3.48Å
49A97.7Very high94.8Very high42 Ų4250.1 Ų50.135%0.34729%0.286SS..Hα-helixtrans-62.9-44.8174.600000111.8L45 M46 L47 I51 F52 L53L45-A49 WeakPolarHBondContact O-CB 3.41Å; L45-A49 PolarHBondContact O-N 2.88Å; M46-A49 PolarHBondContact O-N 3.47Å; L47-A49 VanDerWaalsContact C-N 3.34Å; L47-A49 PolarHBondContact O-N 3.26Å; A49-I51 PolarHBondContact O-N 3Å; A49-F52 PolarHBondContact O-N 3.41Å; A49-L53 WeakPolarHBondContact O-CB 3.49Å; A49-L53 VanDerWaalsContact O-CG 3.24Å; A49-L53 WeakPolarHBondContact O-CG 3.02Å; A49-L53 PolarHBondContact O-N 3.13Å
50A96.6Very high95.1Very high51 Ų5148.5 Ų48.542%0.42128%0.281SS..Hα-helixtrans-61.5-45.4177.500000111.7M46 L47 F52 L53 V54M46-A50 VanDerWaalsContact O-CB 3.3Å; M46-A50 WeakPolarHBondContact O-CB 3.39Å; M46-A50 PolarHBondContact O-N 2.9Å; L47-A50 PolarHBondContact O-N 3.36Å; A50-F52 VanDerWaalsContact C-N 3.32Å; A50-F52 PolarHBondContact O-N 3.28Å; A50-L53 PolarHBondContact O-N 2.83Å; A50-V54 WeakPolarHBondContact O-CB 3.33Å; A50-V54 WeakPolarHBondContact O-CG2 3.38Å; A50-V54 PolarHBondContact O-N 2.77Å
51I96.3Very high95.2Very high8 Ų849.6 Ų49.64%0.04129%0.288CS..Hα-helixtrans-63-40.7177.3-59.2161000110.4L47 Y48 A49 G55 L93 G284 A288 A291L47-I51 HydrophobicContact CD1-CD1 3.83Å; L47-I51 HydrophobicContact CD1-CG1 4.25Å; L47-I51 HydrophobicContact CG-CD1 3.87Å; L47-I51 WeakPolarHBondContact O-CD1 3.37Å; L47-I51 VanDerWaalsContact O-CG1 3.22Å; L47-I51 WeakPolarHBondContact O-CG1 3.46Å; L47-I51 PolarHBondContact O-N 3.47Å; Y48-I51 PolarHBondContact O-N 3.41Å; A49-I51 PolarHBondContact O-N 3Å; I51-G55 VanDerWaalsContact O-CA 3.25Å; I51-G55 WeakPolarHBondContact O-CA 3.32Å; I51-G55 PolarHBondContact O-N 3.14Å; I51-L93 HydrophobicContact CB-CD1 3.65Å; I51-L93 HydrophobicContact CG2-CD1 3.35Å; I51-G284 VanDerWaalsContact CD1-O 3.27Å; I51-G284 WeakPolarHBondContact CD1-O 3.48Å; I51-A288 HydrophobicContact CD1-CB 3.72Å; I51-A288 HydrophobicContact CG1-CB 3.97Å; I51-A291 HydrophobicContact CB-CB 4.45Å; I51-A291 HydrophobicContact CG2-CB 3.81Å
52F97.3Very high95Very high68 Ų6849.1 Ų49.130%0.29829%0.285SS..Hα-helixtrans-63.6-51.8176172.7-99.3000112.2Y48 A49 A50 V54 G55 V56 C90 L93 P94Y48-F52 WeakPolarHBondContact O-CB 3.1Å; Y48-F52 PolarHBondContact O-N 3.31Å; A49-F52 PolarHBondContact O-N 3.41Å; A50-F52 VanDerWaalsContact C-N 3.32Å; A50-F52 PolarHBondContact O-N 3.28Å; F52-V54 VanDerWaalsContact C-N 3.29Å; F52-V54 PolarHBondContact O-N 2.84Å; F52-G55 PolarHBondContact O-N 3.46Å; F52-V56 HydrophobicContact CD2-CG2 3.57Å; F52-V56 HydrophobicContact CE2-CG2 3.55Å; F52-V56 HydrophobicContact CG-CG2 4.34Å; F52-V56 HydrophobicContact CZ-CG2 4.3Å; F52-V56 WeakPolarHBondContact O-CB 3.43Å; F52-V56 WeakPolarHBondContact O-CG2 3.1Å; F52-V56 PolarHBondContact O-N 3.48Å; F52-C90 WeakPolarHBondContact CD2-O 3.44Å; F52-L93 HydrophobicContact CB-CB 4.4Å; F52-L93 HydrophobicContact CB-CD1 4.28Å; F52-P94 HydrophobicContact CD2-CG 3.54Å; F52-P94 HydrophobicContact CE2-CG 3.59Å; F52-P94 HydrophobicContact CG-CG 4.07Å; F52-P94 HydrophobicContact CZ-CG 4.17Å
53L96.3Very high94.8Very high119 Ų11944.9 Ų44.962%0.62327%0.266SS*.Hα-helixtrans-66-29.5-176-71.2174000113A49 A50 P57A49-L53 WeakPolarHBondContact O-CB 3.49Å; A49-L53 VanDerWaalsContact O-CG 3.24Å; A49-L53 WeakPolarHBondContact O-CG 3.02Å; A49-L53 PolarHBondContact O-N 3.13Å; A50-L53 PolarHBondContact O-N 2.83Å; L53-P57 WeakPolarHBondContact O-CD 3.24Å; L53-P57 WeakPolarHBondContact O-CG 3.46Å
54V94.7Very high94.5Very high66 Ų6648.6 Ų48.640%0.427%0.271SS..Hα-helixtrans-86.8-46.8174.1175.80000110.8A50 F52 G58 A291 I295A50-V54 WeakPolarHBondContact O-CB 3.33Å; A50-V54 WeakPolarHBondContact O-CG2 3.38Å; A50-V54 PolarHBondContact O-N 2.77Å; F52-V54 VanDerWaalsContact C-N 3.29Å; F52-V54 PolarHBondContact O-N 2.84Å; V54-G58 WeakPolarHBondContact O-CA 3.48Å; V54-G58 PolarHBondContact O-N 2.91Å; V54-A291 HydrophobicContact CB-CB 4.27Å; V54-A291 HydrophobicContact CG1-CB 4.15Å; V54-I295 HydrophobicContact CG1-CD1 4.15Å; V54-I295 HydrophobicContact CG1-CG1 4.36Å
55G95.1Very high94Very high0 Ų049.7 Ų49.70%028%0.278CS..Hα-helixtrans-71.3-41.5-169.500000113.8I51 F52 N59I51-G55 VanDerWaalsContact O-CA 3.25Å; I51-G55 WeakPolarHBondContact O-CA 3.32Å; I51-G55 PolarHBondContact O-N 3.14Å; F52-G55 PolarHBondContact O-N 3.46Å; G55-N59 VanDerWaalsContact O-CB 3.27Å; G55-N59 WeakPolarHBondContact O-CB 3.18Å; G55-N59 PolarHBondContact O-N 2.95Å; G55-N59 PolarHBondContact O-ND2 2.91Å
56V96.6Very high93.3Very high37 Ų3748 Ų4822%0.22427%0.269CS..Hα-helixtrans-64.1-59.1179.1175.30000112F52 G58 A60 L87 C90 V91F52-V56 HydrophobicContact CD2-CG2 3.57Å; F52-V56 HydrophobicContact CE2-CG2 3.55Å; F52-V56 HydrophobicContact CG-CG2 4.34Å; F52-V56 HydrophobicContact CZ-CG2 4.3Å; F52-V56 WeakPolarHBondContact O-CB 3.43Å; F52-V56 WeakPolarHBondContact O-CG2 3.1Å; F52-V56 PolarHBondContact O-N 3.48Å; V56-G58 VanDerWaalsContact C-N 3.31Å; V56-G58 PolarHBondContact O-N 3.38Å; V56-A60 WeakPolarHBondContact O-CB 3.41Å; V56-A60 PolarHBondContact O-N 2.84Å; V56-L87 HydrophobicContact CG1-CD2 4.42Å; V56-L87 WeakPolarHBondContact O-CD2 3.42Å; V56-C90 HydrophobicContact CG2-CB 3.64Å; V56-V91 HydrophobicContact CG2-CG2 4.25Å
57P95Very high92.9Very high75 Ų7548.1 Ų48.149%0.48726%0.263SS..Hα-helixtrans-65.6-36.7-179.625.2-33.1000112L53 A60 M61L53-P57 WeakPolarHBondContact O-CD 3.24Å; L53-P57 WeakPolarHBondContact O-CG 3.46Å; P57-A60 PolarHBondContact O-N 3.12Å; P57-M61 WeakPolarHBondContact O-CB 3.31Å; P57-M61 PolarHBondContact O-N 2.95Å
58G91.4Very high92.2Very high11 Ų1150.1 Ų50.111%0.11327%0.269CS..Hα-helixtrans-60.4-52.7177.600000112.4V54 V56 M61 V62 P294V54-G58 WeakPolarHBondContact O-CA 3.48Å; V54-G58 PolarHBondContact O-N 2.91Å; V56-G58 VanDerWaalsContact C-N 3.31Å; V56-G58 PolarHBondContact O-N 3.38Å; G58-M61 PolarHBondContact O-N 3.45Å; G58-V62 WeakPolarHBondContact O-CG2 3.34Å; G58-V62 PolarHBondContact O-N 3.26Å; G58-P294 VanDerWaalsContact C-CG 3.46Å
59N93.5Very high91.3Very high1 Ų151.9 Ų51.91%0.00528%0.278CS..Hα-helixtrans-73.4-30.4179.8-70.3-66.3000112.6G55 M61 V62 A63 A83 D86 L87 S290 P294G55-N59 VanDerWaalsContact O-CB 3.27Å; G55-N59 WeakPolarHBondContact O-CB 3.18Å; G55-N59 PolarHBondContact O-N 2.95Å; G55-N59 PolarHBondContact O-ND2 2.91Å; N59-M61 VanDerWaalsContact C-N 3.35Å; N59-V62 PolarHBondContact O-N 3.5Å; N59-A63 VanDerWaalsContact O-CB 3.27Å; N59-A63 WeakPolarHBondContact O-CB 2.93Å; N59-A63 PolarHBondContact O-N 3.48Å; N59-A83 HydrophobicContact CB-CB 4.39Å; N59-D86 HydrophobicContact CB-CB 4.42Å; N59-L87 HydrophobicContact CB-CD2 3.89Å; N59-L87 HydrophobicContact CB-CG 3.73Å; N59-S290 PolarHBondContact ND2-O 2.92Å; N59-P294 HydrophobicContact CB-CG 4.37Å; N59-P294 VanDerWaalsContact CG-CG 3.49Å; N59-P294 VanDerWaalsContact OD1-CG 3.31Å; N59-P294 WeakPolarHBondContact OD1-CG 3.43Å
60A94.1Very high90.5Very high46 Ų4651.4 Ų51.438%0.3827%0.272SS..Hα-helixtrans-61.7-43.8171.600000111.5V56 P57 A63 W64 L87V56-A60 WeakPolarHBondContact O-CB 3.41Å; V56-A60 PolarHBondContact O-N 2.84Å; P57-A60 PolarHBondContact O-N 3.12Å; A60-A63 PolarHBondContact O-N 3.32Å; A60-W64 WeakPolarHBondContact O-CB 3.48Å; A60-W64 PolarHBondContact O-N 2.85Å; A60-L87 HydrophobicContact CB-CD2 4.37Å
61M90Very high89.6Confident68 Ų6857.6 Ų57.634%0.33528%0.284SS..Hα-helixtrans-62.9-46174.2-179.9-179.165.200111.6P57 G58 N59 A63 W64 V65 L298P57-M61 WeakPolarHBondContact O-CB 3.31Å; P57-M61 PolarHBondContact O-N 2.95Å; G58-M61 PolarHBondContact O-N 3.45Å; N59-M61 VanDerWaalsContact C-N 3.35Å; M61-A63 VanDerWaalsContact C-N 3.34Å; M61-A63 PolarHBondContact O-N 3.14Å; M61-W64 PolarHBondContact O-N 3.04Å; M61-V65 WeakPolarHBondContact O-CG2 3.34Å; M61-V65 PolarHBondContact O-N 3.35Å; M61-L298 HydrophobicContact CE-CD1 4.2Å; M61-L298 HydrophobicContact CE-CD2 3.95Å; M61-L298 HydrophobicContact CE-CG 4.31Å
62V88Confident88.5Confident12 Ų1264.7 Ų64.77%0.07332%0.317CS..Hα-helixtrans-59.6-46.8176.6173.40000110.3G58 N59 W64 V65 T66 A83 P294 F297G58-V62 WeakPolarHBondContact O-CG2 3.34Å; G58-V62 PolarHBondContact O-N 3.26Å; N59-V62 PolarHBondContact O-N 3.5Å; V62-W64 VanDerWaalsContact C-N 3.34Å; V62-W64 PolarHBondContact O-N 3.41Å; V62-V65 PolarHBondContact O-N 3.26Å; V62-T66 HydrophobicContact CG1-CG2 4.05Å; V62-T66 VanDerWaalsContact O-CB 3.28Å; V62-T66 WeakPolarHBondContact O-CB 2.98Å; V62-T66 VanDerWaalsContact O-CG2 3.22Å; V62-T66 WeakPolarHBondContact O-CG2 3.48Å; V62-T66 PolarHBondContact O-N 3Å; V62-T66 PolarHBondContact O-OG1 2.9Å; V62-A83 HydrophobicContact CB-CB 4.16Å; V62-A83 HydrophobicContact CG1-CB 3.86Å; V62-P294 HydrophobicContact CG2-CB 4.26Å; V62-P294 HydrophobicContact CG2-CG 4.46Å; V62-F297 HydrophobicContact CG1-CD2 4.26Å; V62-F297 HydrophobicContact CG1-CE2 4.4Å; V62-F297 HydrophobicContact CG2-CD2 3.99Å
63A90.4Very high87.5Confident14 Ų1467.5 Ų67.512%0.11633%0.326CS..Hα-helixtrans-59.7-43.7177.100000111.5N59 A60 M61 T66 W67 L80 A83 L87N59-A63 VanDerWaalsContact O-CB 3.27Å; N59-A63 WeakPolarHBondContact O-CB 2.93Å; N59-A63 PolarHBondContact O-N 3.48Å; A60-A63 PolarHBondContact O-N 3.32Å; M61-A63 VanDerWaalsContact C-N 3.34Å; M61-A63 PolarHBondContact O-N 3.14Å; A63-T66 PolarHBondContact O-OG1 3.49Å; A63-W67 WeakPolarHBondContact O-CB 3.18Å; A63-W67 PolarHBondContact O-N 2.8Å; A63-L80 HydrophobicContact CB-CD1 4.14Å; A63-L80 WeakPolarHBondContact O-CD1 3.27Å; A63-A83 HydrophobicContact CB-CB 4Å; A63-L87 HydrophobicContact CB-CD1 4.42Å
64W88.4Confident86.6Confident159 Ų15964.5 Ų64.560%0.60231%0.31SS*.Hα-helixtrans-62.5-48.2178.6178.3-107.4000112.9A60 M61 V62 K68A60-W64 WeakPolarHBondContact O-CB 3.48Å; A60-W64 PolarHBondContact O-N 2.85Å; M61-W64 PolarHBondContact O-N 3.04Å; V62-W64 VanDerWaalsContact C-N 3.34Å; V62-W64 PolarHBondContact O-N 3.41Å; W64-K68 VanDerWaalsContact CZ2-CE 3.44Å; W64-K68 PolarHBondContact O-N 3.34Å
65V84.6Confident85.7Confident24 Ų2462.7 Ų62.715%0.14531%0.305CS..Hα-helixtrans-66.8-46.3-180174.90000110.8M61 V62 W67 K68 E69 L305M61-V65 WeakPolarHBondContact O-CG2 3.34Å; M61-V65 PolarHBondContact O-N 3.35Å; V62-V65 PolarHBondContact O-N 3.26Å; V65-W67 VanDerWaalsContact C-N 3.34Å; V65-W67 PolarHBondContact O-N 3.02Å; V65-K68 PolarHBondContact O-N 3.44Å; V65-E69 WeakPolarHBondContact O-CB 3.46Å; V65-E69 PolarHBondContact O-N 2.88Å; V65-L305 HydrophobicContact CG1-CD1 3.89Å
66T83.8Confident85Confident15 Ų1563.2 Ų63.29%0.09231%0.309CS..Hα-helixtrans-71.2-29.3-178.256.90000112.4V62 A63 E69 S70 F79 L80V62-T66 HydrophobicContact CG1-CG2 4.05Å; V62-T66 VanDerWaalsContact O-CB 3.28Å; V62-T66 WeakPolarHBondContact O-CB 2.98Å; V62-T66 VanDerWaalsContact O-CG2 3.22Å; V62-T66 WeakPolarHBondContact O-CG2 3.48Å; V62-T66 PolarHBondContact O-N 3Å; V62-T66 PolarHBondContact O-OG1 2.9Å; A63-T66 PolarHBondContact O-OG1 3.49Å; T66-E69 PolarHBondContact O-N 3.12Å; T66-S70 WeakPolarHBondContact O-CA 3.28Å; T66-S70 WeakPolarHBondContact O-CB 3.22Å; T66-S70 PolarHBondContact O-N 3.28Å; T66-S70 PolarHBondContact O-OG 2.91Å; T66-S70 VanDerWaalsContact O-OG 3.13Å; T66-F79 HydrophobicContact CG2-CB 3.62Å; T66-L80 WeakPolarHBondContact OG1-CA 3.3Å; T66-L80 WeakPolarHBondContact OG1-CB 3.49Å; T66-L80 PolarHBondContact OG1-N 2.98Å
67W87.3Confident84.5Confident135 Ų13562.5 Ų62.551%0.51131%0.306SS..Hα-helixtrans-57.3-51.2169.9176.5-104.4000111.3A63 V65 S70 L80A63-W67 WeakPolarHBondContact O-CB 3.18Å; A63-W67 PolarHBondContact O-N 2.8Å; V65-W67 VanDerWaalsContact C-N 3.34Å; V65-W67 PolarHBondContact O-N 3.02Å; W67-S70 PolarHBondContact O-OG 3.42Å; W67-L80 HydrophobicContact CB-CD1 4.18Å; W67-L80 HydrophobicContact CE3-CD1 4.3Å; W67-L80 HydrophobicContact CE3-CD2 3.6Å; W67-L80 HydrophobicContact CZ3-CD2 4.14Å
68K82.3Confident84.1Confident93 Ų9359.2 Ų59.240%0.40428%0.284SS..Hα-helixtrans-63.2-46.4177.4-66.6-175.7179.4-172.60111.5W64 V65 S70 R71W64-K68 VanDerWaalsContact CZ2-CE 3.44Å; W64-K68 PolarHBondContact O-N 3.34Å; V65-K68 PolarHBondContact O-N 3.44Å; K68-S70 PolarHBondContact O-N 3.38Å; K68-R71 WeakPolarHBondContact O-CB 3.49Å; K68-R71 PolarHBondContact O-N 2.63Å
69E77.7Confident83.8Confident45 Ų4561.6 Ų61.621%0.2129%0.291CS..Hα-helixtrans-68.3-33.5-176.8-170.967-163.300113V65 T66 R71 H72 R73 A76V65-E69 WeakPolarHBondContact O-CB 3.46Å; V65-E69 PolarHBondContact O-N 2.88Å; T66-E69 PolarHBondContact O-N 3.12Å; E69-R71 PolarHBondContact O-N 3.5Å; E69-R71 VanDerWaalsContact O-N 3.14Å; E69-H72 PolarHBondContact O-N 3.3Å; E69-R73 HydrophobicContact CG-CB 4.35Å; E69-R73 PolarHBondContact O-N 3.11Å; E69-R73 WeakPolarHBondContact OE1-CD 3.44Å; E69-R73 WeakPolarHBondContact OE1-CG 3.35Å; E69-R73 IonicContact OE1-CZ 3.15Å; E69-R73 IonicContact OE1-NE 3.2Å; E69-R73 PolarHBondContact OE1-NE 3.29Å; E69-R73 IonicContact OE1-NH1 2.72Å; E69-R73 PolarHBondContact OE1-NH1 3.04Å; E69-A76 HydrophobicContact CB-CB 3.8Å; E69-A76 HydrophobicContact CG-CB 3.66Å
70S80.3Confident83.6Confident33 Ų3362.6 Ų62.623%0.23130%0.296CS..Hα-helixtrans-64.5-18.6-178.3670000113.9T66 W67 K68 H72T66-S70 WeakPolarHBondContact O-CA 3.28Å; T66-S70 WeakPolarHBondContact O-CB 3.22Å; T66-S70 PolarHBondContact O-N 3.28Å; T66-S70 PolarHBondContact O-OG 2.91Å; T66-S70 VanDerWaalsContact O-OG 3.13Å; W67-S70 PolarHBondContact O-OG 3.42Å; K68-S70 PolarHBondContact O-N 3.38Å; S70-H72 PolarHBondContact O-N 3.34Å
71R79.3Confident83.6Confident180 Ų18062.9 Ų62.968%0.67929%0.289SS*.THydrogen-bonded Turntrans-64.3-27.1170.3-62.6-178.6179.3-165.8-3.2112.3K68 E69K68-R71 WeakPolarHBondContact O-CB 3.49Å; K68-R71 PolarHBondContact O-N 2.63Å; E69-R71 PolarHBondContact O-N 3.5Å; E69-R71 VanDerWaalsContact O-N 3.14Å
72H73Confident83.6Confident158 Ų15859.9 Ų59.973%0.73128%0.275SS*.THydrogen-bonded Turntrans-114.2-33.6-175.2-58.5-71.6000113.1E69 S70E69-H72 PolarHBondContact O-N 3.3Å; S70-H72 PolarHBondContact O-N 3.34Å
73R74.9Confident83.8Confident126 Ų12659.4 Ų59.448%0.47527%0.272SS..  trans-123.3115-178.2-61.6-165.8-178.3137.8-7.1111.6E69 G75 A76E69-R73 HydrophobicContact CG-CB 4.35Å; E69-R73 PolarHBondContact O-N 3.11Å; E69-R73 WeakPolarHBondContact OE1-CD 3.44Å; E69-R73 WeakPolarHBondContact OE1-CG 3.35Å; E69-R73 IonicContact OE1-CZ 3.15Å; E69-R73 IonicContact OE1-NE 3.2Å; E69-R73 PolarHBondContact OE1-NE 3.29Å; E69-R73 IonicContact OE1-NH1 2.72Å; E69-R73 PolarHBondContact OE1-NH1 3.04Å; R73-G75 PolarHBondContact O-N 3.35Å; R73-G75 VanDerWaalsContact O-N 3.14Å; R73-A76 WeakPolarHBondContact O-CB 3.22Å; R73-A76 PolarHBondContact O-N 2.81Å
74L78.4Confident84Confident57 Ų5761.6 Ų61.630%0.29828%0.284SS..Hα-helixtrans-53.9-37.3178.9-84.568.7000113.2A76 S77 K154L74-A76 PolarHBondContact O-N 3.48Å; L74-S77 VanDerWaalsContact O-CB 3.24Å; L74-S77 WeakPolarHBondContact O-CB 3.24Å; L74-S77 PolarHBondContact O-N 2.88Å; L74-S77 VanDerWaalsContact O-N 3.11Å; L74-K154 HydrophobicContact CD2-CB 3.73Å; L74-K154 HydrophobicContact CD2-CG 3.96Å; L74-K154 HydrophobicContact CG-CG 4.39Å
75G75.1Confident84.4Confident28 Ų2854 Ų5429%0.28926%0.255SS..Hα-helixtrans-62.9-28.3-179.400000114R73 S77 W78R73-G75 PolarHBondContact O-N 3.35Å; R73-G75 VanDerWaalsContact O-N 3.14Å; G75-S77 PolarHBondContact O-N 2.99Å; G75-W78 PolarHBondContact O-N 3.14Å
76A80.8Confident84.8Confident10 Ų1052.9 Ų52.98%0.08325%0.249CC..Hα-helixtrans-67.6-23.9176.700000112.6E69 R73 L74 W78 F79 L80E69-A76 HydrophobicContact CB-CB 3.8Å; E69-A76 HydrophobicContact CG-CB 3.66Å; R73-A76 WeakPolarHBondContact O-CB 3.22Å; R73-A76 PolarHBondContact O-N 2.81Å; L74-A76 PolarHBondContact O-N 3.48Å; A76-W78 VanDerWaalsContact C-N 3.3Å; A76-W78 PolarHBondContact O-N 3.22Å; A76-F79 PolarHBondContact O-N 3.27Å; A76-L80 PolarHBondContact O-N 3.17Å; A76-L80 VanDerWaalsContact O-N 3.12Å
77S85.8Confident85.4Confident23 Ų2354.1 Ų54.116%0.16125%0.254CS..Hα-helixtrans-62.5-35176.7-170.90000112.4L74 G75 F79 L80 H81 Q161L74-S77 VanDerWaalsContact O-CB 3.24Å; L74-S77 WeakPolarHBondContact O-CB 3.24Å; L74-S77 PolarHBondContact O-N 2.88Å; L74-S77 VanDerWaalsContact O-N 3.11Å; G75-S77 PolarHBondContact O-N 2.99Å; S77-F79 VanDerWaalsContact C-N 3.35Å; S77-F79 PolarHBondContact O-N 3.42Å; S77-L80 WeakPolarHBondContact O-CB 3.43Å; S77-L80 PolarHBondContact O-N 3.11Å; S77-H81 PolarHBondContact O-CD2 3.47Å; S77-H81 PolarHBondContact O-N 3.41Å; S77-H81 VanDerWaalsContact O-N 3.1Å; S77-Q161 PolarHBondContact O-NE2 3.49Å; S77-Q161 PolarHBondContact OG-NE2 2.86Å; S77-Q161 PolarHBondContact OG-OE1 3.44Å
78W86.3Confident85.7Confident5 Ų550.9 Ų50.92%0.01925%0.246CC..Hα-helixtrans-60.8-44.7176.5-71.7119000112.2G75 A76 L80 H81 L82 L130 A133 L134 D137 V157 Q161G75-W78 PolarHBondContact O-N 3.14Å; A76-W78 VanDerWaalsContact C-N 3.3Å; A76-W78 PolarHBondContact O-N 3.22Å; W78-L80 VanDerWaalsContact C-N 3.33Å; W78-H81 PolarHBondContact O-N 2.98Å; W78-L82 WeakPolarHBondContact O-CB 3.43Å; W78-L82 PolarHBondContact O-N 2.92Å; W78-L130 HydrophobicContact CE3-CD2 4.32Å; W78-L130 HydrophobicContact CZ3-CD2 4.12Å; W78-A133 HydrophobicContact CH2-CB 3.53Å; W78-A133 HydrophobicContact CZ2-CB 4.46Å; W78-A133 HydrophobicContact CZ3-CB 3.67Å; W78-L134 HydrophobicContact CB-CD1 3.95Å; W78-L134 HydrophobicContact CD2-CB 4.32Å; W78-L134 HydrophobicContact CD2-CD1 4.46Å; W78-L134 HydrophobicContact CG-CB 4.37Å; W78-L134 HydrophobicContact CG-CD1 3.78Å; W78-D137 HydrophobicContact CZ2-CB 4.37Å; W78-D137 PolarHBondContact NE1-OD2 2.99Å; W78-V157 HydrophobicContact CZ2-CB 4.22Å; W78-V157 HydrophobicContact CZ2-CG1 3.8Å; W78-V157 HydrophobicContact CZ2-CG2 4.1Å; W78-Q161 HydrophobicContact CE3-CG 3.89Å; W78-Q161 HydrophobicContact CH2-CG 3.88Å; W78-Q161 HydrophobicContact CZ3-CG 3.51Å
79F85.9Confident86.3Confident62 Ų6246.5 Ų46.527%0.27223%0.228SC..Hα-helixtrans-69.3-32.3179.1-59.7-55.3000112.5T66 A76 S77 L82 A83 L134 F297T66-F79 HydrophobicContact CG2-CB 3.62Å; A76-F79 PolarHBondContact O-N 3.27Å; S77-F79 VanDerWaalsContact C-N 3.35Å; S77-F79 PolarHBondContact O-N 3.42Å; F79-L82 PolarHBondContact O-N 3.19Å; F79-A83 VanDerWaalsContact O-CB 3.25Å; F79-A83 WeakPolarHBondContact O-CB 3.25Å; F79-A83 PolarHBondContact O-N 3.41Å; F79-L134 HydrophobicContact CE1-CD2 4.07Å; F79-F297 AromaticContact CD1-CE1 3.34Å; F79-F297 HydrophobicContact CD1-CE1 3.34Å; F79-F297 HydrophobicContact CD1-CE2 4.32Å; F79-F297 AromaticContact CD1-CZ 3.19Å; F79-F297 HydrophobicContact CD1-CZ 3.19Å; F79-F297 AromaticContact CE1-CE1 3.31Å; F79-F297 HydrophobicContact CE1-CE1 3.31Å; F79-F297 AromaticContact CE1-CZ 3.51Å; F79-F297 HydrophobicContact CE1-CZ 3.51Å; F79-F297 HydrophobicContact CG-CE1 4Å; F79-F297 HydrophobicContact CG-CZ 4.05Å; F79-F297 AromaticContact CZ-CE1 3.97Å; F79-F297 HydrophobicContact CZ-CE1 3.97Å
80L89.4Confident87.1Confident21 Ų2144.4 Ų44.411%0.1122%0.218CC..Hα-helixtrans-61.3-52.6172174.666.6000111.3A63 T66 W67 A76 S77 W78 L82 A83 V84A63-L80 HydrophobicContact CB-CD1 4.14Å; A63-L80 WeakPolarHBondContact O-CD1 3.27Å; T66-L80 WeakPolarHBondContact OG1-CA 3.3Å; T66-L80 WeakPolarHBondContact OG1-CB 3.49Å; T66-L80 PolarHBondContact OG1-N 2.98Å; W67-L80 HydrophobicContact CB-CD1 4.18Å; W67-L80 HydrophobicContact CE3-CD1 4.3Å; W67-L80 HydrophobicContact CE3-CD2 3.6Å; W67-L80 HydrophobicContact CZ3-CD2 4.14Å; A76-L80 PolarHBondContact O-N 3.17Å; A76-L80 VanDerWaalsContact O-N 3.12Å; S77-L80 WeakPolarHBondContact O-CB 3.43Å; S77-L80 PolarHBondContact O-N 3.11Å; W78-L80 VanDerWaalsContact C-N 3.33Å; L80-L82 VanDerWaalsContact C-N 3.3Å; L80-L82 PolarHBondContact O-N 3.33Å; L80-A83 PolarHBondContact O-N 2.77Å; L80-V84 WeakPolarHBondContact O-CG2 3.33Å; L80-V84 PolarHBondContact O-N 2.97Å
81H92.9Very high87.9Confident52 Ų5246.3 Ų46.324%0.24123%0.228CC..Hα-helixtrans-64-36.1179.4-79.8-88.4000112.3S77 W78 V84 A85 L130 Q161 W165S77-H81 PolarHBondContact O-CD2 3.47Å; S77-H81 PolarHBondContact O-N 3.41Å; S77-H81 VanDerWaalsContact O-N 3.1Å; W78-H81 PolarHBondContact O-N 2.98Å; H81-V84 PolarHBondContact O-N 2.95Å; H81-A85 PolarHBondContact O-N 3.01Å; H81-L130 HydrophobicContact CB-CD1 3.93Å; H81-L130 HydrophobicContact CB-CD2 3.96Å; H81-Q161 PolarHBondContact CD2-NE2 2.83Å; H81-W165 AromaticContact CG-NE1 3.89Å; H81-W165 AromaticContact ND1-CD1 3.72Å; H81-W165 AromaticContact ND1-NE1 3.07Å; H81-W165 PolarHBondContact ND1-NE1 3.33Å
82L91.1Very high88.6Confident5 Ų538 Ų383%0.02620%0.198CC..Hα-helixtrans-65.4-44.8174.9-171.864000111.4W78 F79 L80 V84 A85 D86 L131W78-L82 WeakPolarHBondContact O-CB 3.43Å; W78-L82 PolarHBondContact O-N 2.92Å; F79-L82 PolarHBondContact O-N 3.19Å; L80-L82 VanDerWaalsContact C-N 3.3Å; L80-L82 PolarHBondContact O-N 3.33Å; L82-V84 VanDerWaalsContact C-N 3.3Å; L82-V84 PolarHBondContact O-N 3.23Å; L82-A85 WeakPolarHBondContact O-CB 3.38Å; L82-A85 PolarHBondContact O-N 2.84Å; L82-A85 VanDerWaalsContact O-N 3.15Å; L82-D86 PolarHBondContact O-N 3.27Å; L82-L131 HydrophobicContact CD1-CG 4.19Å; L82-L131 HydrophobicContact CD2-CD2 3.98Å
83A92.4Very high89.7Confident2 Ų230.6 Ų30.62%0.01716%0.163CC..Hα-helixtrans-63-36.5176.300000112.2N59 V62 A63 F79 L80 D86 L87N59-A83 HydrophobicContact CB-CB 4.39Å; V62-A83 HydrophobicContact CB-CB 4.16Å; V62-A83 HydrophobicContact CG1-CB 3.86Å; A63-A83 HydrophobicContact CB-CB 4Å; F79-A83 VanDerWaalsContact O-CB 3.25Å; F79-A83 WeakPolarHBondContact O-CB 3.25Å; F79-A83 PolarHBondContact O-N 3.41Å; L80-A83 PolarHBondContact O-N 2.77Å; A83-D86 PolarHBondContact O-N 3.18Å; A83-L87 WeakPolarHBondContact O-CB 3.42Å; A83-L87 VanDerWaalsContact O-CG 3.24Å; A83-L87 WeakPolarHBondContact O-CG 3.41Å; A83-L87 PolarHBondContact O-N 3.25Å
84V95.2Very high90.7Very high60 Ų6027 Ų2736%0.36416%0.156SC..Hα-helixtrans-64.2-44173170.80000111.1L80 H81 L82 L87 L88 W165L80-V84 WeakPolarHBondContact O-CG2 3.33Å; L80-V84 PolarHBondContact O-N 2.97Å; H81-V84 PolarHBondContact O-N 2.95Å; L82-V84 VanDerWaalsContact C-N 3.3Å; L82-V84 PolarHBondContact O-N 3.23Å; V84-L87 PolarHBondContact O-N 3.1Å; V84-L88 WeakPolarHBondContact O-CG 3.47Å; V84-L88 PolarHBondContact O-N 2.91Å; V84-W165 HydrophobicContact CG1-CH2 4.31Å; V84-W165 HydrophobicContact CG1-CZ2 4.24Å
85A94.9Very high91.6Very high0 Ų029.1 Ų29.10%016%0.163CC..Hα-helixtrans-60.7-50174.600000111.1H81 L82 L87 L88 C89 C123 A126 L130 W165H81-A85 PolarHBondContact O-N 3.01Å; L82-A85 WeakPolarHBondContact O-CB 3.38Å; L82-A85 PolarHBondContact O-N 2.84Å; L82-A85 VanDerWaalsContact O-N 3.15Å; A85-L87 VanDerWaalsContact C-N 3.32Å; A85-L87 PolarHBondContact O-N 3.23Å; A85-L88 WeakPolarHBondContact O-CB 3.35Å; A85-L88 PolarHBondContact O-N 3.28Å; A85-L88 VanDerWaalsContact O-N 3.13Å; A85-C89 PolarHBondContact O-N 3.36Å; A85-C89 PolarHBondContact O-SG 3.48Å; A85-C123 PolarHBondContact O-SG 3.47Å; A85-C123 VanDerWaalsContact O-SG 3.37Å; A85-A126 HydrophobicContact CB-CB 4.02Å; A85-L130 HydrophobicContact CB-CD1 4.34Å; A85-W165 HydrophobicContact CB-CH2 4.11Å; A85-W165 HydrophobicContact CB-CZ2 4.24Å
