A0A3B3VW10_9TELE Loading...

Transmembrane protein 50B

AlphaFold DB , UniProt , Accession A0A3B3VW10, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 159 aa.

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

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
1M43.1Very low47.2Very low248 Ų248168.3 Ų168.3100%1.22285%0.845SS**  096.50-87.1169.817200108
2M43.3Very low47.1Very low194 Ų194162.5 Ų162.596%0.95683%0.828SS**  trans-13597.5178.8-85.8-94-87.900106.8
3A48.9Very low47.5Very low98 Ų98163.8 Ų163.881%0.8183%0.829SS**  trans-157.432.2172.100000111.5
4G51.3Low47.3Very low69 Ų69157.6 Ų157.671%0.71181%0.807SS**  trans-110.81.9-176.100000115.3
5F51.9Low47.6Very low194 Ų194157.9 Ų157.985%0.85181%0.811SS**SBendtrans-102.2-8.1-173.3-156.9-102000114.2
6L46.7Very low47.7Very low157 Ų157161.5 Ų161.582%0.82281%0.811SS**SBendtrans-104.8-9.8179.4-64.6178.7000114.2N8L6-N8 PolarHBondContact O-N 3.4Å
7D50.3Low47.6Very low144 Ų144156.8 Ų156.877%0.7778%0.784SS**THydrogen-bonded Turntrans-78.4-2.3177.5-89.6-16.9000114.1
8N46.2Very low48.1Very low148 Ų148152.5 Ų152.579%0.79177%0.765SS**THydrogen-bonded Turntrans-102.67.6-178.5-146.3-15.1000113.9L6 R10L6-N8 PolarHBondContact O-N 3.4Å; N8-R10 VanDerWaalsContact C-N 3.26Å; N8-R10 PolarHBondContact O-N 3.25Å
9F45.3Very low48.8Very low168 Ų168153.7 Ų153.774%0.73776%0.759SS**  trans-97.546.8167.5-115.8-83.1000110.9W11F9-W11 AromaticContact CD1-CE3 3.87Å; F9-W11 HydrophobicContact CD1-CE3 3.87Å; F9-W11 HydrophobicContact CD1-CZ3 4.07Å; F9-W11 AromaticContact CE1-CE3 3.94Å; F9-W11 HydrophobicContact CE1-CE3 3.94Å; F9-W11 AromaticContact CE1-CZ3 3.79Å; F9-W11 HydrophobicContact CE1-CZ3 3.79Å; F9-W11 PolarHBondContact O-N 2.97Å
10R50Low49.5Very low231 Ų231146.5 Ų146.587%0.87273%0.727SS**  trans-74.688161.8-132.3174.9165.4-168.7-6.9106.1N8N8-R10 VanDerWaalsContact C-N 3.26Å; N8-R10 PolarHBondContact O-N 3.25Å
11W42.2Very low50.3Low200 Ų200145.9 Ų145.976%0.75872%0.722SS**  trans-49.4125.6170.3-140.6-72.4000106.9F9 E13F9-W11 AromaticContact CD1-CE3 3.87Å; F9-W11 HydrophobicContact CD1-CE3 3.87Å; F9-W11 HydrophobicContact CD1-CZ3 4.07Å; F9-W11 AromaticContact CE1-CE3 3.94Å; F9-W11 HydrophobicContact CE1-CE3 3.94Å; F9-W11 AromaticContact CE1-CZ3 3.79Å; F9-W11 HydrophobicContact CE1-CZ3 3.79Å; F9-W11 PolarHBondContact O-N 2.97Å; W11-E13 PolarHBondContact O-N 3.02Å
12P46.3Very low51.7Low99 Ų99141.6 Ų141.664%0.64369%0.692SS**  trans-61.2117.7175.624.5-30000106.5C14P12-C14 VanDerWaalsContact C-N 3.34Å; P12-C14 PolarHBondContact O-N 3.24Å
13E51.9Low53.2Low180 Ų180137.6 Ų137.684%0.84167%0.666SS**  trans-55.8106.1166.3-71.2-179.1151.500105.9W11 D15W11-E13 PolarHBondContact O-N 3.02Å; E13-D15 VanDerWaalsContact C-N 3.35Å; E13-D15 PolarHBondContact O-N 3.35Å
14C44.8Very low54.8Low76 Ų76134.6 Ų134.651%0.51464%0.637SS.*  trans-80.888.6-176.4-123.90000106.7P12 W16 F17P12-C14 VanDerWaalsContact C-N 3.34Å; P12-C14 PolarHBondContact O-N 3.24Å; C14-W16 PolarHBondContact O-N 2.95Å; C14-F17 PolarHBondContact O-N 3.43Å
15D52.1Low56.3Low162 Ų162133.9 Ų133.987%0.86662%0.624SS**THydrogen-bonded Turntrans-56.4-6.4179.2-74.9-29.2000114.7E13E13-D15 VanDerWaalsContact C-N 3.35Å; E13-D15 PolarHBondContact O-N 3.35Å
16W48.9Very low57.9Low216 Ų216129 Ų12982%0.81861%0.609SS**THydrogen-bonded Turntrans-88.4-14.5176.288.7-57.9000114.2C14C14-W16 PolarHBondContact O-N 2.95Å
17F46.1Very low59.9Low81 Ų81121.9 Ų121.936%0.35557%0.574SS.*SBendtrans-122.389-178-162.2-97.4000108.2C14 W19C14-F17 PolarHBondContact O-N 3.43Å; F17-W19 AromaticContact CD1-CE3 3.95Å; F17-W19 HydrophobicContact CD1-CE3 3.95Å; F17-W19 AromaticContact CE1-CE3 3.62Å; F17-W19 HydrophobicContact CE1-CE3 3.62Å; F17-W19 AromaticContact CE1-CZ3 3.95Å; F17-W19 HydrophobicContact CE1-CZ3 3.95Å; F17-W19 PolarHBondContact O-N 3.05Å
18D57.5Low61.7Low80 Ų80117.4 Ų117.443%0.42855%0.554SS.*  trans-6580.8-178.8-161.8-19.4000110.9G20 E21 R22D18-G20 PolarHBondContact O-N 3.44Å; D18-G20 PolarHBondContact OD1-N 2.95Å; D18-E21 HydrophobicContact CB-CB 4.05Å; D18-E21 PolarHBondContact O-N 3.32Å; D18-E21 PolarHBondContact OD1-N 3.38Å; D18-E21 WeakPolarHBondContact OD2-CB 3.45Å; D18-R22 PolarHBondContact O-N 3.15Å; D18-R22 VanDerWaalsContact O-N 3.1Å
19W61Low63.8Low175 Ų175115.3 Ų115.366%0.66355%0.546SS*.Hα-helixtrans-64.8-28.8179-173.6-99000110.7F17 R23F17-W19 AromaticContact CD1-CE3 3.95Å; F17-W19 HydrophobicContact CD1-CE3 3.95Å; F17-W19 AromaticContact CE1-CE3 3.62Å; F17-W19 HydrophobicContact CE1-CE3 3.62Å; F17-W19 AromaticContact CE1-CZ3 3.95Å; F17-W19 HydrophobicContact CE1-CZ3 3.95Å; F17-W19 PolarHBondContact O-N 3.05Å; W19-R23 WeakPolarHBondContact O-CB 3.39Å; W19-R23 PolarHBondContact O-N 3.44Å
20G63Low66.1Low10 Ų10110 Ų11010%0.10353%0.527CS..Hα-helixtrans-68.1-49.3175.700000111.7D18 R23 N24D18-G20 PolarHBondContact O-N 3.44Å; D18-G20 PolarHBondContact OD1-N 2.95Å; G20-R23 PolarHBondContact O-N 3.49Å; G20-N24 WeakPolarHBondContact O-CB 3.45Å; G20-N24 PolarHBondContact O-N 3.45Å; G20-N24 PolarHBondContact O-OD1 3.39Å
21E65.8Low68.1Low133 Ų13399 Ų9962%0.62149%0.486SS*.Hα-helixtrans-68.2-41.4-179.3-161171.7-138.900112D18 R23 N24 A25D18-E21 HydrophobicContact CB-CB 4.05Å; D18-E21 PolarHBondContact O-N 3.32Å; D18-E21 PolarHBondContact OD1-N 3.38Å; D18-E21 WeakPolarHBondContact OD2-CB 3.45Å; E21-R23 PolarHBondContact O-N 3.03Å; E21-N24 PolarHBondContact O-N 3.16Å; E21-A25 PolarHBondContact O-N 3.15Å
22R72.7Confident70.4Confident158 Ų15891.4 Ų91.460%0.59647%0.469SS*.Hα-helixtrans-61.2-42.7171.2-81.9-170.1178.3-160.92.9112.6D18 N24 A25 V26D18-R22 PolarHBondContact O-N 3.15Å; D18-R22 VanDerWaalsContact O-N 3.1Å; R22-N24 VanDerWaalsContact C-N 3.35Å; R22-A25 PolarHBondContact O-N 2.85Å; R22-V26 WeakPolarHBondContact O-CB 3.35Å; R22-V26 VanDerWaalsContact O-CG2 3.25Å; R22-V26 WeakPolarHBondContact O-CG2 3.32Å; R22-V26 PolarHBondContact O-N 2.97Å
23R74.8Confident72.7Confident110 Ų11089.4 Ų89.442%0.41546%0.458SS..Hα-helixtrans-65.5-40179-176.3173.460.2-159.3-14.2111.5W19 G20 E21 V26 A27 T154W19-R23 WeakPolarHBondContact O-CB 3.39Å; W19-R23 PolarHBondContact O-N 3.44Å; G20-R23 PolarHBondContact O-N 3.49Å; E21-R23 PolarHBondContact O-N 3.03Å; R23-V26 PolarHBondContact O-N 3.37Å; R23-A27 WeakPolarHBondContact O-CB 3.15Å; R23-A27 PolarHBondContact O-N 3.26Å; R23-T154 PolarHBondContact NE-OG1 2.88Å; R23-T154 PolarHBondContact NH2-OG1 2.78Å
24N81.6Confident74.7Confident36 Ų3682.5 Ų82.519%0.19343%0.426CS..Hα-helixtrans-63.9-43.4176.6-69.9-7.7000112G20 E21 R22 A27 S28 R153 T154G20-N24 WeakPolarHBondContact O-CB 3.45Å; G20-N24 PolarHBondContact O-N 3.45Å; G20-N24 PolarHBondContact O-OD1 3.39Å; E21-N24 PolarHBondContact O-N 3.16Å; R22-N24 VanDerWaalsContact C-N 3.35Å; N24-A27 PolarHBondContact O-N 3.38Å; N24-S28 WeakPolarHBondContact O-CB 3.34Å; N24-S28 PolarHBondContact O-N 3.28Å; N24-S28 PolarHBondContact O-OG 2.86Å; N24-R153 HydrophobicContact CB-CG 4.19Å; N24-R153 WeakPolarHBondContact OD1-CA 3.35Å; N24-T154 PolarHBondContact ND2-O 3.33Å; N24-T154 PolarHBondContact OD1-N 3.02Å; N24-T154 PolarHBondContact OD1-O 2.87Å; N24-T154 PolarHBondContact OD1-OG1 3.01Å
25A83.6Confident77Confident53 Ų5381 Ų8144%0.43841%0.411SS..Hα-helixtrans-64.6-44176.200000112E21 R22 S28 V29E21-A25 PolarHBondContact O-N 3.15Å; R22-A25 PolarHBondContact O-N 2.85Å; A25-S28 PolarHBondContact O-N 2.95Å; A25-S28 PolarHBondContact O-OG 3.32Å; A25-V29 WeakPolarHBondContact O-CB 3.29Å; A25-V29 VanDerWaalsContact O-CG2 3.23Å; A25-V29 WeakPolarHBondContact O-CG2 3.4Å; A25-V29 PolarHBondContact O-N 3.36Å
26V86.2Confident79Confident91 Ų9179.2 Ų79.255%0.55240%0.396SS*.Hα-helixtrans-65.9-44.1177173.10000110.8R22 R23 S28 V29 V30R22-V26 WeakPolarHBondContact O-CB 3.35Å; R22-V26 VanDerWaalsContact O-CG2 3.25Å; R22-V26 WeakPolarHBondContact O-CG2 3.32Å; R22-V26 PolarHBondContact O-N 2.97Å; R23-V26 PolarHBondContact O-N 3.37Å; V26-S28 VanDerWaalsContact C-N 3.35Å; V26-S28 PolarHBondContact O-N 2.89Å; V26-V29 PolarHBondContact O-N 2.94Å; V26-V30 HydrophobicContact CG1-CG2 4.15Å; V26-V30 WeakPolarHBondContact O-CB 3.47Å; V26-V30 VanDerWaalsContact O-CG2 3.24Å; V26-V30 WeakPolarHBondContact O-CG2 3.45Å; V26-V30 PolarHBondContact O-N 2.85Å
27A87Confident81.1Confident9 Ų971.4 Ų71.47%0.07437%0.372CS..Hα-helixtrans-61.7-41.4178.700000112.1R23 N24 A31R23-A27 WeakPolarHBondContact O-CB 3.15Å; R23-A27 PolarHBondContact O-N 3.26Å; N24-A27 PolarHBondContact O-N 3.38Å; A27-A31 WeakPolarHBondContact O-CB 3.41Å; A27-A31 PolarHBondContact O-N 3.19Å
28S89.1Confident83.2Confident50 Ų5067.6 Ų67.635%0.3536%0.355SS..Hα-helixtrans-69.3-40.1177.766.10000112.4N24 A25 V26 G32N24-S28 WeakPolarHBondContact O-CB 3.34Å; N24-S28 PolarHBondContact O-N 3.28Å; N24-S28 PolarHBondContact O-OG 2.86Å; A25-S28 PolarHBondContact O-N 2.95Å; A25-S28 PolarHBondContact O-OG 3.32Å; V26-S28 VanDerWaalsContact C-N 3.35Å; V26-S28 PolarHBondContact O-N 2.89Å; S28-G32 PolarHBondContact O-N 2.88Å
29V91.2Very high84.8Confident103 Ų10367.5 Ų67.562%0.62435%0.349SS*.Hα-helixtrans-63.9-47.5175.21700000111.1A25 V26 G32 S33A25-V29 WeakPolarHBondContact O-CB 3.29Å; A25-V29 VanDerWaalsContact O-CG2 3.23Å; A25-V29 WeakPolarHBondContact O-CG2 3.4Å; A25-V29 PolarHBondContact O-N 3.36Å; V26-V29 PolarHBondContact O-N 2.94Å; V29-G32 PolarHBondContact O-N 3.41Å; V29-S33 WeakPolarHBondContact O-CB 3.14Å; V29-S33 PolarHBondContact O-N 2.89Å; V29-S33 PolarHBondContact O-OG 3.32Å
30V91.7Very high86.2Confident58 Ų5866.5 Ų66.535%0.35235%0.345SS..Hα-helixtrans-63.9-47.4179173.80000110.4V26 G32 S33 L34 I148V26-V30 HydrophobicContact CG1-CG2 4.15Å; V26-V30 WeakPolarHBondContact O-CB 3.47Å; V26-V30 VanDerWaalsContact O-CG2 3.24Å; V26-V30 WeakPolarHBondContact O-CG2 3.45Å; V26-V30 PolarHBondContact O-N 2.85Å; V30-G32 VanDerWaalsContact C-N 3.35Å; V30-G32 PolarHBondContact O-N 3.28Å; V30-S33 PolarHBondContact O-N 3.41Å; V30-S33 PolarHBondContact O-OG 3.01Å; V30-L34 HydrophobicContact CG1-CD1 3.98Å; V30-L34 WeakPolarHBondContact O-CG 3.23Å; V30-L34 PolarHBondContact O-N 3.37Å; V30-I148 HydrophobicContact CB-CG2 4.34Å; V30-I148 HydrophobicContact CG1-CD1 4.14Å; V30-I148 HydrophobicContact CG1-CG2 4.13Å
31A92.2Very high87.3Confident0 Ų068.2 Ų68.20%035%0.352CS..Hα-helixtrans-59.5-4517600000112.1A27 S33 L34 F35 S145 I148 Y149A27-A31 WeakPolarHBondContact O-CB 3.41Å; A27-A31 PolarHBondContact O-N 3.19Å; A31-S33 PolarHBondContact O-N 3.5Å; A31-L34 PolarHBondContact O-N 3.28Å; A31-F35 PolarHBondContact O-N 3.32Å; A31-S145 WeakPolarHBondContact CB-O 3.5Å; A31-S145 WeakPolarHBondContact O-CB 3.33Å; A31-S145 PolarHBondContact O-OG 3.48Å; A31-I148 HydrophobicContact CB-CG2 4.26Å; A31-Y149 HydrophobicContact CB-CD2 3.84Å; A31-Y149 HydrophobicContact CB-CG 4.27Å
32G92Very high88.2Confident39 Ų3962.1 Ų62.140%0.40232%0.323SS..Hα-helixtrans-60.4-44.2177.200000112.4S28 V29 V30 L34 F35 F36S28-G32 PolarHBondContact O-N 2.88Å; V29-G32 PolarHBondContact O-N 3.41Å; V30-G32 VanDerWaalsContact C-N 3.35Å; V30-G32 PolarHBondContact O-N 3.28Å; G32-L34 PolarHBondContact O-N 2.82Å; G32-F35 PolarHBondContact O-N 3.16Å; G32-F36 WeakPolarHBondContact O-CB 3.3Å; G32-F36 PolarHBondContact O-N 2.95Å
33S94.4Very high88.9Confident58 Ų5859.4 Ų59.441%0.40632%0.319SS..Hα-helixtrans-61.2-43.7176.669.80000112.1V29 V30 A31 F36 T37V29-S33 WeakPolarHBondContact O-CB 3.14Å; V29-S33 PolarHBondContact O-N 2.89Å; V29-S33 PolarHBondContact O-OG 3.32Å; V30-S33 PolarHBondContact O-N 3.41Å; V30-S33 PolarHBondContact O-OG 3.01Å; A31-S33 PolarHBondContact O-N 3.5Å; S33-F36 PolarHBondContact O-N 3.45Å; S33-T37 VanDerWaalsContact O-CG2 3.3Å; S33-T37 WeakPolarHBondContact O-CG2 3.4Å; S33-T37 PolarHBondContact O-N 3.18Å; S33-T37 PolarHBondContact O-OG1 3.12Å