86D94.6Very high92.5Very high1 Ų129.2 Ų29.21%0.00516%0.157CC..Hα-helixtrans-61.8-37.2179.5-74.8-34000112.8N59 L82 A83 L88 C89 C90 S290 N293N59-D86 HydrophobicContact CB-CB 4.42Å; L82-D86 PolarHBondContact O-N 3.27Å; A83-D86 PolarHBondContact O-N 3.18Å; D86-L88 PolarHBondContact O-N 3.25Å; D86-C89 WeakPolarHBondContact O-CB 3.45Å; D86-C89 PolarHBondContact O-N 2.98Å; D86-C89 VanDerWaalsContact O-N 3.09Å; D86-C90 PolarHBondContact O-N 2.79Å; D86-C90 PolarHBondContact O-SG 3.39Å; D86-S290 WeakPolarHBondContact OD1-CA 3.34Å; D86-S290 WeakPolarHBondContact OD1-CB 3.37Å; D86-S290 PolarHBondContact OD1-OG 3.26Å; D86-N293 PolarHBondContact OD2-ND2 2.95Å
87L95.5Very high93.3Very high40 Ų4029.5 Ų29.521%0.20916%0.16CC..Hα-helixtrans-60.2-43173.5-82.7172.2000112.4V56 N59 A60 A63 A83 V84 A85 C89 C90 V91V56-L87 HydrophobicContact CG1-CD2 4.42Å; V56-L87 WeakPolarHBondContact O-CD2 3.42Å; N59-L87 HydrophobicContact CB-CD2 3.89Å; N59-L87 HydrophobicContact CB-CG 3.73Å; A60-L87 HydrophobicContact CB-CD2 4.37Å; A63-L87 HydrophobicContact CB-CD1 4.42Å; A83-L87 WeakPolarHBondContact O-CB 3.42Å; A83-L87 VanDerWaalsContact O-CG 3.24Å; A83-L87 WeakPolarHBondContact O-CG 3.41Å; A83-L87 PolarHBondContact O-N 3.25Å; V84-L87 PolarHBondContact O-N 3.1Å; A85-L87 VanDerWaalsContact C-N 3.32Å; A85-L87 PolarHBondContact O-N 3.23Å; L87-C89 PolarHBondContact O-N 3.5Å; L87-C90 PolarHBondContact O-N 3.09Å; L87-V91 WeakPolarHBondContact O-CB 3.28Å; L87-V91 VanDerWaalsContact O-CG2 3.28Å; L87-V91 WeakPolarHBondContact O-CG2 3.38Å; L87-V91 PolarHBondContact O-N 2.86Å
88L94.1Very high93.8Very high67 Ų6730.7 Ų30.735%0.35117%0.166SC..Hα-helixtrans-57.9-35.7175.3-68.6170.1000110.9V84 A85 D86 S92 V119 C123 W165V84-L88 WeakPolarHBondContact O-CG 3.47Å; V84-L88 PolarHBondContact O-N 2.91Å; A85-L88 WeakPolarHBondContact O-CB 3.35Å; A85-L88 PolarHBondContact O-N 3.28Å; A85-L88 VanDerWaalsContact O-N 3.13Å; D86-L88 PolarHBondContact O-N 3.25Å; L88-S92 PolarHBondContact O-N 2.97Å; L88-S92 PolarHBondContact O-OG 3.26Å; L88-V119 HydrophobicContact CB-CG1 4.41Å; L88-C123 VanDerWaalsContact C-SG 3.56Å; L88-W165 HydrophobicContact CD1-CH2 3.97Å; L88-W165 HydrophobicContact CD1-CZ3 4.17Å
89C93.7Very high94.1Very high2 Ų231.2 Ų31.21%0.01417%0.17CC..Hα-helixtrans-75.4-46.8-177.5-42.30000110.3A85 D86 L87 V91 S92 L93 C123 L287A85-C89 PolarHBondContact O-N 3.36Å; A85-C89 PolarHBondContact O-SG 3.48Å; D86-C89 WeakPolarHBondContact O-CB 3.45Å; D86-C89 PolarHBondContact O-N 2.98Å; D86-C89 VanDerWaalsContact O-N 3.09Å; L87-C89 PolarHBondContact O-N 3.5Å; C89-V91 PolarHBondContact O-N 2.95Å; C89-S92 WeakPolarHBondContact O-CB 3.25Å; C89-S92 PolarHBondContact O-N 2.88Å; C89-L93 PolarHBondContact O-N 3.2Å; C89-C123 WeakPolarHBondContact CA-SG 3.41Å; C89-C123 HydrophobicContact CB-CB 4.01Å; C89-C123 WeakPolarHBondContact CB-SG 3.27Å; C89-C123 PolarHBondContact N-SG 3.47Å; C89-C123 WeakPolarHBondContact SG-CB 3.47Å; C89-C123 CovalentContact SG-SG 2.04Å; C89-C123 PolarHBondContact SG-SG 2.89Å; C89-L287 HydrophobicContact CB-CD2 4.1Å
90C96.1Very high94.5Very high0 Ų029.2 Ų29.20%016%0.162CC..Hα-helixtrans-63.1-44.4179.4-65.40000111.5F52 V56 D86 L87 S92 L93F52-C90 WeakPolarHBondContact CD2-O 3.44Å; V56-C90 HydrophobicContact CG2-CB 3.64Å; D86-C90 PolarHBondContact O-N 2.79Å; D86-C90 PolarHBondContact O-SG 3.39Å; L87-C90 PolarHBondContact O-N 3.09Å; C90-S92 PolarHBondContact O-N 2.84Å; C90-L93 WeakPolarHBondContact O-CB 3.45Å; C90-L93 PolarHBondContact O-N 3.15Å; C90-L93 VanDerWaalsContact O-N 3.1Å
91V95.9Very high94.7Very high73 Ų7330.8 Ų30.844%0.44218%0.177SC..Hα-helixtrans-64.9-23.2178172.50000112.4V56 L87 C89 P94 F95V56-V91 HydrophobicContact CG2-CG2 4.25Å; L87-V91 WeakPolarHBondContact O-CB 3.28Å; L87-V91 VanDerWaalsContact O-CG2 3.28Å; L87-V91 WeakPolarHBondContact O-CG2 3.38Å; L87-V91 PolarHBondContact O-N 2.86Å; C89-V91 PolarHBondContact O-N 2.95Å; V91-P94 WeakPolarHBondContact O-CD 3.34Å; V91-F95 WeakPolarHBondContact O-CD2 3.32Å; V91-F95 WeakPolarHBondContact O-CE2 3.46Å
92S95.2Very high94.7Very high7 Ų732.5 Ų32.55%0.04919%0.186CC..Hα-helixtrans-75.3-23.1175.5-60.80000113.4L88 C89 C90 F95 L96 V119L88-S92 PolarHBondContact O-N 2.97Å; L88-S92 PolarHBondContact O-OG 3.26Å; C89-S92 WeakPolarHBondContact O-CB 3.25Å; C89-S92 PolarHBondContact O-N 2.88Å; C90-S92 PolarHBondContact O-N 2.84Å; S92-F95 WeakPolarHBondContact O-CB 3.24Å; S92-F95 PolarHBondContact O-N 3.27Å; S92-L96 WeakPolarHBondContact O-CG 3.32Å; S92-L96 PolarHBondContact O-N 3.46Å; S92-L96 VanDerWaalsContact O-N 3.07Å; S92-V119 WeakPolarHBondContact OG-CG1 3.45Å
93L95.9Very high94.5Very high1 Ų138.3 Ų38.31%0.00521%0.211CC..Hα-helixtrans-59.7-44.5-173.4-73.8162.3000114.9Y48 I51 F52 C89 C90 F95 L96 A97 L287Y48-L93 HydrophobicContact CD2-CB 4.5Å; Y48-L93 HydrophobicContact CD2-CD2 3.63Å; Y48-L93 HydrophobicContact CE2-CD2 4.03Å; Y48-L93 HydrophobicContact CG-CD2 3.96Å; I51-L93 HydrophobicContact CB-CD1 3.65Å; I51-L93 HydrophobicContact CG2-CD1 3.35Å; F52-L93 HydrophobicContact CB-CB 4.4Å; F52-L93 HydrophobicContact CB-CD1 4.28Å; C89-L93 PolarHBondContact O-N 3.2Å; C90-L93 WeakPolarHBondContact O-CB 3.45Å; C90-L93 PolarHBondContact O-N 3.15Å; C90-L93 VanDerWaalsContact O-N 3.1Å; L93-F95 PolarHBondContact O-N 2.87Å; L93-L96 CarbonylContact O-C 3.58Å; L93-L96 PolarHBondContact O-N 3.13Å; L93-L96 VanDerWaalsContact O-N 3.1Å; L93-A97 WeakPolarHBondContact O-CB 3.41Å; L93-A97 PolarHBondContact O-N 3.01Å; L93-L287 HydrophobicContact CD2-CB 4.1Å; L93-L287 HydrophobicContact CD2-CD1 3.54Å; L93-L287 HydrophobicContact CD2-CG 4.45Å; L93-L287 HydrophobicContact CG-CD1 4.43Å
94P95.9Very high94.3Very high51 Ų5139.6 Ų39.633%0.33122%0.224SC..Hα-helixtrans-58.6-38.3177.3-24.535.2000112.2F52 V91 A97 V98F52-P94 HydrophobicContact CD2-CG 3.54Å; F52-P94 HydrophobicContact CE2-CG 3.59Å; F52-P94 HydrophobicContact CG-CG 4.07Å; F52-P94 HydrophobicContact CZ-CG 4.17Å; V91-P94 WeakPolarHBondContact O-CD 3.34Å; P94-A97 PolarHBondContact O-N 3.43Å; P94-V98 PolarHBondContact O-N 2.94Å
95F96.4Very high94.2Very high101 Ų10139.8 Ų39.844%0.44322%0.221SC..Hα-helixtrans-69.4-35.2177.2-58.5-84.3000112V91 S92 L93 A97 P99 Y108 L116V91-F95 WeakPolarHBondContact O-CD2 3.32Å; V91-F95 WeakPolarHBondContact O-CE2 3.46Å; S92-F95 WeakPolarHBondContact O-CB 3.24Å; S92-F95 PolarHBondContact O-N 3.27Å; L93-F95 PolarHBondContact O-N 2.87Å; F95-A97 VanDerWaalsContact C-N 3.32Å; F95-P99 WeakPolarHBondContact O-CD 3.4Å; F95-Y108 HydrophobicContact CB-CE2 4.42Å; F95-Y108 HydrophobicContact CD1-CE1 4.1Å; F95-Y108 WeakPolarHBondContact O-CE2 3.33Å; F95-Y108 PolarHBondContact O-OH 3.41Å; F95-L116 HydrophobicContact CB-CD1 3.95Å; F95-L116 HydrophobicContact CB-CD2 3.52Å; F95-L116 HydrophobicContact CB-CG 4.43Å
96L95.3Very high94.2Very high31 Ų3140.6 Ų40.616%0.16222%0.224CC..Hα-helixtrans-73.5-25.2174-63169000112.7Y48 S92 L93 P99 L116 T120 L287Y48-L96 HydrophobicContact CD2-CB 4.21Å; Y48-L96 HydrophobicContact CE2-CB 3.73Å; S92-L96 WeakPolarHBondContact O-CG 3.32Å; S92-L96 PolarHBondContact O-N 3.46Å; S92-L96 VanDerWaalsContact O-N 3.07Å; L93-L96 CarbonylContact O-C 3.58Å; L93-L96 PolarHBondContact O-N 3.13Å; L93-L96 VanDerWaalsContact O-N 3.1Å; L96-P99 WeakPolarHBondContact O-CD 3.15Å; L96-L116 HydrophobicContact CD2-CD2 3.53Å; L96-L116 HydrophobicContact CD2-CG 3.79Å; L96-L116 HydrophobicContact CG-CD2 3.91Å; L96-L116 HydrophobicContact CG-CG 4.23Å; L96-T120 HydrophobicContact CD1-CG2 3.67Å; L96-T120 HydrophobicContact CD2-CG2 4.24Å; L96-T120 HydrophobicContact CG-CG2 4.43Å; L96-L287 HydrophobicContact CD1-CD1 3.71Å
97A96.4Very high94.3Very high16 Ų1643.2 Ų43.213%0.13224%0.241CC..Hα-helixtrans-73.4-30.3178.600000112.5L45 Y48 L93 P94 F95 I100 A101L45-A97 HydrophobicContact CD2-CB 3.87Å; L45-A97 WeakPolarHBondContact CD2-O 3.31Å; Y48-A97 HydrophobicContact CD2-CB 4.23Å; L93-A97 WeakPolarHBondContact O-CB 3.41Å; L93-A97 PolarHBondContact O-N 3.01Å; P94-A97 PolarHBondContact O-N 3.43Å; F95-A97 VanDerWaalsContact C-N 3.32Å; A97-I100 WeakPolarHBondContact O-CB 3.37Å; A97-I100 PolarHBondContact O-N 3.5Å; A97-A101 PolarHBondContact O-N 3.1Å
98V96.3Very high94.3Very high47 Ų4745 Ų4529%0.28525%0.245SC..Hα-helixtrans-62.2-48.6-179171.30000112.7P94 I100 A101 Q102 P107 Y108P94-V98 PolarHBondContact O-N 2.94Å; V98-I100 PolarHBondContact O-N 3Å; V98-A101 PolarHBondContact O-N 3.45Å; V98-A101 VanDerWaalsContact O-N 3.12Å; V98-Q102 HydrophobicContact CG1-CG 4.28Å; V98-Q102 WeakPolarHBondContact O-CG 3.47Å; V98-Q102 PolarHBondContact O-N 3.32Å; V98-P107 HydrophobicContact CG1-CG 3.74Å; V98-Y108 HydrophobicContact CB-CE2 4.4Å; V98-Y108 WeakPolarHBondContact CB-OH 3.27Å; V98-Y108 VanDerWaalsContact CG2-OH 3.23Å; V98-Y108 WeakPolarHBondContact CG2-OH 3.32Å
99P93.4Very high94.3Very high16 Ų1643 Ų4310%0.10424%0.241CC..Hα-helixtrans-59.3-32.1174.2-25.733.6000113.6F95 L96 Q102 K103 G104 H105 W106 Y108F95-P99 WeakPolarHBondContact O-CD 3.4Å; L96-P99 WeakPolarHBondContact O-CD 3.15Å; P99-Q102 CarbonylContact O-C 3.51Å; P99-Q102 PolarHBondContact O-N 3.39Å; P99-K103 PolarHBondContact O-N 3.13Å; P99-G104 WeakPolarHBondContact O-CA 3.46Å; P99-G104 PolarHBondContact O-N 2.82Å; P99-H105 VanDerWaalsContact CA-O 3.32Å; P99-H105 WeakPolarHBondContact CA-O 3.39Å; P99-W106 HydrophobicContact CB-CE3 4.23Å; P99-W106 HydrophobicContact CG-CD2 4.47Å; P99-W106 HydrophobicContact CG-CE3 3.51Å; P99-W106 HydrophobicContact CG-CZ3 3.73Å; P99-Y108 HydrophobicContact CG-CE2 4.39Å
100I93.1Very high94.4Very high21 Ų2145.1 Ų45.111%0.10826%0.259CS..Hα-helixtrans-66.7-46.9174.9-61.4171.5000110V41 L44 L45 Y48 A97 V98 Q102 K103 P280V41-I100 HydrophobicContact CG1-CG2 4.23Å; L44-I100 HydrophobicContact CB-CG2 3.96Å; L44-I100 HydrophobicContact CD1-CG2 3.91Å; L45-I100 HydrophobicContact CD2-CB 4.27Å; L45-I100 HydrophobicContact CD2-CG2 4.17Å; L45-I100 HydrophobicContact CG-CG2 4.38Å; Y48-I100 HydrophobicContact CD2-CD1 4.22Å; Y48-I100 HydrophobicContact CE1-CD1 4.12Å; Y48-I100 HydrophobicContact CE2-CD1 3.69Å; A97-I100 WeakPolarHBondContact O-CB 3.37Å; A97-I100 PolarHBondContact O-N 3.5Å; V98-I100 PolarHBondContact O-N 3Å; I100-Q102 VanDerWaalsContact C-N 3.27Å; I100-Q102 PolarHBondContact O-N 2.94Å; I100-K103 PolarHBondContact O-N 3.4Å; I100-P280 HydrophobicContact CD1-CB 4.11Å; I100-P280 HydrophobicContact CG1-CB 4.44Å
101A94.1Very high94.4Very high53 Ų5348.9 Ų48.944%0.43829%0.29SS..Hα-helixtrans-63.4-33176.300000112.7L45 A97 V98 K103L45-A101 HydrophobicContact CD1-CB 4.06Å; L45-A101 HydrophobicContact CD2-CB 4.1Å; A97-A101 PolarHBondContact O-N 3.1Å; V98-A101 PolarHBondContact O-N 3.45Å; V98-A101 VanDerWaalsContact O-N 3.12Å; A101-K103 VanDerWaalsContact C-N 3.28Å; A101-K103 PolarHBondContact O-N 3.3Å
102Q92.4Very high94.4Very high88 Ų8846.2 Ų46.241%0.41128%0.277SS..THydrogen-bonded Turntrans-90.824.2178.2-62-173.2-12.600113.4V98 P99 I100 G104 H105V98-Q102 HydrophobicContact CG1-CG 4.28Å; V98-Q102 WeakPolarHBondContact O-CG 3.47Å; V98-Q102 PolarHBondContact O-N 3.32Å; P99-Q102 CarbonylContact O-C 3.51Å; P99-Q102 PolarHBondContact O-N 3.39Å; I100-Q102 VanDerWaalsContact C-N 3.27Å; I100-Q102 PolarHBondContact O-N 2.94Å; Q102-G104 PolarHBondContact O-N 3.12Å; Q102-G104 VanDerWaalsContact O-N 3.13Å; Q102-H105 HydrophobicContact CB-CB 3.97Å; Q102-H105 WeakPolarHBondContact O-CB 3.24Å; Q102-H105 PolarHBondContact O-N 3.04Å; Q102-H105 VanDerWaalsContact O-N 3.08Å; Q102-H105 PolarHBondContact OE1-CD2 3.29Å
103K88.4Confident94.4Very high128 Ų12845.9 Ų45.956%0.55728%0.275SS*.THydrogen-bonded Turntrans52.739.1174.3-59.1-174.4175.3-1690113.3D38 P99 I100 A101 R189D38-K103 IonicContact OD1-NZ 3.79Å; D38-K103 PolarHBondContact OD1-NZ 3.49Å; P99-K103 PolarHBondContact O-N 3.13Å; I100-K103 PolarHBondContact O-N 3.4Å; A101-K103 VanDerWaalsContact C-N 3.28Å; A101-K103 PolarHBondContact O-N 3.3Å; K103-R189 PolarHBondContact O-NH1 3.35Å
104G87.6Confident94.4Very high29 Ų2951 Ų5130%0.29929%0.294SS..THydrogen-bonded Turntrans96-4177.100000115.5P99 Q102P99-G104 WeakPolarHBondContact O-CA 3.46Å; P99-G104 PolarHBondContact O-N 2.82Å; Q102-G104 PolarHBondContact O-N 3.12Å; Q102-G104 VanDerWaalsContact O-N 3.13Å
105H92.4Very high94.4Very high63 Ų6354.2 Ų54.229%0.29231%0.308SS..  trans-70.4133.3176.3-175.587.5000111.7P99 Q102 P107 R189 L190P99-H105 VanDerWaalsContact CA-O 3.32Å; P99-H105 WeakPolarHBondContact CA-O 3.39Å; Q102-H105 HydrophobicContact CB-CB 3.97Å; Q102-H105 WeakPolarHBondContact O-CB 3.24Å; Q102-H105 PolarHBondContact O-N 3.04Å; Q102-H105 VanDerWaalsContact O-N 3.08Å; Q102-H105 PolarHBondContact OE1-CD2 3.29Å; H105-P107 WeakPolarHBondContact O-CD 3.48Å; H105-R189 HydrophobicContact CB-CB 4.38Å; H105-L190 CarbonylContact C-O 3.52Å; H105-L190 WeakPolarHBondContact CA-O 3.29Å; H105-L190 PolarHBondContact ND1-N 3.1Å
106W95.6Very high94.3Very high18 Ų1850.2 Ų50.27%0.06829%0.291CS..  trans-101.8104.8179.6-175.6-90.2000111.9P99 Y108 G109 G112 C113 L116 L181 L190 C192P99-W106 HydrophobicContact CB-CE3 4.23Å; P99-W106 HydrophobicContact CG-CD2 4.47Å; P99-W106 HydrophobicContact CG-CE3 3.51Å; P99-W106 HydrophobicContact CG-CZ3 3.73Å; W106-Y108 HydrophobicContact CD2-CD2 4.28Å; W106-Y108 AromaticContact CE2-CD2 3.82Å; W106-Y108 HydrophobicContact CH2-CD2 4.12Å; W106-Y108 AromaticContact CZ2-CD2 3.7Å; W106-Y108 HydrophobicContact CZ2-CD2 3.7Å; W106-Y108 HydrophobicContact CZ2-CG 4.35Å; W106-G109 PolarHBondContact NE1-O 2.88Å; W106-G112 VanDerWaalsContact CZ2-C 3.44Å; W106-G112 WeakPolarHBondContact CZ2-O 3.22Å; W106-C113 VanDerWaalsContact CZ2-CA 3.41Å; W106-C113 HydrophobicContact CZ2-CB 4.21Å; W106-L116 HydrophobicContact CH2-CB 4.01Å; W106-L116 HydrophobicContact CH2-CD2 3.62Å; W106-L116 HydrophobicContact CH2-CG 4.34Å; W106-L116 HydrophobicContact CZ2-CB 4.4Å; W106-L116 HydrophobicContact CZ2-CD2 4.44Å; W106-L116 HydrophobicContact CZ3-CD2 4.35Å; W106-L181 HydrophobicContact CB-CD1 4.12Å; W106-L181 HydrophobicContact CG-CD1 3.95Å; W106-L190 HydrophobicContact CB-CB 4.41Å; W106-L190 WeakPolarHBondContact CB-O 3.5Å; W106-L190 PolarHBondContact N-O 3.2Å; W106-C192 HydrophobicContact CB-CB 4.47Å; W106-C192 HydrophobicContact CD2-CB 3.61Å; W106-C192 HydrophobicContact CE3-CB 3.73Å; W106-C192 HydrophobicContact CG-CB 3.92Å; W106-C192 HydrophobicContact CZ3-CB 4.2Å
107P95.6Very high94.2Very high56 Ų5649.5 Ų49.536%0.36429%0.288SS..THydrogen-bonded Turntrans-88.1-9.9-172.734.4-36.8000114.5V98 H105 G109V98-P107 HydrophobicContact CG1-CG 3.74Å; H105-P107 WeakPolarHBondContact O-CD 3.48Å; P107-G109 VanDerWaalsContact C-N 3.32Å; P107-G109 PolarHBondContact O-N 3.07Å
108Y95.8Very high94.2Very high76 Ų7649.6 Ų49.630%0.29829%0.288SS..THydrogen-bonded Turntrans-89.78-169.7-51.1-68.7000114.6F95 V98 P99 W106 G112F95-Y108 HydrophobicContact CB-CE2 4.42Å; F95-Y108 HydrophobicContact CD1-CE1 4.1Å; F95-Y108 WeakPolarHBondContact O-CE2 3.33Å; F95-Y108 PolarHBondContact O-OH 3.41Å; V98-Y108 HydrophobicContact CB-CE2 4.4Å; V98-Y108 WeakPolarHBondContact CB-OH 3.27Å; V98-Y108 VanDerWaalsContact CG2-OH 3.23Å; V98-Y108 WeakPolarHBondContact CG2-OH 3.32Å; P99-Y108 HydrophobicContact CG-CE2 4.39Å; W106-Y108 HydrophobicContact CD2-CD2 4.28Å; W106-Y108 AromaticContact CE2-CD2 3.82Å; W106-Y108 HydrophobicContact CH2-CD2 4.12Å; W106-Y108 AromaticContact CZ2-CD2 3.7Å; W106-Y108 HydrophobicContact CZ2-CD2 3.7Å; W106-Y108 HydrophobicContact CZ2-CG 4.35Å; Y108-G112 PolarHBondContact O-N 3.35Å
109G95.7Very high94.1Very high26 Ų2648.9 Ų48.927%0.26828%0.284SS..Hα-helixtrans60.3-168.9-176.800000114.1W106 P107 G112 C113W106-G109 PolarHBondContact NE1-O 2.88Å; P107-G109 VanDerWaalsContact C-N 3.32Å; P107-G109 PolarHBondContact O-N 3.07Å; G109-G112 PolarHBondContact O-N 3.35Å; G109-C113 WeakPolarHBondContact O-CB 3.43Å; G109-C113 PolarHBondContact O-N 3.05Å
110A95.6Very high94.1Very high46 Ų4649.6 Ų49.638%0.3829%0.288SS..Hα-helixtrans-69.4-35.7-173.300000113.2C113 R114 L181A110-C113 PolarHBondContact O-N 3.34Å; A110-R114 PolarHBondContact O-N 3.45Å; A110-L181 HydrophobicContact CB-CB 4.22Å; A110-L181 HydrophobicContact CB-CD2 4.49Å
111A95.4Very high94.1Very high80 Ų8049.4 Ų49.466%0.66129%0.288SS*.Hα-helixtrans-65.2-46.9177.400000111.1C113 R114 L115A111-C113 VanDerWaalsContact C-N 3.31Å; A111-C113 PolarHBondContact O-N 3.24Å; A111-R114 PolarHBondContact O-N 3.24Å; A111-L115 WeakPolarHBondContact O-CB 3.27Å; A111-L115 PolarHBondContact O-N 3.23Å
112G95.2Very high94.2Very high16 Ų1648 Ų4817%0.16527%0.273CS..Hα-helixtrans-60.4-41.5174.800000112.1W106 Y108 G109 R114 L115 L116W106-G112 VanDerWaalsContact CZ2-C 3.44Å; W106-G112 WeakPolarHBondContact CZ2-O 3.22Å; Y108-G112 PolarHBondContact O-N 3.35Å; G109-G112 PolarHBondContact O-N 3.35Å; G112-R114 VanDerWaalsContact C-N 3.33Å; G112-R114 PolarHBondContact O-N 2.89Å; G112-L115 PolarHBondContact O-N 3.24Å; G112-L116 WeakPolarHBondContact O-CB 3.5Å; G112-L116 PolarHBondContact O-N 3.44Å
113C95.9Very high94.2Very high0 Ų043.9 Ų43.90%025%0.254CS..Hα-helixtrans-57.9-44.3179.21730000112W106 G109 A110 A111 S117 R180 C192W106-C113 VanDerWaalsContact CZ2-CA 3.41Å; W106-C113 HydrophobicContact CZ2-CB 4.21Å; G109-C113 WeakPolarHBondContact O-CB 3.43Å; G109-C113 PolarHBondContact O-N 3.05Å; A110-C113 PolarHBondContact O-N 3.34Å; A111-C113 VanDerWaalsContact C-N 3.31Å; A111-C113 PolarHBondContact O-N 3.24Å; C113-S117 WeakPolarHBondContact O-CB 3.33Å; C113-S117 PolarHBondContact O-N 3.42Å; C113-S117 PolarHBondContact O-OG 3.45Å; C113-R180 PolarHBondContact SG-O 3.26Å; C113-C192 WeakPolarHBondContact CA-SG 3.22Å; C113-C192 HydrophobicContact CB-CB 3.73Å; C113-C192 WeakPolarHBondContact CB-SG 3.29Å; C113-C192 PolarHBondContact O-SG 2.86Å; C113-C192 VanDerWaalsContact SG-CA 3.54Å; C113-C192 WeakPolarHBondContact SG-CB 3.25Å; C113-C192 CovalentContact SG-SG 2.03Å; C113-C192 PolarHBondContact SG-SG 3Å
114R96.1Very high94.5Very high109 Ų10938 Ų3841%0.41123%0.228SC..Hα-helixtrans-70.7-49.3175.8-63.5178.1-166.6175.35.7111.3A110 A111 G112 S118A110-R114 PolarHBondContact O-N 3.45Å; A111-R114 PolarHBondContact O-N 3.24Å; G112-R114 VanDerWaalsContact C-N 3.33Å; G112-R114 PolarHBondContact O-N 2.89Å; R114-S118 VanDerWaalsContact O-CB 3.26Å; R114-S118 WeakPolarHBondContact O-CB 3.17Å; R114-S118 PolarHBondContact O-N 3.39Å; R114-S118 PolarHBondContact O-OG 3.23Å
115L95Very high94.9Very high119 Ų11937 Ų3762%0.62322%0.215SC*.Hα-helixtrans-62.3-51.8-174.2179.861.7000112.1A111 G112 S117 S118 V119A111-L115 WeakPolarHBondContact O-CB 3.27Å; A111-L115 PolarHBondContact O-N 3.23Å; G112-L115 PolarHBondContact O-N 3.24Å; L115-S117 PolarHBondContact O-N 2.9Å; L115-S118 WeakPolarHBondContact O-CB 3.45Å; L115-S118 PolarHBondContact O-N 3.27Å; L115-V119 HydrophobicContact CD1-CG2 4.19Å; L115-V119 WeakPolarHBondContact O-CG2 3.3Å; L115-V119 PolarHBondContact O-N 3.21Å
116L94.8Very high95Very high17 Ų1734 Ų349%0.08920%0.202CC..Hα-helixtrans-67.9-39.2-175.3-166.961.1000111.4F95 L96 W106 G112 S118 V119 T120F95-L116 HydrophobicContact CB-CD1 3.95Å; F95-L116 HydrophobicContact CB-CD2 3.52Å; F95-L116 HydrophobicContact CB-CG 4.43Å; L96-L116 HydrophobicContact CD2-CD2 3.53Å; L96-L116 HydrophobicContact CD2-CG 3.79Å; L96-L116 HydrophobicContact CG-CD2 3.91Å; L96-L116 HydrophobicContact CG-CG 4.23Å; W106-L116 HydrophobicContact CH2-CB 4.01Å; W106-L116 HydrophobicContact CH2-CD2 3.62Å; W106-L116 HydrophobicContact CH2-CG 4.34Å; W106-L116 HydrophobicContact CZ2-CB 4.4Å; W106-L116 HydrophobicContact CZ2-CD2 4.44Å; W106-L116 HydrophobicContact CZ3-CD2 4.35Å; G112-L116 WeakPolarHBondContact O-CB 3.5Å; G112-L116 PolarHBondContact O-N 3.44Å; L116-S118 VanDerWaalsContact C-N 3.33Å; L116-S118 PolarHBondContact O-N 3.12Å; L116-V119 PolarHBondContact O-N 3.21Å; L116-T120 WeakPolarHBondContact O-CG2 3.36Å; L116-T120 PolarHBondContact O-N 2.91Å; L116-T120 PolarHBondContact O-OG1 2.94Å
117S94.3Very high94.9Very high15 Ų1533.1 Ų33.111%0.10520%0.199CC..Hα-helixtrans-66.3-34.3174.2-52.90000112.5C113 L115 T120 T121 S175 H179C113-S117 WeakPolarHBondContact O-CB 3.33Å; C113-S117 PolarHBondContact O-N 3.42Å; C113-S117 PolarHBondContact O-OG 3.45Å; L115-S117 PolarHBondContact O-N 2.9Å; S117-T120 PolarHBondContact O-OG1 3.3Å; S117-T121 WeakPolarHBondContact O-CB 3.46Å; S117-T121 PolarHBondContact O-N 3.48Å; S117-T121 PolarHBondContact O-OG1 3.46Å; S117-S175 PolarHBondContact O-OG 3.39Å; S117-H179 PolarHBondContact OG-CD2 2.87Å; S117-H179 VanDerWaalsContact OG-CD2 3.3Å
118S95.6Very high94.9Very high19 Ų1930.5 Ų30.513%0.13318%0.181CC..Hα-helixtrans-68.9-44.1172.1-69.70000111.9R114 L115 L116 T120 T121 L122 T172 A176R114-S118 VanDerWaalsContact O-CB 3.26Å; R114-S118 WeakPolarHBondContact O-CB 3.17Å; R114-S118 PolarHBondContact O-N 3.39Å; R114-S118 PolarHBondContact O-OG 3.23Å; L115-S118 WeakPolarHBondContact O-CB 3.45Å; L115-S118 PolarHBondContact O-N 3.27Å; L116-S118 VanDerWaalsContact C-N 3.33Å; L116-S118 PolarHBondContact O-N 3.12Å; S118-T120 PolarHBondContact O-N 2.84Å; S118-T121 PolarHBondContact O-N 2.93Å; S118-L122 VanDerWaalsContact O-CB 3.29Å; S118-L122 WeakPolarHBondContact O-CB 3.27Å; S118-L122 PolarHBondContact O-N 3.43Å; S118-T172 VanDerWaalsContact O-CG2 3.22Å; S118-T172 WeakPolarHBondContact O-CG2 3.42Å; S118-A176 WeakPolarHBondContact OG-CA 3.24Å; S118-A176 VanDerWaalsContact OG-CB 3.29Å; S118-A176 WeakPolarHBondContact OG-CB 3.44Å; S118-A176 PolarHBondContact OG-N 2.9Å
119V94.8Very high94.9Very high32 Ų3227.9 Ų27.919%0.19417%0.173CC..Hα-helixtrans-62.4-44.9179.71730000111.1L88 S92 L115 L116 T121 L122 C123L88-V119 HydrophobicContact CB-CG1 4.41Å; S92-V119 WeakPolarHBondContact OG-CG1 3.45Å; L115-V119 HydrophobicContact CD1-CG2 4.19Å; L115-V119 WeakPolarHBondContact O-CG2 3.3Å; L115-V119 PolarHBondContact O-N 3.21Å; L116-V119 PolarHBondContact O-N 3.21Å; V119-T121 VanDerWaalsContact C-N 3.31Å; V119-T121 PolarHBondContact O-N 3.45Å; V119-L122 PolarHBondContact O-N 3.23Å; V119-C123 VanDerWaalsContact O-CB 3.25Å; V119-C123 WeakPolarHBondContact O-CB 3.42Å; V119-C123 PolarHBondContact O-N 3.5Å