34L92.9Very high89.4Confident34 Ų3459.1 Ų59.118%0.17833%0.326CS..Hα-helixtrans-66-40.4178-69.2168.1000112.6V30 A31 G32 F36 T37 G38 F141 F144 I148V30-L34 HydrophobicContact CG1-CD1 3.98Å; V30-L34 WeakPolarHBondContact O-CG 3.23Å; V30-L34 PolarHBondContact O-N 3.37Å; A31-L34 PolarHBondContact O-N 3.28Å; G32-L34 PolarHBondContact O-N 2.82Å; L34-F36 VanDerWaalsContact C-N 3.34Å; L34-T37 WeakPolarHBondContact CA-OG1 3.3Å; L34-T37 PolarHBondContact O-N 3.11Å; L34-T37 PolarHBondContact O-OG1 3.14Å; L34-G38 PolarHBondContact O-N 3.26Å; L34-F141 HydrophobicContact CD2-CD1 3.81Å; L34-F141 HydrophobicContact CD2-CE1 4.27Å; L34-F141 WeakPolarHBondContact O-CB 3.47Å; L34-F144 HydrophobicContact CD1-CB 4.48Å; L34-I148 HydrophobicContact CD1-CD1 3.37Å
35F93.4Very high89.5Confident44 Ų4457.7 Ų57.719%0.19332%0.319CS..Hα-helixtrans-63.1-44.4175.2-176.3-96.9000111.1A31 G32 G38 W39 T67 F70 F71 I142A31-F35 PolarHBondContact O-N 3.32Å; G32-F35 PolarHBondContact O-N 3.16Å; F35-G38 PolarHBondContact O-N 3.48Å; F35-W39 AromaticContact CD1-CD1 3.85Å; F35-W39 AromaticContact CE1-CD1 3.45Å; F35-W39 VanDerWaalsContact CE1-CD1 3.45Å; F35-W39 AromaticContact CE1-NE1 3.45Å; F35-W39 AromaticContact CE2-NE1 3.57Å; F35-W39 AromaticContact CZ-CD1 3.58Å; F35-W39 AromaticContact CZ-NE1 3.08Å; F35-W39 PolarHBondContact O-N 3.28Å; F35-T67 HydrophobicContact CE2-CG2 3.72Å; F35-T67 HydrophobicContact CZ-CG2 4.06Å; F35-F70 HydrophobicContact CD2-CD1 4.32Å; F35-F70 HydrophobicContact CD2-CD2 4.4Å; F35-F70 HydrophobicContact CD2-CE1 4.48Å; F35-F70 HydrophobicContact CD2-CG 4.31Å; F35-F70 HydrophobicContact CE2-CD1 4.17Å; F35-F70 HydrophobicContact CE2-CG 4.34Å; F35-F71 HydrophobicContact CZ-CE2 4.5Å; F35-I142 HydrophobicContact CD2-CG1 4.11Å; F35-I142 HydrophobicContact CD2-CG2 4.28Å; F35-I142 HydrophobicContact CE2-CG1 4.47Å; F35-I142 HydrophobicContact CE2-CG2 4.38Å
36F94.2Very high89.4Confident126 Ų12657 Ų5755%0.55331%0.313SS*.Hα-helixtrans-61-47.2175.6177.1-98.6000111.6G32 S33 L34 G38 W39 W40G32-F36 WeakPolarHBondContact O-CB 3.3Å; G32-F36 PolarHBondContact O-N 2.95Å; S33-F36 PolarHBondContact O-N 3.45Å; L34-F36 VanDerWaalsContact C-N 3.34Å; F36-G38 VanDerWaalsContact C-N 3.29Å; F36-G38 PolarHBondContact O-N 2.92Å; F36-W39 PolarHBondContact O-N 3.45Å; F36-W40 HydrophobicContact CE1-CE3 4.21Å; F36-W40 HydrophobicContact CE2-CE3 4.47Å; F36-W40 HydrophobicContact CZ-CD2 4.49Å; F36-W40 AromaticContact CZ-CE3 3.71Å; F36-W40 HydrophobicContact CZ-CE3 3.71Å; F36-W40 HydrophobicContact CZ-CZ3 4.25Å; F36-W40 WeakPolarHBondContact O-CB 3.42Å; F36-W40 PolarHBondContact O-N 3.44Å
37T93.3Very high89.2Confident52 Ų5258.1 Ų58.132%0.31932%0.32SS..Hα-helixtrans-62.8-36.1177.956.60000112.4S33 L34 W40 I41S33-T37 VanDerWaalsContact O-CG2 3.3Å; S33-T37 WeakPolarHBondContact O-CG2 3.4Å; S33-T37 PolarHBondContact O-N 3.18Å; S33-T37 PolarHBondContact O-OG1 3.12Å; L34-T37 WeakPolarHBondContact CA-OG1 3.3Å; L34-T37 PolarHBondContact O-N 3.11Å; L34-T37 PolarHBondContact O-OG1 3.14Å; T37-W40 PolarHBondContact O-N 3.26Å; T37-I41 VanDerWaalsContact O-CG1 3.3Å; T37-I41 WeakPolarHBondContact O-CG1 3.15Å; T37-I41 PolarHBondContact O-N 3.18Å
38G90.1Very high88.9Confident0 Ų063.7 Ų63.70%035%0.346CS..Hα-helixtrans-60.2-47.3175.700000112.4L34 F35 F36 M42 Q138L34-G38 PolarHBondContact O-N 3.26Å; F35-G38 PolarHBondContact O-N 3.48Å; F36-G38 VanDerWaalsContact C-N 3.29Å; F36-G38 PolarHBondContact O-N 2.92Å; G38-M42 PolarHBondContact O-N 3.19Å; G38-Q138 WeakPolarHBondContact O-CG 3.42Å
39W90Very high88.1Confident79 Ų7963.4 Ų63.430%0.29934%0.338SS..Hα-helixtrans-71.5-35.2175.9-78.7109.3000113.6F35 F36 I41 M42 I43 V64 T67F35-W39 AromaticContact CD1-CD1 3.85Å; F35-W39 AromaticContact CE1-CD1 3.45Å; F35-W39 VanDerWaalsContact CE1-CD1 3.45Å; F35-W39 AromaticContact CE1-NE1 3.45Å; F35-W39 AromaticContact CE2-NE1 3.57Å; F35-W39 AromaticContact CZ-CD1 3.58Å; F35-W39 AromaticContact CZ-NE1 3.08Å; F35-W39 PolarHBondContact O-N 3.28Å; F36-W39 PolarHBondContact O-N 3.45Å; W39-I41 VanDerWaalsContact C-N 3.32Å; W39-I41 PolarHBondContact O-N 2.88Å; W39-M42 PolarHBondContact O-N 2.93Å; W39-M42 VanDerWaalsContact O-N 3.16Å; W39-I43 WeakPolarHBondContact O-CG1 3.06Å; W39-I43 PolarHBondContact O-N 3.05Å; W39-V64 HydrophobicContact CH2-CG2 4.14Å; W39-T67 VanDerWaalsContact CE2-CG2 3.49Å; W39-T67 HydrophobicContact CH2-CG2 4.28Å; W39-T67 HydrophobicContact CZ2-CG2 3.2Å
40W90.1Very high86.8Confident154 Ų15463.2 Ų63.258%0.58334%0.338SS*.Hα-helixtrans-57.3-46.6175.7-175.9-90.9000111.5F36 T37 M42 I43 D44F36-W40 HydrophobicContact CE1-CE3 4.21Å; F36-W40 HydrophobicContact CE2-CE3 4.47Å; F36-W40 HydrophobicContact CZ-CD2 4.49Å; F36-W40 AromaticContact CZ-CE3 3.71Å; F36-W40 HydrophobicContact CZ-CE3 3.71Å; F36-W40 HydrophobicContact CZ-CZ3 4.25Å; F36-W40 WeakPolarHBondContact O-CB 3.42Å; F36-W40 PolarHBondContact O-N 3.44Å; T37-W40 PolarHBondContact O-N 3.26Å; W40-M42 VanDerWaalsContact C-N 3.26Å; W40-M42 PolarHBondContact O-N 3.23Å; W40-I43 PolarHBondContact O-N 3.26Å; W40-I43 VanDerWaalsContact O-N 3.15Å; W40-D44 PolarHBondContact O-N 3.45Å
41I87.5Confident85.4Confident46 Ų4664 Ų6424%0.23634%0.344CS..Hα-helixtrans-60.4-36.2177.7-70.9166.1000111.7T37 W39 A45 A134 F137 F141T37-I41 VanDerWaalsContact O-CG1 3.3Å; T37-I41 WeakPolarHBondContact O-CG1 3.15Å; T37-I41 PolarHBondContact O-N 3.18Å; W39-I41 VanDerWaalsContact C-N 3.32Å; W39-I41 PolarHBondContact O-N 2.88Å; I41-A45 WeakPolarHBondContact O-CB 3.45Å; I41-A45 PolarHBondContact O-N 3.44Å; I41-A134 HydrophobicContact CG2-CB 3.92Å; I41-F137 HydrophobicContact CD1-CB 4.29Å; I41-F141 HydrophobicContact CD1-CD2 3.69Å; I41-F141 HydrophobicContact CD1-CE2 3.34Å; I41-F141 HydrophobicContact CD1-CZ 4.47Å
42M84.7Confident83.7Confident4 Ų468.1 Ų68.12%0.0236%0.363CS..Hα-helixtrans-70.3-38.5175.3-79.2-52.4-71.400113.9G38 W39 W40 D44 A45 A46 H60 V135 Q138G38-M42 PolarHBondContact O-N 3.19Å; W39-M42 PolarHBondContact O-N 2.93Å; W39-M42 VanDerWaalsContact O-N 3.16Å; W40-M42 VanDerWaalsContact C-N 3.26Å; W40-M42 PolarHBondContact O-N 3.23Å; M42-D44 VanDerWaalsContact C-N 3.32Å; M42-A45 PolarHBondContact O-N 2.88Å; M42-A46 VanDerWaalsContact O-CB 3.29Å; M42-A46 WeakPolarHBondContact O-CB 3.34Å; M42-A46 PolarHBondContact O-N 2.73Å; M42-H60 VanDerWaalsContact CE-CE1 3.43Å; M42-H60 WeakPolarHBondContact CE-CE1 3.45Å; M42-H60 WeakPolarHBondContact CE-ND1 3.39Å; M42-V135 HydrophobicContact CE-CG2 4.18Å; M42-V135 HydrophobicContact SD-CG2 4.14Å; M42-Q138 HydrophobicContact CG-CB 3.73Å; M42-Q138 HydrophobicContact CG-CG 3.63Å; M42-Q138 VanDerWaalsContact CG-NE2 3.28Å; M42-Q138 HydrophobicContact SD-CB 4.04Å; M42-Q138 HydrophobicContact SD-CG 4.45Å; M42-Q138 PolarHBondContact SD-OE1 3.16Å
43I85.9Confident82Confident102 Ų10273.2 Ų73.252%0.52338%0.381SS..Hα-helixtrans-64.7-44.5177.3-66.3167.4000109W39 W40 A45 A46 V47W39-I43 WeakPolarHBondContact O-CG1 3.06Å; W39-I43 PolarHBondContact O-N 3.05Å; W40-I43 PolarHBondContact O-N 3.26Å; W40-I43 VanDerWaalsContact O-N 3.15Å; I43-A45 PolarHBondContact O-N 3.49Å; I43-A46 PolarHBondContact O-N 3.35Å; I43-V47 WeakPolarHBondContact O-CG2 3.45Å; I43-V47 PolarHBondContact O-N 3.38Å
44D87.1Confident80.2Confident104 Ų10473.3 Ų73.356%0.55638%0.376SS*.Hα-helixtrans-58.2-48.1175.2-171.468.8000111.7W40 M42 A46 V47 M48W40-D44 PolarHBondContact O-N 3.45Å; M42-D44 VanDerWaalsContact C-N 3.32Å; D44-A46 VanDerWaalsContact C-N 3.34Å; D44-A46 PolarHBondContact O-N 3.04Å; D44-V47 PolarHBondContact O-N 2.96Å; D44-M48 WeakPolarHBondContact O-CB 3.43Å; D44-M48 PolarHBondContact O-N 3.2Å
45A83.1Confident78.5Confident6 Ų672.1 Ų72.15%0.0537%0.37CS..Hα-helixtrans-63.1-37.1176.400000113.3I41 M42 I43 V47 M48 Y49 A134I41-A45 WeakPolarHBondContact O-CB 3.45Å; I41-A45 PolarHBondContact O-N 3.44Å; M42-A45 PolarHBondContact O-N 2.88Å; I43-A45 PolarHBondContact O-N 3.49Å; A45-V47 VanDerWaalsContact C-N 3.34Å; A45-M48 PolarHBondContact O-N 3.3Å; A45-Y49 WeakPolarHBondContact O-CD2 3.42Å; A45-Y49 PolarHBondContact O-N 2.88Å; A45-A134 HydrophobicContact CB-CB 3.5Å; A45-A134 VanDerWaalsContact CB-CB 3.5Å
46A81.4Confident77.1Confident38 Ų3873.7 Ų73.731%0.31438%0.38SS..Hα-helixtrans-68.8-32.3177.500000113M42 I43 D44 M55M42-A46 VanDerWaalsContact O-CB 3.29Å; M42-A46 WeakPolarHBondContact O-CB 3.34Å; M42-A46 PolarHBondContact O-N 2.73Å; I43-A46 PolarHBondContact O-N 3.35Å; D44-A46 VanDerWaalsContact C-N 3.34Å; D44-A46 PolarHBondContact O-N 3.04Å; A46-M55 HydrophobicContact CB-CE 4.08Å
47V82.1Confident75.5Confident114 Ų11473.3 Ų73.369%0.69138%0.38SS*.Hα-helixtrans-74.6-40.2174.4174.40000111I43 D44 A45I43-V47 WeakPolarHBondContact O-CG2 3.45Å; I43-V47 PolarHBondContact O-N 3.38Å; D44-V47 PolarHBondContact O-N 2.96Å; A45-V47 VanDerWaalsContact C-N 3.34Å
48M79.5Confident74.1Confident126 Ų12674 Ų7462%0.62139%0.387SS*.Hα-helixtrans-72.8-32.2-178.6-170.364.617900113D44 A45 P50D44-M48 WeakPolarHBondContact O-CB 3.43Å; D44-M48 PolarHBondContact O-N 3.2Å; A45-M48 PolarHBondContact O-N 3.3Å; M48-P50 VanDerWaalsContact C-CD 3.48Å; M48-P50 WeakPolarHBondContact O-CD 3.48Å
49Y72.6Confident73.1Confident45 Ų4575.9 Ų75.918%0.17640%0.395CS..  trans-124.671.4-176.9-57.6-74.7000112.1A45 T51 I54 A130 P131A45-Y49 WeakPolarHBondContact O-CD2 3.42Å; A45-Y49 PolarHBondContact O-N 2.88Å; Y49-T51 VanDerWaalsContact C-N 3.28Å; Y49-T51 PolarHBondContact O-N 3.47Å; Y49-I54 HydrophobicContact CD1-CG2 3.89Å; Y49-I54 HydrophobicContact CG-CG2 4.46Å; Y49-A130 HydrophobicContact CE2-CB 3.99Å; Y49-A130 WeakPolarHBondContact OH-CB 3.12Å; Y49-P131 HydrophobicContact CD2-CB 4.37Å
50P63.7Low72.3Confident98 Ų9874.5 Ų74.564%0.63639%0.392SS*.  trans-74.1-14.8-175.929.5-35.4000114.1M48M48-P50 VanDerWaalsContact C-CD 3.48Å; M48-P50 WeakPolarHBondContact O-CD 3.48Å
51T62.6Low71.8Confident76 Ų7670.6 Ų70.647%0.46639%0.385SS..  trans-85.7126.8-176.116.10000112.6Y49 D53 I54 M55Y49-T51 VanDerWaalsContact C-N 3.28Å; Y49-T51 PolarHBondContact O-N 3.47Å; T51-D53 PolarHBondContact O-N 2.9Å; T51-D53 VanDerWaalsContact O-N 3.15Å; T51-I54 PolarHBondContact O-N 3.43Å; T51-I54 WeakPolarHBondContact OG1-CD1 3.24Å; T51-M55 PolarHBondContact O-N 3.3Å; T51-M55 VanDerWaalsContact O-N 3.16Å
52Q57.7Low71.6Confident86 Ų8669 Ų6940%0.40238%0.378SS..THydrogen-bonded Turntrans-59-25-179-67.4-61.7-65.900114.8I54 M55 H57Q52-I54 PolarHBondContact O-N 3.02Å; Q52-M55 CarbonylContact O-C 3.58Å; Q52-H57 VanDerWaalsContact CD-ND1 3.28Å; Q52-H57 PolarHBondContact NE2-CD2 2.96Å; Q52-H57 PolarHBondContact NE2-CE1 3.04Å; Q52-H57 PolarHBondContact NE2-ND1 2.84Å; Q52-H57 PolarHBondContact NE2-NE2 3.35Å; Q52-H57 PolarHBondContact OE1-CE1 3.48Å; Q52-H57 VanDerWaalsContact OE1-CG 3.23Å; Q52-H57 PolarHBondContact OE1-ND1 3.47Å
53D54.8Low71.7Confident146 Ų14668.8 Ų68.878%0.78138%0.377SS*.THydrogen-bonded Turntrans-68.3-22176.4-83.2-59.8000113.4T51T51-D53 PolarHBondContact O-N 2.9Å; T51-D53 VanDerWaalsContact O-N 3.15Å
54I57.1Low71.8Confident60 Ų6067 Ų6731%0.30837%0.371SS..THydrogen-bonded Turntrans-105.7-38.6-174.9-47.4179.4000110.1Y49 T51 Q52 Y122 P131Y49-I54 HydrophobicContact CD1-CG2 3.89Å; Y49-I54 HydrophobicContact CG-CG2 4.46Å; T51-I54 PolarHBondContact O-N 3.43Å; T51-I54 WeakPolarHBondContact OG1-CD1 3.24Å; Q52-I54 PolarHBondContact O-N 3.02Å; I54-Y122 WeakPolarHBondContact O-CE1 3.25Å; I54-Y122 PolarHBondContact O-OH 3.35Å; I54-P131 HydrophobicContact CG2-CG 4.39Å
55M57.5Low72Confident8 Ų867 Ų674%0.03937%0.366CS..SBendtrans-131.7100.5174.5-167.7178.563.600110.3A46 T51 Q52 H57 H60A46-M55 HydrophobicContact CB-CE 4.08Å; T51-M55 PolarHBondContact O-N 3.3Å; T51-M55 VanDerWaalsContact O-N 3.16Å; Q52-M55 CarbonylContact O-C 3.58Å; M55-H57 PolarHBondContact O-N 3.47Å; M55-H60 WeakPolarHBondContact CE-NE2 3.36Å
56N64Low72.3Confident78 Ų7866.7 Ų66.742%0.41736%0.364SS..  trans-67.1131.5176-167.4-35.9000108.9S58 F59N56-S58 PolarHBondContact O-N 2.86Å; N56-S58 WeakPolarHBondContact OD1-CB 3.23Å; N56-S58 PolarHBondContact OD1-N 2.88Å; N56-S58 VanDerWaalsContact OD1-N 3.16Å; N56-S58 PolarHBondContact OD1-OG 2.62Å; N56-S58 VanDerWaalsContact OD1-OG 3.05Å; N56-F59 HydrophobicContact CB-CD2 3.96Å; N56-F59 HydrophobicContact CB-CE2 3.8Å; N56-F59 HydrophobicContact CB-CZ 4.35Å; N56-F59 PolarHBondContact O-N 3.33Å