120T92.4Very high94.8Very high30 Ų3026.9 Ų26.918%0.18416%0.161CC..Hα-helixtrans-63-37.7176.955.10000112.5L96 L116 S117 S118 C123 M124L96-T120 HydrophobicContact CD1-CG2 3.67Å; L96-T120 HydrophobicContact CD2-CG2 4.24Å; L96-T120 HydrophobicContact CG-CG2 4.43Å; L116-T120 WeakPolarHBondContact O-CG2 3.36Å; L116-T120 PolarHBondContact O-N 2.91Å; L116-T120 PolarHBondContact O-OG1 2.94Å; S117-T120 PolarHBondContact O-OG1 3.3Å; S118-T120 PolarHBondContact O-N 2.84Å; T120-C123 VanDerWaalsContact O-CB 3.23Å; T120-C123 WeakPolarHBondContact O-CB 3.32Å; T120-M124 PolarHBondContact O-N 3.13Å
121T94.1Very high94.6Very high17 Ų1724.9 Ų24.910%0.10414%0.144CC..Hα-helixtrans-70.1-41.8175.9-57.50000111.9S117 S118 V119 C123 M124 Y125 T172 S175S117-T121 WeakPolarHBondContact O-CB 3.46Å; S117-T121 PolarHBondContact O-N 3.48Å; S117-T121 PolarHBondContact O-OG1 3.46Å; S118-T121 PolarHBondContact O-N 2.93Å; V119-T121 VanDerWaalsContact C-N 3.31Å; V119-T121 PolarHBondContact O-N 3.45Å; T121-C123 VanDerWaalsContact C-N 3.32Å; T121-C123 PolarHBondContact O-N 2.9Å; T121-M124 WeakPolarHBondContact O-CB 3.35Å; T121-M124 PolarHBondContact O-N 3.43Å; T121-Y125 HydrophobicContact CG2-CD2 3.75Å; T121-Y125 HydrophobicContact CG2-CE2 3.49Å; T121-Y125 VanDerWaalsContact CG2-CE2 3.49Å; T121-Y125 WeakPolarHBondContact O-CD2 3.33Å; T121-Y125 PolarHBondContact O-N 3.11Å; T121-Y125 VanDerWaalsContact O-N 3.13Å; T121-T172 HydrophobicContact CG2-CG2 4.24Å; T121-S175 PolarHBondContact OG1-OG 3.47Å
122L96.1Very high94.5Very high25 Ų2522.2 Ų22.213%0.13112%0.119CC..Hα-helixtrans-61.3-44.6176.7176.460.4000110.6S118 V119 M124 Y125 A126 A168 L169 T172S118-L122 VanDerWaalsContact O-CB 3.29Å; S118-L122 WeakPolarHBondContact O-CB 3.27Å; S118-L122 PolarHBondContact O-N 3.43Å; V119-L122 PolarHBondContact O-N 3.23Å; L122-M124 PolarHBondContact O-N 3.36Å; L122-Y125 PolarHBondContact O-N 3.35Å; L122-A126 WeakPolarHBondContact O-CB 3.45Å; L122-A126 PolarHBondContact O-N 3.03Å; L122-A168 HydrophobicContact CD1-CB 3.79Å; L122-L169 HydrophobicContact CD1-CD2 3.82Å; L122-L169 HydrophobicContact CD1-CG 3.99Å; L122-L169 HydrophobicContact CD2-CD2 3.89Å; L122-T172 VanDerWaalsContact CA-OG1 3.28Å; L122-T172 WeakPolarHBondContact CA-OG1 3.45Å; L122-T172 HydrophobicContact CB-CG2 4.2Å; L122-T172 PolarHBondContact N-OG1 3.45Å
123C92.9Very high94.4Very high1 Ų122.3 Ų22.31%0.00712%0.119CC..Hα-helixtrans-49.6-52.3172.7-1050000113.7A85 L88 C89 V119 T120 T121 S127A85-C123 PolarHBondContact O-SG 3.47Å; A85-C123 VanDerWaalsContact O-SG 3.37Å; L88-C123 VanDerWaalsContact C-SG 3.56Å; C89-C123 WeakPolarHBondContact CA-SG 3.41Å; C89-C123 HydrophobicContact CB-CB 4.01Å; C89-C123 WeakPolarHBondContact CB-SG 3.27Å; C89-C123 PolarHBondContact N-SG 3.47Å; C89-C123 WeakPolarHBondContact SG-CB 3.47Å; C89-C123 CovalentContact SG-SG 2.04Å; C89-C123 PolarHBondContact SG-SG 2.89Å; V119-C123 VanDerWaalsContact O-CB 3.25Å; V119-C123 WeakPolarHBondContact O-CB 3.42Å; V119-C123 PolarHBondContact O-N 3.5Å; T120-C123 VanDerWaalsContact O-CB 3.23Å; T120-C123 WeakPolarHBondContact O-CB 3.32Å; T121-C123 VanDerWaalsContact C-N 3.32Å; T121-C123 PolarHBondContact O-N 2.9Å; C123-S127 VanDerWaalsContact O-CB 3.27Å; C123-S127 WeakPolarHBondContact O-CB 3.4Å; C123-S127 PolarHBondContact O-N 3.35Å; C123-S127 PolarHBondContact O-OG 3.09Å
124M93Very high94Very high4 Ų423.3 Ų23.32%0.0212%0.124CC..Hα-helixtrans-57.5-54.9177.6179.3-171.476.700111.2T120 T121 L122 S127 V128 R210 W252 F255T120-M124 PolarHBondContact O-N 3.13Å; T121-M124 WeakPolarHBondContact O-CB 3.35Å; T121-M124 PolarHBondContact O-N 3.43Å; L122-M124 PolarHBondContact O-N 3.36Å; M124-S127 PolarHBondContact O-N 2.94Å; M124-V128 WeakPolarHBondContact O-CG1 3.29Å; M124-V128 PolarHBondContact O-N 3.22Å; M124-R210 HydrophobicContact CE-CG 3.85Å; M124-W252 HydrophobicContact CB-CH2 3.34Å; M124-W252 HydrophobicContact CB-CZ2 3.99Å; M124-W252 HydrophobicContact CB-CZ3 3.64Å; M124-W252 HydrophobicContact CG-CD2 4.34Å; M124-W252 HydrophobicContact CG-CE3 3.72Å; M124-W252 HydrophobicContact CG-CH2 3.5Å; M124-W252 VanDerWaalsContact CG-CH2 3.5Å; M124-W252 HydrophobicContact CG-CZ2 4.09Å; M124-W252 HydrophobicContact CG-CZ3 3.27Å; M124-W252 HydrophobicContact SD-CE3 3.97Å; M124-W252 HydrophobicContact SD-CH2 4.26Å; M124-W252 HydrophobicContact SD-CZ3 3.52Å; M124-W252 VanDerWaalsContact SD-CZ3 3.52Å; M124-F255 HydrophobicContact SD-CE1 4.18Å
125Y96.1Very high93.6Very high7 Ų718.4 Ų18.43%0.02711%0.106CC..Hα-helixtrans-67.1-41.4-176.5-72.4-57.2000112.5T121 L122 V128 L129 L171 R210T121-Y125 HydrophobicContact CG2-CD2 3.75Å; T121-Y125 HydrophobicContact CG2-CE2 3.49Å; T121-Y125 VanDerWaalsContact CG2-CE2 3.49Å; T121-Y125 WeakPolarHBondContact O-CD2 3.33Å; T121-Y125 PolarHBondContact O-N 3.11Å; T121-Y125 VanDerWaalsContact O-N 3.13Å; L122-Y125 PolarHBondContact O-N 3.35Å; Y125-V128 WeakPolarHBondContact O-CG1 3.21Å; Y125-L129 WeakPolarHBondContact O-CB 3.23Å; Y125-L129 WeakPolarHBondContact O-CD1 3.44Å; Y125-L129 WeakPolarHBondContact O-CG 3.37Å; Y125-L129 PolarHBondContact O-N 3.48Å; Y125-L171 HydrophobicContact CD1-CB 4.2Å; Y125-L171 HydrophobicContact CD1-CD1 3.81Å; Y125-L171 HydrophobicContact CD2-CB 3.68Å; Y125-L171 HydrophobicContact CE1-CB 4.12Å; Y125-L171 HydrophobicContact CE1-CD1 3.93Å; Y125-L171 HydrophobicContact CE2-CB 3.57Å; Y125-L171 VanDerWaalsContact CE2-O 3.3Å; Y125-L171 WeakPolarHBondContact CE2-O 3.5Å; Y125-L171 HydrophobicContact CG-CB 3.99Å; Y125-L171 HydrophobicContact CG-CD1 4.23Å; Y125-R210 VanDerWaalsContact OH-CA 3.31Å; Y125-R210 WeakPolarHBondContact OH-CA 3.18Å
126A96.2Very high93.4Very high1 Ų114 Ų141%0.0089%0.087CC..Hα-helixtrans-60.8-48.2177.400000110.4A85 L122 L130 W165 A168A85-A126 HydrophobicContact CB-CB 4.02Å; L122-A126 WeakPolarHBondContact O-CB 3.45Å; L122-A126 PolarHBondContact O-N 3.03Å; A126-L130 VanDerWaalsContact O-CB 3.23Å; A126-L130 WeakPolarHBondContact O-CB 3.05Å; A126-L130 WeakPolarHBondContact O-CD1 3.3Å; A126-L130 WeakPolarHBondContact O-CG 3.31Å; A126-L130 PolarHBondContact O-N 3.3Å; A126-W165 HydrophobicContact CB-CE3 4.27Å; A126-W165 HydrophobicContact CB-CH2 4.07Å; A126-W165 HydrophobicContact CB-CZ2 4.46Å; A126-W165 HydrophobicContact CB-CZ3 3.96Å; A126-A168 HydrophobicContact CB-CB 4.15Å
127S93.3Very high93Very high0 Ų013.5 Ų13.50%08%0.084CC..Hα-helixtrans-60.7-50-180-580000111.9C123 M124 L130 L131C123-S127 VanDerWaalsContact O-CB 3.27Å; C123-S127 WeakPolarHBondContact O-CB 3.4Å; C123-S127 PolarHBondContact O-N 3.35Å; C123-S127 PolarHBondContact O-OG 3.09Å; M124-S127 PolarHBondContact O-N 2.94Å; S127-L130 PolarHBondContact O-N 3.18Å; S127-L131 WeakPolarHBondContact O-CB 3.38Å; S127-L131 VanDerWaalsContact O-CG 3.31Å; S127-L131 WeakPolarHBondContact O-CG 3.27Å; S127-L131 PolarHBondContact O-N 3.12Å
128V94.6Very high92.5Very high0 Ų014.4 Ų14.40%09%0.088CC..Hα-helixtrans-68.3-39.3-177.175.80000112.5M124 Y125 L131 T132 P218 M222 F248M124-V128 WeakPolarHBondContact O-CG1 3.29Å; M124-V128 PolarHBondContact O-N 3.22Å; Y125-V128 WeakPolarHBondContact O-CG1 3.21Å; V128-L131 PolarHBondContact O-N 2.76Å; V128-T132 WeakPolarHBondContact O-CB 3.15Å; V128-T132 PolarHBondContact O-N 3.49Å; V128-T132 PolarHBondContact O-OG1 3.46Å; V128-P218 HydrophobicContact CG2-CB 3.43Å; V128-P218 VanDerWaalsContact CG2-CB 3.43Å; V128-P218 HydrophobicContact CG2-CG 3.69Å; V128-M222 HydrophobicContact CG2-CE 4.23Å; V128-F248 HydrophobicContact CB-CE1 4.06Å; V128-F248 HydrophobicContact CB-CE2 4.1Å; V128-F248 HydrophobicContact CB-CZ 3.51Å; V128-F248 HydrophobicContact CG2-CE1 3.63Å; V128-F248 HydrophobicContact CG2-CZ 3.65Å
129L96Very high91.9Very high22 Ų2216.3 Ų16.312%0.1159%0.094CC..Hα-helixtrans-69.7-41.2178.9-68.8172.4000111.2Y125 T132 A133 L167 A168 L171Y125-L129 WeakPolarHBondContact O-CB 3.23Å; Y125-L129 WeakPolarHBondContact O-CD1 3.44Å; Y125-L129 WeakPolarHBondContact O-CG 3.37Å; Y125-L129 PolarHBondContact O-N 3.48Å; L129-T132 PolarHBondContact O-N 3.3Å; L129-A133 WeakPolarHBondContact O-CB 2.83Å; L129-A133 PolarHBondContact O-N 2.86Å; L129-L167 HydrophobicContact CD1-CB 4.03Å; L129-L167 HydrophobicContact CD1-CD2 3.97Å; L129-L167 HydrophobicContact CD1-CG 3.92Å; L129-L167 HydrophobicContact CD2-CD2 4.05Å; L129-A168 HydrophobicContact CD1-CB 4.11Å; L129-L171 HydrophobicContact CD1-CD1 4.49Å
130L93.3Very high91.5Very high4 Ų417.8 Ų17.82%0.02110%0.1CC..Hα-helixtrans-64-41.8174.8-71.3168.3000111.8W78 H81 A85 A126 S127 A133 L134 W165W78-L130 HydrophobicContact CE3-CD2 4.32Å; W78-L130 HydrophobicContact CZ3-CD2 4.12Å; H81-L130 HydrophobicContact CB-CD1 3.93Å; H81-L130 HydrophobicContact CB-CD2 3.96Å; A85-L130 HydrophobicContact CB-CD1 4.34Å; A126-L130 VanDerWaalsContact O-CB 3.23Å; A126-L130 WeakPolarHBondContact O-CB 3.05Å; A126-L130 WeakPolarHBondContact O-CD1 3.3Å; A126-L130 WeakPolarHBondContact O-CG 3.31Å; A126-L130 PolarHBondContact O-N 3.3Å; S127-L130 PolarHBondContact O-N 3.18Å; L130-A133 PolarHBondContact O-N 3.31Å; L130-L134 VanDerWaalsContact O-CB 3.3Å; L130-L134 WeakPolarHBondContact O-CB 3.44Å; L130-L134 PolarHBondContact O-N 3.47Å; L130-W165 HydrophobicContact CD1-CZ2 4.34Å
131L90.9Very high90.9Very high4 Ų418.4 Ų18.42%0.02110%0.101CC..Hα-helixtrans-64.5-40174.7-77.1171.9000112.3L82 S127 V128 L134 S135 M222 V244 F248L82-L131 HydrophobicContact CD1-CG 4.19Å; L82-L131 HydrophobicContact CD2-CD2 3.98Å; S127-L131 WeakPolarHBondContact O-CB 3.38Å; S127-L131 VanDerWaalsContact O-CG 3.31Å; S127-L131 WeakPolarHBondContact O-CG 3.27Å; S127-L131 PolarHBondContact O-N 3.12Å; V128-L131 PolarHBondContact O-N 2.76Å; L131-L134 PolarHBondContact O-N 3.14Å; L131-S135 WeakPolarHBondContact O-CB 3.25Å; L131-S135 PolarHBondContact O-N 3.1Å; L131-S135 PolarHBondContact O-OG 3.28Å; L131-M222 HydrophobicContact CB-SD 4.02Å; L131-V244 HydrophobicContact CD1-CG1 4.46Å; L131-V244 HydrophobicContact CD2-CG1 3.61Å; L131-F248 HydrophobicContact CD1-CB 4.14Å; L131-F248 HydrophobicContact CD1-CD2 3.75Å; L131-F248 HydrophobicContact CD1-CE2 4.47Å; L131-F248 HydrophobicContact CD1-CG 4.02Å
132T93.9Very high90.2Very high24 Ų2418.5 Ų18.515%0.14710%0.104CC..Hα-helixtrans-63.3-47175.7-57.40000110.6V128 L129 S135 A136 P218 F221V128-T132 WeakPolarHBondContact O-CB 3.15Å; V128-T132 PolarHBondContact O-N 3.49Å; V128-T132 PolarHBondContact O-OG1 3.46Å; L129-T132 PolarHBondContact O-N 3.3Å; T132-S135 WeakPolarHBondContact O-CB 3.33Å; T132-S135 PolarHBondContact O-N 3.47Å; T132-A136 PolarHBondContact O-N 3.19Å; T132-P218 WeakPolarHBondContact OG1-CB 3.28Å; T132-F221 HydrophobicContact CG2-CD1 3.55Å; T132-F221 HydrophobicContact CG2-CE1 3.94Å; T132-F221 HydrophobicContact CG2-CG 4.29Å
133A93.1Very high89.4Confident18 Ų1820.8 Ų20.815%0.14911%0.113CC..Hα-helixtrans-66.5-39.4179.100000112.4W78 L129 L130 A136 D137W78-A133 HydrophobicContact CH2-CB 3.53Å; W78-A133 HydrophobicContact CZ2-CB 4.46Å; W78-A133 HydrophobicContact CZ3-CB 3.67Å; L129-A133 WeakPolarHBondContact O-CB 2.83Å; L129-A133 PolarHBondContact O-N 2.86Å; L130-A133 PolarHBondContact O-N 3.31Å; A133-A136 WeakPolarHBondContact O-CB 3.47Å; A133-A136 PolarHBondContact O-N 3.07Å; A133-D137 PolarHBondContact O-N 3.34Å
134L88.4Confident89Confident22 Ų2228.5 Ų28.512%0.11514%0.142CC..Hα-helixtrans-59.2-49.3170.6172.760.3000110.5W78 F79 L130 L131 A136 D137 L138W78-L134 HydrophobicContact CB-CD1 3.95Å; W78-L134 HydrophobicContact CD2-CB 4.32Å; W78-L134 HydrophobicContact CD2-CD1 4.46Å; W78-L134 HydrophobicContact CG-CB 4.37Å; W78-L134 HydrophobicContact CG-CD1 3.78Å; F79-L134 HydrophobicContact CE1-CD2 4.07Å; L130-L134 VanDerWaalsContact O-CB 3.3Å; L130-L134 WeakPolarHBondContact O-CB 3.44Å; L130-L134 PolarHBondContact O-N 3.47Å; L131-L134 PolarHBondContact O-N 3.14Å; L134-A136 PolarHBondContact O-N 3.28Å; L134-D137 PolarHBondContact O-N 2.85Å; L134-D137 VanDerWaalsContact O-N 3.12Å; L134-L138 HydrophobicContact CD1-CD1 3.93Å; L134-L138 HydrophobicContact CD1-CD2 4.2Å; L134-L138 HydrophobicContact CD1-CG 3.91Å; L134-L138 HydrophobicContact CG-CD1 3.95Å; L134-L138 HydrophobicContact CG-CG 4.34Å; L134-L138 VanDerWaalsContact O-CG 3.25Å; L134-L138 WeakPolarHBondContact O-CG 3.38Å; L134-L138 PolarHBondContact O-N 2.04Å
135S87.6Confident88.3Confident5 Ų532.9 Ų32.94%0.03517%0.17CC..Hα-helixtrans-57.5-38.6178-58.20000111.9L131 T132 F139 H226L131-S135 WeakPolarHBondContact O-CB 3.25Å; L131-S135 PolarHBondContact O-N 3.1Å; L131-S135 PolarHBondContact O-OG 3.28Å; T132-S135 WeakPolarHBondContact O-CB 3.33Å; T132-S135 PolarHBondContact O-N 3.47Å; S135-F139 VanDerWaalsContact O-CB 3.28Å; S135-F139 WeakPolarHBondContact O-CB 3.46Å; S135-F139 PolarHBondContact O-N 3.48Å; S135-H226 PolarHBondContact OG-NE2 3.12Å
136A90.4Very high87.7Confident26 Ų2636.6 Ų36.622%0.21520%0.197CC..Hα-helixtrans-66-46.1174.200000112.7T132 A133 L134 L138 F139 L140 F221T132-A136 PolarHBondContact O-N 3.19Å; A133-A136 WeakPolarHBondContact O-CB 3.47Å; A133-A136 PolarHBondContact O-N 3.07Å; L134-A136 PolarHBondContact O-N 3.28Å; A136-L138 VanDerWaalsContact C-N 3.32Å; A136-L138 PolarHBondContact O-N 3.01Å; A136-F139 PolarHBondContact O-N 2.74Å; A136-L140 WeakPolarHBondContact O-CG 3.35Å; A136-L140 PolarHBondContact O-N 2.96Å; A136-F221 HydrophobicContact CB-CE1 3.9Å; A136-F221 HydrophobicContact CB-CZ 3.74Å
137D86.3Confident87.1Confident8 Ų839.4 Ų39.44%0.04321%0.208CC..Hα-helixtrans-62.4-39.7176.7-177.646000111.3W78 A133 L134 L140 Q141 W147 R153W78-D137 HydrophobicContact CZ2-CB 4.37Å; W78-D137 PolarHBondContact NE1-OD2 2.99Å; A133-D137 PolarHBondContact O-N 3.34Å; L134-D137 PolarHBondContact O-N 2.85Å; L134-D137 VanDerWaalsContact O-N 3.12Å; D137-L140 PolarHBondContact O-N 3.36Å; D137-Q141 VanDerWaalsContact CG-NE2 3.25Å; D137-Q141 WeakPolarHBondContact O-CB 3.48Å; D137-Q141 VanDerWaalsContact O-CG 3.27Å; D137-Q141 WeakPolarHBondContact O-CG 3.14Å; D137-Q141 PolarHBondContact O-N 3.18Å; D137-Q141 PolarHBondContact O-NE2 2.93Å; D137-Q141 PolarHBondContact OD1-NE2 3.29Å; D137-Q141 PolarHBondContact OD2-NE2 2.91Å; D137-W147 PolarHBondContact OD1-NE1 2.66Å; D137-R153 IonicContact OD1-CZ 3.92Å; D137-R153 IonicContact OD1-NE 3.12Å; D137-R153 PolarHBondContact OD1-NE 3.37Å; D137-R153 VanDerWaalsContact OD1-NE 3.12Å; D137-R153 IonicContact OD1-NH2 3.78Å; D137-R153 IonicContact OD2-CZ 3.77Å; D137-R153 IonicContact OD2-NE 3.68Å; D137-R153 IonicContact OD2-NH2 2.94Å; D137-R153 PolarHBondContact OD2-NH2 3.42Å
138L83.2Confident86.1Confident33 Ų3346 Ų4617%0.17324%0.236CC..Hα-helixtrans-66-42.4176.4-64.3176.1000111.4L134 A136 Q141 A142 W238L134-L138 HydrophobicContact CD1-CD1 3.93Å; L134-L138 HydrophobicContact CD1-CD2 4.2Å; L134-L138 HydrophobicContact CD1-CG 3.91Å; L134-L138 HydrophobicContact CG-CD1 3.95Å; L134-L138 HydrophobicContact CG-CG 4.34Å; L134-L138 VanDerWaalsContact O-CG 3.25Å; L134-L138 WeakPolarHBondContact O-CG 3.38Å; L134-L138 PolarHBondContact O-N 2.04Å; A136-L138 VanDerWaalsContact C-N 3.32Å; A136-L138 PolarHBondContact O-N 3.01Å; L138-Q141 PolarHBondContact O-N 2.76Å; L138-A142 PolarHBondContact O-N 3.44Å; L138-A142 VanDerWaalsContact O-N 3.13Å; L138-W238 HydrophobicContact CB-CH2 4Å; L138-W238 HydrophobicContact CB-CZ3 3.75Å; L138-W238 HydrophobicContact CD1-CE3 4.45Å; L138-W238 HydrophobicContact CD1-CZ3 3.8Å; L138-W238 HydrophobicContact CD2-CH2 3.96Å; L138-W238 HydrophobicContact CD2-CZ3 3.65Å; L138-W238 HydrophobicContact CG-CH2 4.4Å; L138-W238 HydrophobicContact CG-CZ3 3.87Å
139F84Confident85.3Confident59 Ų5951.7 Ų51.726%0.25927%0.271SS..Hα-helixtrans-61.1-49.1174.4-178.2-93.9000111.3S135 A136 Q141 A142 F143 C225 V228S135-F139 VanDerWaalsContact O-CB 3.28Å; S135-F139 WeakPolarHBondContact O-CB 3.46Å; S135-F139 PolarHBondContact O-N 3.48Å; A136-F139 PolarHBondContact O-N 2.74Å; F139-Q141 VanDerWaalsContact C-N 3.32Å; F139-Q141 PolarHBondContact O-N 3.5Å; F139-A142 PolarHBondContact O-N 2.99Å; F139-A142 VanDerWaalsContact O-N 3.1Å; F139-F143 HydrophobicContact CD1-CD2 4.16Å; F139-F143 AromaticContact CD2-CD2 3.71Å; F139-F143 HydrophobicContact CD2-CD2 3.71Å; F139-F143 AromaticContact CD2-CE2 3.66Å; F139-F143 HydrophobicContact CD2-CE2 3.66Å; F139-F143 AromaticContact CE1-CD2 3.94Å; F139-F143 HydrophobicContact CE1-CD2 3.94Å; F139-F143 HydrophobicContact CE1-CG 4.37Å; F139-F143 AromaticContact CE2-CD2 3.48Å; F139-F143 HydrophobicContact CE2-CD2 3.48Å; F139-F143 VanDerWaalsContact CE2-CD2 3.48Å; F139-F143 AromaticContact CE2-CE2 3.25Å; F139-F143 HydrophobicContact CE2-CE2 3.25Å; F139-F143 HydrophobicContact CE2-CG 4.46Å; F139-F143 HydrophobicContact CE2-CZ 4.09Å; F139-F143 HydrophobicContact CG-CD2 4.05Å; F139-F143 HydrophobicContact CG-CE2 4.45Å; F139-F143 AromaticContact CZ-CD2 3.59Å; F139-F143 HydrophobicContact CZ-CD2 3.59Å; F139-F143 AromaticContact CZ-CE2 3.74Å; F139-F143 HydrophobicContact CZ-CE2 3.74Å; F139-F143 HydrophobicContact CZ-CG 4.17Å; F139-F143 HydrophobicContact CZ-CZ 4.4Å; F139-F143 WeakPolarHBondContact O-CD2 3.36Å; F139-F143 PolarHBondContact O-N 3.48Å; F139-C225 HydrophobicContact CB-CB 4.31Å; F139-C225 HydrophobicContact CD2-CB 4.11Å; F139-C225 HydrophobicContact CG-CB 4.46Å; F139-V228 HydrophobicContact CE2-CB 4.26Å; F139-V228 HydrophobicContact CE2-CG1 3.97Å
140L85.4Confident84.7Confident64 Ų6452.3 Ų52.334%0.33528%0.278SS..Hα-helixtrans-61.2-39.2178.5-72.5172.7000112.6A136 D137 A142 F143 R144 W147A136-L140 WeakPolarHBondContact O-CG 3.35Å; A136-L140 PolarHBondContact O-N 2.96Å; D137-L140 PolarHBondContact O-N 3.36Å; L140-A142 VanDerWaalsContact C-N 3.3Å; L140-A142 PolarHBondContact O-N 3.48Å; L140-F143 PolarHBondContact O-N 2.89Å; L140-R144 WeakPolarHBondContact O-CA 3.12Å; L140-R144 WeakPolarHBondContact O-CB 3.23Å; L140-R144 PolarHBondContact O-N 3.25Å; L140-W147 HydrophobicContact CB-CG 4.05Å; L140-W147 HydrophobicContact CD1-CZ2 4.42Å
141Q80.2Confident84.1Confident42 Ų4259.4 Ų59.420%0.19632%0.315CS..Hα-helixtrans-64.1-33.5175.4-76.9170.790.100113.1D137 L138 F139 R153D137-Q141 VanDerWaalsContact CG-NE2 3.25Å; D137-Q141 WeakPolarHBondContact O-CB 3.48Å; D137-Q141 VanDerWaalsContact O-CG 3.27Å; D137-Q141 WeakPolarHBondContact O-CG 3.14Å; D137-Q141 PolarHBondContact O-N 3.18Å; D137-Q141 PolarHBondContact O-NE2 2.93Å; D137-Q141 PolarHBondContact OD1-NE2 3.29Å; D137-Q141 PolarHBondContact OD2-NE2 2.91Å; L138-Q141 PolarHBondContact O-N 2.76Å; F139-Q141 VanDerWaalsContact C-N 3.32Å; F139-Q141 PolarHBondContact O-N 3.5Å; Q141-R153 VanDerWaalsContact CD-NH2 3.32Å
142A78.2Confident83.9Confident19 Ų1965.7 Ų65.716%0.15734%0.344CS..Hα-helixtrans-73.9-39.7177.600000112.2L138 F139 L140 L229 M233L138-A142 PolarHBondContact O-N 3.44Å; L138-A142 VanDerWaalsContact O-N 3.13Å; F139-A142 PolarHBondContact O-N 2.99Å; F139-A142 VanDerWaalsContact O-N 3.1Å; L140-A142 VanDerWaalsContact C-N 3.3Å; L140-A142 PolarHBondContact O-N 3.48Å; A142-L229 HydrophobicContact CB-CD1 3.57Å; A142-M233 HydrophobicContact CB-CE 3.98Å
143F81.2Confident83.6Confident74 Ų7466 Ų6633%0.32534%0.343SS..Hα-helixtrans-95.3-24.8-172.5-80.3-81.9000115.2F139 L140 V228F139-F143 HydrophobicContact CD1-CD2 4.16Å; F139-F143 AromaticContact CD2-CD2 3.71Å; F139-F143 HydrophobicContact CD2-CD2 3.71Å; F139-F143 AromaticContact CD2-CE2 3.66Å; F139-F143 HydrophobicContact CD2-CE2 3.66Å; F139-F143 AromaticContact CE1-CD2 3.94Å; F139-F143 HydrophobicContact CE1-CD2 3.94Å; F139-F143 HydrophobicContact CE1-CG 4.37Å; F139-F143 AromaticContact CE2-CD2 3.48Å; F139-F143 HydrophobicContact CE2-CD2 3.48Å; F139-F143 VanDerWaalsContact CE2-CD2 3.48Å; F139-F143 AromaticContact CE2-CE2 3.25Å; F139-F143 HydrophobicContact CE2-CE2 3.25Å; F139-F143 HydrophobicContact CE2-CG 4.46Å; F139-F143 HydrophobicContact CE2-CZ 4.09Å; F139-F143 HydrophobicContact CG-CD2 4.05Å; F139-F143 HydrophobicContact CG-CE2 4.45Å; F139-F143 AromaticContact CZ-CD2 3.59Å; F139-F143 HydrophobicContact CZ-CD2 3.59Å; F139-F143 AromaticContact CZ-CE2 3.74Å; F139-F143 HydrophobicContact CZ-CE2 3.74Å; F139-F143 HydrophobicContact CZ-CG 4.17Å; F139-F143 HydrophobicContact CZ-CZ 4.4Å; F139-F143 WeakPolarHBondContact O-CD2 3.36Å; F139-F143 PolarHBondContact O-N 3.48Å; L140-F143 PolarHBondContact O-N 2.89Å; F143-V228 HydrophobicContact CE1-CG1 4.3Å; F143-V228 HydrophobicContact CE2-CG1 3.53Å; F143-V228 HydrophobicContact CZ-CG1 3.18Å
144R82.9Confident83.5Confident163 Ų16370.1 Ų70.162%0.61536%0.357SS*.  trans-124.189.3178.4-64-159.7-178.2-169.92.9109.1L140 S146 W147L140-R144 WeakPolarHBondContact O-CA 3.12Å; L140-R144 WeakPolarHBondContact O-CB 3.23Å; L140-R144 PolarHBondContact O-N 3.25Å; R144-S146 PolarHBondContact O-N 3.28Å; R144-S146 VanDerWaalsContact O-N 3.1Å; R144-W147 HydrophobicContact CB-CB 3.94Å; R144-W147 WeakPolarHBondContact O-CA 3.37Å; R144-W147 WeakPolarHBondContact O-CB 3.17Å; R144-W147 PolarHBondContact O-N 3.12Å
145P78.5Confident83.6Confident96 Ų9674.2 Ų74.262%0.62338%0.379SS*.Hα-helixtrans-53.9-33177.1-26.934.9000113W147 K148P145-W147 VanDerWaalsContact C-N 3.27Å; P145-W147 PolarHBondContact O-N 3.43Å; P145-K148 VanDerWaalsContact O-CB 3.32Å; P145-K148 WeakPolarHBondContact O-CB 3.27Å; P145-K148 PolarHBondContact O-N 3.13Å; P145-K148 VanDerWaalsContact O-N 3.13Å
146S84.4Confident83.8Confident84 Ų8475 Ų7559%0.58739%0.388SS*.Hα-helixtrans-62.8-28.4173.856.20000113.8R144 K148 S150R144-S146 PolarHBondContact O-N 3.28Å; R144-S146 VanDerWaalsContact O-N 3.1Å; S146-K148 VanDerWaalsContact C-N 3.34Å; S146-S150 VanDerWaalsContact O-CB 3.32Å; S146-S150 WeakPolarHBondContact O-CB 3.4Å; S146-S150 PolarHBondContact O-N 3.43Å; S146-S150 VanDerWaalsContact O-N 3.12Å
147W83.4Confident83.8Confident61 Ų6174 Ų7423%0.23138%0.379CS..Hα-helixtrans-66-37.8173.4-179.3-109.9000111.6D137 L140 R144 P145 T149 S150 R153D137-W147 PolarHBondContact OD1-NE1 2.66Å; L140-W147 HydrophobicContact CB-CG 4.05Å; L140-W147 HydrophobicContact CD1-CZ2 4.42Å; R144-W147 HydrophobicContact CB-CB 3.94Å; R144-W147 WeakPolarHBondContact O-CA 3.37Å; R144-W147 WeakPolarHBondContact O-CB 3.17Å; R144-W147 PolarHBondContact O-N 3.12Å; P145-W147 VanDerWaalsContact C-N 3.27Å; P145-W147 PolarHBondContact O-N 3.43Å; W147-T149 PolarHBondContact O-N 3.36Å; W147-S150 PolarHBondContact O-N 3.1Å; W147-R153 HydrophobicContact CD2-CB 4.33Å; W147-R153 HydrophobicContact CD2-CG 4.44Å; W147-R153 HydrophobicContact CH2-CB 4.4Å; W147-R153 HydrophobicContact CZ2-CB 4.07Å; W147-R153 HydrophobicContact CZ2-CG 3.9Å; W147-R153 WeakPolarHBondContact O-CD 3.39Å
148K72.5Confident84.2Confident137 Ų13780.5 Ų80.560%0.59640%0.403SS*.Hα-helixtrans-60.8-35.7-178-171.4-180177.5-177.50112.2P145 S146P145-K148 VanDerWaalsContact O-CB 3.32Å; P145-K148 WeakPolarHBondContact O-CB 3.27Å; P145-K148 PolarHBondContact O-N 3.13Å; P145-K148 VanDerWaalsContact O-N 3.13Å; S146-K148 VanDerWaalsContact C-N 3.34Å
149T78.2Confident84.8Confident120 Ų12083 Ų8374%0.73642%0.419SS*.THydrogen-bonded Turntrans-104.26.2-178.957.60000113.3W147W147-T149 PolarHBondContact O-N 3.36Å
150S82.6Confident85.3Confident36 Ų3682.3 Ų82.325%0.25242%0.422SS..  trans-77.3132-178.1-177.30000111.7S146 W147 H152 R153S146-S150 VanDerWaalsContact O-CB 3.32Å; S146-S150 WeakPolarHBondContact O-CB 3.4Å; S146-S150 PolarHBondContact O-N 3.43Å; S146-S150 VanDerWaalsContact O-N 3.12Å; W147-S150 PolarHBondContact O-N 3.1Å; S150-H152 PolarHBondContact O-N 2.81Å; S150-H152 PolarHBondContact OG-N 3.43Å; S150-R153 VanDerWaalsContact O-CB 3.27Å; S150-R153 WeakPolarHBondContact O-CB 3.41Å; S150-R153 PolarHBondContact O-N 3.04Å
151D81.8Confident85.8Confident152 Ų15279.6 Ų79.681%0.81341%0.407SS*.THydrogen-bonded Turntrans-60.1-28.3170.6-68-30.9000112.3R153D151-R153 VanDerWaalsContact C-N 3.26Å; D151-R153 PolarHBondContact O-N 3.32Å
152H85.9Confident86.6Confident136 Ų13682 Ų8263%0.6343%0.425SS*.Hα-helixtrans-71-17.8176.9-60.1-63.5000113.5S150 K154 L155 G156S150-H152 PolarHBondContact O-N 2.81Å; S150-H152 PolarHBondContact OG-N 3.43Å; H152-K154 VanDerWaalsContact C-N 3.28Å; H152-K154 PolarHBondContact O-N 2.86Å; H152-L155 PolarHBondContact O-N 2.94Å; H152-G156 PolarHBondContact O-N 2.86Å
153R88.2Confident87.5Confident30 Ų3084 Ų8411%0.11344%0.437CS..Hα-helixtrans-61.7-38.2179.5178.2172.3171-117.9-5.6112D137 Q141 W147 S150 D151 L155 G156 V157D137-R153 IonicContact OD1-CZ 3.92Å; D137-R153 IonicContact OD1-NE 3.12Å; D137-R153 PolarHBondContact OD1-NE 3.37Å; D137-R153 VanDerWaalsContact OD1-NE 3.12Å; D137-R153 IonicContact OD1-NH2 3.78Å; D137-R153 IonicContact OD2-CZ 3.77Å; D137-R153 IonicContact OD2-NE 3.68Å; D137-R153 IonicContact OD2-NH2 2.94Å; D137-R153 PolarHBondContact OD2-NH2 3.42Å; Q141-R153 VanDerWaalsContact CD-NH2 3.32Å; W147-R153 HydrophobicContact CD2-CB 4.33Å; W147-R153 HydrophobicContact CD2-CG 4.44Å; W147-R153 HydrophobicContact CH2-CB 4.4Å; W147-R153 HydrophobicContact CZ2-CB 4.07Å; W147-R153 HydrophobicContact CZ2-CG 3.9Å; W147-R153 WeakPolarHBondContact O-CD 3.39Å; S150-R153 VanDerWaalsContact O-CB 3.27Å; S150-R153 WeakPolarHBondContact O-CB 3.41Å; S150-R153 PolarHBondContact O-N 3.04Å; D151-R153 VanDerWaalsContact C-N 3.26Å; D151-R153 PolarHBondContact O-N 3.32Å; R153-L155 VanDerWaalsContact C-N 3.31Å; R153-L155 PolarHBondContact O-N 2.75Å; R153-G156 PolarHBondContact O-N 3.02Å; R153-V157 HydrophobicContact CG-CG2 4.31Å; R153-V157 WeakPolarHBondContact O-CG2 3.26Å; R153-V157 PolarHBondContact O-N 3.32Å
154K89.3Confident88.3Confident105 Ų10580.9 Ų80.946%0.45743%0.425SS..Hα-helixtrans-60.5-43.4177.6-168.9173.4179.7177.40111.8L74 H152 R158L74-K154 HydrophobicContact CD2-CB 3.73Å; L74-K154 HydrophobicContact CD2-CG 3.96Å; L74-K154 HydrophobicContact CG-CG 4.39Å; H152-K154 VanDerWaalsContact C-N 3.28Å; H152-K154 PolarHBondContact O-N 2.86Å; K154-R158 VanDerWaalsContact CE-NH2 3.3Å; K154-R158 WeakPolarHBondContact O-CG 3.46Å; K154-R158 PolarHBondContact O-N 2.89Å
155L91.3Very high89Confident109 Ų10975.1 Ų75.157%0.57140%0.403SS*.Hα-helixtrans-65.8-46.6175.5-179.561.3000110.6H152 R153 V157 R158 V159H152-L155 PolarHBondContact O-N 2.94Å; R153-L155 VanDerWaalsContact C-N 3.31Å; R153-L155 PolarHBondContact O-N 2.75Å; L155-V157 PolarHBondContact O-N 3.27Å; L155-R158 PolarHBondContact O-N 3.46Å; L155-V159 HydrophobicContact CD1-CG2 3.98Å; L155-V159 HydrophobicContact CG-CG2 4.25Å; L155-V159 WeakPolarHBondContact O-CB 3.31Å; L155-V159 VanDerWaalsContact O-CG2 3.31Å; L155-V159 WeakPolarHBondContact O-CG2 3.38Å; L155-V159 PolarHBondContact O-N 3.06Å
156G92.3Very high89.9Confident21 Ų2176.2 Ų76.222%0.21640%0.401CS..Hα-helixtrans-55.1-49.8177.700000112.9H152 R153 R158 V159 S160H152-G156 PolarHBondContact O-N 2.86Å; R153-G156 PolarHBondContact O-N 3.02Å; G156-R158 PolarHBondContact O-N 3.28Å; G156-V159 PolarHBondContact O-N 3.12Å; G156-S160 WeakPolarHBondContact O-CB 3.29Å; G156-S160 PolarHBondContact O-N 3.49Å; G156-S160 PolarHBondContact O-OG 3.43Å; G156-S160 VanDerWaalsContact O-OG 3.06Å
157V91.1Very high90.5Very high6 Ų675.5 Ų75.54%0.03639%0.391CS..Hα-helixtrans-58.8-47.7177.21690000111.4W78 R153 L155 V159 S160 Q161W78-V157 HydrophobicContact CZ2-CB 4.22Å; W78-V157 HydrophobicContact CZ2-CG1 3.8Å; W78-V157 HydrophobicContact CZ2-CG2 4.1Å; R153-V157 HydrophobicContact CG-CG2 4.31Å; R153-V157 WeakPolarHBondContact O-CG2 3.26Å; R153-V157 PolarHBondContact O-N 3.32Å; L155-V157 PolarHBondContact O-N 3.27Å; V157-V159 PolarHBondContact O-N 3.46Å; V157-S160 PolarHBondContact O-N 2.88Å; V157-Q161 HydrophobicContact CG1-CG 4.42Å; V157-Q161 VanDerWaalsContact O-CG 3.27Å; V157-Q161 WeakPolarHBondContact O-CG 3.42Å; V157-Q161 PolarHBondContact O-N 3.35Å
158R93Very high91.2Very high144 Ų14472.6 Ų72.654%0.54338%0.38SS..Hα-helixtrans-62.4-45.3179.2-74.2175.8177.6-178.1-5.8112.2K154 L155 G156 S160 Q161 V162K154-R158 VanDerWaalsContact CE-NH2 3.3Å; K154-R158 WeakPolarHBondContact O-CG 3.46Å; K154-R158 PolarHBondContact O-N 2.89Å; L155-R158 PolarHBondContact O-N 3.46Å; G156-R158 PolarHBondContact O-N 3.28Å; R158-S160 VanDerWaalsContact C-N 3.33Å; R158-S160 PolarHBondContact O-N 3.5Å; R158-Q161 PolarHBondContact O-N 3.44Å; R158-V162 WeakPolarHBondContact O-CG2 3.32Å; R158-V162 PolarHBondContact O-N 3.39Å
159V95.4Very high92.4Very high84 Ų8470 Ų7051%0.50937%0.372SS..Hα-helixtrans-60.5-45.5177.2169.40000110.1L155 G156 V157 Q161 V162 S163L155-V159 HydrophobicContact CD1-CG2 3.98Å; L155-V159 HydrophobicContact CG-CG2 4.25Å; L155-V159 WeakPolarHBondContact O-CB 3.31Å; L155-V159 VanDerWaalsContact O-CG2 3.31Å; L155-V159 WeakPolarHBondContact O-CG2 3.38Å; L155-V159 PolarHBondContact O-N 3.06Å; G156-V159 PolarHBondContact O-N 3.12Å; V157-V159 PolarHBondContact O-N 3.46Å; V159-Q161 PolarHBondContact O-N 2.96Å; V159-V162 PolarHBondContact O-N 3.49Å; V159-S163 VanDerWaalsContact O-CB 3.26Å; V159-S163 WeakPolarHBondContact O-CB 3.49Å; V159-S163 PolarHBondContact O-N 3.3Å; V159-S163 PolarHBondContact O-OG 2.95Å; V159-S163 VanDerWaalsContact O-OG 3.11Å
160S95.6Very high93.3Very high45 Ų4569.8 Ų69.832%0.31537%0.366SS..Hα-helixtrans-63.7-37.4177.3-65.20000113G156 V157 R158 S163 S164G156-S160 WeakPolarHBondContact O-CB 3.29Å; G156-S160 PolarHBondContact O-N 3.49Å; G156-S160 PolarHBondContact O-OG 3.43Å; G156-S160 VanDerWaalsContact O-OG 3.06Å; V157-S160 PolarHBondContact O-N 2.88Å; R158-S160 VanDerWaalsContact C-N 3.33Å; R158-S160 PolarHBondContact O-N 3.5Å; S160-S163 WeakPolarHBondContact CA-OG 3.4Å; S160-S163 PolarHBondContact O-OG 3.38Å; S160-S163 VanDerWaalsContact O-OG 3.09Å; S160-S164 VanDerWaalsContact O-CB 3.28Å; S160-S164 WeakPolarHBondContact O-CB 3.16Å; S160-S164 PolarHBondContact O-N 3Å; S160-S164 PolarHBondContact O-OG 3.41Å
161Q95.3Very high94Very high7 Ų769.3 Ų69.33%0.03336%0.36CS..Hα-helixtrans-65.7-51.6175.7-73.4173-37.100111.1S77 W78 H81 V157 R158 V159 S163 S164 W165S77-Q161 PolarHBondContact O-NE2 3.49Å; S77-Q161 PolarHBondContact OG-NE2 2.86Å; S77-Q161 PolarHBondContact OG-OE1 3.44Å; W78-Q161 HydrophobicContact CE3-CG 3.89Å; W78-Q161 HydrophobicContact CH2-CG 3.88Å; W78-Q161 HydrophobicContact CZ3-CG 3.51Å; H81-Q161 PolarHBondContact CD2-NE2 2.83Å; V157-Q161 HydrophobicContact CG1-CG 4.42Å; V157-Q161 VanDerWaalsContact O-CG 3.27Å; V157-Q161 WeakPolarHBondContact O-CG 3.42Å; V157-Q161 PolarHBondContact O-N 3.35Å; R158-Q161 PolarHBondContact O-N 3.44Å; V159-Q161 PolarHBondContact O-N 2.96Å; Q161-S163 VanDerWaalsContact C-N 3.35Å; Q161-S163 PolarHBondContact O-N 2.82Å; Q161-S164 PolarHBondContact O-N 2.88Å; Q161-W165 VanDerWaalsContact O-CD1 3.27Å; Q161-W165 PolarHBondContact O-N 3.19Å; Q161-W165 VanDerWaalsContact O-N 3.12Å
162V97.1Very high94.7Very high94 Ų9462.5 Ų62.557%0.5732%0.324SS*.Hα-helixtrans-60.7-45.9178.4172.90000110.5R158 V159 S164 W165 M166R158-V162 WeakPolarHBondContact O-CG2 3.32Å; R158-V162 PolarHBondContact O-N 3.39Å; V159-V162 PolarHBondContact O-N 3.49Å; V162-S164 VanDerWaalsContact C-N 3.31Å; V162-S164 PolarHBondContact O-N 2.96Å; V162-W165 PolarHBondContact O-N 3.43Å; V162-M166 HydrophobicContact CG1-CG 4.18Å; V162-M166 VanDerWaalsContact O-CG 3.29Å; V162-M166 WeakPolarHBondContact O-CG 3.4Å; V162-M166 PolarHBondContact O-N 3.42Å
163S97.3Very high95.2Very high59 Ų5959.7 Ų59.741%0.41332%0.316SS..Hα-helixtrans-63.9-36.9179.371.10000112.3V159 S160 Q161 M166 L167V159-S163 VanDerWaalsContact O-CB 3.26Å; V159-S163 WeakPolarHBondContact O-CB 3.49Å; V159-S163 PolarHBondContact O-N 3.3Å; V159-S163 PolarHBondContact O-OG 2.95Å; V159-S163 VanDerWaalsContact O-OG 3.11Å; S160-S163 WeakPolarHBondContact CA-OG 3.4Å; S160-S163 PolarHBondContact O-OG 3.38Å; S160-S163 VanDerWaalsContact O-OG 3.09Å; Q161-S163 VanDerWaalsContact C-N 3.35Å; Q161-S163 PolarHBondContact O-N 2.82Å; S163-M166 PolarHBondContact O-N 2.74Å; S163-L167 WeakPolarHBondContact O-CB 3.47Å; S163-L167 PolarHBondContact O-N 3.22Å
164S97.5Very high95.4Very high9 Ų960.3 Ų60.36%0.06332%0.324CS..Hα-helixtrans-61.8-45.2175.2-61.70000111.6S160 Q161 V162 A168S160-S164 VanDerWaalsContact O-CB 3.28Å; S160-S164 WeakPolarHBondContact O-CB 3.16Å; S160-S164 PolarHBondContact O-N 3Å; S160-S164 PolarHBondContact O-OG 3.41Å; Q161-S164 PolarHBondContact O-N 2.88Å; V162-S164 VanDerWaalsContact C-N 3.31Å; V162-S164 PolarHBondContact O-N 2.96Å; S164-A168 VanDerWaalsContact O-CB 3.23Å; S164-A168 WeakPolarHBondContact O-CB 3.47Å; S164-A168 PolarHBondContact O-N 3.48Å
165W98.1Very high95.5Very high42 Ų4255.5 Ų55.516%0.15930%0.304CS..Hα-helixtrans-66-45.7176.8-81.4100.5000112.5H81 V84 A85 L88 A126 L130 Q161 V162 L167 A168 L169H81-W165 AromaticContact CG-NE1 3.89Å; H81-W165 AromaticContact ND1-CD1 3.72Å; H81-W165 AromaticContact ND1-NE1 3.07Å; H81-W165 PolarHBondContact ND1-NE1 3.33Å; V84-W165 HydrophobicContact CG1-CH2 4.31Å; V84-W165 HydrophobicContact CG1-CZ2 4.24Å; A85-W165 HydrophobicContact CB-CH2 4.11Å; A85-W165 HydrophobicContact CB-CZ2 4.24Å; L88-W165 HydrophobicContact CD1-CH2 3.97Å; L88-W165 HydrophobicContact CD1-CZ3 4.17Å; A126-W165 HydrophobicContact CB-CE3 4.27Å; A126-W165 HydrophobicContact CB-CH2 4.07Å; A126-W165 HydrophobicContact CB-CZ2 4.46Å; A126-W165 HydrophobicContact CB-CZ3 3.96Å; L130-W165 HydrophobicContact CD1-CZ2 4.34Å; Q161-W165 VanDerWaalsContact O-CD1 3.27Å; Q161-W165 PolarHBondContact O-N 3.19Å; Q161-W165 VanDerWaalsContact O-N 3.12Å; V162-W165 PolarHBondContact O-N 3.43Å; W165-L167 VanDerWaalsContact C-N 3.34Å; W165-L167 PolarHBondContact O-N 3.22Å; W165-A168 PolarHBondContact O-N 2.89Å; W165-L169 WeakPolarHBondContact O-CB 3.49Å; W165-L169 WeakPolarHBondContact O-CG 3.44Å; W165-L169 PolarHBondContact O-N 3.24Å
166M98.1Very high95.6Very high119 Ų11952 Ų5259%0.58629%0.291SS*.Hα-helixtrans-63.1-42.1178.6-67.5-54.6-63.300111.8V162 S163 L169 L170V162-M166 HydrophobicContact CG1-CG 4.18Å; V162-M166 VanDerWaalsContact O-CG 3.29Å; V162-M166 WeakPolarHBondContact O-CG 3.4Å; V162-M166 PolarHBondContact O-N 3.42Å; S163-M166 PolarHBondContact O-N 2.74Å; M166-L169 PolarHBondContact O-N 3.22Å; M166-L169 HydrophobicContact SD-CD1 4.4Å; M166-L170 WeakPolarHBondContact O-CB 3.32Å; M166-L170 PolarHBondContact O-N 3.15Å
167L97.6Very high95.6Very high70 Ų7054.3 Ų54.337%0.36630%0.3SS..Hα-helixtrans-67.4-40.3176.2-176.860.1000111.4L129 S163 W165 L169 L170 L171L129-L167 HydrophobicContact CD1-CB 4.03Å; L129-L167 HydrophobicContact CD1-CD2 3.97Å; L129-L167 HydrophobicContact CD1-CG 3.92Å; L129-L167 HydrophobicContact CD2-CD2 4.05Å; S163-L167 WeakPolarHBondContact O-CB 3.47Å; S163-L167 PolarHBondContact O-N 3.22Å; W165-L167 VanDerWaalsContact C-N 3.34Å; W165-L167 PolarHBondContact O-N 3.22Å; L167-L169 VanDerWaalsContact C-N 3.35Å; L167-L169 PolarHBondContact O-N 3.48Å; L167-L170 HydrophobicContact CD1-CD2 4.41Å; L167-L170 PolarHBondContact O-N 3.44Å; L167-L171 HydrophobicContact CD1-CD1 4.18Å; L167-L171 HydrophobicContact CD1-CG 4.12Å; L167-L171 HydrophobicContact CG-CD1 3.95Å; L167-L171 HydrophobicContact CG-CG 4.33Å; L167-L171 WeakPolarHBondContact O-CB 3.36Å; L167-L171 VanDerWaalsContact O-CG 3.28Å; L167-L171 WeakPolarHBondContact O-CG 3.32Å; L167-L171 PolarHBondContact O-N 3.09Å
168A97.8Very high95.8Very high0 Ų056.9 Ų56.90%031%0.31CS..Hα-helixtrans-61.6-42.5175.400000112.1L122 A126 L129 S164 W165 L171 T172L122-A168 HydrophobicContact CD1-CB 3.79Å; A126-A168 HydrophobicContact CB-CB 4.15Å; L129-A168 HydrophobicContact CD1-CB 4.11Å; S164-A168 VanDerWaalsContact O-CB 3.23Å; S164-A168 WeakPolarHBondContact O-CB 3.47Å; S164-A168 PolarHBondContact O-N 3.48Å; W165-A168 PolarHBondContact O-N 2.89Å; A168-L171 PolarHBondContact O-N 3.42Å; A168-T172 WeakPolarHBondContact O-CB 3.43Å; A168-T172 PolarHBondContact O-N 3.14Å; A168-T172 VanDerWaalsContact O-N 3.07Å; A168-T172 PolarHBondContact O-OG1 3.17Å
169L97.4Very high95.8Very high83 Ų8351.1 Ų51.144%0.43529%0.289SS..Hα-helixtrans-61.6-46.4174.1-74.1166000111.2L122 W165 M166 L167 T172 V173L122-L169 HydrophobicContact CD1-CD2 3.82Å; L122-L169 HydrophobicContact CD1-CG 3.99Å; L122-L169 HydrophobicContact CD2-CD2 3.89Å; W165-L169 WeakPolarHBondContact O-CB 3.49Å; W165-L169 WeakPolarHBondContact O-CG 3.44Å; W165-L169 PolarHBondContact O-N 3.24Å; M166-L169 PolarHBondContact O-N 3.22Å; M166-L169 HydrophobicContact SD-CD1 4.4Å; L167-L169 VanDerWaalsContact C-N 3.35Å; L167-L169 PolarHBondContact O-N 3.48Å; L169-T172 WeakPolarHBondContact O-CB 3.32Å; L169-T172 PolarHBondContact O-N 3.47Å; L169-T172 VanDerWaalsContact O-N 3.16Å; L169-V173 PolarHBondContact O-N 3.49Å
170L97.4Very high95.8Very high115 Ų11550.2 Ų50.260%0.60228%0.276SS*.Hα-helixtrans-59.8-47.9177.6-179.863.5000112M166 L167 T172 V173M166-L170 WeakPolarHBondContact O-CB 3.32Å; M166-L170 PolarHBondContact O-N 3.15Å; L167-L170 HydrophobicContact CD1-CD2 4.41Å; L167-L170 PolarHBondContact O-N 3.44Å; L170-T172 PolarHBondContact O-N 3.36Å; L170-V173 WeakPolarHBondContact O-CB 3.36Å; L170-V173 WeakPolarHBondContact O-CG2 3.22Å; L170-V173 PolarHBondContact O-N 2.9Å
171L96.3Very high95.7Very high26 Ų2650.5 Ų50.514%0.13627%0.274CS..Hα-helixtrans-67.5-17.7179-68.5173.6000113.1Y125 L129 L167 A168 P174 V209 F213Y125-L171 HydrophobicContact CD1-CB 4.2Å; Y125-L171 HydrophobicContact CD1-CD1 3.81Å; Y125-L171 HydrophobicContact CD2-CB 3.68Å; Y125-L171 HydrophobicContact CE1-CB 4.12Å; Y125-L171 HydrophobicContact CE1-CD1 3.93Å; Y125-L171 HydrophobicContact CE2-CB 3.57Å; Y125-L171 VanDerWaalsContact CE2-O 3.3Å; Y125-L171 WeakPolarHBondContact CE2-O 3.5Å; Y125-L171 HydrophobicContact CG-CB 3.99Å; Y125-L171 HydrophobicContact CG-CD1 4.23Å; L129-L171 HydrophobicContact CD1-CD1 4.49Å; L167-L171 HydrophobicContact CD1-CD1 4.18Å; L167-L171 HydrophobicContact CD1-CG 4.12Å; L167-L171 HydrophobicContact CG-CD1 3.95Å; L167-L171 HydrophobicContact CG-CG 4.33Å; L167-L171 WeakPolarHBondContact O-CB 3.36Å; L167-L171 VanDerWaalsContact O-CG 3.28Å; L167-L171 WeakPolarHBondContact O-CG 3.32Å; L167-L171 PolarHBondContact O-N 3.09Å; A168-L171 PolarHBondContact O-N 3.42Å; L171-P174 WeakPolarHBondContact O-CD 3.46Å; L171-V209 HydrophobicContact CD2-CG1 4.1Å; L171-F213 HydrophobicContact CD1-CB 4.11Å
172T97Very high95.6Very high9 Ų953.5 Ų53.56%0.05529%0.288CS..Hα-helixtrans-83.2-20.1176.5-61.70000112.8S118 T121 L122 A168 L169 L170 P174 S175 A176S118-T172 VanDerWaalsContact O-CG2 3.22Å; S118-T172 WeakPolarHBondContact O-CG2 3.42Å; T121-T172 HydrophobicContact CG2-CG2 4.24Å; L122-T172 VanDerWaalsContact CA-OG1 3.28Å; L122-T172 WeakPolarHBondContact CA-OG1 3.45Å; L122-T172 HydrophobicContact CB-CG2 4.2Å; L122-T172 PolarHBondContact N-OG1 3.45Å; A168-T172 WeakPolarHBondContact O-CB 3.43Å; A168-T172 PolarHBondContact O-N 3.14Å; A168-T172 VanDerWaalsContact O-N 3.07Å; A168-T172 PolarHBondContact O-OG1 3.17Å; L169-T172 WeakPolarHBondContact O-CB 3.32Å; L169-T172 PolarHBondContact O-N 3.47Å; L169-T172 VanDerWaalsContact O-N 3.16Å; L170-T172 PolarHBondContact O-N 3.36Å; T172-P174 VanDerWaalsContact C-CD 3.48Å; T172-S175 WeakPolarHBondContact O-CA 3.22Å; T172-S175 WeakPolarHBondContact O-CB 3.49Å; T172-S175 PolarHBondContact O-N 2.96Å; T172-A176 PolarHBondContact O-N 3.3Å
173V95.9Very high95.4Very high77 Ų7753.1 Ų53.147%0.46728%0.28SS..Hα-helixtrans-51-45.9-177.71740000113.3L169 L170 S175 A176 V177L169-V173 PolarHBondContact O-N 3.49Å; L170-V173 WeakPolarHBondContact O-CB 3.36Å; L170-V173 WeakPolarHBondContact O-CG2 3.22Å; L170-V173 PolarHBondContact O-N 2.9Å; V173-S175 PolarHBondContact O-N 3.47Å; V173-A176 WeakPolarHBondContact O-CB 3.06Å; V173-A176 PolarHBondContact O-N 3.29Å; V173-V177 HydrophobicContact CG1-CG2 4.07Å; V173-V177 WeakPolarHBondContact O-CG2 3.32Å; V173-V177 PolarHBondContact O-N 2.99Å
174P93.1Very high95Very high43 Ų4353.7 Ų53.728%0.27928%0.276SS..Hα-helixtrans-57.5-36.7177.3-25.135.6000112.9L171 T172 A176 V177 Y178 I206L171-P174 WeakPolarHBondContact O-CD 3.46Å; T172-P174 VanDerWaalsContact C-CD 3.48Å; P174-A176 VanDerWaalsContact C-N 3.35Å; P174-A176 PolarHBondContact O-N 3.48Å; P174-V177 PolarHBondContact O-N 3.41Å; P174-Y178 HydrophobicContact CB-CD2 4.15Å; P174-Y178 HydrophobicContact CB-CE2 4.38Å; P174-Y178 WeakPolarHBondContact O-CB 3.41Å; P174-Y178 WeakPolarHBondContact O-CD2 3.27Å; P174-Y178 PolarHBondContact O-N 3.12Å; P174-I206 HydrophobicContact CB-CD1 4.08Å; P174-I206 HydrophobicContact CB-CG1 4.24Å; P174-I206 HydrophobicContact CB-CG2 4.36Å
175S91.6Very high94.4Very high4 Ų459.6 Ų59.63%0.02830%0.302CS..Hα-helixtrans-60.6-45176.2-170.70000111.3S117 T121 T172 V173 V177 H179S117-S175 PolarHBondContact O-OG 3.39Å; T121-S175 PolarHBondContact OG1-OG 3.47Å; T172-S175 WeakPolarHBondContact O-CA 3.22Å; T172-S175 WeakPolarHBondContact O-CB 3.49Å; T172-S175 PolarHBondContact O-N 2.96Å; V173-S175 PolarHBondContact O-N 3.47Å; S175-V177 VanDerWaalsContact C-N 3.32Å; S175-V177 PolarHBondContact O-N 3.38Å; S175-H179 WeakPolarHBondContact O-CB 3.38Å; S175-H179 PolarHBondContact O-N 2.92Å; S175-H179 PolarHBondContact O-ND1 3.24Å; S175-H179 PolarHBondContact OG-CE1 3.43Å; S175-H179 VanDerWaalsContact OG-CE1 3.29Å; S175-H179 PolarHBondContact OG-ND1 2.86Å
176A91.9Very high93.6Very high35 Ų3567 Ų6729%0.28934%0.336SS..Hα-helixtrans-65-36.217800000112.8S118 T172 V173 P174S118-A176 WeakPolarHBondContact OG-CA 3.24Å; S118-A176 VanDerWaalsContact OG-CB 3.29Å; S118-A176 WeakPolarHBondContact OG-CB 3.44Å; S118-A176 PolarHBondContact OG-N 2.9Å; T172-A176 PolarHBondContact O-N 3.3Å; V173-A176 WeakPolarHBondContact O-CB 3.06Å; V173-A176 PolarHBondContact O-N 3.29Å; P174-A176 VanDerWaalsContact C-N 3.35Å; P174-A176 PolarHBondContact O-N 3.48Å
177V94.1Very high92.9Very high69 Ų6965.5 Ų65.542%0.41834%0.335SS..Hα-helixtrans-76.2-44.6-175.4172.70000111.8V173 P174 S175 R180V173-V177 HydrophobicContact CG1-CG2 4.07Å; V173-V177 WeakPolarHBondContact O-CG2 3.32Å; V173-V177 PolarHBondContact O-N 2.99Å; P174-V177 PolarHBondContact O-N 3.41Å; S175-V177 VanDerWaalsContact C-N 3.32Å; S175-V177 PolarHBondContact O-N 3.38Å; V177-R180 VanDerWaalsContact O-CZ 3.3Å; V177-R180 PolarHBondContact O-NH1 3.44Å; V177-R180 PolarHBondContact O-NH2 2.87Å
178Y93.6Very high92.5Very high61 Ų6166.5 Ų66.524%0.23935%0.348CS..Hα-helixtrans-95.4-12.8-169.9-66.5-71.8000114.4P174 R180 D195 Y196 T202 I206P174-Y178 HydrophobicContact CB-CD2 4.15Å; P174-Y178 HydrophobicContact CB-CE2 4.38Å; P174-Y178 WeakPolarHBondContact O-CB 3.41Å; P174-Y178 WeakPolarHBondContact O-CD2 3.27Å; P174-Y178 PolarHBondContact O-N 3.12Å; Y178-R180 PolarHBondContact O-N 3.17Å; Y178-D195 WeakPolarHBondContact CD1-O 3.46Å; Y178-D195 PolarHBondContact O-N 3.49Å; Y178-Y196 AromaticContact CD1-CD1 3.93Å; Y178-Y196 HydrophobicContact CD1-CD1 3.93Å; Y178-Y196 HydrophobicContact CD2-CD1 4.29Å; Y178-Y196 HydrophobicContact CD2-CE1 4.33Å; Y178-Y196 HydrophobicContact CE1-CD1 4.44Å; Y178-Y196 AromaticContact CG-CD1 3.84Å; Y178-Y196 HydrophobicContact CG-CD1 3.84Å; Y178-Y196 HydrophobicContact CG-CE1 4.1Å; Y178-T202 HydrophobicContact CE1-CG2 4.06Å; Y178-T202 HydrophobicContact CE2-CG2 4.22Å; Y178-T202 WeakPolarHBondContact OH-CG2 3.46Å; Y178-I206 HydrophobicContact CD2-CD1 3.51Å; Y178-I206 HydrophobicContact CE2-CD1 3.41Å; Y178-I206 VanDerWaalsContact CE2-CD1 3.41Å; Y178-I206 HydrophobicContact CG-CD1 4.39Å
179H94Very high92.2Very high22 Ų2270.1 Ų70.110%0.10236%0.362CS..EExtended strand (participates in β ladder)trans-72.1130.7170.2-77.783.6000111.2S117 S175 A193 T194S117-H179 PolarHBondContact OG-CD2 2.87Å; S117-H179 VanDerWaalsContact OG-CD2 3.3Å; S175-H179 WeakPolarHBondContact O-CB 3.38Å; S175-H179 PolarHBondContact O-N 2.92Å; S175-H179 PolarHBondContact O-ND1 3.24Å; S175-H179 PolarHBondContact OG-CE1 3.43Å; S175-H179 VanDerWaalsContact OG-CE1 3.29Å; S175-H179 PolarHBondContact OG-ND1 2.86Å; H179-A193 WeakPolarHBondContact CA-O 3.23Å; H179-T194 VanDerWaalsContact CE1-CG2 3.47Å; H179-T194 WeakPolarHBondContact CE1-CG2 3.17Å; H179-T194 WeakPolarHBondContact NE2-CG2 3.28Å
180R94.3Very high92Very high65 Ų6568.4 Ų68.425%0.24535%0.353CS..EExtended strand (participates in β ladder)trans-137.2149.6-177.3-71.9-68.3-176.8-89.5-3.6110.2C113 V177 Y178 H182 A193 D195C113-R180 PolarHBondContact SG-O 3.26Å; V177-R180 VanDerWaalsContact O-CZ 3.3Å; V177-R180 PolarHBondContact O-NH1 3.44Å; V177-R180 PolarHBondContact O-NH2 2.87Å; Y178-R180 PolarHBondContact O-N 3.17Å; R180-H182 WeakPolarHBondContact CB-NE2 3.34Å; R180-A193 PolarHBondContact N-O 2.94Å; R180-A193 PolarHBondContact O-N 3.36Å; R180-D195 HydrophobicContact CB-CB 4.11Å; R180-D195 HydrophobicContact CG-CB 4Å
181L95.2Very high91.8Very high51 Ų5164.3 Ų64.327%0.26733%0.333SS..EExtended strand (participates in β ladder)trans-89.9123.2172.8-17072.6000107.7W106 A110 L190 V191W106-L181 HydrophobicContact CB-CD1 4.12Å; W106-L181 HydrophobicContact CG-CD1 3.95Å; A110-L181 HydrophobicContact CB-CB 4.22Å; A110-L181 HydrophobicContact CB-CD2 4.49Å; L181-L190 HydrophobicContact CD1-CB 4.12Å; L181-L190 HydrophobicContact CD2-CD1 4.4Å; L181-L190 HydrophobicContact CD2-CD2 3.92Å; L181-L190 HydrophobicContact CG-CD2 4.03Å; L181-V191 WeakPolarHBondContact CA-O 3.37Å
182H92.6Very high91.7Very high71 Ų7164.4 Ų64.433%0.32934%0.335SS..EExtended strand (participates in β ladder)trans-114.3144.7178.3-66.1-81.7000110.2R180 L190 V191 D195R180-H182 WeakPolarHBondContact CB-NE2 3.34Å; H182-L190 CarbonylContact O-C 3.56Å; H182-L190 WeakPolarHBondContact O-CA 3.45Å; H182-V191 PolarHBondContact N-O 2.92Å; H182-V191 PolarHBondContact O-N 3.44Å; H182-D195 IonicContact CE1-OD2 2.74Å