57H60.7Low72.9Confident117 Ų11765.5 Ų65.554%0.54235%0.353SS..THydrogen-bonded Turntrans-52.9-24.7177.5-76140.4000113.5Q52 M55 F59 H60Q52-H57 VanDerWaalsContact CD-ND1 3.28Å; Q52-H57 PolarHBondContact NE2-CD2 2.96Å; Q52-H57 PolarHBondContact NE2-CE1 3.04Å; Q52-H57 PolarHBondContact NE2-ND1 2.84Å; Q52-H57 PolarHBondContact NE2-NE2 3.35Å; Q52-H57 PolarHBondContact OE1-CE1 3.48Å; Q52-H57 VanDerWaalsContact OE1-CG 3.23Å; Q52-H57 PolarHBondContact OE1-ND1 3.47Å; M55-H57 PolarHBondContact O-N 3.47Å; H57-F59 PolarHBondContact O-N 3.45Å; H57-H60 PolarHBondContact O-N 3.22Å
58S63.3Low73.4Confident66 Ų6663.6 Ų63.646%0.46234%0.338SS..Hα-helixtrans-55.7-29.7173.6-58.80000113.1N56 H60 T61N56-S58 PolarHBondContact O-N 2.86Å; N56-S58 WeakPolarHBondContact OD1-CB 3.23Å; N56-S58 PolarHBondContact OD1-N 2.88Å; N56-S58 VanDerWaalsContact OD1-N 3.16Å; N56-S58 PolarHBondContact OD1-OG 2.62Å; N56-S58 VanDerWaalsContact OD1-OG 3.05Å; S58-H60 VanDerWaalsContact C-N 3.33Å; S58-H60 PolarHBondContact O-N 3.19Å; S58-T61 WeakPolarHBondContact O-CB 3.46Å; S58-T61 WeakPolarHBondContact O-CG2 3.41Å; S58-T61 PolarHBondContact O-N 3.45Å; S58-T61 PolarHBondContact O-OG1 3.44Å
59F68.9Low74Confident41 Ų4157.6 Ų57.618%0.1831%0.308CS..Hα-helixtrans-73.4-23.4-178.7-59.1-41.7000113.6N56 H57 T61 C62 I117 A121 Y122 V135N56-F59 HydrophobicContact CB-CD2 3.96Å; N56-F59 HydrophobicContact CB-CE2 3.8Å; N56-F59 HydrophobicContact CB-CZ 4.35Å; N56-F59 PolarHBondContact O-N 3.33Å; H57-F59 PolarHBondContact O-N 3.45Å; F59-T61 PolarHBondContact O-N 2.87Å; F59-C62 PolarHBondContact O-N 3.1Å; F59-I117 HydrophobicContact CD1-CB 4.49Å; F59-I117 HydrophobicContact CD1-CD1 3.64Å; F59-I117 HydrophobicContact CD1-CG1 3.87Å; F59-I117 HydrophobicContact CD1-CG2 3.77Å; F59-I117 HydrophobicContact CE1-CB 4.5Å; F59-I117 HydrophobicContact CE1-CD1 4.18Å; F59-I117 HydrophobicContact CE1-CG1 3.9Å; F59-I117 HydrophobicContact CE1-CG2 3.83Å; F59-I117 HydrophobicContact CG-CG2 4.15Å; F59-I117 HydrophobicContact CZ-CG2 4.25Å; F59-A121 HydrophobicContact CZ-CB 4.15Å; F59-Y122 HydrophobicContact CD2-CE2 4.36Å; F59-Y122 WeakPolarHBondContact CD2-OH 3.11Å; F59-Y122 HydrophobicContact CE2-CE2 4.05Å; F59-Y122 AromaticContact CE2-CZ 3.98Å; F59-Y122 WeakPolarHBondContact CE2-OH 3.29Å; F59-V135 HydrophobicContact CB-CG2 4.15Å
60H74.7Confident74.9Confident49 Ų4956.5 Ų56.523%0.22730%0.304CS..Hα-helixtrans-64.7-27.6171.1-67.6-71.5000112.5M42 M55 H57 S58 C62 G63 V64M42-H60 VanDerWaalsContact CE-CE1 3.43Å; M42-H60 WeakPolarHBondContact CE-CE1 3.45Å; M42-H60 WeakPolarHBondContact CE-ND1 3.39Å; M55-H60 WeakPolarHBondContact CE-NE2 3.36Å; H57-H60 PolarHBondContact O-N 3.22Å; S58-H60 VanDerWaalsContact C-N 3.33Å; S58-H60 PolarHBondContact O-N 3.19Å; H60-C62 VanDerWaalsContact C-N 3.26Å; H60-C62 PolarHBondContact O-N 3.46Å; H60-G63 PolarHBondContact O-N 3.07Å; H60-V64 WeakPolarHBondContact O-CG2 3.46Å; H60-V64 PolarHBondContact O-N 2.9Å; H60-V64 VanDerWaalsContact O-N 3.14Å
61T78.2Confident76.2Confident73 Ų7357.8 Ų57.845%0.44830%0.3SS..Hα-helixtrans-62-35.4-178.368.10000112S58 F59 G63 V64 F65S58-T61 WeakPolarHBondContact O-CB 3.46Å; S58-T61 WeakPolarHBondContact O-CG2 3.41Å; S58-T61 PolarHBondContact O-N 3.45Å; S58-T61 PolarHBondContact O-OG1 3.44Å; F59-T61 PolarHBondContact O-N 2.87Å; T61-G63 PolarHBondContact O-N 3.32Å; T61-V64 WeakPolarHBondContact O-CB 3.43Å; T61-V64 PolarHBondContact O-N 3.41Å; T61-V64 VanDerWaalsContact O-N 3.16Å; T61-F65 WeakPolarHBondContact O-CD2 2.99Å; T61-F65 PolarHBondContact O-N 2.88Å
62C84.8Confident77.5Confident12 Ų1255 Ų558%0.08128%0.282CS..Hα-helixtrans-60.4-46.1178.4-174.70000111.6F59 H60 V64 F65 S66 S110 I117 N139F59-C62 PolarHBondContact O-N 3.1Å; H60-C62 VanDerWaalsContact C-N 3.26Å; H60-C62 PolarHBondContact O-N 3.46Å; C62-V64 PolarHBondContact O-N 3.42Å; C62-F65 PolarHBondContact O-N 3.39Å; C62-S66 PolarHBondContact O-N 2.96Å; C62-S66 VanDerWaalsContact O-N 3.08Å; C62-S110 PolarHBondContact SG-O 2.88Å; C62-I117 HydrophobicContact CB-CD1 4.33Å; C62-N139 PolarHBondContact O-OD1 3.49Å; C62-N139 PolarHBondContact SG-ND2 2.92Å; C62-N139 VanDerWaalsContact SG-ND2 3.42Å
63G85.9Confident79Confident0 Ų050.9 Ų50.90%026%0.263CS..Hα-helixtrans-61.2-42.9173.100000112.9H60 T61 S66 T67H60-G63 PolarHBondContact O-N 3.07Å; T61-G63 PolarHBondContact O-N 3.32Å; G63-S66 WeakPolarHBondContact O-CB 3.49Å; G63-S66 PolarHBondContact O-N 3.49Å; G63-T67 VanDerWaalsContact O-CG2 3.22Å; G63-T67 WeakPolarHBondContact O-CG2 3.28Å; G63-T67 PolarHBondContact O-N 3.02Å
64V88.7Confident80.5Confident64 Ų6445.1 Ų45.139%0.38823%0.232SC..Hα-helixtrans-60.8-46.6177.1175.70000111.3W39 H60 T61 C62 S66 T67 I68W39-V64 HydrophobicContact CH2-CG2 4.14Å; H60-V64 WeakPolarHBondContact O-CG2 3.46Å; H60-V64 PolarHBondContact O-N 2.9Å; H60-V64 VanDerWaalsContact O-N 3.14Å; T61-V64 WeakPolarHBondContact O-CB 3.43Å; T61-V64 PolarHBondContact O-N 3.41Å; T61-V64 VanDerWaalsContact O-N 3.16Å; C62-V64 PolarHBondContact O-N 3.42Å; V64-S66 VanDerWaalsContact C-N 3.3Å; V64-S66 PolarHBondContact O-N 3.05Å; V64-T67 PolarHBondContact O-N 2.66Å; V64-T67 PolarHBondContact O-OG1 3.14Å; V64-I68 HydrophobicContact CG1-CD1 4.04Å; V64-I68 HydrophobicContact CG1-CG1 4.5Å; V64-I68 WeakPolarHBondContact O-CG1 3.42Å; V64-I68 PolarHBondContact O-N 3.05Å
65F90.1Very high81.8Confident103 Ų10346.1 Ų46.145%0.45225%0.249SC..Hα-helixtrans-60.2-40.3176-77.4-67.1000112.2T61 C62 T67 I68 A69 M106 S110T61-F65 WeakPolarHBondContact O-CD2 2.99Å; T61-F65 PolarHBondContact O-N 2.88Å; C62-F65 PolarHBondContact O-N 3.39Å; F65-T67 VanDerWaalsContact C-N 3.25Å; F65-T67 PolarHBondContact O-N 3.16Å; F65-I68 PolarHBondContact O-N 3.03Å; F65-A69 WeakPolarHBondContact O-CB 3.16Å; F65-A69 PolarHBondContact O-N 3.46Å; F65-M106 HydrophobicContact CB-CG 4.31Å; F65-M106 HydrophobicContact CD1-CG 4.4Å; F65-M106 HydrophobicContact CD1-SD 4.04Å; F65-S110 VanDerWaalsContact CB-OG 3.3Å; F65-S110 WeakPolarHBondContact CB-OG 3.18Å