183Q92.6Very high91.4Very high85 Ų8565.8 Ų65.840%0.39735%0.347SS..EExtended strand (participates in β ladder)trans-94.7112.9169-175.771.431.400108.2H185 S188Q183-H185 PolarHBondContact O-ND1 3.29Å; Q183-S188 PolarHBondContact NE2-OG 2.87Å
184E88.3Confident91.1Very high71 Ų7164.5 Ų64.533%0.33234%0.34SS..EExtended strand (participates in β ladder)trans-83.7137.5163.2-67.7-175.517700108.2S188 R189 V191E184-S188 CarbonylContact O-C 3.59Å; E184-S188 VanDerWaalsContact O-CA 3.25Å; E184-S188 WeakPolarHBondContact O-CA 3.33Å; E184-R189 HydrophobicContact CB-CG 4.06Å; E184-R189 PolarHBondContact N-O 2.99Å; E184-R189 PolarHBondContact O-N 3.24Å; E184-R189 IonicContact OE2-CZ 3.19Å; E184-R189 IonicContact OE2-NE 2.76Å; E184-R189 PolarHBondContact OE2-NE 2.92Å; E184-R189 IonicContact OE2-NH2 3.19Å; E184-R189 PolarHBondContact OE2-NH2 3.27Å; E184-V191 HydrophobicContact CG-CG2 3.97Å
185H85.3Confident90.9Very high133 Ų13365.2 Ų65.262%0.61634%0.341SS*.EExtended strand (participates in β ladder)trans-97.6-20.1-176.1-65.778.9000112.4Q183 P187 S188Q183-H185 PolarHBondContact O-ND1 3.29Å; H185-P187 CarbonylContact O-C 3.55Å; H185-S188 PolarHBondContact O-N 2.96Å
186F81.5Confident90.7Very high197 Ų19765.9 Ų65.986%0.86434%0.343SS*.THydrogen-bonded Turntrans-137.898.5-175.5-58.9-77.2000111.1
187P83.3Confident90.5Very high89 Ų8973.5 Ų73.558%0.57837%0.365SS*.THydrogen-bonded Turncis-67.6158.9-1431.3-35.3000111.7H185 R189H185-P187 CarbonylContact O-C 3.55Å; P187-R189 PolarHBondContact O-N 3.44Å; P187-R189 VanDerWaalsContact O-N 3.09Å
188S89.1Confident89.8Confident91 Ų9173.5 Ų73.564%0.63638%0.379SS*.EExtended strand (participates in β ladder)trans-66.1110.5179.3-1730000111.3Q183 E184 H185Q183-S188 PolarHBondContact NE2-OG 2.87Å; E184-S188 CarbonylContact O-C 3.59Å; E184-S188 VanDerWaalsContact O-CA 3.25Å; E184-S188 WeakPolarHBondContact O-CA 3.33Å; H185-S188 PolarHBondContact O-N 2.96Å
189R91.3Very high89.7Confident76 Ų7672.7 Ų72.729%0.28738%0.381SS..EExtended strand (participates in β ladder)trans-156.1154.4176.662.7-179.6-179.6-172.3-1.6112.3K103 H105 E184 P187 V191K103-R189 PolarHBondContact O-NH1 3.35Å; H105-R189 HydrophobicContact CB-CB 4.38Å; E184-R189 HydrophobicContact CB-CG 4.06Å; E184-R189 PolarHBondContact N-O 2.99Å; E184-R189 PolarHBondContact O-N 3.24Å; E184-R189 IonicContact OE2-CZ 3.19Å; E184-R189 IonicContact OE2-NE 2.76Å; E184-R189 PolarHBondContact OE2-NE 2.92Å; E184-R189 IonicContact OE2-NH2 3.19Å; E184-R189 PolarHBondContact OE2-NH2 3.27Å; P187-R189 PolarHBondContact O-N 3.44Å; P187-R189 VanDerWaalsContact O-N 3.09Å; R189-V191 HydrophobicContact CG-CG2 3.94Å
190L93.8Very high89.4Confident47 Ų4778.3 Ų78.325%0.24641%0.412CS..EExtended strand (participates in β ladder)trans-86.7132.2169.7-69.9169000109.1H105 W106 L181 H182H105-L190 CarbonylContact C-O 3.52Å; H105-L190 WeakPolarHBondContact CA-O 3.29Å; H105-L190 PolarHBondContact ND1-N 3.1Å; W106-L190 HydrophobicContact CB-CB 4.41Å; W106-L190 WeakPolarHBondContact CB-O 3.5Å; W106-L190 PolarHBondContact N-O 3.2Å; L181-L190 HydrophobicContact CD1-CB 4.12Å; L181-L190 HydrophobicContact CD2-CD1 4.4Å; L181-L190 HydrophobicContact CD2-CD2 3.92Å; L181-L190 HydrophobicContact CG-CD2 4.03Å; H182-L190 CarbonylContact O-C 3.56Å; H182-L190 WeakPolarHBondContact O-CA 3.45Å
191V92.7Very high89.3Confident29 Ų2978.8 Ų78.818%0.17643%0.429CS..EExtended strand (participates in β ladder)trans-126.9136.2178-176.90000109.3L181 H182 E184 R189L181-V191 WeakPolarHBondContact CA-O 3.37Å; H182-V191 PolarHBondContact N-O 2.92Å; H182-V191 PolarHBondContact O-N 3.44Å; E184-V191 HydrophobicContact CG-CG2 3.97Å; R189-V191 HydrophobicContact CG-CG2 3.94Å
192C94.1Very high89.2Confident27 Ų2778.2 Ų78.218%0.18243%0.428CS..EExtended strand (participates in β ladder)trans-93.4115.6170.8179.50000108.8W106 C113W106-C192 HydrophobicContact CB-CB 4.47Å; W106-C192 HydrophobicContact CD2-CB 3.61Å; W106-C192 HydrophobicContact CE3-CB 3.73Å; W106-C192 HydrophobicContact CG-CB 3.92Å; W106-C192 HydrophobicContact CZ3-CB 4.2Å; C113-C192 WeakPolarHBondContact CA-SG 3.22Å; C113-C192 HydrophobicContact CB-CB 3.73Å; C113-C192 WeakPolarHBondContact CB-SG 3.29Å; C113-C192 PolarHBondContact O-SG 2.86Å; C113-C192 VanDerWaalsContact SG-CA 3.54Å; C113-C192 WeakPolarHBondContact SG-CB 3.25Å; C113-C192 CovalentContact SG-SG 2.03Å; C113-C192 PolarHBondContact SG-SG 3Å
193A90.8Very high89.1Confident38 Ų3877 Ų7731%0.31442%0.423SS..EExtended strand (participates in β ladder)trans-139.2164.2-177.800000111.6H179 R180H179-A193 WeakPolarHBondContact CA-O 3.23Å; R180-A193 PolarHBondContact N-O 2.94Å; R180-A193 PolarHBondContact O-N 3.36Å
194T89.9Confident89.1Confident51 Ų5175.2 Ų75.231%0.31342%0.422SS..EExtended strand (participates in β ladder)trans-80.4125.2171.949.50000110.5H179H179-T194 VanDerWaalsContact CE1-CG2 3.47Å; H179-T194 WeakPolarHBondContact CE1-CG2 3.17Å; H179-T194 WeakPolarHBondContact NE2-CG2 3.28Å
195D89.6Confident89.4Confident57 Ų5774.3 Ų74.331%0.30543%0.427SS..  trans-118.5101.1175.7176.57.1000110.1Y178 R180 H182 R197Y178-D195 WeakPolarHBondContact CD1-O 3.46Å; Y178-D195 PolarHBondContact O-N 3.49Å; R180-D195 HydrophobicContact CB-CB 4.11Å; R180-D195 HydrophobicContact CG-CB 4Å; H182-D195 IonicContact CE1-OD2 2.74Å; D195-R197 PolarHBondContact O-N 3.35Å; D195-R197 WeakPolarHBondContact OD1-CA 3.22Å; D195-R197 PolarHBondContact OD1-N 3.45Å
196Y87.4Confident89.8Confident19 Ų1969.1 Ų69.18%0.07540%0.404CS..  trans-85.418177-55.5-69.5000113.4Y178 G198 S199 T202 E203 I206Y178-Y196 AromaticContact CD1-CD1 3.93Å; Y178-Y196 HydrophobicContact CD1-CD1 3.93Å; Y178-Y196 HydrophobicContact CD2-CD1 4.29Å; Y178-Y196 HydrophobicContact CD2-CE1 4.33Å; Y178-Y196 HydrophobicContact CE1-CD1 4.44Å; Y178-Y196 AromaticContact CG-CD1 3.84Å; Y178-Y196 HydrophobicContact CG-CD1 3.84Å; Y178-Y196 HydrophobicContact CG-CE1 4.1Å; Y196-G198 PolarHBondContact O-N 3.04Å; Y196-G198 VanDerWaalsContact O-N 3.17Å; Y196-S199 WeakPolarHBondContact O-CB 3.15Å; Y196-S199 PolarHBondContact O-N 2.67Å; Y196-T202 HydrophobicContact CD1-CG2 4.27Å; Y196-E203 HydrophobicContact CD2-CB 3.52Å; Y196-E203 HydrophobicContact CD2-CG 3.56Å; Y196-E203 HydrophobicContact CE2-CB 3.91Å; Y196-E203 HydrophobicContact CE2-CG 3.49Å; Y196-E203 VanDerWaalsContact CE2-CG 3.49Å; Y196-E203 HydrophobicContact CG-CB 3.86Å; Y196-E203 HydrophobicContact CG-CG 4.36Å; Y196-I206 HydrophobicContact CD1-CD1 3.83Å; Y196-I206 HydrophobicContact CE1-CB 4.39Å; Y196-I206 HydrophobicContact CE1-CD1 3.52Å; Y196-I206 HydrophobicContact CE1-CG2 4.36Å
197R86.1Confident90.3Very high195 Ų19560.2 Ų60.274%0.73637%0.366SS*.THydrogen-bonded Turntrans54.432.9179.4-57177.5174.1-89.77.3113.4D195 S199D195-R197 PolarHBondContact O-N 3.35Å; D195-R197 WeakPolarHBondContact OD1-CA 3.22Å; D195-R197 PolarHBondContact OD1-N 3.45Å; R197-S199 VanDerWaalsContact C-N 3.27Å; R197-S199 PolarHBondContact O-N 2.91Å
198G81.4Confident90.9Very high69 Ų6958.1 Ų58.171%0.71136%0.356SS*.THydrogen-bonded Turntrans74.95.9-178.200000115.6Y196 L200Y196-G198 PolarHBondContact O-N 3.04Å; Y196-G198 VanDerWaalsContact O-N 3.17Å; G198-L200 PolarHBondContact O-N 3.44Å
199S90.6Very high91.1Very high43 Ų4356.7 Ų56.730%0.30134%0.343SS..  trans-85.399178.11780000111.7Y196 R197 A201 T202 E203Y196-S199 WeakPolarHBondContact O-CB 3.15Å; Y196-S199 PolarHBondContact O-N 2.67Å; R197-S199 VanDerWaalsContact C-N 3.27Å; R197-S199 PolarHBondContact O-N 2.91Å; S199-A201 PolarHBondContact O-N 3.5Å; S199-T202 WeakPolarHBondContact CB-OG1 3.35Å; S199-T202 PolarHBondContact O-N 2.94Å; S199-T202 WeakPolarHBondContact OG-CB 3.48Å; S199-T202 PolarHBondContact OG-N 3.32Å; S199-T202 VanDerWaalsContact OG-N 3.16Å; S199-T202 PolarHBondContact OG-OG1 3.39Å; S199-E203 PolarHBondContact O-N 3.25Å; S199-E203 VanDerWaalsContact O-N 3.08Å
200L88.4Confident91.3Very high140 Ų14054 Ų5473%0.73333%0.333SS*.Hα-helixtrans-58.6-36173.7-71.899.2000112.1G198 T202 E203 A204G198-L200 PolarHBondContact O-N 3.44Å; L200-T202 PolarHBondContact O-N 3.3Å; L200-E203 PolarHBondContact O-N 3.49Å; L200-A204 VanDerWaalsContact O-CB 3.28Å; L200-A204 WeakPolarHBondContact O-CB 3.33Å; L200-A204 PolarHBondContact O-N 3.32Å
201A91.6Very high91.3Very high75 Ų7554.5 Ų54.562%0.6233%0.333SS*.Hα-helixtrans-64.8-40.3178.500000111.8S199 A205S199-A201 PolarHBondContact O-N 3.5Å; A201-A205 WeakPolarHBondContact O-CB 3.35Å; A201-A205 PolarHBondContact O-N 3.05Å
202T91.9Very high91.4Very high39 Ų3957.2 Ų57.224%0.23935%0.346CS..Hα-helixtrans-67.7-44.1177.4-59.50000111.1Y178 Y196 S199 L200 A205 I206Y178-T202 HydrophobicContact CE1-CG2 4.06Å; Y178-T202 HydrophobicContact CE2-CG2 4.22Å; Y178-T202 WeakPolarHBondContact OH-CG2 3.46Å; Y196-T202 HydrophobicContact CD1-CG2 4.27Å; S199-T202 WeakPolarHBondContact CB-OG1 3.35Å; S199-T202 PolarHBondContact O-N 2.94Å; S199-T202 WeakPolarHBondContact OG-CB 3.48Å; S199-T202 PolarHBondContact OG-N 3.32Å; S199-T202 VanDerWaalsContact OG-N 3.16Å; S199-T202 PolarHBondContact OG-OG1 3.39Å; L200-T202 PolarHBondContact O-N 3.3Å; T202-A205 PolarHBondContact O-N 3.48Å; T202-I206 HydrophobicContact CG2-CD1 3.73Å; T202-I206 WeakPolarHBondContact O-CB 3.23Å; T202-I206 VanDerWaalsContact O-CG1 3.29Å; T202-I206 WeakPolarHBondContact O-CG1 3.5Å; T202-I206 PolarHBondContact O-N 2.9Å
203E92Very high91.3Very high46 Ų4661 Ų6122%0.21536%0.36CS..Hα-helixtrans-59-52.1175.3-178.8173178.400111.4Y196 S199 L200 A205 I206 T207 T263Y196-E203 HydrophobicContact CD2-CB 3.52Å; Y196-E203 HydrophobicContact CD2-CG 3.56Å; Y196-E203 HydrophobicContact CE2-CB 3.91Å; Y196-E203 HydrophobicContact CE2-CG 3.49Å; Y196-E203 VanDerWaalsContact CE2-CG 3.49Å; Y196-E203 HydrophobicContact CG-CB 3.86Å; Y196-E203 HydrophobicContact CG-CG 4.36Å; S199-E203 PolarHBondContact O-N 3.25Å; S199-E203 VanDerWaalsContact O-N 3.08Å; L200-E203 PolarHBondContact O-N 3.49Å; E203-A205 VanDerWaalsContact C-N 3.34Å; E203-A205 PolarHBondContact O-N 3.4Å; E203-I206 PolarHBondContact O-N 3.29Å; E203-T207 WeakPolarHBondContact O-CB 3.33Å; E203-T207 PolarHBondContact O-N 2.78Å; E203-T207 PolarHBondContact O-OG1 3.3Å; E203-T263 HydrophobicContact CG-CG2 3.88Å; E203-T263 WeakPolarHBondContact OE1-CA 3.32Å; E203-T263 PolarHBondContact OE1-OG1 3.18Å
204A92.3Very high91.4Very high47 Ų4759.2 Ų59.239%0.38835%0.345SS..Hα-helixtrans-59.5-43.3178.500000112.1L200 T207 A208 T263L200-A204 VanDerWaalsContact O-CB 3.28Å; L200-A204 WeakPolarHBondContact O-CB 3.33Å; L200-A204 PolarHBondContact O-N 3.32Å; A204-T207 PolarHBondContact O-N 3.44Å; A204-A208 WeakPolarHBondContact O-CB 3.28Å; A204-A208 PolarHBondContact O-N 2.98Å; A204-T263 HydrophobicContact CB-CG2 4.37Å
205A94.1Very high91.5Very high53 Ų5357.6 Ų57.644%0.43833%0.334SS..Hα-helixtrans-63.3-44.917800000112A201 T202 E203 A208 V209A201-A205 WeakPolarHBondContact O-CB 3.35Å; A201-A205 PolarHBondContact O-N 3.05Å; T202-A205 PolarHBondContact O-N 3.48Å; E203-A205 VanDerWaalsContact C-N 3.34Å; E203-A205 PolarHBondContact O-N 3.4Å; A205-A208 PolarHBondContact O-N 3.48Å; A205-V209 WeakPolarHBondContact O-CB 3.28Å; A205-V209 VanDerWaalsContact O-CG2 3.27Å; A205-V209 WeakPolarHBondContact O-CG2 3.39Å; A205-V209 PolarHBondContact O-N 3.32Å
206I93.3Very high91.7Very high23 Ų2357.6 Ų57.612%0.11833%0.333CS..Hα-helixtrans-66.4-43.4179-70166.8000110.8P174 Y178 Y196 T202 E203 V209 R210P174-I206 HydrophobicContact CB-CD1 4.08Å; P174-I206 HydrophobicContact CB-CG1 4.24Å; P174-I206 HydrophobicContact CB-CG2 4.36Å; Y178-I206 HydrophobicContact CD2-CD1 3.51Å; Y178-I206 HydrophobicContact CE2-CD1 3.41Å; Y178-I206 VanDerWaalsContact CE2-CD1 3.41Å; Y178-I206 HydrophobicContact CG-CD1 4.39Å; Y196-I206 HydrophobicContact CD1-CD1 3.83Å; Y196-I206 HydrophobicContact CE1-CB 4.39Å; Y196-I206 HydrophobicContact CE1-CD1 3.52Å; Y196-I206 HydrophobicContact CE1-CG2 4.36Å; T202-I206 HydrophobicContact CG2-CD1 3.73Å; T202-I206 WeakPolarHBondContact O-CB 3.23Å; T202-I206 VanDerWaalsContact O-CG1 3.29Å; T202-I206 WeakPolarHBondContact O-CG1 3.5Å; T202-I206 PolarHBondContact O-N 2.9Å; E203-I206 PolarHBondContact O-N 3.29Å; I206-V209 PolarHBondContact O-N 3.26Å; I206-R210 VanDerWaalsContact O-CB 3.27Å; I206-R210 WeakPolarHBondContact O-CB 3.28Å; I206-R210 PolarHBondContact O-N 3.38Å
207T93.1Very high92.1Very high11 Ų1158.4 Ų58.47%0.06735%0.347CS..Hα-helixtrans-62.9-42.5176-68.10000111.2E203 A204 R210 F211 V260 T263E203-T207 WeakPolarHBondContact O-CB 3.33Å; E203-T207 PolarHBondContact O-N 2.78Å; E203-T207 PolarHBondContact O-OG1 3.3Å; A204-T207 PolarHBondContact O-N 3.44Å; T207-R210 PolarHBondContact O-N 3.25Å; T207-F211 WeakPolarHBondContact O-CB 3.23Å; T207-F211 PolarHBondContact O-N 2.94Å; T207-V260 HydrophobicContact CG2-CG2 4.19Å; T207-T263 PolarHBondContact OG1-OG1 3.06Å
208A94.3Very high92.5Very high45 Ų4549.6 Ų49.637%0.37232%0.315SS..Hα-helixtrans-64.8-46.8176.900000112.2A204 A205 R210 F211 L212A204-A208 WeakPolarHBondContact O-CB 3.28Å; A204-A208 PolarHBondContact O-N 2.98Å; A205-A208 PolarHBondContact O-N 3.48Å; A208-R210 VanDerWaalsContact C-N 3.32Å; A208-R210 PolarHBondContact O-N 2.78Å; A208-F211 PolarHBondContact O-N 2.97Å; A208-L212 WeakPolarHBondContact O-CB 3.16Å; A208-L212 VanDerWaalsContact O-CG 3.28Å; A208-L212 WeakPolarHBondContact O-CG 3.29Å; A208-L212 PolarHBondContact O-N 2.87Å
209V94.6Very high93.1Very high60 Ų6048.7 Ų48.736%0.36429%0.294SS..Hα-helixtrans-59.3-45.7175.4168.20000110.3L171 A205 I206 F211 L212 F213L171-V209 HydrophobicContact CD2-CG1 4.1Å; A205-V209 WeakPolarHBondContact O-CB 3.28Å; A205-V209 VanDerWaalsContact O-CG2 3.27Å; A205-V209 WeakPolarHBondContact O-CG2 3.39Å; A205-V209 PolarHBondContact O-N 3.32Å; I206-V209 PolarHBondContact O-N 3.26Å; V209-F211 VanDerWaalsContact C-N 3.33Å; V209-F211 PolarHBondContact O-N 3.13Å; V209-L212 PolarHBondContact O-N 3.25Å; V209-F213 HydrophobicContact CG1-CD2 3.92Å; V209-F213 HydrophobicContact CG1-CE2 4.46Å; V209-F213 WeakPolarHBondContact O-CB 3.5Å; V209-F213 WeakPolarHBondContact O-CD2 3.27Å; V209-F213 PolarHBondContact O-N 3.31Å
210R94.5Very high93.2Very high20 Ų2051.3 Ų51.38%0.07530%0.304CS..Hα-helixtrans-59.8-43.4176.4-174.4-175-66135-2.9112M124 Y125 I206 T207 A208 G214M124-R210 HydrophobicContact CE-CG 3.85Å; Y125-R210 VanDerWaalsContact OH-CA 3.31Å; Y125-R210 WeakPolarHBondContact OH-CA 3.18Å; I206-R210 VanDerWaalsContact O-CB 3.27Å; I206-R210 WeakPolarHBondContact O-CB 3.28Å; I206-R210 PolarHBondContact O-N 3.38Å; T207-R210 PolarHBondContact O-N 3.25Å; A208-R210 VanDerWaalsContact C-N 3.32Å; A208-R210 PolarHBondContact O-N 2.78Å; R210-G214 WeakPolarHBondContact O-CA 3.48Å; R210-G214 PolarHBondContact O-N 3.39Å
211F94.2Very high93.5Very high58 Ų5848.6 Ų48.625%0.25429%0.287SS..Hα-helixtrans-67.3-44.4178.9-177.1-106000112.2T207 A208 V209 F215 L216 H256 V260T207-F211 WeakPolarHBondContact O-CB 3.23Å; T207-F211 PolarHBondContact O-N 2.94Å; A208-F211 PolarHBondContact O-N 2.97Å; V209-F211 VanDerWaalsContact C-N 3.33Å; V209-F211 PolarHBondContact O-N 3.13Å; F211-F215 HydrophobicContact CD2-CD1 4.26Å; F211-F215 AromaticContact CE2-CD1 3.67Å; F211-F215 HydrophobicContact CE2-CD1 3.67Å; F211-F215 HydrophobicContact CE2-CE1 4.2Å; F211-F215 HydrophobicContact CZ-CD1 4.13Å; F211-F215 CarbonylContact O-C 3.58Å; F211-F215 WeakPolarHBondContact O-CA 3.37Å; F211-F215 WeakPolarHBondContact O-CB 3.39Å; F211-F215 PolarHBondContact O-N 2.87Å; F211-F215 VanDerWaalsContact O-N 3.15Å; F211-L216 HydrophobicContact CD1-CB 4.29Å; F211-L216 HydrophobicContact CE1-CB 3.92Å; F211-L216 HydrophobicContact CE1-CD2 3.91Å; F211-L216 HydrophobicContact CE1-CG 4.44Å; F211-L216 HydrophobicContact CZ-CB 4.31Å; F211-L216 PolarHBondContact O-N 2.84Å; F211-H256 HydrophobicContact CD2-CB 4Å; F211-H256 HydrophobicContact CE2-CB 4.24Å; F211-V260 HydrophobicContact CD2-CG2 4.19Å; F211-V260 HydrophobicContact CG-CG2 4.47Å
212L94.4Very high93.5Very high86 Ų8645 Ų4545%0.4526%0.257SS..Iπ-helixtrans-69.2-49.7-178.1-70.3171.4000112.1A208 V209 L216 G217 P218A208-L212 WeakPolarHBondContact O-CB 3.16Å; A208-L212 VanDerWaalsContact O-CG 3.28Å; A208-L212 WeakPolarHBondContact O-CG 3.29Å; A208-L212 PolarHBondContact O-N 2.87Å; V209-L212 PolarHBondContact O-N 3.25Å; L212-L216 HydrophobicContact CD2-CD2 4.12Å; L212-G217 WeakPolarHBondContact O-CA 3.14Å; L212-G217 PolarHBondContact O-N 2.92Å; L212-P218 WeakPolarHBondContact O-CD 3.15Å
213F93.1Very high93.4Very high106 Ų10645.9 Ų45.947%0.46527%0.268SS..Iπ-helixtrans-89.1-25.6-174.9-69.7-83.9000113.7L171 V209 P218L171-F213 HydrophobicContact CD1-CB 4.11Å; V209-F213 HydrophobicContact CG1-CD2 3.92Å; V209-F213 HydrophobicContact CG1-CE2 4.46Å; V209-F213 WeakPolarHBondContact O-CB 3.5Å; V209-F213 WeakPolarHBondContact O-CD2 3.27Å; V209-F213 PolarHBondContact O-N 3.31Å; F213-P218 VanDerWaalsContact O-CG 3.22Å; F213-P218 WeakPolarHBondContact O-CG 3.35Å
214G91.6Very high93.3Very high0 Ų049 Ų490%029%0.285CS..Iπ-helixtrans-87.8-18.3177.300000113.9R210R210-G214 WeakPolarHBondContact O-CA 3.48Å; R210-G214 PolarHBondContact O-N 3.39Å
215F93.4Very high93Very high18 Ų1847 Ų478%0.07927%0.268CS..Iπ-helixtrans-142.6-72.6-171.5-172.7-100.1000114.2F211 P218 L219 F249 T253 H256F211-F215 HydrophobicContact CD2-CD1 4.26Å; F211-F215 AromaticContact CE2-CD1 3.67Å; F211-F215 HydrophobicContact CE2-CD1 3.67Å; F211-F215 HydrophobicContact CE2-CE1 4.2Å; F211-F215 HydrophobicContact CZ-CD1 4.13Å; F211-F215 CarbonylContact O-C 3.58Å; F211-F215 WeakPolarHBondContact O-CA 3.37Å; F211-F215 WeakPolarHBondContact O-CB 3.39Å; F211-F215 PolarHBondContact O-N 2.87Å; F211-F215 VanDerWaalsContact O-N 3.15Å; F215-P218 WeakPolarHBondContact O-CD 3.45Å; F215-L219 HydrophobicContact CE1-CD2 4.02Å; F215-L219 HydrophobicContact CZ-CD2 4.16Å; F215-L219 WeakPolarHBondContact O-CB 3.45Å; F215-L219 PolarHBondContact O-N 3.49Å; F215-F249 AromaticContact CD2-CD1 3.72Å; F215-F249 HydrophobicContact CD2-CD1 3.72Å; F215-F249 AromaticContact CD2-CE1 3.93Å; F215-F249 HydrophobicContact CD2-CE1 3.93Å; F215-F249 AromaticContact CE2-CD1 3.5Å; F215-F249 HydrophobicContact CE2-CD1 3.5Å; F215-F249 VanDerWaalsContact CE2-CD1 3.5Å; F215-F249 HydrophobicContact CE2-CE1 4.16Å; F215-F249 HydrophobicContact CZ-CD1 4.2Å; F215-T253 VanDerWaalsContact CE2-OG1 3.28Å; F215-T253 WeakPolarHBondContact CE2-OG1 3.04Å; F215-T253 HydrophobicContact CZ-CG2 4.1Å; F215-T253 WeakPolarHBondContact CZ-OG1 3.01Å; F215-H256 HydrophobicContact CB-CB 4.44Å; F215-H256 HydrophobicContact CD2-CB 4.37Å; F215-H256 AromaticContact CD2-CD2 3.35Å; F215-H256 WeakPolarHBondContact CD2-CD2 3.14Å; F215-H256 AromaticContact CD2-CG 3.98Å; F215-H256 HydrophobicContact CG-CB 4.22Å; F215-H256 AromaticContact CG-CD2 3.65Å; F215-H256 AromaticContact CG-CG 3.87Å
216L94.1Very high92.4Very high57 Ų5745.1 Ų45.130%0.29825%0.25SS..Iπ-helixtrans-65.2-48.7-165.4-178.962.8000113F211 L212 L219 L220F211-L216 HydrophobicContact CD1-CB 4.29Å; F211-L216 HydrophobicContact CE1-CB 3.92Å; F211-L216 HydrophobicContact CE1-CD2 3.91Å; F211-L216 HydrophobicContact CE1-CG 4.44Å; F211-L216 HydrophobicContact CZ-CB 4.31Å; F211-L216 PolarHBondContact O-N 2.84Å; L212-L216 HydrophobicContact CD2-CD2 4.12Å; L216-L219 PolarHBondContact O-N 3.48Å; L216-L220 HydrophobicContact CD1-CD1 3.96Å; L216-L220 HydrophobicContact CD1-CD2 4.47Å; L216-L220 HydrophobicContact CD1-CG 4.02Å; L216-L220 HydrophobicContact CG-CD1 4.03Å; L216-L220 HydrophobicContact CG-CG 4.45Å; L216-L220 VanDerWaalsContact O-CG 3.28Å; L216-L220 WeakPolarHBondContact O-CG 3.39Å; L216-L220 PolarHBondContact O-N 3.29Å
217G94.8Very high91.9Very high36 Ų3645.3 Ų45.337%0.37126%0.258SS..Hα-helixtrans-59.2-55.2178.300000112.2L212 L219 L220 F221L212-G217 WeakPolarHBondContact O-CA 3.14Å; L212-G217 PolarHBondContact O-N 2.92Å; G217-L219 VanDerWaalsContact C-N 3.31Å; G217-L219 PolarHBondContact O-N 3.44Å; G217-L220 PolarHBondContact O-N 3.47Å; G217-F221 WeakPolarHBondContact O-CB 3.33Å; G217-F221 PolarHBondContact O-N 3.26Å; G217-F221 VanDerWaalsContact O-N 3.07Å
218P94.8Very high91.4Very high10 Ų1047 Ų477%0.06527%0.268CS..Hα-helixtrans-54.9-41.9173-29.536.4000114.1V128 T132 L212 F213 F215 F221 M222 F249V128-P218 HydrophobicContact CG2-CB 3.43Å; V128-P218 VanDerWaalsContact CG2-CB 3.43Å; V128-P218 HydrophobicContact CG2-CG 3.69Å; T132-P218 WeakPolarHBondContact OG1-CB 3.28Å; L212-P218 WeakPolarHBondContact O-CD 3.15Å; F213-P218 VanDerWaalsContact O-CG 3.22Å; F213-P218 WeakPolarHBondContact O-CG 3.35Å; F215-P218 WeakPolarHBondContact O-CD 3.45Å; P218-F221 PolarHBondContact O-N 2.66Å; P218-M222 HydrophobicContact CB-CE 3.79Å; P218-M222 WeakPolarHBondContact O-CB 3.46Å; P218-M222 WeakPolarHBondContact O-CE 3.16Å; P218-M222 WeakPolarHBondContact O-CG 3.43Å; P218-M222 PolarHBondContact O-N 2.96Å; P218-F249 HydrophobicContact CB-CZ 4.35Å
219L93.6Very high90.6Very high50 Ų5045 Ų4526%0.26225%0.251SS..Hα-helixtrans-60-52.8179.3175.462.2000111.5F215 L216 G217 F221 M222 A223 F249F215-L219 HydrophobicContact CE1-CD2 4.02Å; F215-L219 HydrophobicContact CZ-CD2 4.16Å; F215-L219 WeakPolarHBondContact O-CB 3.45Å; F215-L219 PolarHBondContact O-N 3.49Å; L216-L219 PolarHBondContact O-N 3.48Å; G217-L219 VanDerWaalsContact C-N 3.31Å; G217-L219 PolarHBondContact O-N 3.44Å; L219-F221 VanDerWaalsContact C-N 3.32Å; L219-F221 PolarHBondContact O-N 2.89Å; L219-M222 PolarHBondContact O-N 2.85Å; L219-A223 WeakPolarHBondContact O-CB 3.45Å; L219-A223 PolarHBondContact O-N 3.09Å; L219-F249 HydrophobicContact CB-CD1 4.05Å; L219-F249 HydrophobicContact CB-CE1 3.48Å; L219-F249 VanDerWaalsContact CB-CE1 3.48Å; L219-F249 HydrophobicContact CB-CE2 4.07Å; L219-F249 HydrophobicContact CB-CZ 3.49Å; L219-F249 VanDerWaalsContact CB-CZ 3.49Å; L219-F249 HydrophobicContact CD1-CB 4.24Å; L219-F249 HydrophobicContact CD1-CD1 3.78Å; L219-F249 HydrophobicContact CD1-CD2 3.4Å; L219-F249 VanDerWaalsContact CD1-CD2 3.4Å; L219-F249 HydrophobicContact CD1-CE1 3.97Å; L219-F249 HydrophobicContact CD1-CE2 3.59Å; L219-F249 HydrophobicContact CD1-CG 3.52Å; L219-F249 HydrophobicContact CD1-CZ 3.89Å; L219-F249 HydrophobicContact CG-CD1 4.32Å; L219-F249 HydrophobicContact CG-CE1 4.21Å; L219-F249 HydrophobicContact CG-CE2 4.44Å; L219-F249 HydrophobicContact CG-CZ 4.28Å
220L94.1Very high89.7Confident97 Ų9746.5 Ų46.551%0.50826%0.255SS..Hα-helixtrans-61.1-45.3-179-67.3174.7000110.6L216 G217 A223 I224L216-L220 HydrophobicContact CD1-CD1 3.96Å; L216-L220 HydrophobicContact CD1-CD2 4.47Å; L216-L220 HydrophobicContact CD1-CG 4.02Å; L216-L220 HydrophobicContact CG-CD1 4.03Å; L216-L220 HydrophobicContact CG-CG 4.45Å; L216-L220 VanDerWaalsContact O-CG 3.28Å; L216-L220 WeakPolarHBondContact O-CG 3.39Å; L216-L220 PolarHBondContact O-N 3.29Å; G217-L220 PolarHBondContact O-N 3.47Å; L220-A223 PolarHBondContact O-N 3.11Å; L220-I224 WeakPolarHBondContact O-CD1 3.2Å; L220-I224 WeakPolarHBondContact O-CG1 3.47Å; L220-I224 PolarHBondContact O-N 3.42Å
221F94.3Very high88.9Confident84 Ų8456.5 Ų56.537%0.36829%0.292SS..Hα-helixtrans-60.9-52.8177.8-179.9-94.4000112.1T132 A136 G217 P218 L219 A223 I224 C225T132-F221 HydrophobicContact CG2-CD1 3.55Å; T132-F221 HydrophobicContact CG2-CE1 3.94Å; T132-F221 HydrophobicContact CG2-CG 4.29Å; A136-F221 HydrophobicContact CB-CE1 3.9Å; A136-F221 HydrophobicContact CB-CZ 3.74Å; G217-F221 WeakPolarHBondContact O-CB 3.33Å; G217-F221 PolarHBondContact O-N 3.26Å; G217-F221 VanDerWaalsContact O-N 3.07Å; P218-F221 PolarHBondContact O-N 2.66Å; L219-F221 VanDerWaalsContact C-N 3.32Å; L219-F221 PolarHBondContact O-N 2.89Å; F221-A223 VanDerWaalsContact C-N 3.35Å; F221-A223 PolarHBondContact O-N 2.92Å; F221-I224 PolarHBondContact O-N 3.06Å; F221-C225 VanDerWaalsContact CE1-SG 3.59Å; F221-C225 VanDerWaalsContact CZ-SG 3.54Å; F221-C225 PolarHBondContact O-N 3.01Å; F221-C225 PolarHBondContact O-SG 3.4Å; F221-C225 VanDerWaalsContact O-SG 3.41Å
222M90.5Very high87.8Confident0 Ų059.3 Ų59.30%031%0.306CS..Hα-helixtrans-64.8-38.3-179-71.7-170.1-86.100111.9V128 L131 P218 L219 I224 C225 H226 V245 F249V128-M222 HydrophobicContact CG2-CE 4.23Å; L131-M222 HydrophobicContact CB-SD 4.02Å; P218-M222 HydrophobicContact CB-CE 3.79Å; P218-M222 WeakPolarHBondContact O-CB 3.46Å; P218-M222 WeakPolarHBondContact O-CE 3.16Å; P218-M222 WeakPolarHBondContact O-CG 3.43Å; P218-M222 PolarHBondContact O-N 2.96Å; L219-M222 PolarHBondContact O-N 2.85Å; M222-I224 PolarHBondContact O-N 3.46Å; M222-C225 PolarHBondContact O-N 2.99Å; M222-H226 WeakPolarHBondContact O-CB 3.49Å; M222-H226 PolarHBondContact O-CD2 3.27Å; M222-H226 VanDerWaalsContact O-CD2 3.27Å; M222-H226 PolarHBondContact O-N 3.36Å; M222-V245 HydrophobicContact CB-CG1 3.91Å; M222-V245 HydrophobicContact SD-CG1 4.06Å; M222-V245 HydrophobicContact SD-CG2 3.79Å; M222-F249 HydrophobicContact CE-CE2 3.38Å; M222-F249 HydrophobicContact CE-CZ 3.3Å; M222-F249 HydrophobicContact SD-CE2 4.41Å
223A89.8Confident86.2Confident57 Ų5758.7 Ų58.747%0.47130%0.302SS..Hα-helixtrans-61.7-42.8175.700000111.8L219 L220 F221 G227L219-A223 WeakPolarHBondContact O-CB 3.45Å; L219-A223 PolarHBondContact O-N 3.09Å; L220-A223 PolarHBondContact O-N 3.11Å; F221-A223 VanDerWaalsContact C-N 3.35Å; F221-A223 PolarHBondContact O-N 2.92Å; A223-G227 WeakPolarHBondContact O-CA 3.03Å; A223-G227 PolarHBondContact O-N 3.48Å
224I90.2Very high84.5Confident111 Ų11158.3 Ų58.357%0.56931%0.308SS*.Hα-helixtrans-63.3-52.2174.7-67.6163.8000110L220 F221 M222 H226 G227 V228L220-I224 WeakPolarHBondContact O-CD1 3.2Å; L220-I224 WeakPolarHBondContact O-CG1 3.47Å; L220-I224 PolarHBondContact O-N 3.42Å; F221-I224 PolarHBondContact O-N 3.06Å; M222-I224 PolarHBondContact O-N 3.46Å; I224-H226 PolarHBondContact O-N 3.07Å; I224-G227 PolarHBondContact O-N 2.56Å; I224-V228 HydrophobicContact CG2-CG2 4.48Å; I224-V228 WeakPolarHBondContact O-CB 3.35Å; I224-V228 VanDerWaalsContact O-CG2 3.22Å; I224-V228 WeakPolarHBondContact O-CG2 3.22Å; I224-V228 PolarHBondContact O-N 2.89Å
225C86Confident82.8Confident6 Ų668.9 Ų68.94%0.04135%0.348CS..Hα-helixtrans-57.9-50.4-178.6-72.30000112.2F139 F221 M222 L229F139-C225 HydrophobicContact CB-CB 4.31Å; F139-C225 HydrophobicContact CD2-CB 4.11Å; F139-C225 HydrophobicContact CG-CB 4.46Å; F221-C225 VanDerWaalsContact CE1-SG 3.59Å; F221-C225 VanDerWaalsContact CZ-SG 3.54Å; F221-C225 PolarHBondContact O-N 3.01Å; F221-C225 PolarHBondContact O-SG 3.4Å; F221-C225 VanDerWaalsContact O-SG 3.41Å; M222-C225 PolarHBondContact O-N 2.99Å; C225-L229 VanDerWaalsContact O-CB 3.29Å; C225-L229 WeakPolarHBondContact O-CB 3.36Å; C225-L229 PolarHBondContact O-N 3.21Å
226H82.4Confident80.9Confident12 Ų1279.1 Ų79.16%0.05639%0.386CS..Hα-helixtrans-72.8-36.7-178.6-78.8-83.1000112.8S135 M222 I224 V228 L229 Q230 T242S135-H226 PolarHBondContact OG-NE2 3.12Å; M222-H226 WeakPolarHBondContact O-CB 3.49Å; M222-H226 PolarHBondContact O-CD2 3.27Å; M222-H226 VanDerWaalsContact O-CD2 3.27Å; M222-H226 PolarHBondContact O-N 3.36Å; I224-H226 PolarHBondContact O-N 3.07Å; H226-V228 VanDerWaalsContact C-N 3.32Å; H226-V228 PolarHBondContact O-N 2.73Å; H226-L229 PolarHBondContact O-N 3.26Å; H226-Q230 WeakPolarHBondContact O-CB 3.05Å; H226-Q230 VanDerWaalsContact O-CG 3.24Å; H226-Q230 WeakPolarHBondContact O-CG 3.49Å; H226-Q230 PolarHBondContact O-N 3.13Å; H226-T242 PolarHBondContact ND1-OG1 3.37Å
227G83.2Confident79Confident28 Ų2883.4 Ų83.429%0.28940%0.404SS..Hα-helixtrans-63.3-40.1176.400000111.9A223 I224 R231A223-G227 WeakPolarHBondContact O-CA 3.03Å; A223-G227 PolarHBondContact O-N 3.48Å; I224-G227 PolarHBondContact O-N 2.56Å; G227-R231 WeakPolarHBondContact O-CG 3.21Å; G227-R231 PolarHBondContact O-N 2.96Å
228V81.4Confident77.5Confident45 Ų4584.2 Ų84.227%0.27340%0.396SS..Hα-helixtrans-67.2-45.4173.5171.80000111.1F139 F143 I224 H226 Q230 R231 Q232F139-V228 HydrophobicContact CE2-CB 4.26Å; F139-V228 HydrophobicContact CE2-CG1 3.97Å; F143-V228 HydrophobicContact CE1-CG1 4.3Å; F143-V228 HydrophobicContact CE2-CG1 3.53Å; F143-V228 HydrophobicContact CZ-CG1 3.18Å; I224-V228 HydrophobicContact CG2-CG2 4.48Å; I224-V228 WeakPolarHBondContact O-CB 3.35Å; I224-V228 VanDerWaalsContact O-CG2 3.22Å; I224-V228 WeakPolarHBondContact O-CG2 3.22Å; I224-V228 PolarHBondContact O-N 2.89Å; H226-V228 VanDerWaalsContact C-N 3.32Å; H226-V228 PolarHBondContact O-N 2.73Å; V228-Q230 VanDerWaalsContact C-N 3.32Å; V228-Q230 PolarHBondContact O-N 2.8Å; V228-R231 PolarHBondContact O-N 3.35Å; V228-R231 VanDerWaalsContact O-N 3.13Å; V228-Q232 PolarHBondContact O-N 2.82Å
229L77.1Confident76.3Confident4 Ų485.8 Ų85.82%0.02141%0.41CS..Hα-helixtrans-61.5-38.2-179.1-169.958000112.9A142 C225 H226 R231 Q232 M233 W238A142-L229 HydrophobicContact CB-CD1 3.57Å; C225-L229 VanDerWaalsContact O-CB 3.29Å; C225-L229 WeakPolarHBondContact O-CB 3.36Å; C225-L229 PolarHBondContact O-N 3.21Å; H226-L229 PolarHBondContact O-N 3.26Å; L229-R231 VanDerWaalsContact C-N 3.32Å; L229-R231 PolarHBondContact O-N 3.16Å; L229-Q232 PolarHBondContact O-N 3.44Å; L229-M233 HydrophobicContact CD1-CG 3.88Å; L229-M233 WeakPolarHBondContact O-CB 3.38Å; L229-M233 PolarHBondContact O-N 3.08Å; L229-M233 VanDerWaalsContact O-N 3.11Å; L229-W238 HydrophobicContact CD1-CD2 4.13Å; L229-W238 HydrophobicContact CD1-CG 4.4Å; L229-W238 HydrophobicContact CD1-CZ2 3.85Å; L229-W238 HydrophobicContact CD2-CB 4.24Å; L229-W238 HydrophobicContact CD2-CD2 3.28Å; L229-W238 HydrophobicContact CD2-CE3 3.4Å; L229-W238 VanDerWaalsContact CD2-CE3 3.4Å; L229-W238 HydrophobicContact CD2-CG 3.68Å; L229-W238 HydrophobicContact CD2-CH2 4.11Å; L229-W238 HydrophobicContact CD2-CZ2 4.04Å; L229-W238 HydrophobicContact CD2-CZ3 3.83Å; L229-W238 HydrophobicContact CG-CB 4.4Å; L229-W238 HydrophobicContact CG-CD2 3.72Å; L229-W238 HydrophobicContact CG-CE3 4.35Å; L229-W238 HydrophobicContact CG-CG 3.73Å; L229-W238 HydrophobicContact CG-CZ2 4.34Å
230Q76Confident75.2Confident92 Ų9285.2 Ų85.243%0.4341%0.407SS..Hα-helixtrans-67.5-29.2176.3-75.1175.18.900113.8H226 V228 T242H226-Q230 WeakPolarHBondContact O-CB 3.05Å; H226-Q230 VanDerWaalsContact O-CG 3.24Å; H226-Q230 WeakPolarHBondContact O-CG 3.49Å; H226-Q230 PolarHBondContact O-N 3.13Å; V228-Q230 VanDerWaalsContact C-N 3.32Å; V228-Q230 PolarHBondContact O-N 2.8Å; Q230-T242 PolarHBondContact NE2-OG1 3.26Å
231R78.2Confident74Confident230 Ų23081.7 Ų81.787%0.86839%0.394SS*.Hα-helixtrans-77.5-30.9179-74.2178.6178.4-175.10.3112.5G227 V228 L229G227-R231 WeakPolarHBondContact O-CG 3.21Å; G227-R231 PolarHBondContact O-N 2.96Å; V228-R231 PolarHBondContact O-N 3.35Å; V228-R231 VanDerWaalsContact O-N 3.13Å; L229-R231 VanDerWaalsContact C-N 3.32Å; L229-R231 PolarHBondContact O-N 3.16Å
232Q69.9Low73.1Confident116 Ų11678.9 Ų78.954%0.54238%0.384SS..Hα-helixtrans-99.9-23.2-172.5-65-168.4-2.300114.4V228 L229V228-Q232 PolarHBondContact O-N 2.82Å; L229-Q232 PolarHBondContact O-N 3.44Å
233M62.7Low72.5Confident73 Ų7380.1 Ų80.136%0.3639%0.394SS..SBendtrans-113.9151.1-175.8-63.2-72.6176.700111.1A142 L229 R235A142-M233 HydrophobicContact CB-CE 3.98Å; L229-M233 HydrophobicContact CD1-CG 3.88Å; L229-M233 WeakPolarHBondContact O-CB 3.38Å; L229-M233 PolarHBondContact O-N 3.08Å; L229-M233 VanDerWaalsContact O-N 3.11Å; M233-R235 PolarHBondContact O-N 3.08Å
234T56.9Low71.9Confident99 Ų9977.8 Ų77.861%0.60737%0.374SS*.  trans-57125.3174.351.30000110R236 H237T234-R236 PolarHBondContact O-N 2.85Å; T234-H237 PolarHBondContact O-N 2.83Å; T234-H237 PolarHBondContact OG1-ND1 3.44Å; T234-H237 VanDerWaalsContact OG1-ND1 3.14Å
235R55.2Low71.5Confident222 Ų22273.1 Ų73.184%0.83835%0.351SS*.G310 helixtrans-47.5-25.1-170.9-72.6-173177.1-179.8-0.5115.2M233 H237M233-R235 PolarHBondContact O-N 3.08Å; R235-H237 PolarHBondContact O-N 3.23Å
236R54.3Low71.4Confident232 Ų23276.3 Ų76.388%0.87537%0.37SS*.G310 helixtrans-72.2-25.2-172.6-158.8168.1-172.7164.23114.5T234T234-R236 PolarHBondContact O-N 2.85Å
237H54.1Low71.6Confident147 Ų14776.3 Ų76.368%0.68137%0.373SS*.G310 helixtrans-85.8-18.8-174.2-69.593.8000114.4T234 R235T234-H237 PolarHBondContact O-N 2.83Å; T234-H237 PolarHBondContact OG1-ND1 3.44Å; T234-H237 VanDerWaalsContact OG1-ND1 3.14Å; R235-H237 PolarHBondContact O-N 3.23Å
238W63.6Low71.6Confident53 Ų5375 Ų7520%0.20136%0.359CS..THydrogen-bonded Turntrans-119.73-170.3-61.9107.6000115L138 L229 L240 G241 T242L138-W238 HydrophobicContact CB-CH2 4Å; L138-W238 HydrophobicContact CB-CZ3 3.75Å; L138-W238 HydrophobicContact CD1-CE3 4.45Å; L138-W238 HydrophobicContact CD1-CZ3 3.8Å; L138-W238 HydrophobicContact CD2-CH2 3.96Å; L138-W238 HydrophobicContact CD2-CZ3 3.65Å; L138-W238 HydrophobicContact CG-CH2 4.4Å; L138-W238 HydrophobicContact CG-CZ3 3.87Å; L229-W238 HydrophobicContact CD1-CD2 4.13Å; L229-W238 HydrophobicContact CD1-CG 4.4Å; L229-W238 HydrophobicContact CD1-CZ2 3.85Å; L229-W238 HydrophobicContact CD2-CB 4.24Å; L229-W238 HydrophobicContact CD2-CD2 3.28Å; L229-W238 HydrophobicContact CD2-CE3 3.4Å; L229-W238 VanDerWaalsContact CD2-CE3 3.4Å; L229-W238 HydrophobicContact CD2-CG 3.68Å; L229-W238 HydrophobicContact CD2-CH2 4.11Å; L229-W238 HydrophobicContact CD2-CZ2 4.04Å; L229-W238 HydrophobicContact CD2-CZ3 3.83Å; L229-W238 HydrophobicContact CG-CB 4.4Å; L229-W238 HydrophobicContact CG-CD2 3.72Å; L229-W238 HydrophobicContact CG-CE3 4.35Å; L229-W238 HydrophobicContact CG-CG 3.73Å; L229-W238 HydrophobicContact CG-CZ2 4.34Å; W238-L240 VanDerWaalsContact C-N 3.32Å; W238-L240 PolarHBondContact O-N 3.45Å; W238-G241 PolarHBondContact O-N 3.49Å; W238-T242 PolarHBondContact O-N 3.42Å
239A68.6Low72Confident43 Ų4373.5 Ų73.536%0.35535%0.349SS..Hα-helixtrans-59.3-38.7-176.600000113.3A243 F300A239-A243 WeakPolarHBondContact O-CB 3.3Å; A239-A243 PolarHBondContact O-N 2.86Å; A239-F300 HydrophobicContact CB-CE1 4.46Å
240L70.4Confident72.8Confident39 Ų3978.5 Ų78.520%0.20438%0.375CS..Hα-helixtrans-64.1-49.5178.2172.455000112.1W238 T242 A243 V244 M296 F297 F300W238-L240 VanDerWaalsContact C-N 3.32Å; W238-L240 PolarHBondContact O-N 3.45Å; L240-T242 VanDerWaalsContact C-N 3.33Å; L240-T242 PolarHBondContact O-N 3.45Å; L240-A243 PolarHBondContact O-N 3.07Å; L240-A243 VanDerWaalsContact O-N 3.11Å; L240-V244 HydrophobicContact CD1-CG2 3.91Å; L240-V244 WeakPolarHBondContact O-CG2 3.33Å; L240-V244 PolarHBondContact O-N 2.97Å; L240-M296 HydrophobicContact CD1-CB 3.78Å; L240-F297 HydrophobicContact CD2-CD1 4.25Å; L240-F297 HydrophobicContact CD2-CE1 4.42Å; L240-F300 HydrophobicContact CB-CB 3.71Å; L240-F300 HydrophobicContact CB-CD2 4.35Å; L240-F300 HydrophobicContact CB-CG 4.01Å; L240-F300 HydrophobicContact CD1-CB 3.84Å; L240-F300 HydrophobicContact CD1-CD2 3.67Å; L240-F300 HydrophobicContact CD1-CG 4.06Å; L240-F300 HydrophobicContact CD2-CB 4.01Å; L240-F300 HydrophobicContact CG-CB 4.03Å
241G69.8Low73.5Confident22 Ų2274.7 Ų74.723%0.22736%0.358CS..Hα-helixtrans-60.6-43.2-179.700000111.8W238 V244 V245W238-G241 PolarHBondContact O-N 3.49Å; G241-V244 PolarHBondContact O-N 3.41Å; G241-V245 WeakPolarHBondContact O-CG2 3.49Å; G241-V245 PolarHBondContact O-N 2.75Å; G241-V245 VanDerWaalsContact O-N 3.14Å
242T74.8Confident74.3Confident26 Ų2664.1 Ų64.116%0.1632%0.318CS..Hα-helixtrans-62.3-43173-64.10000112H226 Q230 W238 L240 V244 V245 V246H226-T242 PolarHBondContact ND1-OG1 3.37Å; Q230-T242 PolarHBondContact NE2-OG1 3.26Å; W238-T242 PolarHBondContact O-N 3.42Å; L240-T242 VanDerWaalsContact C-N 3.33Å; L240-T242 PolarHBondContact O-N 3.45Å; T242-V244 VanDerWaalsContact C-N 3.35Å; T242-V244 PolarHBondContact O-N 3.42Å; T242-V245 PolarHBondContact O-N 3.4Å; T242-V246 HydrophobicContact CG2-CG2 4.1Å; T242-V246 WeakPolarHBondContact O-CB 3.26Å; T242-V246 VanDerWaalsContact O-CG2 3.27Å; T242-V246 WeakPolarHBondContact O-CG2 3.36Å; T242-V246 PolarHBondContact O-N 3.32Å
243A77.6Confident75.4Confident25 Ų2560.7 Ų60.721%0.20731%0.305CS..Hα-helixtrans-61.7-42.2-179.800000112.2A239 L240 V246 G247 M296 F300A239-A243 WeakPolarHBondContact O-CB 3.3Å; A239-A243 PolarHBondContact O-N 2.86Å; L240-A243 PolarHBondContact O-N 3.07Å; L240-A243 VanDerWaalsContact O-N 3.11Å; A243-V246 PolarHBondContact O-N 3.02Å; A243-G247 PolarHBondContact O-N 3.46Å; A243-M296 VanDerWaalsContact C-SD 3.6Å; A243-M296 HydrophobicContact CB-CE 4.4Å; A243-M296 HydrophobicContact CB-SD 4.03Å; A243-M296 WeakPolarHBondContact O-CE 3.39Å; A243-F300 HydrophobicContact CB-CE2 3.93Å; A243-F300 HydrophobicContact CB-CZ 4.22Å
244V77.3Confident77Confident9 Ų959.2 Ų59.26%0.05530%0.301CS..Hα-helixtrans-62.5-47.5176.71730000110.9L131 L240 G241 T242 V246 G247 F248 M296L131-V244 HydrophobicContact CD1-CG1 4.46Å; L131-V244 HydrophobicContact CD2-CG1 3.61Å; L240-V244 HydrophobicContact CD1-CG2 3.91Å; L240-V244 WeakPolarHBondContact O-CG2 3.33Å; L240-V244 PolarHBondContact O-N 2.97Å; G241-V244 PolarHBondContact O-N 3.41Å; T242-V244 VanDerWaalsContact C-N 3.35Å; T242-V244 PolarHBondContact O-N 3.42Å; V244-V246 PolarHBondContact O-N 2.03Å; V244-G247 PolarHBondContact O-N 2.96Å; V244-F248 PolarHBondContact O-N 2.69Å; V244-M296 VanDerWaalsContact CA-SD 3.57Å; V244-M296 HydrophobicContact CB-SD 4.19Å; V244-M296 HydrophobicContact CG2-CB 4.25Å; V244-M296 HydrophobicContact CG2-SD 3.58Å; V244-M296 VanDerWaalsContact CG2-SD 3.58Å
245V81.1Confident78.8Confident13 Ų1355.4 Ų55.48%0.07928%0.276CS..Hα-helixtrans-61.7-45.4178.31710000111.5M222 G241 T242 F248 F249M222-V245 HydrophobicContact CB-CG1 3.91Å; M222-V245 HydrophobicContact SD-CG1 4.06Å; M222-V245 HydrophobicContact SD-CG2 3.79Å; G241-V245 WeakPolarHBondContact O-CG2 3.49Å; G241-V245 PolarHBondContact O-N 2.75Å; G241-V245 VanDerWaalsContact O-N 3.14Å; T242-V245 PolarHBondContact O-N 3.4Å; V245-F248 WeakPolarHBondContact O-CB 3.29Å; V245-F248 PolarHBondContact O-N 3.3Å; V245-F249 HydrophobicContact CG1-CD2 3.94Å; V245-F249 HydrophobicContact CG1-CE2 3.85Å; V245-F249 WeakPolarHBondContact O-CD2 3.22Å; V245-F249 PolarHBondContact O-N 3.17Å; V245-F249 VanDerWaalsContact O-N 3.17Å
246V85.5Confident80.7Confident73 Ų7345 Ų4544%0.44224%0.237SC..Hα-helixtrans-63.9-43.7177.6169.80000110.9T242 A243 V244 F248 F249 I250T242-V246 HydrophobicContact CG2-CG2 4.1Å; T242-V246 WeakPolarHBondContact O-CB 3.26Å; T242-V246 VanDerWaalsContact O-CG2 3.27Å; T242-V246 WeakPolarHBondContact O-CG2 3.36Å; T242-V246 PolarHBondContact O-N 3.32Å; A243-V246 PolarHBondContact O-N 3.02Å; V244-V246 PolarHBondContact O-N 2.03Å; V246-F248 PolarHBondContact O-N 3.48Å; V246-F249 PolarHBondContact O-N 3.29Å; V246-I250 HydrophobicContact CG1-CD1 3.59Å; V246-I250 HydrophobicContact CG1-CG1 4.28Å; V246-I250 VanDerWaalsContact O-CG1 3.29Å; V246-I250 WeakPolarHBondContact O-CG1 3.43Å; V246-I250 PolarHBondContact O-N 2.76Å
247G85.1Confident82.6Confident11 Ų1138.2 Ų38.211%0.11322%0.217CC..Hα-helixtrans-59.2-44.1176.500000112.6A243 V244 I250 C251A243-G247 PolarHBondContact O-N 3.46Å; V244-G247 PolarHBondContact O-N 2.96Å; G247-I250 PolarHBondContact O-N 3.22Å; G247-C251 WeakPolarHBondContact O-CB 3.36Å; G247-C251 PolarHBondContact O-N 2.89Å; G247-C251 VanDerWaalsContact O-N 3.09Å; G247-C251 PolarHBondContact O-SG 3.05Å
248F84.8Confident84.5Confident0 Ų031.7 Ų31.70%019%0.187CC..Hα-helixtrans-53.7-57.4173.4-179.1-88000110.5V128 L131 V244 V245 V246 I250 C251 W252 H289V128-F248 HydrophobicContact CB-CE1 4.06Å; V128-F248 HydrophobicContact CB-CE2 4.1Å; V128-F248 HydrophobicContact CB-CZ 3.51Å; V128-F248 HydrophobicContact CG2-CE1 3.63Å; V128-F248 HydrophobicContact CG2-CZ 3.65Å; L131-F248 HydrophobicContact CD1-CB 4.14Å; L131-F248 HydrophobicContact CD1-CD2 3.75Å; L131-F248 HydrophobicContact CD1-CE2 4.47Å; L131-F248 HydrophobicContact CD1-CG 4.02Å; V244-F248 PolarHBondContact O-N 2.69Å; V245-F248 WeakPolarHBondContact O-CB 3.29Å; V245-F248 PolarHBondContact O-N 3.3Å; V246-F248 PolarHBondContact O-N 3.48Å; F248-I250 PolarHBondContact O-N 2.99Å; F248-C251 PolarHBondContact O-N 3.21Å; F248-C251 VanDerWaalsContact O-N 3.14Å; F248-W252 AromaticContact CD1-CD1 3.93Å; F248-W252 HydrophobicContact CD1-CG 4.45Å; F248-W252 AromaticContact CD2-CD1 3.42Å; F248-W252 VanDerWaalsContact CD2-CD1 3.42Å; F248-W252 HydrophobicContact CD2-CG 4.46Å; F248-W252 AromaticContact CD2-NE1 3.54Å; F248-W252 HydrophobicContact CE1-CB 4.2Å; F248-W252 AromaticContact CE1-CD1 3.78Å; F248-W252 AromaticContact CE1-CG 4Å; F248-W252 HydrophobicContact CE1-CG 4Å; F248-W252 AromaticContact CE2-CD1 3.27Å; F248-W252 HydrophobicContact CE2-CD2 4.36Å; F248-W252 AromaticContact CE2-CE2 3.91Å; F248-W252 HydrophobicContact CE2-CG 4.04Å; F248-W252 AromaticContact CE2-NE1 3.19Å; F248-W252 AromaticContact CG-CD1 3.74Å; F248-W252 HydrophobicContact CZ-CB 4.4Å; F248-W252 AromaticContact CZ-CD1 3.42Å; F248-W252 VanDerWaalsContact CZ-CD1 3.42Å; F248-W252 HydrophobicContact CZ-CD2 4.15Å; F248-W252 AromaticContact CZ-CG 3.74Å; F248-W252 HydrophobicContact CZ-CG 3.74Å; F248-W252 AromaticContact CZ-NE1 3.69Å; F248-W252 WeakPolarHBondContact O-CB 3.47Å; F248-W252 PolarHBondContact O-N 3.17Å; F248-H289 WeakPolarHBondContact CA-CD2 3.42Å; F248-H289 AromaticContact CD2-CD2 3.98Å; F248-H289 AromaticContact CD2-CE1 3.56Å; F248-H289 AromaticContact CD2-ND1 3.84Å; F248-H289 AromaticContact CD2-NE2 3.63Å; F248-H289 PolarHBondContact N-CD2 3.48Å
249F89.7Confident85.9Confident14 Ų1431.2 Ų31.26%0.06119%0.185CC..Hα-helixtrans-67.1-35.2-174.7-72.2-64.6000113.5F215 P218 L219 M222 V245 V246 C251 W252 T253F215-F249 AromaticContact CD2-CD1 3.72Å; F215-F249 HydrophobicContact CD2-CD1 3.72Å; F215-F249 AromaticContact CD2-CE1 3.93Å; F215-F249 HydrophobicContact CD2-CE1 3.93Å; F215-F249 AromaticContact CE2-CD1 3.5Å; F215-F249 HydrophobicContact CE2-CD1 3.5Å; F215-F249 VanDerWaalsContact CE2-CD1 3.5Å; F215-F249 HydrophobicContact CE2-CE1 4.16Å; F215-F249 HydrophobicContact CZ-CD1 4.2Å; P218-F249 HydrophobicContact CB-CZ 4.35Å; L219-F249 HydrophobicContact CB-CD1 4.05Å; L219-F249 HydrophobicContact CB-CE1 3.48Å; L219-F249 VanDerWaalsContact CB-CE1 3.48Å; L219-F249 HydrophobicContact CB-CE2 4.07Å; L219-F249 HydrophobicContact CB-CZ 3.49Å; L219-F249 VanDerWaalsContact CB-CZ 3.49Å; L219-F249 HydrophobicContact CD1-CB 4.24Å; L219-F249 HydrophobicContact CD1-CD1 3.78Å; L219-F249 HydrophobicContact CD1-CD2 3.4Å; L219-F249 VanDerWaalsContact CD1-CD2 3.4Å; L219-F249 HydrophobicContact CD1-CE1 3.97Å; L219-F249 HydrophobicContact CD1-CE2 3.59Å; L219-F249 HydrophobicContact CD1-CG 3.52Å; L219-F249 HydrophobicContact CD1-CZ 3.89Å; L219-F249 HydrophobicContact CG-CD1 4.32Å; L219-F249 HydrophobicContact CG-CE1 4.21Å; L219-F249 HydrophobicContact CG-CE2 4.44Å; L219-F249 HydrophobicContact CG-CZ 4.28Å; M222-F249 HydrophobicContact CE-CE2 3.38Å; M222-F249 HydrophobicContact CE-CZ 3.3Å; M222-F249 HydrophobicContact SD-CE2 4.41Å; V245-F249 HydrophobicContact CG1-CD2 3.94Å; V245-F249 HydrophobicContact CG1-CE2 3.85Å; V245-F249 WeakPolarHBondContact O-CD2 3.22Å; V245-F249 PolarHBondContact O-N 3.17Å; V245-F249 VanDerWaalsContact O-N 3.17Å; V246-F249 PolarHBondContact O-N 3.29Å; F249-C251 VanDerWaalsContact C-N 3.31Å; F249-C251 PolarHBondContact O-N 3.43Å; F249-W252 PolarHBondContact O-N 3.27Å; F249-T253 VanDerWaalsContact O-CB 3.23Å; F249-T253 WeakPolarHBondContact O-CB 3.28Å; F249-T253 PolarHBondContact O-N 3.18Å; F249-T253 PolarHBondContact O-OG1 3.36Å
250I92.1Very high87.1Confident110 Ų11031.8 Ų31.856%0.56418%0.184SC*.Hα-helixtrans-59.6-44.1173.5-70.8170.6000111V246 G247 F248 P254V246-I250 HydrophobicContact CG1-CD1 3.59Å; V246-I250 HydrophobicContact CG1-CG1 4.28Å; V246-I250 VanDerWaalsContact O-CG1 3.29Å; V246-I250 WeakPolarHBondContact O-CG1 3.43Å; V246-I250 PolarHBondContact O-N 2.76Å; G247-I250 PolarHBondContact O-N 3.22Å; F248-I250 PolarHBondContact O-N 2.99Å; I250-P254 VanDerWaalsContact O-CD 3.27Å; I250-P254 WeakPolarHBondContact O-CD 3.45Å
251C92.4Very high88.2Confident11 Ų1132.4 Ų32.47%0.07419%0.187CC..Hα-helixtrans-71.1-39.5-178.9-65.20000112.6G247 F248 F249 L285 A286 H289G247-C251 WeakPolarHBondContact O-CB 3.36Å; G247-C251 PolarHBondContact O-N 2.89Å; G247-C251 VanDerWaalsContact O-N 3.09Å; G247-C251 PolarHBondContact O-SG 3.05Å; F248-C251 PolarHBondContact O-N 3.21Å; F248-C251 VanDerWaalsContact O-N 3.14Å; F249-C251 VanDerWaalsContact C-N 3.31Å; F249-C251 PolarHBondContact O-N 3.43Å; C251-L285 WeakPolarHBondContact CB-O 3.49Å; C251-A286 WeakPolarHBondContact O-CA 3.42Å; C251-A286 PolarHBondContact O-N 3.4Å; C251-H289 HydrophobicContact CB-CB 3.82Å