66S90.1Very high82.9Confident1 Ų146.3 Ų46.31%0.00725%0.251CS..Hα-helixtrans-60.8-35.2174.1-167.70000112.3C62 G63 V64 A69 F70 N139 I142C62-S66 PolarHBondContact O-N 2.96Å; C62-S66 VanDerWaalsContact O-N 3.08Å; G63-S66 WeakPolarHBondContact O-CB 3.49Å; G63-S66 PolarHBondContact O-N 3.49Å; V64-S66 VanDerWaalsContact C-N 3.3Å; V64-S66 PolarHBondContact O-N 3.05Å; S66-A69 PolarHBondContact O-N 3.5Å; S66-F70 WeakPolarHBondContact O-CB 3.4Å; S66-F70 PolarHBondContact O-N 3.31Å; S66-N139 WeakPolarHBondContact CB-OD1 3.46Å; S66-I142 VanDerWaalsContact OG-CG2 3.3Å; S66-I142 WeakPolarHBondContact OG-CG2 3.28Å
67T92.9Very high83.4Confident13 Ų1344.6 Ų44.68%0.0825%0.245CC..Hα-helixtrans-75.3-38.6177.865.50000114F35 W39 G63 V64 F65 A69 F70 F71 I142F35-T67 HydrophobicContact CE2-CG2 3.72Å; F35-T67 HydrophobicContact CZ-CG2 4.06Å; W39-T67 VanDerWaalsContact CE2-CG2 3.49Å; W39-T67 HydrophobicContact CH2-CG2 4.28Å; W39-T67 HydrophobicContact CZ2-CG2 3.2Å; G63-T67 VanDerWaalsContact O-CG2 3.22Å; G63-T67 WeakPolarHBondContact O-CG2 3.28Å; G63-T67 PolarHBondContact O-N 3.02Å; V64-T67 PolarHBondContact O-N 2.66Å; V64-T67 PolarHBondContact O-OG1 3.14Å; F65-T67 VanDerWaalsContact C-N 3.25Å; F65-T67 PolarHBondContact O-N 3.16Å; T67-A69 VanDerWaalsContact C-N 3.27Å; T67-A69 PolarHBondContact O-N 3.25Å; T67-F70 WeakPolarHBondContact O-CB 3.49Å; T67-F70 PolarHBondContact O-N 3.44Å; T67-F71 WeakPolarHBondContact O-CD2 3.33Å; T67-F71 PolarHBondContact O-N 3.21Å; T67-I142 HydrophobicContact CG2-CD1 3.54Å; T67-I142 HydrophobicContact CG2-CG2 4.28Å
68I93.1Very high83.7Confident74 Ų7440.8 Ų40.838%0.37923%0.229SC..Hα-helixtrans-59.7-46.6171.6-66.1169000108.5V64 F65 F70 F71 M72 M106V64-I68 HydrophobicContact CG1-CD1 4.04Å; V64-I68 HydrophobicContact CG1-CG1 4.5Å; V64-I68 WeakPolarHBondContact O-CG1 3.42Å; V64-I68 PolarHBondContact O-N 3.05Å; F65-I68 PolarHBondContact O-N 3.03Å; I68-F70 VanDerWaalsContact C-N 3.33Å; I68-F70 PolarHBondContact O-N 2.89Å; I68-F71 PolarHBondContact O-N 2.6Å; I68-M72 HydrophobicContact CG2-CG 4.3Å; I68-M72 HydrophobicContact CG2-SD 3.92Å; I68-M72 VanDerWaalsContact O-CG 3.29Å; I68-M72 WeakPolarHBondContact O-CG 3.5Å; I68-M72 PolarHBondContact O-N 3.23Å; I68-M106 HydrophobicContact CB-SD 4.19Å; I68-M106 HydrophobicContact CG2-SD 3.94Å
69A92Very high83.6Confident0 Ų038.2 Ų38.20%021%0.213CC..Hα-helixtrans-61-40.2176.800000112.7F65 S66 T67 F71 M72 I73 G103 M106 M107F65-A69 WeakPolarHBondContact O-CB 3.16Å; F65-A69 PolarHBondContact O-N 3.46Å; S66-A69 PolarHBondContact O-N 3.5Å; T67-A69 VanDerWaalsContact C-N 3.27Å; T67-A69 PolarHBondContact O-N 3.25Å; A69-F71 PolarHBondContact O-N 3.41Å; A69-M72 PolarHBondContact O-N 3.01Å; A69-I73 WeakPolarHBondContact O-CB 3.23Å; A69-I73 WeakPolarHBondContact O-CD1 3.37Å; A69-I73 VanDerWaalsContact O-CG1 3.28Å; A69-I73 WeakPolarHBondContact O-CG1 3.49Å; A69-I73 PolarHBondContact O-N 3.48Å; A69-G103 WeakPolarHBondContact CB-O 3.25Å; A69-M106 HydrophobicContact CB-CB 4.01Å; A69-M106 HydrophobicContact CB-CG 4.03Å; A69-M106 HydrophobicContact CB-SD 4.22Å; A69-M107 HydrophobicContact CB-CB 3.81Å; A69-M107 HydrophobicContact CB-CE 3.98Å
70F92.1Very high83.4Confident21 Ų2141 Ų419%0.09223%0.226CC..Hα-helixtrans-55.5-50.7172.6171.7-85.9000111.2F35 S66 T67 I68 N74 M107 I142 S145F35-F70 HydrophobicContact CD2-CD1 4.32Å; F35-F70 HydrophobicContact CD2-CD2 4.4Å; F35-F70 HydrophobicContact CD2-CE1 4.48Å; F35-F70 HydrophobicContact CD2-CG 4.31Å; F35-F70 HydrophobicContact CE2-CD1 4.17Å; F35-F70 HydrophobicContact CE2-CG 4.34Å; S66-F70 WeakPolarHBondContact O-CB 3.4Å; S66-F70 PolarHBondContact O-N 3.31Å; T67-F70 WeakPolarHBondContact O-CB 3.49Å; T67-F70 PolarHBondContact O-N 3.44Å; I68-F70 VanDerWaalsContact C-N 3.33Å; I68-F70 PolarHBondContact O-N 2.89Å; F70-N74 WeakPolarHBondContact CD2-ND2 3.46Å; F70-N74 WeakPolarHBondContact CE2-ND2 3.45Å; F70-N74 VanDerWaalsContact CZ-ND2 3.28Å; F70-N74 WeakPolarHBondContact CZ-ND2 3.49Å; F70-N74 VanDerWaalsContact O-CB 3.27Å; F70-N74 WeakPolarHBondContact O-CB 3.15Å; F70-N74 PolarHBondContact O-N 3.34Å; F70-N74 PolarHBondContact O-ND2 3.01Å; F70-M107 HydrophobicContact CB-CE 4.16Å; F70-I142 HydrophobicContact CB-CG2 4.05Å; F70-S145 WeakPolarHBondContact CE2-OG 3.35Å
71F90.9Very high82.8Confident125 Ų12541 Ų4155%0.54823%0.229SC..Hα-helixtrans-64.7-41.5177.7-73.3-65.6000112F35 T67 I68 A69 I73 N74 A75F35-F71 HydrophobicContact CZ-CE2 4.5Å; T67-F71 WeakPolarHBondContact O-CD2 3.33Å; T67-F71 PolarHBondContact O-N 3.21Å; I68-F71 PolarHBondContact O-N 2.6Å; A69-F71 PolarHBondContact O-N 3.41Å; F71-I73 PolarHBondContact O-N 3.4Å; F71-N74 PolarHBondContact O-N 2.93Å; F71-A75 WeakPolarHBondContact O-CB 3.22Å; F71-A75 PolarHBondContact O-N 3.1Å
72M89.4Confident82Confident18 Ų1845.8 Ų45.89%0.08924%0.239CC..Hα-helixtrans-60.6-45.5179-71.8178.871.900112.5I68 A69 W99 I102 M106I68-M72 HydrophobicContact CG2-CG 4.3Å; I68-M72 HydrophobicContact CG2-SD 3.92Å; I68-M72 VanDerWaalsContact O-CG 3.29Å; I68-M72 WeakPolarHBondContact O-CG 3.5Å; I68-M72 PolarHBondContact O-N 3.23Å; A69-M72 PolarHBondContact O-N 3.01Å; M72-W99 HydrophobicContact CE-CD2 3.9Å; M72-W99 HydrophobicContact CE-CE3 4.21Å; M72-W99 HydrophobicContact CE-CG 4.43Å; M72-W99 HydrophobicContact CE-CH2 4.19Å; M72-W99 HydrophobicContact CE-CZ2 3.87Å; M72-W99 HydrophobicContact CE-CZ3 4.35Å; M72-W99 HydrophobicContact CG-CZ2 3.83Å; M72-W99 PolarHBondContact O-NE1 3.32Å; M72-W99 HydrophobicContact SD-CZ2 4.45Å; M72-I102 HydrophobicContact CE-CB 4.27Å; M72-I102 HydrophobicContact CE-CG2 3.86Å; M72-M106 HydrophobicContact SD-CE 4.35Å; M72-M106 HydrophobicContact SD-SD 4.44Å
73I89.2Confident80.7Confident0 Ų046.4 Ų46.40%025%0.247CC..Hα-helixtrans-68.4-42.4-179.4-68.1163.4000110.7A69 F71 L100 F104 M107 K150A69-I73 WeakPolarHBondContact O-CB 3.23Å; A69-I73 WeakPolarHBondContact O-CD1 3.37Å; A69-I73 VanDerWaalsContact O-CG1 3.28Å; A69-I73 WeakPolarHBondContact O-CG1 3.49Å; A69-I73 PolarHBondContact O-N 3.48Å; F71-I73 PolarHBondContact O-N 3.4Å; I73-L100 HydrophobicContact CG2-CD2 4.38Å; I73-F104 HydrophobicContact CD1-CD1 3.66Å; I73-F104 HydrophobicContact CD1-CE1 3.92Å; I73-F104 HydrophobicContact CD1-CG 4.18Å; I73-F104 HydrophobicContact CG1-CD1 4.3Å; I73-F104 HydrophobicContact CG1-CE1 4.45Å; I73-F104 HydrophobicContact CG1-CG 4.44Å; I73-F104 HydrophobicContact CG2-CE1 4.22Å; I73-F104 HydrophobicContact CG2-CZ 4.11Å; I73-M107 HydrophobicContact CD1-CB 4.05Å; I73-M107 HydrophobicContact CD1-CE 3.66Å; I73-M107 HydrophobicContact CD1-CG 4.44Å; I73-M107 HydrophobicContact CD1-SD 3.48Å; I73-M107 WeakPolarHBondContact CD1-SD 3.41Å; I73-K150 HydrophobicContact CG2-CB 4.16Å; I73-K150 HydrophobicContact CG2-CD 4.01Å; I73-K150 HydrophobicContact CG2-CG 3.95Å; I73-K150 PolarHBondContact O-NZ 3.4Å