252W93.4Very high89.2Confident8 Ų832.8 Ų32.83%0.0318%0.184CC..Hα-helixtrans-88-24-173.4-75.294.5000114.2M124 F248 F249 F255 H256 A286M124-W252 HydrophobicContact CB-CH2 3.34Å; M124-W252 HydrophobicContact CB-CZ2 3.99Å; M124-W252 HydrophobicContact CB-CZ3 3.64Å; M124-W252 HydrophobicContact CG-CD2 4.34Å; M124-W252 HydrophobicContact CG-CE3 3.72Å; M124-W252 HydrophobicContact CG-CH2 3.5Å; M124-W252 VanDerWaalsContact CG-CH2 3.5Å; M124-W252 HydrophobicContact CG-CZ2 4.09Å; M124-W252 HydrophobicContact CG-CZ3 3.27Å; M124-W252 HydrophobicContact SD-CE3 3.97Å; M124-W252 HydrophobicContact SD-CH2 4.26Å; M124-W252 HydrophobicContact SD-CZ3 3.52Å; M124-W252 VanDerWaalsContact SD-CZ3 3.52Å; F248-W252 AromaticContact CD1-CD1 3.93Å; F248-W252 HydrophobicContact CD1-CG 4.45Å; F248-W252 AromaticContact CD2-CD1 3.42Å; F248-W252 VanDerWaalsContact CD2-CD1 3.42Å; F248-W252 HydrophobicContact CD2-CG 4.46Å; F248-W252 AromaticContact CD2-NE1 3.54Å; F248-W252 HydrophobicContact CE1-CB 4.2Å; F248-W252 AromaticContact CE1-CD1 3.78Å; F248-W252 AromaticContact CE1-CG 4Å; F248-W252 HydrophobicContact CE1-CG 4Å; F248-W252 AromaticContact CE2-CD1 3.27Å; F248-W252 HydrophobicContact CE2-CD2 4.36Å; F248-W252 AromaticContact CE2-CE2 3.91Å; F248-W252 HydrophobicContact CE2-CG 4.04Å; F248-W252 AromaticContact CE2-NE1 3.19Å; F248-W252 AromaticContact CG-CD1 3.74Å; F248-W252 HydrophobicContact CZ-CB 4.4Å; F248-W252 AromaticContact CZ-CD1 3.42Å; F248-W252 VanDerWaalsContact CZ-CD1 3.42Å; F248-W252 HydrophobicContact CZ-CD2 4.15Å; F248-W252 AromaticContact CZ-CG 3.74Å; F248-W252 HydrophobicContact CZ-CG 3.74Å; F248-W252 AromaticContact CZ-NE1 3.69Å; F248-W252 WeakPolarHBondContact O-CB 3.47Å; F248-W252 PolarHBondContact O-N 3.17Å; F249-W252 PolarHBondContact O-N 3.27Å; W252-F255 HydrophobicContact CE3-CD1 4.02Å; W252-F255 HydrophobicContact CE3-CG 4.49Å; W252-F255 HydrophobicContact CZ3-CD1 4.05Å; W252-F255 HydrophobicContact CZ3-CE1 4.26Å; W252-F255 WeakPolarHBondContact O-CB 3.45Å; W252-F255 PolarHBondContact O-N 3.18Å; W252-F255 VanDerWaalsContact O-N 3.12Å; W252-H256 PolarHBondContact O-CD2 3.34Å; W252-H256 VanDerWaalsContact O-CD2 3.23Å; W252-H256 PolarHBondContact O-N 2.91Å; W252-H256 VanDerWaalsContact O-N 3.08Å; W252-A286 HydrophobicContact CD2-CB 3.89Å; W252-A286 HydrophobicContact CE3-CB 3.75Å; W252-A286 HydrophobicContact CH2-CB 4.11Å; W252-A286 HydrophobicContact CZ2-CB 4.3Å; W252-A286 HydrophobicContact CZ3-CB 3.84Å; W252-A286 PolarHBondContact NE1-O 3.29Å
253T94.8Very high89.9Confident44 Ų4433 Ų3327%0.2719%0.185SC..Hα-helixtrans-54.7-48.8-178.7-62.80000112.6F215 F249 F255 H256 I257F215-T253 VanDerWaalsContact CE2-OG1 3.28Å; F215-T253 WeakPolarHBondContact CE2-OG1 3.04Å; F215-T253 HydrophobicContact CZ-CG2 4.1Å; F215-T253 WeakPolarHBondContact CZ-OG1 3.01Å; F249-T253 VanDerWaalsContact O-CB 3.23Å; F249-T253 WeakPolarHBondContact O-CB 3.28Å; F249-T253 PolarHBondContact O-N 3.18Å; F249-T253 PolarHBondContact O-OG1 3.36Å; T253-F255 PolarHBondContact O-N 2.7Å; T253-H256 PolarHBondContact O-N 2.95Å; T253-I257 HydrophobicContact CG2-CD1 3.59Å; T253-I257 HydrophobicContact CG2-CG1 4.2Å; T253-I257 WeakPolarHBondContact O-CG1 3.43Å; T253-I257 PolarHBondContact O-N 3.44Å
254P95.5Very high90.6Very high42 Ų4237.2 Ų37.227%0.27321%0.208SC..Hα-helixtrans-60-37-179.8-26.139000112.1I250 L258 V282 L285I250-P254 VanDerWaalsContact O-CD 3.27Å; I250-P254 WeakPolarHBondContact O-CD 3.45Å; P254-L258 WeakPolarHBondContact O-CB 3.38Å; P254-L258 PolarHBondContact O-N 3.07Å; P254-V282 HydrophobicContact CB-CG1 3.94Å; P254-V282 HydrophobicContact CB-CG2 4.27Å; P254-L285 HydrophobicContact CB-CD2 4.35Å; P254-L285 HydrophobicContact CG-CD2 3.81Å
255F94.6Very high91.1Very high20 Ų2037.6 Ų37.69%0.08821%0.212CC..Hα-helixtrans-65.5-46.3177.9178-95.7000112.4M124 W252 T253 L258 R259 V282 A286M124-F255 HydrophobicContact SD-CE1 4.18Å; W252-F255 HydrophobicContact CE3-CD1 4.02Å; W252-F255 HydrophobicContact CE3-CG 4.49Å; W252-F255 HydrophobicContact CZ3-CD1 4.05Å; W252-F255 HydrophobicContact CZ3-CE1 4.26Å; W252-F255 WeakPolarHBondContact O-CB 3.45Å; W252-F255 PolarHBondContact O-N 3.18Å; W252-F255 VanDerWaalsContact O-N 3.12Å; T253-F255 PolarHBondContact O-N 2.7Å; F255-L258 PolarHBondContact O-N 3.48Å; F255-R259 HydrophobicContact CD1-CG 4.34Å; F255-R259 HydrophobicContact CE1-CG 3.98Å; F255-R259 HydrophobicContact CE2-CG 4.31Å; F255-R259 HydrophobicContact CZ-CG 3.97Å; F255-R259 WeakPolarHBondContact O-CG 3.44Å; F255-R259 PolarHBondContact O-N 3.27Å; F255-V282 HydrophobicContact CB-CG1 3.73Å; F255-V282 HydrophobicContact CD2-CG1 4.37Å; F255-A286 HydrophobicContact CB-CB 4.03Å; F255-A286 HydrophobicContact CG-CB 4.4Å
256H94.4Very high91.3Very high3 Ų339.9 Ų39.91%0.01423%0.233CC..Hα-helixtrans-66.7-40.6179.2-76.4-69.4000112.6F211 F215 W252 T253 R259 V260F211-H256 HydrophobicContact CD2-CB 4Å; F211-H256 HydrophobicContact CE2-CB 4.24Å; F215-H256 HydrophobicContact CB-CB 4.44Å; F215-H256 HydrophobicContact CD2-CB 4.37Å; F215-H256 AromaticContact CD2-CD2 3.35Å; F215-H256 WeakPolarHBondContact CD2-CD2 3.14Å; F215-H256 AromaticContact CD2-CG 3.98Å; F215-H256 HydrophobicContact CG-CB 4.22Å; F215-H256 AromaticContact CG-CD2 3.65Å; F215-H256 AromaticContact CG-CG 3.87Å; W252-H256 PolarHBondContact O-CD2 3.34Å; W252-H256 VanDerWaalsContact O-CD2 3.23Å; W252-H256 PolarHBondContact O-N 2.91Å; W252-H256 VanDerWaalsContact O-N 3.08Å; T253-H256 PolarHBondContact O-N 2.95Å; H256-R259 PolarHBondContact O-N 2.96Å; H256-V260 WeakPolarHBondContact O-CG2 3.47Å; H256-V260 PolarHBondContact O-N 3.35Å; H256-V260 VanDerWaalsContact O-N 3.09Å
257I94.6Very high91.3Very high89 Ų8941.1 Ų41.146%0.45624%0.242SC..Hα-helixtrans-60.3-48.6173.5-68.4173.4000110T253 R259 V260 I261T253-I257 HydrophobicContact CG2-CD1 3.59Å; T253-I257 HydrophobicContact CG2-CG1 4.2Å; T253-I257 WeakPolarHBondContact O-CG1 3.43Å; T253-I257 PolarHBondContact O-N 3.44Å; I257-R259 VanDerWaalsContact C-N 3.33Å; I257-R259 PolarHBondContact O-N 2.92Å; I257-V260 PolarHBondContact O-N 3.16Å; I257-I261 HydrophobicContact CG2-CD1 3.71Å; I257-I261 HydrophobicContact CG2-CG1 4.37Å; I257-I261 WeakPolarHBondContact O-CG1 3.34Å; I257-I261 PolarHBondContact O-N 3.24Å
258L94.8Very high91.2Very high11 Ų1150.5 Ų50.56%0.05828%0.28CS..Hα-helixtrans-57.9-44.5-179.7-172.2145.1000111.7P254 F255 I261 I262 V275 A278 E279 V282P254-L258 WeakPolarHBondContact O-CB 3.38Å; P254-L258 PolarHBondContact O-N 3.07Å; F255-L258 PolarHBondContact O-N 3.48Å; L258-I261 PolarHBondContact O-N 2.87Å; L258-I262 HydrophobicContact CD2-CD1 3.53Å; L258-I262 HydrophobicContact CD2-CG1 4.2Å; L258-I262 WeakPolarHBondContact O-CG1 3.39Å; L258-I262 PolarHBondContact O-N 3.02Å; L258-V275 HydrophobicContact CD1-CG1 4.22Å; L258-V275 HydrophobicContact CD2-CG1 3.88Å; L258-V275 HydrophobicContact CG-CG1 3.65Å; L258-A278 HydrophobicContact CD1-CB 4.18Å; L258-E279 HydrophobicContact CD2-CB 4.18Å; L258-E279 HydrophobicContact CD2-CG 4.28Å; L258-V282 HydrophobicContact CB-CG1 4.22Å; L258-V282 HydrophobicContact CD1-CB 3.91Å; L258-V282 HydrophobicContact CD1-CG1 4.1Å; L258-V282 HydrophobicContact CD1-CG2 3.76Å
259R93.2Very high91.4Very high43 Ų4352 Ų5216%0.16229%0.291CS..Hα-helixtrans-64.2-39.4177-70.2-60.3-172.3-161.7-4.6113.3F255 H256 I257 I261 I262 T263 E279F255-R259 HydrophobicContact CD1-CG 4.34Å; F255-R259 HydrophobicContact CE1-CG 3.98Å; F255-R259 HydrophobicContact CE2-CG 4.31Å; F255-R259 HydrophobicContact CZ-CG 3.97Å; F255-R259 WeakPolarHBondContact O-CG 3.44Å; F255-R259 PolarHBondContact O-N 3.27Å; H256-R259 PolarHBondContact O-N 2.96Å; I257-R259 VanDerWaalsContact C-N 3.33Å; I257-R259 PolarHBondContact O-N 2.92Å; R259-I261 VanDerWaalsContact C-N 3.33Å; R259-I262 PolarHBondContact O-N 2.01Å; R259-T263 PolarHBondContact O-N 3.28Å; R259-T263 PolarHBondContact O-OG1 3.27Å; R259-E279 IonicContact CZ-OE1 2.68Å; R259-E279 IonicContact NH1-OE1 3.74Å; R259-E279 PolarHBondContact NH1-OE1 3.02Å; R259-E279 IonicContact NH1-OE2 3.05Å; R259-E279 IonicContact NH2-OE1 2.71Å; R259-E279 PolarHBondContact NH2-OE1 3.43Å
260V93.6Very high91.3Very high55 Ų5557 Ų5733%0.33332%0.317SS..Hα-helixtrans-63.5-43174.5171.40000110.2T207 F211 H256 I257 T263 V264T207-V260 HydrophobicContact CG2-CG2 4.19Å; F211-V260 HydrophobicContact CD2-CG2 4.19Å; F211-V260 HydrophobicContact CG-CG2 4.47Å; H256-V260 WeakPolarHBondContact O-CG2 3.47Å; H256-V260 PolarHBondContact O-N 3.35Å; H256-V260 VanDerWaalsContact O-N 3.09Å; I257-V260 PolarHBondContact O-N 3.16Å; V260-T263 PolarHBondContact O-N 3.04Å; V260-V264 WeakPolarHBondContact O-CG2 3.28Å; V260-V264 PolarHBondContact O-N 3.46Å
261I93.3Very high91.1Very high51 Ų5156.2 Ų56.226%0.26231%0.314SS..Hα-helixtrans-62.5-44.9178.1-63.4166.8000111.1I257 L258 R259 T263 V264 A265 L271 V275I257-I261 HydrophobicContact CG2-CD1 3.71Å; I257-I261 HydrophobicContact CG2-CG1 4.37Å; I257-I261 WeakPolarHBondContact O-CG1 3.34Å; I257-I261 PolarHBondContact O-N 3.24Å; L258-I261 PolarHBondContact O-N 2.87Å; R259-I261 VanDerWaalsContact C-N 3.33Å; I261-T263 PolarHBondContact O-N 3.36Å; I261-V264 PolarHBondContact O-N 3.43Å; I261-V264 VanDerWaalsContact O-N 3.17Å; I261-A265 WeakPolarHBondContact O-CB 3.25Å; I261-A265 PolarHBondContact O-N 3.02Å; I261-L271 HydrophobicContact CG2-CD1 4.21Å; I261-L271 HydrophobicContact CG2-CD2 3.94Å; I261-L271 HydrophobicContact CG2-CG 4Å; I261-V275 HydrophobicContact CB-CG2 4.43Å; I261-V275 HydrophobicContact CG2-CG2 3.77Å
262I90.9Very high90.9Very high30 Ų3057.4 Ų57.415%0.15432%0.319CS..Hα-helixtrans-52.9-45.9176.8-71.8175.2000110.9L258 R259 V264 V275 L276L258-I262 HydrophobicContact CD2-CD1 3.53Å; L258-I262 HydrophobicContact CD2-CG1 4.2Å; L258-I262 WeakPolarHBondContact O-CG1 3.39Å; L258-I262 PolarHBondContact O-N 3.02Å; R259-I262 PolarHBondContact O-N 2.01Å; I262-V264 VanDerWaalsContact C-N 3.35Å; I262-V264 PolarHBondContact O-N 3.46Å; I262-V275 HydrophobicContact CD1-CG1 3.92Å; I262-V275 HydrophobicContact CG1-CG1 3.32Å; I262-L276 HydrophobicContact CD1-CD2 4.26Å
263T89.8Confident90.6Very high32 Ų3259.8 Ų59.820%0.19634%0.341CS..Hα-helixtrans-70.4-26.8-176.5-660000114E203 A204 T207 R259 V260 I261E203-T263 HydrophobicContact CG-CG2 3.88Å; E203-T263 WeakPolarHBondContact OE1-CA 3.32Å; E203-T263 PolarHBondContact OE1-OG1 3.18Å; A204-T263 HydrophobicContact CB-CG2 4.37Å; T207-T263 PolarHBondContact OG1-OG1 3.06Å; R259-T263 PolarHBondContact O-N 3.28Å; R259-T263 PolarHBondContact O-OG1 3.27Å; V260-T263 PolarHBondContact O-N 3.04Å; I261-T263 PolarHBondContact O-N 3.36Å
264V91.3Very high90.3Very high112 Ų11265.7 Ų65.768%0.67936%0.358SS*.Hα-helixtrans-103.6-12.3-178.8-54.70000113.8V260 I261 I262V260-V264 WeakPolarHBondContact O-CG2 3.28Å; V260-V264 PolarHBondContact O-N 3.46Å; I261-V264 PolarHBondContact O-N 3.43Å; I261-V264 VanDerWaalsContact O-N 3.17Å; I262-V264 VanDerWaalsContact C-N 3.35Å; I262-V264 PolarHBondContact O-N 3.46Å
265A89.4Confident90.1Very high18 Ų1864.4 Ų64.415%0.14935%0.349CS..SBendtrans-67.7139.6-178.700000110.8I261 L271 L272I261-A265 WeakPolarHBondContact O-CB 3.25Å; I261-A265 PolarHBondContact O-N 3.02Å; A265-L271 HydrophobicContact CB-CD2 4.48Å; A265-L272 HydrophobicContact CB-CB 4.12Å; A265-L272 HydrophobicContact CB-CD1 4.38Å
266A85.3Confident89.9Confident61 Ų6167.5 Ų67.550%0.50437%0.366SS..PPolyproline II helixtrans-62.8141.6174.500000110.5S269A266-S269 VanDerWaalsContact O-CB 3.25Å; A266-S269 WeakPolarHBondContact O-CB 3.39Å; A266-S269 PolarHBondContact O-N 2.92Å; A266-S269 PolarHBondContact O-OG 2.99Å
267P84.1Confident89.6Confident99 Ų9973.1 Ų73.164%0.64339%0.391SS*.THydrogen-bonded Turntrans-58.4143175.826.2-34.2000109.8S269P267-S269 PolarHBondContact O-N 3.34Å; P267-S269 VanDerWaalsContact O-N 3.1Å
268F82.7Confident89.5Confident208 Ų20870.4 Ų70.491%0.91238%0.381SS*.THydrogen-bonded Turntrans59.715.6-178.9-44.9-69.6000115.7
269S88.9Confident89.4Confident32 Ų3272.2 Ų72.222%0.22439%0.39CS..  trans-76.6150.5176.265.60000112.7A266 P267 L271 L272 A273A266-S269 VanDerWaalsContact O-CB 3.25Å; A266-S269 WeakPolarHBondContact O-CB 3.39Å; A266-S269 PolarHBondContact O-N 2.92Å; A266-S269 PolarHBondContact O-OG 2.99Å; P267-S269 PolarHBondContact O-N 3.34Å; P267-S269 VanDerWaalsContact O-N 3.1Å; S269-L271 PolarHBondContact O-N 2.74Å; S269-L272 WeakPolarHBondContact O-CB 3.4Å; S269-L272 PolarHBondContact O-N 3.42Å; S269-L272 VanDerWaalsContact O-N 3.11Å; S269-L272 WeakPolarHBondContact OG-CB 3.38Å; S269-L272 PolarHBondContact OG-N 2.95Å; S269-A273 PolarHBondContact O-N 3.09Å; S269-A273 VanDerWaalsContact O-N 3.12Å
270L88Confident89.4Confident118 Ų11871.9 Ų71.962%0.61839%0.393SS*.Hα-helixtrans-57-33.5171.9179.563.2000112A273 R274L270-A273 PolarHBondContact O-N 3.24Å; L270-R274 HydrophobicContact CD1-CG 4.46Å; L270-R274 WeakPolarHBondContact O-CG 3.44Å; L270-R274 PolarHBondContact O-N 2.76Å
271L89Confident89.5Confident94 Ų9473 Ų7349%0.49240%0.397SS..Hα-helixtrans-62.4-48.2175.9177.961.6000111.2I261 A265 S269 A273 R274 V275I261-L271 HydrophobicContact CG2-CD1 4.21Å; I261-L271 HydrophobicContact CG2-CD2 3.94Å; I261-L271 HydrophobicContact CG2-CG 4Å; A265-L271 HydrophobicContact CB-CD2 4.48Å; S269-L271 PolarHBondContact O-N 2.74Å; L271-A273 VanDerWaalsContact C-N 3.34Å; L271-A273 PolarHBondContact O-N 2.86Å; L271-R274 PolarHBondContact O-N 2.85Å; L271-V275 HydrophobicContact CD1-CG2 4.16Å; L271-V275 WeakPolarHBondContact O-CB 3.47Å; L271-V275 WeakPolarHBondContact O-CG2 3.27Å; L271-V275 PolarHBondContact O-N 2.98Å
272L87.7Confident89.6Confident35 Ų3571.5 Ų71.518%0.18339%0.39CS..Hα-helixtrans-59.6-45.5177.7179.961.2000111A265 S269 R274 V275 L276A265-L272 HydrophobicContact CB-CB 4.12Å; A265-L272 HydrophobicContact CB-CD1 4.38Å; S269-L272 WeakPolarHBondContact O-CB 3.4Å; S269-L272 PolarHBondContact O-N 3.42Å; S269-L272 VanDerWaalsContact O-N 3.11Å; S269-L272 WeakPolarHBondContact OG-CB 3.38Å; S269-L272 PolarHBondContact OG-N 2.95Å; L272-R274 PolarHBondContact O-N 3.09Å; L272-V275 PolarHBondContact O-N 2.68Å; L272-L276 HydrophobicContact CD1-CD1 4.06Å; L272-L276 HydrophobicContact CD1-CG 4.1Å; L272-L276 HydrophobicContact CG-CD1 3.97Å; L272-L276 HydrophobicContact CG-CG 4.42Å; L272-L276 VanDerWaalsContact O-CG 3.31Å; L272-L276 WeakPolarHBondContact O-CG 3.49Å; L272-L276 PolarHBondContact O-N 2.71Å
273A86.8Confident89.7Confident59 Ų5971.2 Ų71.249%0.48839%0.39SS..Hα-helixtrans-58.8-46.7177.500000112.6S269 L270 L271 V275 L276 F277S269-A273 PolarHBondContact O-N 3.09Å; S269-A273 VanDerWaalsContact O-N 3.12Å; L270-A273 PolarHBondContact O-N 3.24Å; L271-A273 VanDerWaalsContact C-N 3.34Å; L271-A273 PolarHBondContact O-N 2.86Å; A273-V275 VanDerWaalsContact C-N 3.33Å; A273-V275 PolarHBondContact O-N 3.07Å; A273-L276 PolarHBondContact O-N 3.33Å; A273-F277 WeakPolarHBondContact O-CB 3.48Å; A273-F277 PolarHBondContact O-N 3.15Å
274R89.4Confident90Very high168 Ų16869.7 Ų69.763%0.63438%0.381SS*.Hα-helixtrans-63.2-39.1177.7-73.5179.8-178.5-149.10.3112.6L270 L271 L272 F277 A278L270-R274 HydrophobicContact CD1-CG 4.46Å; L270-R274 WeakPolarHBondContact O-CG 3.44Å; L270-R274 PolarHBondContact O-N 2.76Å; L271-R274 PolarHBondContact O-N 2.85Å; L272-R274 PolarHBondContact O-N 3.09Å; R274-F277 PolarHBondContact O-N 2.86Å; R274-A278 WeakPolarHBondContact O-CB 3.41Å; R274-A278 PolarHBondContact O-N 3.37Å
275V90.7Very high90.2Very high14 Ų1467.6 Ų67.69%0.08537%0.365CS..Hα-helixtrans-69.5-44.2-179.7160.40000111.5L258 I261 I262 L271 L272 A273 F277 A278 E279L258-V275 HydrophobicContact CD1-CG1 4.22Å; L258-V275 HydrophobicContact CD2-CG1 3.88Å; L258-V275 HydrophobicContact CG-CG1 3.65Å; I261-V275 HydrophobicContact CB-CG2 4.43Å; I261-V275 HydrophobicContact CG2-CG2 3.77Å; I262-V275 HydrophobicContact CD1-CG1 3.92Å; I262-V275 HydrophobicContact CG1-CG1 3.32Å; L271-V275 HydrophobicContact CD1-CG2 4.16Å; L271-V275 WeakPolarHBondContact O-CB 3.47Å; L271-V275 WeakPolarHBondContact O-CG2 3.27Å; L271-V275 PolarHBondContact O-N 2.98Å; L272-V275 PolarHBondContact O-N 2.68Å; A273-V275 VanDerWaalsContact C-N 3.33Å; A273-V275 PolarHBondContact O-N 3.07Å; V275-F277 VanDerWaalsContact C-N 3.29Å; V275-F277 PolarHBondContact O-N 2.84Å; V275-A278 PolarHBondContact O-N 3.22Å; V275-E279 PolarHBondContact O-N 2.83Å
276L89.1Confident90.4Very high85 Ų8566.8 Ų66.845%0.44536%0.359SS..Hα-helixtrans-62-38.4174.4-68.5172.5000111.4I262 L272 A273 A278 E279I262-L276 HydrophobicContact CD1-CD2 4.26Å; L272-L276 HydrophobicContact CD1-CD1 4.06Å; L272-L276 HydrophobicContact CD1-CG 4.1Å; L272-L276 HydrophobicContact CG-CD1 3.97Å; L272-L276 HydrophobicContact CG-CG 4.42Å; L272-L276 VanDerWaalsContact O-CG 3.31Å; L272-L276 WeakPolarHBondContact O-CG 3.49Å; L272-L276 PolarHBondContact O-N 2.71Å; A273-L276 PolarHBondContact O-N 3.33Å; L276-A278 VanDerWaalsContact C-N 3.34Å; L276-A278 PolarHBondContact O-N 2.87Å; L276-E279 WeakPolarHBondContact O-CB 3.44Å; L276-E279 PolarHBondContact O-N 2.92Å
277F89.3Confident90.8Very high122 Ų12264.1 Ų64.154%0.53534%0.336SS..Hα-helixtrans-63.2-37.8174.4-176.7-96.3000112.9Y40 A273 R274 V275 P280Y40-F277 HydrophobicContact CD1-CE1 4.06Å; Y40-F277 AromaticContact CD1-CE2 3.95Å; Y40-F277 HydrophobicContact CD1-CE2 3.95Å; Y40-F277 AromaticContact CD1-CZ 3.46Å; Y40-F277 HydrophobicContact CD1-CZ 3.46Å; Y40-F277 VanDerWaalsContact CD1-CZ 3.46Å; Y40-F277 HydrophobicContact CD2-CE1 4.41Å; Y40-F277 HydrophobicContact CD2-CZ 4.43Å; Y40-F277 HydrophobicContact CE1-CD1 4.4Å; Y40-F277 HydrophobicContact CE1-CD2 4.5Å; Y40-F277 AromaticContact CE1-CE1 3.84Å; Y40-F277 HydrophobicContact CE1-CE1 3.84Å; Y40-F277 AromaticContact CE1-CE2 3.96Å; Y40-F277 HydrophobicContact CE1-CE2 3.96Å; Y40-F277 AromaticContact CE1-CZ 3.6Å; Y40-F277 HydrophobicContact CE1-CZ 3.6Å; Y40-F277 HydrophobicContact CE2-CE1 4.25Å; Y40-F277 HydrophobicContact CG-CE1 4.32Å; Y40-F277 AromaticContact CG-CZ 3.89Å; Y40-F277 HydrophobicContact CG-CZ 3.89Å; Y40-F277 AromaticContact CZ-CE1 3.95Å; Y40-F277 PolarHBondContact OH-O 2.89Å; A273-F277 WeakPolarHBondContact O-CB 3.48Å; A273-F277 PolarHBondContact O-N 3.15Å; R274-F277 PolarHBondContact O-N 2.86Å; V275-F277 VanDerWaalsContact C-N 3.29Å; V275-F277 PolarHBondContact O-N 2.84Å; F277-P280 WeakPolarHBondContact O-CD 3.31Å
278A91.9Very high91.3Very high31 Ų3160.1 Ų60.126%0.25631%0.311SS..Hα-helixtrans-80.7-13.3179.800000114.2L258 R274 V275 L276 L281 V282L258-A278 HydrophobicContact CD1-CB 4.18Å; R274-A278 WeakPolarHBondContact O-CB 3.41Å; R274-A278 PolarHBondContact O-N 3.37Å; V275-A278 PolarHBondContact O-N 3.22Å; L276-A278 VanDerWaalsContact C-N 3.34Å; L276-A278 PolarHBondContact O-N 2.87Å; A278-L281 PolarHBondContact O-N 2.9Å; A278-V282 WeakPolarHBondContact O-CG2 3.47Å; A278-V282 PolarHBondContact O-N 3.42Å; A278-V282 VanDerWaalsContact O-N 3.07Å
279E92.1Very high91.7Very high49 Ų4950.2 Ų50.223%0.22927%0.268CS..Hα-helixtrans-54.8-47.9-175-179.9175.8-179.700113.4L258 R259 V275 L276 L281 V282 T283L258-E279 HydrophobicContact CD2-CB 4.18Å; L258-E279 HydrophobicContact CD2-CG 4.28Å; R259-E279 IonicContact CZ-OE1 2.68Å; R259-E279 IonicContact NH1-OE1 3.74Å; R259-E279 PolarHBondContact NH1-OE1 3.02Å; R259-E279 IonicContact NH1-OE2 3.05Å; R259-E279 IonicContact NH2-OE1 2.71Å; R259-E279 PolarHBondContact NH2-OE1 3.43Å; V275-E279 PolarHBondContact O-N 2.83Å; L276-E279 WeakPolarHBondContact O-CB 3.44Å; L276-E279 PolarHBondContact O-N 2.92Å; E279-L281 VanDerWaalsContact C-N 3.33Å; E279-L281 PolarHBondContact O-N 2.79Å; E279-V282 PolarHBondContact O-N 3.46Å; E279-T283 WeakPolarHBondContact O-CB 3.21Å; E279-T283 PolarHBondContact O-N 2.83Å; E279-T283 PolarHBondContact O-OG1 2.82Å
280P93.8Very high91.8Very high37 Ų3748.8 Ų48.824%0.2426%0.257CS..Hα-helixtrans-61.6-39.3179.4-23.234.9000113L44 Y48 I100 F277 G284L44-P280 HydrophobicContact CD1-CB 3.81Å; L44-P280 HydrophobicContact CD2-CB 4.33Å; Y48-P280 PolarHBondContact OH-O 3.2Å; I100-P280 HydrophobicContact CD1-CB 4.11Å; I100-P280 HydrophobicContact CG1-CB 4.44Å; F277-P280 WeakPolarHBondContact O-CD 3.31Å; P280-G284 PolarHBondContact O-N 2.95Å
281L95.3Very high91.9Very high77 Ų7743.5 Ų43.540%0.40323%0.231SC..Hα-helixtrans-63-47.8177.3177.362000111.1Y40 L44 L47 A278 E279 G284 L285Y40-L281 HydrophobicContact CE2-CB 4.4Å; L44-L281 VanDerWaalsContact CD2-CA 3.46Å; L44-L281 HydrophobicContact CD2-CB 3.83Å; L44-L281 HydrophobicContact CD2-CD1 4.06Å; L47-L281 HydrophobicContact CD2-CD1 4.13Å; A278-L281 PolarHBondContact O-N 2.9Å; E279-L281 VanDerWaalsContact C-N 3.33Å; E279-L281 PolarHBondContact O-N 2.79Å; L281-G284 PolarHBondContact O-N 2.9Å; L281-L285 PolarHBondContact O-N 3.42Å
282V95.4Very high91.7Very high20 Ų2041.1 Ų41.112%0.12122%0.22CC..Hα-helixtrans-68.7-36.7-178167.40000111.5P254 F255 L258 A278 E279 L285 A286P254-V282 HydrophobicContact CB-CG1 3.94Å; P254-V282 HydrophobicContact CB-CG2 4.27Å; F255-V282 HydrophobicContact CB-CG1 3.73Å; F255-V282 HydrophobicContact CD2-CG1 4.37Å; L258-V282 HydrophobicContact CB-CG1 4.22Å; L258-V282 HydrophobicContact CD1-CB 3.91Å; L258-V282 HydrophobicContact CD1-CG1 4.1Å; L258-V282 HydrophobicContact CD1-CG2 3.76Å; A278-V282 WeakPolarHBondContact O-CG2 3.47Å; A278-V282 PolarHBondContact O-N 3.42Å; A278-V282 VanDerWaalsContact O-N 3.07Å; E279-V282 PolarHBondContact O-N 3.46Å; V282-L285 PolarHBondContact O-N 3.27Å; V282-A286 PolarHBondContact O-N 3.22Å
283T94.6Very high91.3Very high25 Ų2539.4 Ų39.415%0.15321%0.211CC..Hα-helixtrans-63.7-44.1170-67.60000111.4E279 L285 A286 L287E279-T283 WeakPolarHBondContact O-CB 3.21Å; E279-T283 PolarHBondContact O-N 2.83Å; E279-T283 PolarHBondContact O-OG1 2.82Å; T283-L285 VanDerWaalsContact C-N 3.33Å; T283-L285 PolarHBondContact O-N 3.05Å; T283-A286 PolarHBondContact O-N 3.18Å; T283-L287 HydrophobicContact CG2-CD1 3.92Å; T283-L287 HydrophobicContact CG2-CG 4.43Å; T283-L287 WeakPolarHBondContact O-CG 3.47Å; T283-L287 PolarHBondContact O-N 3.29Å
284G95.2Very high90.9Very high0 Ų036.8 Ų36.80%019%0.189CC..Hα-helixtrans-57.1-45173.600000112.4Y48 I51 P280 L281 L287 A288Y48-G284 VanDerWaalsContact CE1-CA 3.48Å; I51-G284 VanDerWaalsContact CD1-O 3.27Å; I51-G284 WeakPolarHBondContact CD1-O 3.48Å; P280-G284 PolarHBondContact O-N 2.95Å; L281-G284 PolarHBondContact O-N 2.9Å; G284-L287 PolarHBondContact O-N 2.66Å; G284-A288 WeakPolarHBondContact O-CB 3.43Å; G284-A288 PolarHBondContact O-N 3.35Å
285L95.1Very high90.1Very high68 Ų6833.2 Ų33.236%0.35618%0.182SC..Hα-helixtrans-62.3-42.7176.3-179.360.2000112.3C251 P254 L281 V282 T283 L287 A288C251-L285 WeakPolarHBondContact CB-O 3.49Å; P254-L285 HydrophobicContact CB-CD2 4.35Å; P254-L285 HydrophobicContact CG-CD2 3.81Å; L281-L285 PolarHBondContact O-N 3.42Å; V282-L285 PolarHBondContact O-N 3.27Å; T283-L285 VanDerWaalsContact C-N 3.33Å; T283-L285 PolarHBondContact O-N 3.05Å; L285-L287 VanDerWaalsContact C-N 3.34Å; L285-L287 PolarHBondContact O-N 3.45Å; L285-A288 VanDerWaalsContact O-CB 3.3Å; L285-A288 WeakPolarHBondContact O-CB 3.38Å; L285-A288 PolarHBondContact O-N 3.06Å
286A94.7Very high89.1Confident1 Ų133.9 Ų33.91%0.00818%0.184CC..Hα-helixtrans-60.9-43.5175.400000111.9C251 W252 F255 V282 T283 A288 H289C251-A286 WeakPolarHBondContact O-CA 3.42Å; C251-A286 PolarHBondContact O-N 3.4Å; W252-A286 HydrophobicContact CD2-CB 3.89Å; W252-A286 HydrophobicContact CE3-CB 3.75Å; W252-A286 HydrophobicContact CH2-CB 4.11Å; W252-A286 HydrophobicContact CZ2-CB 4.3Å; W252-A286 HydrophobicContact CZ3-CB 3.84Å; W252-A286 PolarHBondContact NE1-O 3.29Å; F255-A286 HydrophobicContact CB-CB 4.03Å; F255-A286 HydrophobicContact CG-CB 4.4Å; V282-A286 PolarHBondContact O-N 3.22Å; T283-A286 PolarHBondContact O-N 3.18Å; A286-A288 VanDerWaalsContact C-N 3.3Å; A286-A288 PolarHBondContact O-N 2.98Å; A286-H289 WeakPolarHBondContact O-CB 3.38Å; A286-H289 PolarHBondContact O-N 2.88Å
287L93.9Very high88.1Confident4 Ų431 Ų312%0.02117%0.168CC..Hα-helixtrans-71.6-23.4177.4-64.9172.4000112.9C89 L93 L96 T283 G284 L285 H289 S290C89-L287 HydrophobicContact CB-CD2 4.1Å; L93-L287 HydrophobicContact CD2-CB 4.1Å; L93-L287 HydrophobicContact CD2-CD1 3.54Å; L93-L287 HydrophobicContact CD2-CG 4.45Å; L93-L287 HydrophobicContact CG-CD1 4.43Å; L96-L287 HydrophobicContact CD1-CD1 3.71Å; T283-L287 HydrophobicContact CG2-CD1 3.92Å; T283-L287 HydrophobicContact CG2-CG 4.43Å; T283-L287 WeakPolarHBondContact O-CG 3.47Å; T283-L287 PolarHBondContact O-N 3.29Å; G284-L287 PolarHBondContact O-N 2.66Å; L285-L287 VanDerWaalsContact C-N 3.34Å; L285-L287 PolarHBondContact O-N 3.45Å; L287-H289 PolarHBondContact O-N 3.2Å; L287-S290 WeakPolarHBondContact O-CB 3.4Å; L287-S290 PolarHBondContact O-N 3.47Å; L287-S290 VanDerWaalsContact O-N 3.09Å
288A93.6Very high87Confident16 Ų1628.9 Ų28.913%0.13216%0.162CC..Hα-helixtrans-60.2-28.8177.400000112.6I51 G284 L285 A286 S290 A291 V292I51-A288 HydrophobicContact CD1-CB 3.72Å; I51-A288 HydrophobicContact CG1-CB 3.97Å; G284-A288 WeakPolarHBondContact O-CB 3.43Å; G284-A288 PolarHBondContact O-N 3.35Å; L285-A288 VanDerWaalsContact O-CB 3.3Å; L285-A288 WeakPolarHBondContact O-CB 3.38Å; L285-A288 PolarHBondContact O-N 3.06Å; A286-A288 VanDerWaalsContact C-N 3.3Å; A286-A288 PolarHBondContact O-N 2.98Å; A288-S290 PolarHBondContact O-N 3.44Å; A288-A291 PolarHBondContact O-N 2.98Å; A288-V292 WeakPolarHBondContact O-CG2 3.34Å; A288-V292 PolarHBondContact O-N 3.33Å
289H90.7Very high85.6Confident0 Ų035.8 Ų35.80%018%0.183CC..Hα-helixtrans-49.6-41.5172.7165-95.7000112.4F248 C251 A286 L287 A291 V292 N293F248-H289 WeakPolarHBondContact CA-CD2 3.42Å; F248-H289 AromaticContact CD2-CD2 3.98Å; F248-H289 AromaticContact CD2-CE1 3.56Å; F248-H289 AromaticContact CD2-ND1 3.84Å; F248-H289 AromaticContact CD2-NE2 3.63Å; F248-H289 PolarHBondContact N-CD2 3.48Å; C251-H289 HydrophobicContact CB-CB 3.82Å; A286-H289 WeakPolarHBondContact O-CB 3.38Å; A286-H289 PolarHBondContact O-N 2.88Å; L287-H289 PolarHBondContact O-N 3.2Å; H289-A291 PolarHBondContact O-N 3.45Å; H289-V292 WeakPolarHBondContact O-CB 3.33Å; H289-V292 PolarHBondContact O-N 3.47Å; H289-N293 PolarHBondContact CE1-ND2 3.18Å; H289-N293 PolarHBondContact NE2-ND2 3.37Å; H289-N293 PolarHBondContact NE2-OD1 2.95Å; H289-N293 PolarHBondContact O-N 3.12Å
290S91Very high83.9Confident1 Ų137.9 Ų37.91%0.00719%0.191CC..Hα-helixtrans-64-27.5-179.1-64.90000112.9N59 D86 L287 A288 P294N59-S290 PolarHBondContact ND2-O 2.92Å; D86-S290 WeakPolarHBondContact OD1-CA 3.34Å; D86-S290 WeakPolarHBondContact OD1-CB 3.37Å; D86-S290 PolarHBondContact OD1-OG 3.26Å; L287-S290 WeakPolarHBondContact O-CB 3.4Å; L287-S290 PolarHBondContact O-N 3.47Å; L287-S290 VanDerWaalsContact O-N 3.09Å; A288-S290 PolarHBondContact O-N 3.44Å; S290-P294 WeakPolarHBondContact O-CD 3.31Å
291A90.1Very high82.1Confident7 Ų737 Ų376%0.05819%0.188CC..Hα-helixtrans-84.6-21.4173.200000113.4I51 V54 A288 H289I51-A291 HydrophobicContact CB-CB 4.45Å; I51-A291 HydrophobicContact CG2-CB 3.81Å; V54-A291 HydrophobicContact CB-CB 4.27Å; V54-A291 HydrophobicContact CG1-CB 4.15Å; A288-A291 PolarHBondContact O-N 2.98Å; H289-A291 PolarHBondContact O-N 3.45Å
292V85.3Confident79.9Confident44 Ų4442.1 Ų42.127%0.26720%0.202SC..Hα-helixtrans-74-33.5178.3173.70000111.6A288 H289 I295 M296A288-V292 WeakPolarHBondContact O-CG2 3.34Å; A288-V292 PolarHBondContact O-N 3.33Å; H289-V292 WeakPolarHBondContact O-CB 3.33Å; H289-V292 PolarHBondContact O-N 3.47Å; V292-I295 WeakPolarHBondContact O-CB 3.43Å; V292-I295 PolarHBondContact O-N 3.24Å; V292-I295 VanDerWaalsContact O-N 3.12Å; V292-M296 HydrophobicContact CG1-CE 3.26Å; V292-M296 HydrophobicContact CG1-CG 3.96Å; V292-M296 HydrophobicContact CG1-SD 4.08Å; V292-M296 WeakPolarHBondContact O-CG 3.28Å; V292-M296 PolarHBondContact O-N 2.88Å
293N80.2Confident77.5Confident0 Ų049.5 Ų49.50%023%0.233CC..Hα-helixtrans-55.4-52.6-177.5-76-13.4000113.7D86 H289 I295 M296 F297D86-N293 PolarHBondContact OD2-ND2 2.95Å; H289-N293 PolarHBondContact CE1-ND2 3.18Å; H289-N293 PolarHBondContact NE2-ND2 3.37Å; H289-N293 PolarHBondContact NE2-OD1 2.95Å; H289-N293 PolarHBondContact O-N 3.12Å; N293-I295 VanDerWaalsContact C-N 3.3Å; N293-I295 PolarHBondContact O-N 3.29Å; N293-M296 PolarHBondContact O-N 3.26Å; N293-F297 HydrophobicContact CB-CE2 4.22Å; N293-F297 WeakPolarHBondContact O-CD2 3.43Å; N293-F297 PolarHBondContact O-N 3.44Å
294P78.1Confident75.2Confident3 Ų353.4 Ų53.42%0.01925%0.249CC..Hα-helixtrans-56.3-39.1173.8-27.535.2000114.4G58 N59 V62 S290 M296 F297 L298G58-P294 VanDerWaalsContact C-CG 3.46Å; N59-P294 HydrophobicContact CB-CG 4.37Å; N59-P294 VanDerWaalsContact CG-CG 3.49Å; N59-P294 VanDerWaalsContact OD1-CG 3.31Å; N59-P294 WeakPolarHBondContact OD1-CG 3.43Å; V62-P294 HydrophobicContact CG2-CB 4.26Å; V62-P294 HydrophobicContact CG2-CG 4.46Å; S290-P294 WeakPolarHBondContact O-CD 3.31Å; P294-M296 VanDerWaalsContact C-N 3.34Å; P294-F297 PolarHBondContact O-N 3.46Å; P294-L298 WeakPolarHBondContact O-CG 3.29Å; P294-L298 PolarHBondContact O-N 3.39Å
295I73.3Confident72.8Confident93 Ų9355.1 Ų55.148%0.47726%0.258SS..Hα-helixtrans-63.7-43.9178.7-58.3173.6000109.8V54 V292 N293 F297 L298 Y299V54-I295 HydrophobicContact CG1-CD1 4.15Å; V54-I295 HydrophobicContact CG1-CG1 4.36Å; V292-I295 WeakPolarHBondContact O-CB 3.43Å; V292-I295 PolarHBondContact O-N 3.24Å; V292-I295 VanDerWaalsContact O-N 3.12Å; N293-I295 VanDerWaalsContact C-N 3.3Å; N293-I295 PolarHBondContact O-N 3.29Å; I295-F297 VanDerWaalsContact C-N 3.34Å; I295-F297 PolarHBondContact O-N 3.38Å; I295-L298 PolarHBondContact O-N 2.83Å; I295-Y299 WeakPolarHBondContact O-CB 3.47Å; I295-Y299 PolarHBondContact O-N 3.22Å
296M69.4Low70.5Confident28 Ų2854.5 Ų54.514%0.13826%0.259CS..Hα-helixtrans-63.7-39.4176.3-68.1-168.2-177.200111.7L240 A243 V244 V292 N293 P294 L298 Y299 F300L240-M296 HydrophobicContact CD1-CB 3.78Å; A243-M296 VanDerWaalsContact C-SD 3.6Å; A243-M296 HydrophobicContact CB-CE 4.4Å; A243-M296 HydrophobicContact CB-SD 4.03Å; A243-M296 WeakPolarHBondContact O-CE 3.39Å; V244-M296 VanDerWaalsContact CA-SD 3.57Å; V244-M296 HydrophobicContact CB-SD 4.19Å; V244-M296 HydrophobicContact CG2-CB 4.25Å; V244-M296 HydrophobicContact CG2-SD 3.58Å; V244-M296 VanDerWaalsContact CG2-SD 3.58Å; V292-M296 HydrophobicContact CG1-CE 3.26Å; V292-M296 HydrophobicContact CG1-CG 3.96Å; V292-M296 HydrophobicContact CG1-SD 4.08Å; V292-M296 WeakPolarHBondContact O-CG 3.28Å; V292-M296 PolarHBondContact O-N 2.88Å; N293-M296 PolarHBondContact O-N 3.26Å; P294-M296 VanDerWaalsContact C-N 3.34Å; M296-L298 PolarHBondContact O-N 3.4Å; M296-Y299 PolarHBondContact O-N 3.44Å; M296-F300 HydrophobicContact CB-CD2 4.38Å; M296-F300 WeakPolarHBondContact O-CD2 3.33Å; M296-F300 PolarHBondContact O-N 2.86Å
297F66.7Low68.2Low24 Ų2460 Ų6011%0.10528%0.284CS..Hα-helixtrans-63-39.6173.7-70.9-59.3000112.9V62 F79 L240 N293 P294 I295 G301V62-F297 HydrophobicContact CG1-CD2 4.26Å; V62-F297 HydrophobicContact CG1-CE2 4.4Å; V62-F297 HydrophobicContact CG2-CD2 3.99Å; F79-F297 AromaticContact CD1-CE1 3.34Å; F79-F297 HydrophobicContact CD1-CE1 3.34Å; F79-F297 HydrophobicContact CD1-CE2 4.32Å; F79-F297 AromaticContact CD1-CZ 3.19Å; F79-F297 HydrophobicContact CD1-CZ 3.19Å; F79-F297 AromaticContact CE1-CE1 3.31Å; F79-F297 HydrophobicContact CE1-CE1 3.31Å; F79-F297 AromaticContact CE1-CZ 3.51Å; F79-F297 HydrophobicContact CE1-CZ 3.51Å; F79-F297 HydrophobicContact CG-CE1 4Å; F79-F297 HydrophobicContact CG-CZ 4.05Å; F79-F297 AromaticContact CZ-CE1 3.97Å; F79-F297 HydrophobicContact CZ-CE1 3.97Å; L240-F297 HydrophobicContact CD2-CD1 4.25Å; L240-F297 HydrophobicContact CD2-CE1 4.42Å; N293-F297 HydrophobicContact CB-CE2 4.22Å; N293-F297 WeakPolarHBondContact O-CD2 3.43Å; N293-F297 PolarHBondContact O-N 3.44Å; P294-F297 PolarHBondContact O-N 3.46Å; I295-F297 VanDerWaalsContact C-N 3.34Å; I295-F297 PolarHBondContact O-N 3.38Å; F297-G301 WeakPolarHBondContact O-CA 3.27Å; F297-G301 PolarHBondContact O-N 3.47Å
298L67.3Low65.8Low79 Ų7961.5 Ų61.541%0.41430%0.295SS..Hα-helixtrans-68.9-43176.9-72.6166.1000112.2M61 P294 I295 M296 L305M61-L298 HydrophobicContact CE-CD1 4.2Å; M61-L298 HydrophobicContact CE-CD2 3.95Å; M61-L298 HydrophobicContact CE-CG 4.31Å; P294-L298 WeakPolarHBondContact O-CG 3.29Å; P294-L298 PolarHBondContact O-N 3.39Å; I295-L298 PolarHBondContact O-N 2.83Å; M296-L298 PolarHBondContact O-N 3.4Å; L298-L305 HydrophobicContact CD2-CD2 3.6Å
299Y63Low63.2Low175 Ų17564.2 Ų64.269%0.68631%0.307SS*.Hα-helixtrans-72-49.4-176.1-173.1-101.1000112.5I295 M296I295-Y299 WeakPolarHBondContact O-CB 3.47Å; I295-Y299 PolarHBondContact O-N 3.22Å; M296-Y299 PolarHBondContact O-N 3.44Å
300F56.4Low60.6Low94 Ų9470.1 Ų70.141%0.41234%0.335SS..Hα-helixtrans-93.2-24-177.7-64-78.8000113.6A239 L240 A243 M296 R302A239-F300 HydrophobicContact CB-CE1 4.46Å; L240-F300 HydrophobicContact CB-CB 3.71Å; L240-F300 HydrophobicContact CB-CD2 4.35Å; L240-F300 HydrophobicContact CB-CG 4.01Å; L240-F300 HydrophobicContact CD1-CB 3.84Å; L240-F300 HydrophobicContact CD1-CD2 3.67Å; L240-F300 HydrophobicContact CD1-CG 4.06Å; L240-F300 HydrophobicContact CD2-CB 4.01Å; L240-F300 HydrophobicContact CG-CB 4.03Å; A243-F300 HydrophobicContact CB-CE2 3.93Å; A243-F300 HydrophobicContact CB-CZ 4.22Å; M296-F300 HydrophobicContact CB-CD2 4.38Å; M296-F300 WeakPolarHBondContact O-CD2 3.33Å; M296-F300 PolarHBondContact O-N 2.86Å; F300-R302 VanDerWaalsContact C-N 3.33Å
301G55Low58Low17 Ų1772.8 Ų72.818%0.17536%0.357CS..SBendtrans-872.7178.600000114.2F297 K303 Q304 L305F297-G301 WeakPolarHBondContact O-CA 3.27Å; F297-G301 PolarHBondContact O-N 3.47Å; G301-K303 PolarHBondContact O-N 3.28Å; G301-Q304 PolarHBondContact O-N 2.9Å; G301-L305 WeakPolarHBondContact O-CB 3.42Å; G301-L305 PolarHBondContact O-N 3.36Å
302R49.1Very low55.2Low185 Ų18574.7 Ų74.770%0.69837%0.373SS*.Hα-helixtrans-47.9-32.2-175.1-145.3174.6175.6-173.2-1.4114.3F300 C306F300-R302 VanDerWaalsContact C-N 3.33Å; R302-C306 WeakPolarHBondContact O-CB 3.38Å; R302-C306 PolarHBondContact O-N 3.48Å; R302-C306 PolarHBondContact O-SG 2.77Å
303K46.1Very low52.5Low176 Ų17680 Ų8077%0.76539%0.39SS*.Hα-helixtrans-75.9-37.3175.4-95.1-174173.2-172.80114.4G301 Q307G301-K303 PolarHBondContact O-N 3.28Å; K303-Q307 VanDerWaalsContact O-CG 3.29Å; K303-Q307 WeakPolarHBondContact O-CG 3.43Å
304Q44.2Very low50.1Low106 Ų10686.5 Ų86.550%0.49542%0.42SS..Hα-helixtrans-87.9-38.5-176.5-13477.213.400111.4G301 S308G301-Q304 PolarHBondContact O-N 2.9Å; Q304-S308 PolarHBondContact O-N 2.97Å; Q304-S308 PolarHBondContact O-OG 2.87Å
305L45Very low47.8Very low36 Ų3695.6 Ų95.619%0.18845%0.453CS..Hα-helixtrans-76.1-36.5179.5-156.379.3000112V65 L298 G301 Q307 S308 L309V65-L305 HydrophobicContact CG1-CD1 3.89Å; L298-L305 HydrophobicContact CD2-CD2 3.6Å; G301-L305 WeakPolarHBondContact O-CB 3.42Å; G301-L305 PolarHBondContact O-N 3.36Å; L305-Q307 VanDerWaalsContact C-N 3.27Å; L305-Q307 PolarHBondContact O-N 3.4Å; L305-S308 PolarHBondContact O-N 3.29Å; L305-L309 HydrophobicContact CD2-CD1 4Å; L305-L309 HydrophobicContact CG-CD1 3.98Å; L305-L309 HydrophobicContact CG-CG 4.33Å; L305-L309 VanDerWaalsContact O-CB 3.31Å; L305-L309 WeakPolarHBondContact O-CB 3.44Å; L305-L309 WeakPolarHBondContact O-CG 3.5Å; L305-L309 PolarHBondContact O-N 3.23Å
306C48Very low45.6Very low55 Ų5594.9 Ų94.937%0.37246%0.461SS..Hα-helixtrans-64.1-32.9172.9-73.20000111.8R302 Q310R302-C306 WeakPolarHBondContact O-CB 3.38Å; R302-C306 PolarHBondContact O-N 3.48Å; R302-C306 PolarHBondContact O-SG 2.77Å; C306-Q310 WeakPolarHBondContact O-CB 3.2Å; C306-Q310 WeakPolarHBondContact O-CG 3.42Å; C306-Q310 PolarHBondContact O-N 3.22Å; C306-Q310 PolarHBondContact O-OE1 2.84Å
307Q45.6Very low43.8Very low116 Ų11698.8 Ų98.854%0.54248%0.483SS..Hα-helixtrans-65.4-43.3173.1-72.6173.4-8.100111.5K303 L305 A311K303-Q307 VanDerWaalsContact O-CG 3.29Å; K303-Q307 WeakPolarHBondContact O-CG 3.43Å; L305-Q307 VanDerWaalsContact C-N 3.27Å; L305-Q307 PolarHBondContact O-N 3.4Å; Q307-A311 VanDerWaalsContact O-CB 3.28Å; Q307-A311 WeakPolarHBondContact O-CB 3.28Å; Q307-A311 PolarHBondContact O-N 3.44Å
308S43.4Very low42.1Very low36 Ų36106.7 Ų106.725%0.25251%0.512SS..Hα-helixtrans-71.8-34.2177.4-58.30000113.6Q304 L305 A312Q304-S308 PolarHBondContact O-N 2.97Å; Q304-S308 PolarHBondContact O-OG 2.87Å; L305-S308 PolarHBondContact O-N 3.29Å; S308-A312 WeakPolarHBondContact O-CB 3.21Å; S308-A312 PolarHBondContact O-N 3.17Å
309L39.3Very low40.5Very low73 Ų73108.3 Ų108.338%0.38252%0.521SS..Hα-helixtrans-76.1-38.3176.6-73.6169.8000112L305 A311 A312 Y313L305-L309 HydrophobicContact CD2-CD1 4Å; L305-L309 HydrophobicContact CG-CD1 3.98Å; L305-L309 HydrophobicContact CG-CG 4.33Å; L305-L309 VanDerWaalsContact O-CB 3.31Å; L305-L309 WeakPolarHBondContact O-CB 3.44Å; L305-L309 WeakPolarHBondContact O-CG 3.5Å; L305-L309 PolarHBondContact O-N 3.23Å; L309-A311 VanDerWaalsContact C-N 3.33Å; L309-A312 PolarHBondContact O-N 3.04Å; L309-Y313 VanDerWaalsContact O-CB 3.26Å; L309-Y313 WeakPolarHBondContact O-CB 3.4Å; L309-Y313 PolarHBondContact O-N 3.48Å
310Q36.1Very low39.4Very low124 Ų124105.1 Ų105.158%0.57952%0.521SS*.Hα-helixtrans-63.6-40.2170.5-76.7174.8-30.500110.9C306 Y313 H314C306-Q310 WeakPolarHBondContact O-CB 3.2Å; C306-Q310 WeakPolarHBondContact O-CG 3.42Å; C306-Q310 PolarHBondContact O-N 3.22Å; C306-Q310 PolarHBondContact O-OE1 2.84Å; Q310-Y313 PolarHBondContact O-N 3.11Å; Q310-H314 WeakPolarHBondContact O-CB 3.47Å; Q310-H314 PolarHBondContact O-CD2 3.23Å; Q310-H314 VanDerWaalsContact O-CD2 3.31Å; Q310-H314 PolarHBondContact O-N 2.74Å
311A37.3Very low38.4Very low58 Ų58107.7 Ų107.748%0.47953%0.534SS..Hα-helixtrans-65.7-39.6174.300000112.5Q307 L309 W315Q307-A311 VanDerWaalsContact O-CB 3.28Å; Q307-A311 WeakPolarHBondContact O-CB 3.28Å; Q307-A311 PolarHBondContact O-N 3.44Å; L309-A311 VanDerWaalsContact C-N 3.33Å; A311-W315 WeakPolarHBondContact O-CB 3.19Å; A311-W315 PolarHBondContact O-N 3.28Å
312A31.2Very low37.6Very low47 Ų47112.2 Ų112.239%0.38856%0.555SS.*Hα-helixtrans-70.2-35.9176.400000113S308 L309 W315 A316S308-A312 WeakPolarHBondContact O-CB 3.21Å; S308-A312 PolarHBondContact O-N 3.17Å; L309-A312 PolarHBondContact O-N 3.04Å; A312-W315 PolarHBondContact O-N 3.29Å; A312-A316 WeakPolarHBondContact O-CB 3.33Å; A312-A316 PolarHBondContact O-N 3.44Å
313Y27.1Very low37.1Very low156 Ų156110.8 Ų110.861%0.61256%0.556SS**Hα-helixtrans-68.6-43.8173.9-179.2-102.6000111.8L309 Q310 W315 A316 L317L309-Y313 VanDerWaalsContact O-CB 3.26Å; L309-Y313 WeakPolarHBondContact O-CB 3.4Å; L309-Y313 PolarHBondContact O-N 3.48Å; Q310-Y313 PolarHBondContact O-N 3.11Å; Y313-W315 VanDerWaalsContact C-N 3.3Å; Y313-W315 PolarHBondContact O-N 3.08Å; Y313-A316 PolarHBondContact O-N 3.31Å; Y313-L317 HydrophobicContact CD1-CD1 3.82Å; Y313-L317 HydrophobicContact CD2-CD1 4.36Å; Y313-L317 HydrophobicContact CE1-CD1 3.32Å; Y313-L317 HydrophobicContact CE2-CD1 3.93Å; Y313-L317 HydrophobicContact CG-CD1 4.32Å; Y313-L317 PolarHBondContact O-N 3.18Å; Y313-L317 VanDerWaalsContact O-N 3.16Å
314H30.6Very low36.9Very low136 Ų136110 Ų11063%0.6356%0.555SS**Hα-helixtrans-65.7-31.5173.6-90.2-69.5000113.2Q310Q310-H314 WeakPolarHBondContact O-CB 3.47Å; Q310-H314 PolarHBondContact O-CD2 3.23Å; Q310-H314 VanDerWaalsContact O-CD2 3.31Å; Q310-H314 PolarHBondContact O-N 2.74Å
315W28.8Very low36.7Very low193 Ų193108.5 Ų108.573%0.73155%0.553SS**Hα-helixtrans-74.6-34.1175.3-172.784.1000112.3A311 A312 Y313 L317A311-W315 WeakPolarHBondContact O-CB 3.19Å; A311-W315 PolarHBondContact O-N 3.28Å; A312-W315 PolarHBondContact O-N 3.29Å; Y313-W315 VanDerWaalsContact C-N 3.3Å; Y313-W315 PolarHBondContact O-N 3.08Å; W315-L317 VanDerWaalsContact C-N 3.32Å
316A29.1Very low36.4Very low78 Ų78113.8 Ų113.865%0.64558%0.579SS**Hα-helixtrans-76.2-15.6176.300000114.2A312 Y313A312-A316 WeakPolarHBondContact O-CB 3.33Å; A312-A316 PolarHBondContact O-N 3.44Å; Y313-A316 PolarHBondContact O-N 3.31Å
317L30.8Very low36.2Very low111 Ų111116.2 Ų116.258%0.58159%0.592SS**THydrogen-bonded Turntrans-98.62.5176.2-81.6165000113.8Y313 W315 D319Y313-L317 HydrophobicContact CD1-CD1 3.82Å; Y313-L317 HydrophobicContact CD2-CD1 4.36Å; Y313-L317 HydrophobicContact CE1-CD1 3.32Å; Y313-L317 HydrophobicContact CE2-CD1 3.93Å; Y313-L317 HydrophobicContact CG-CD1 4.32Å; Y313-L317 PolarHBondContact O-N 3.18Å; Y313-L317 VanDerWaalsContact O-N 3.16Å; W315-L317 VanDerWaalsContact C-N 3.32Å; L317-D319 PolarHBondContact O-N 3.4Å
318R31.3Very low36Very low190 Ų190114.2 Ų114.272%0.71759%0.59SS**  trans-78.5110.4166.9-93.2-175.5-179.2-178.7-0.4108.5
319D32.7Very low36Very low113 Ų113119.3 Ų119.360%0.60461%0.608SS**  trans-64.8140.8171.9-132.3-14.4000109.2L317 Q321L317-D319 PolarHBondContact O-N 3.4Å; D319-Q321 PolarHBondContact O-N 3.43Å
320P40.2Very low36.2Very low107 Ų107119.8 Ų119.870%0.69561%0.614SS**THydrogen-bonded Turntrans-63.1-8.8-176.1-21.332.8000115.2D322P320-D322 PolarHBondContact O-N 2.92Å
321Q35.1Very low36.5Very low148 Ų148117 Ų11769%0.69261%0.608SS**THydrogen-bonded Turntrans-77.9-13.3-176-79.6-178-2800114.6D319 T325D319-Q321 PolarHBondContact O-N 3.43Å; Q321-T325 PolarHBondContact O-OG1 2.9Å
322D37.8Very low37Very low113 Ų113118.5 Ų118.560%0.60461%0.611SS**Hα-helixtrans-82.8-16.1-179-80.9-27.4000114.3P320P320-D322 PolarHBondContact O-N 2.92Å
323E40.5Very low37.7Very low155 Ų155119.5 Ų119.572%0.72462%0.615SS**Hα-helixtrans-80.8-30.3179.9-83.7-171.9165.300113.6V327E323-V327 PolarHBondContact O-N 3.16Å
324E40.3Very low38.4Very low160 Ų160118.7 Ų118.775%0.74862%0.617SS**Hα-helixtrans-71-32.1177-76.9-172.8159.300112.5M326 S328E324-M326 PolarHBondContact O-N 3.5Å; E324-S328 WeakPolarHBondContact O-CB 3.38Å; E324-S328 PolarHBondContact O-N 2.76Å
325T40.1Very low38.9Very low73 Ų73119.6 Ų119.645%0.44862%0.622SS.*Hα-helixtrans-74.9-22.9-178.1-20.80000113.6Q321 K329Q321-T325 PolarHBondContact O-OG1 2.9Å; T325-K329 WeakPolarHBondContact O-CG 3.46Å
326M38.9Very low39.7Very low147 Ų147113.8 Ų113.872%0.72462%0.615SS**Hα-helixtrans-84.9-35.9175.1-84.7-159166.300112.7E324 V330E324-M326 PolarHBondContact O-N 3.5Å; M326-V330 WeakPolarHBondContact O-CG2 3.25Å; M326-V330 PolarHBondContact O-N 3.23Å
327V44.4Very low40.4Very low107 Ų107115.4 Ų115.465%0.64862%0.616SS**Hα-helixtrans-71-37.8178.2178.20000111.3E323 K329 V330 S331E323-V327 PolarHBondContact O-N 3.16Å; V327-K329 PolarHBondContact O-N 3.1Å; V327-V330 PolarHBondContact O-N 3.32Å; V327-S331 PolarHBondContact O-N 2.84Å
328S41.6Very low41Very low73 Ų73115.3 Ų115.351%0.5163%0.625SS.*Hα-helixtrans-64.3-35.7176.1170.30000113.5E324 S331 T332E324-S328 WeakPolarHBondContact O-CB 3.38Å; E324-S328 PolarHBondContact O-N 2.76Å; S328-S331 PolarHBondContact O-OG 3.04Å; S328-T332 PolarHBondContact O-N 3.31Å; S328-T332 PolarHBondContact O-OG1 3.01Å
329K41.9Very low41.8Very low143 Ų143115 Ų11562%0.62263%0.632SS**Hα-helixtrans-76.8-26.3179.9-74.6-180-179.6177.30113.7T325 V327 S333T325-K329 WeakPolarHBondContact O-CG 3.46Å; V327-K329 PolarHBondContact O-N 3.1Å; K329-S333 PolarHBondContact O-OG 3.1Å
330V44.3Very low42.5Very low83 Ų83115.7 Ų115.750%0.50364%0.64SS.*Hα-helixtrans-77.4-35.4176.8174.40000111.1M326 V327 S333 Q334M326-V330 WeakPolarHBondContact O-CG2 3.25Å; M326-V330 PolarHBondContact O-N 3.23Å; V327-V330 PolarHBondContact O-N 3.32Å; V330-S333 PolarHBondContact O-OG 3.35Å; V330-Q334 PolarHBondContact O-N 3.35Å
331S43.2Very low42.8Very low66 Ų66116.9 Ų116.946%0.46265%0.645SS.*Hα-helixtrans-70.8-39.1177.4710000112.9V327 S328 S333 Q334 E335V327-S331 PolarHBondContact O-N 2.84Å; S328-S331 PolarHBondContact O-OG 3.04Å; S331-S333 VanDerWaalsContact C-N 3.3Å; S331-S333 PolarHBondContact O-N 3.36Å; S331-Q334 PolarHBondContact O-N 3.17Å; S331-E335 PolarHBondContact O-N 3.42Å
332T46.8Very low42.9Very low90 Ų90121.7 Ų121.755%0.55267%0.674SS**Hα-helixtrans-70.4-24.6178.613.60000113.5S328S328-T332 PolarHBondContact O-N 3.31Å; S328-T332 PolarHBondContact O-OG1 3.01Å
333S46.3Very low43.1Very low67 Ų67122.1 Ų122.147%0.46968%0.677SS.*Hα-helixtrans-87.3-19.6178.944.90000113.6K329 V330 S331 V337K329-S333 PolarHBondContact O-OG 3.1Å; V330-S333 PolarHBondContact O-OG 3.35Å; S331-S333 VanDerWaalsContact C-N 3.3Å; S331-S333 PolarHBondContact O-N 3.36Å; S333-V337 WeakPolarHBondContact O-CG2 3.13Å
334Q42.5Very low43.3Very low139 Ų139120.4 Ų120.465%0.6568%0.675SS**Hα-helixtrans-84.5-29.7173.5-83.1176.9-46.500113.6V330 S331V330-Q334 PolarHBondContact O-N 3.35Å; S331-Q334 PolarHBondContact O-N 3.17Å
335E41.2Very low43.4Very low155 Ų155118.2 Ų118.272%0.72467%0.671SS**Hα-helixtrans-73.5-33.5174.3-80.4-179.6157.800112.7S331 V337S331-E335 PolarHBondContact O-N 3.42Å; E335-V337 VanDerWaalsContact C-N 3.28Å; E335-V337 PolarHBondContact O-N 3.39Å
336A43.8Very low43.6Very low71 Ų71120.8 Ų120.859%0.58768%0.684SS**THydrogen-bonded Turntrans-72.3-13.2-17900000115.1
337V45.7Very low43.9Very low112 Ų112119.2 Ų119.268%0.67968%0.681SS**THydrogen-bonded Turntrans-96.2-13-176.2178.40000112.7S333 E335S333-V337 WeakPolarHBondContact O-CG2 3.13Å; E335-V337 VanDerWaalsContact C-N 3.28Å; E335-V337 PolarHBondContact O-N 3.39Å
338S43Very low43.9Very low109 Ų109120 Ų12076%0.76268%0.684SS**SBendtrans-90.1-4.7-179.4-70.20000115.3
339E47.9Very low44.1Very low184 Ų184123.4 Ų123.486%0.8670%0.696SS**SBendtrans-100.37.4-177-104.3-174173.400115.9
340V46.8Very low44.2Very low127 Ų127121.8 Ų121.877%0.7770%0.702SS**SBendtrans-117.824-176.3-1700000113.8
341V46Very low44.2Very low133 Ų133125.1 Ų125.181%0.80672%0.718SS**  trans-128.680.3168.6-171.70000110.2
342L37.6Very low44.3Very low248 Ų248130.5 Ų130.5100%1.29874%0.741SS**  trans-154.50146.5-128132000110.9

Retrieved 342 of 342 residues in 89.7 ms (Link to these results)