74N87.3Confident79.3Confident25 Ų2550.5 Ų50.513%0.13427%0.269CS..Hα-helixtrans-83.4-18.8-174.1-68.5-41.3000114.1F70 F71 V76 S146 Y149 K150F70-N74 WeakPolarHBondContact CD2-ND2 3.46Å; F70-N74 WeakPolarHBondContact CE2-ND2 3.45Å; F70-N74 VanDerWaalsContact CZ-ND2 3.28Å; F70-N74 WeakPolarHBondContact CZ-ND2 3.49Å; F70-N74 VanDerWaalsContact O-CB 3.27Å; F70-N74 WeakPolarHBondContact O-CB 3.15Å; F70-N74 PolarHBondContact O-N 3.34Å; F70-N74 PolarHBondContact O-ND2 3.01Å; F71-N74 PolarHBondContact O-N 2.93Å; N74-V76 VanDerWaalsContact C-N 3.32Å; N74-S146 PolarHBondContact OD1-O 3.46Å; N74-Y149 HydrophobicContact CB-CD1 3.61Å; N74-Y149 HydrophobicContact CB-CE1 3.87Å; N74-Y149 VanDerWaalsContact OD1-CD1 3.22Å; N74-Y149 WeakPolarHBondContact OD1-CD1 3.48Å; N74-K150 PolarHBondContact OD1-N 3.31Å
75A84.8Confident77.6Confident81 Ų8150.4 Ų50.467%0.66928%0.275SS*.Hα-helixtrans-72-24.2173.900000113.1F71F71-A75 WeakPolarHBondContact O-CB 3.22Å; F71-A75 PolarHBondContact O-N 3.1Å
76V80.8Confident75.7Confident11 Ų1157.2 Ų57.27%0.06730%0.3CS..SBendtrans-85.9121.4178.4-1770000109.8N74 Q80 V81 A96 W99 L100 K150N74-V76 VanDerWaalsContact C-N 3.32Å; V76-Q80 HydrophobicContact CG1-CB 4.39Å; V76-V81 HydrophobicContact CG1-CG2 4.08Å; V76-A96 HydrophobicContact CG1-CB 4.34Å; V76-W99 HydrophobicContact CG2-CG 4.47Å; V76-L100 HydrophobicContact CB-CD1 4.2Å; V76-L100 HydrophobicContact CB-CG 4.37Å; V76-L100 HydrophobicContact CG1-CD1 3.96Å; V76-K150 PolarHBondContact O-NZ 3.36Å
77S73.1Confident73.9Confident43 Ų4359.8 Ų59.830%0.30133%0.326SS..  trans-65.8144.9173.4145.80000111.5G79 Q80 E155S77-G79 PolarHBondContact O-N 2.98Å; S77-G79 PolarHBondContact OG-N 3.5Å; S77-G79 VanDerWaalsContact OG-N 3.16Å; S77-Q80 PolarHBondContact O-N 2.96Å; S77-E155 VanDerWaalsContact CA-OE1 3.23Å; S77-E155 WeakPolarHBondContact CA-OE1 3.16Å; S77-E155 WeakPolarHBondContact CB-OE1 3.26Å; S77-E155 VanDerWaalsContact OG-CD 3.28Å; S77-E155 PolarHBondContact OG-OE1 3.46Å; S77-E155 PolarHBondContact OG-OE2 3.47Å
78N66.8Low72Confident37 Ų3769.2 Ų69.220%0.19837%0.37CS..Hα-helixtrans-61.8-32.3176.3-73.6-41.6000111.9Q80 V81 R82 K150 E155N78-Q80 VanDerWaalsContact C-N 3.35Å; N78-Q80 PolarHBondContact O-N 2.89Å; N78-V81 WeakPolarHBondContact O-CB 3.47Å; N78-V81 PolarHBondContact O-N 2.9Å; N78-V81 VanDerWaalsContact O-N 3.16Å; N78-R82 PolarHBondContact O-N 3.42Å; N78-R82 VanDerWaalsContact O-N 3.16Å; N78-K150 PolarHBondContact ND2-O 3.26Å; N78-K150 WeakPolarHBondContact OD1-CE 3.06Å; N78-E155 WeakPolarHBondContact CA-OE2 3.43Å; N78-E155 VanDerWaalsContact N-CD 3.27Å; N78-E155 PolarHBondContact N-OE1 3.32Å; N78-E155 PolarHBondContact N-OE2 3.44Å
79G63Low70Confident12 Ų1267.9 Ų67.912%0.12438%0.375CS..Hα-helixtrans-61.1-36.1173.200000114.1S77 V81 R82 G83 D84 E155S77-G79 PolarHBondContact O-N 2.98Å; S77-G79 PolarHBondContact OG-N 3.5Å; S77-G79 VanDerWaalsContact OG-N 3.16Å; G79-V81 VanDerWaalsContact C-N 3.26Å; G79-V81 PolarHBondContact O-N 2.83Å; G79-R82 PolarHBondContact O-N 3.44Å; G79-G83 PolarHBondContact O-N 3.29Å; G79-D84 PolarHBondContact O-N 3.41Å; G79-E155 PolarHBondContact N-OE2 3.1Å
80Q64.6Low68.1Low99 Ų9974.9 Ų74.946%0.46342%0.422SS..Hα-helixtrans-69.2-24.5175.4-65.3-151.8-50.700113.2V76 S77 N78 A96V76-Q80 HydrophobicContact CG1-CB 4.39Å; S77-Q80 PolarHBondContact O-N 2.96Å; N78-Q80 VanDerWaalsContact C-N 3.35Å; N78-Q80 PolarHBondContact O-N 2.89Å; Q80-A96 HydrophobicContact CB-CB 4.43Å
81V62Low66.3Low49 Ų4980.9 Ų80.930%0.29745%0.454SS..Hα-helixtrans-78.7-43.7176.8-175.40000111.1V76 N78 G79 G83 R97 L100V76-V81 HydrophobicContact CG1-CG2 4.08Å; N78-V81 WeakPolarHBondContact O-CB 3.47Å; N78-V81 PolarHBondContact O-N 2.9Å; N78-V81 VanDerWaalsContact O-N 3.16Å; G79-V81 VanDerWaalsContact C-N 3.26Å; G79-V81 PolarHBondContact O-N 2.83Å; V81-G83 VanDerWaalsContact C-N 3.33Å; V81-R97 PolarHBondContact O-NH2 3.48Å; V81-R97 VanDerWaalsContact O-NH2 3.1Å; V81-L100 HydrophobicContact CG2-CD1 3.26Å
82R60.5Low65.1Low173 Ų17376.6 Ų76.665%0.65345%0.445SS*.Hα-helixtrans-65.2-36.7177.9-72.1-179170.2179.4-3.1111.6N78 G79 R93N78-R82 PolarHBondContact O-N 3.42Å; N78-R82 VanDerWaalsContact O-N 3.16Å; G79-R82 PolarHBondContact O-N 3.44Å; R82-R93 PolarHBondContact O-NH2 2.91Å
83G58.1Low64Low25 Ų2582 Ų8226%0.25847%0.465SS..THydrogen-bonded Turntrans95.827.7174.100000113.7G79 V81 A85G79-G83 PolarHBondContact O-N 3.29Å; V81-G83 VanDerWaalsContact C-N 3.33Å; G83-A85 PolarHBondContact O-N 3.23Å
84D56.1Low63.2Low86 Ų8686.7 Ų86.746%0.4649%0.494SS..  trans-83.95.8177.2-56.3-37.1000112.3G79 Y86 L157G79-D84 PolarHBondContact O-N 3.41Å; D84-Y86 PolarHBondContact O-N 2.98Å; D84-L157 HydrophobicContact CB-CD2 3.75Å; D84-L157 WeakPolarHBondContact OD2-CD2 3.42Å
85A53.8Low62.8Low62 Ų6286.6 Ų86.651%0.51250%0.498SS..  trans-84.1111.6176.700000111.1G83 G87G83-A85 PolarHBondContact O-N 3.23Å; A85-G87 PolarHBondContact O-N 3.44Å
86Y48.9Very low62.6Low246 Ų24683.3 Ų83.397%0.96547%0.471SS*.  trans-68.932.4179.3-77.2-86.4000115.5D84D84-Y86 PolarHBondContact O-N 2.98Å
87G52.1Low62.7Low55 Ų5588.2 Ų88.257%0.56749%0.488SS*.  trans-129.5106-17500000114A85 G89A85-G87 PolarHBondContact O-N 3.44Å; G87-G89 PolarHBondContact O-N 3.49Å
88E53.3Low63.3Low211 Ų21190.8 Ų90.899%0.98650%0.498SS*.  trans-69.287.4163.8-75.3-172.2143.600110.4
89G52.3Low64.2Low47 Ų4795.3 Ų95.349%0.48551%0.513SS..  trans-94.8147.4162.400000111.5G87 L91 G92G87-G89 PolarHBondContact O-N 3.49Å; G89-L91 PolarHBondContact O-N 3.15Å; G89-G92 PolarHBondContact O-N 2.91Å
90C51.8Low65.4Low146 Ų14695.4 Ų95.499%0.98651%0.51SS*.THydrogen-bonded Turntrans-57-19.4-175.2-171.20000115.4
91L53.8Low66.6Low147 Ų14796.6 Ų96.677%0.7751%0.514SS*.THydrogen-bonded Turntrans-119.910.2174.7-95.2156000113.3G89 G95G89-L91 PolarHBondContact O-N 3.15Å; L91-G95 VanDerWaalsContact O-CA 3.26Å; L91-G95 WeakPolarHBondContact O-CA 3.39Å; L91-G95 PolarHBondContact O-N 2.9Å; L91-G95 VanDerWaalsContact O-N 3.13Å
92G66.4Low68Low36 Ų3698.1 Ų98.137%0.37152%0.52SS..Hα-helixtrans-52.6-96-158.300000116.7G89 A96G89-G92 PolarHBondContact O-N 2.91Å; G92-A96 PolarHBondContact O-N 3.31Å
93R66.1Low69.5Low131 Ų13189.9 Ų89.949%0.49449%0.489SS..Hα-helixtrans-69.9-39.1-170.2-170177.2-173.2176.92.9113.4R82 R97R82-R93 PolarHBondContact O-NH2 2.91Å; R93-R97 VanDerWaalsContact NH2-NH2 3.13Å; R93-R97 WeakPolarHBondContact O-CG 3.18Å; R93-R97 PolarHBondContact O-N 2.68Å
94T72.6Confident71Confident99 Ų9991 Ų9161%0.60749%0.487SS*.Hα-helixtrans-72.3-37.1-177.9-50.10000111.3R97 L98T94-R97 PolarHBondContact O-N 3.17Å; T94-L98 HydrophobicContact CG2-CD1 4.08Å; T94-L98 WeakPolarHBondContact O-CB 3.47Å; T94-L98 WeakPolarHBondContact O-CG 3.47Å; T94-L98 PolarHBondContact O-N 3.39Å
95G78.5Confident72.9Confident22 Ų2292.1 Ų92.123%0.22749%0.491CS..Hα-helixtrans-65.5-4417600000112.5L91 R97 L98 W99L91-G95 VanDerWaalsContact O-CA 3.26Å; L91-G95 WeakPolarHBondContact O-CA 3.39Å; L91-G95 PolarHBondContact O-N 2.9Å; L91-G95 VanDerWaalsContact O-N 3.13Å; G95-R97 VanDerWaalsContact C-N 3.33Å; G95-R97 PolarHBondContact O-N 3.2Å; G95-L98 PolarHBondContact O-N 3.47Å; G95-W99 WeakPolarHBondContact O-CB 3.37Å; G95-W99 PolarHBondContact O-N 3.21Å
96A80.8Confident74.7Confident13 Ų1391.8 Ų91.811%0.10748%0.479CS..Hα-helixtrans-60.8-40.7175.400000112.3V76 Q80 G92 L100V76-A96 HydrophobicContact CG1-CB 4.34Å; Q80-A96 HydrophobicContact CB-CB 4.43Å; G92-A96 PolarHBondContact O-N 3.31Å; A96-L100 WeakPolarHBondContact O-CB 3.18Å; A96-L100 PolarHBondContact O-N 3.04Å
97R81.6Confident76.9Confident113 Ų11380 Ų8043%0.42643%0.433SS..Hα-helixtrans-67.4-43.1176-72.3173.9179.2-176.7-4.8112.6V81 R93 T94 G95 L100 F101V81-R97 PolarHBondContact O-NH2 3.48Å; V81-R97 VanDerWaalsContact O-NH2 3.1Å; R93-R97 VanDerWaalsContact NH2-NH2 3.13Å; R93-R97 WeakPolarHBondContact O-CG 3.18Å; R93-R97 PolarHBondContact O-N 2.68Å; T94-R97 PolarHBondContact O-N 3.17Å; G95-R97 VanDerWaalsContact C-N 3.33Å; G95-R97 PolarHBondContact O-N 3.2Å; R97-L100 PolarHBondContact O-N 3.48Å; R97-F101 VanDerWaalsContact O-CB 3.25Å; R97-F101 WeakPolarHBondContact O-CB 3.46Å; R97-F101 PolarHBondContact O-N 2.97Å
98L85.6Confident78.8Confident97 Ų9782 Ų8251%0.50843%0.426SS..Hα-helixtrans-62.8-43.4175.2-81.5163.9000111.4T94 G95 L100 F101 I102T94-L98 HydrophobicContact CG2-CD1 4.08Å; T94-L98 WeakPolarHBondContact O-CB 3.47Å; T94-L98 WeakPolarHBondContact O-CG 3.47Å; T94-L98 PolarHBondContact O-N 3.39Å; G95-L98 PolarHBondContact O-N 3.47Å; L98-L100 PolarHBondContact O-N 3.5Å; L98-F101 PolarHBondContact O-N 3.07Å; L98-I102 VanDerWaalsContact O-CG1 3.25Å; L98-I102 WeakPolarHBondContact O-CG1 3.44Å; L98-I102 PolarHBondContact O-N 3.41Å
99W87.5Confident80.7Confident133 Ų13374 Ų7450%0.50440%0.401SS..Hα-helixtrans-60-46.1176.7-173.2-92.8000111.9M72 V76 G95 I102 G103M72-W99 HydrophobicContact CE-CD2 3.9Å; M72-W99 HydrophobicContact CE-CE3 4.21Å; M72-W99 HydrophobicContact CE-CG 4.43Å; M72-W99 HydrophobicContact CE-CH2 4.19Å; M72-W99 HydrophobicContact CE-CZ2 3.87Å; M72-W99 HydrophobicContact CE-CZ3 4.35Å; M72-W99 HydrophobicContact CG-CZ2 3.83Å; M72-W99 PolarHBondContact O-NE1 3.32Å; M72-W99 HydrophobicContact SD-CZ2 4.45Å; V76-W99 HydrophobicContact CG2-CG 4.47Å; G95-W99 WeakPolarHBondContact O-CB 3.37Å; G95-W99 PolarHBondContact O-N 3.21Å; W99-I102 PolarHBondContact O-N 3.23Å; W99-G103 PolarHBondContact O-N 2.87Å
100L88.2Confident82.6Confident13 Ų1372.3 Ų72.37%0.06838%0.381CS..Hα-helixtrans-66.8-39.3177.9-144.7175.2000111.3I73 V76 V81 A96 R97 L98 G103 F104I73-L100 HydrophobicContact CG2-CD2 4.38Å; V76-L100 HydrophobicContact CB-CD1 4.2Å; V76-L100 HydrophobicContact CB-CG 4.37Å; V76-L100 HydrophobicContact CG1-CD1 3.96Å; V81-L100 HydrophobicContact CG2-CD1 3.26Å; A96-L100 WeakPolarHBondContact O-CB 3.18Å; A96-L100 PolarHBondContact O-N 3.04Å; R97-L100 PolarHBondContact O-N 3.48Å; L98-L100 PolarHBondContact O-N 3.5Å; L100-G103 PolarHBondContact O-N 3.47Å; L100-F104 HydrophobicContact CD2-CD2 3.25Å; L100-F104 HydrophobicContact CD2-CE2 3.02Å; L100-F104 HydrophobicContact CD2-CG 4.34Å; L100-F104 HydrophobicContact CD2-CZ 3.95Å; L100-F104 WeakPolarHBondContact O-CD2 3.02Å; L100-F104 PolarHBondContact O-N 3.28Å
101F89.6Confident84.5Confident124 Ų12467.4 Ų67.454%0.54434%0.343SS..Hα-helixtrans-62-47.3175-179.2-107000111.9R97 L98 G103 F104 M105R97-F101 VanDerWaalsContact O-CB 3.25Å; R97-F101 WeakPolarHBondContact O-CB 3.46Å; R97-F101 PolarHBondContact O-N 2.97Å; L98-F101 PolarHBondContact O-N 3.07Å; F101-G103 VanDerWaalsContact C-N 3.31Å; F101-G103 PolarHBondContact O-N 3.28Å; F101-F104 PolarHBondContact O-N 2.96Å; F101-M105 HydrophobicContact CD1-CG 4.35Å; F101-M105 HydrophobicContact CD1-SD 3.76Å; F101-M105 HydrophobicContact CE1-CG 4.05Å; F101-M105 HydrophobicContact CE1-SD 3.16Å; F101-M105 WeakPolarHBondContact CE1-SD 3.22Å; F101-M105 HydrophobicContact CE2-CG 4.39Å; F101-M105 HydrophobicContact CE2-SD 4.43Å; F101-M105 HydrophobicContact CZ-CG 4.06Å; F101-M105 HydrophobicContact CZ-SD 3.56Å; F101-M105 VanDerWaalsContact CZ-SD 3.56Å; F101-M105 WeakPolarHBondContact O-CG 3.4Å; F101-M105 PolarHBondContact O-N 2.89Å
102I91.4Very high86.4Confident82 Ų8265.7 Ų65.742%0.42133%0.333SS..Hα-helixtrans-61.1-42.2175.4-66.9164.7000110.4M72 L98 W99 F104 M105 M106M72-I102 HydrophobicContact CE-CB 4.27Å; M72-I102 HydrophobicContact CE-CG2 3.86Å; L98-I102 VanDerWaalsContact O-CG1 3.25Å; L98-I102 WeakPolarHBondContact O-CG1 3.44Å; L98-I102 PolarHBondContact O-N 3.41Å; W99-I102 PolarHBondContact O-N 3.23Å; I102-F104 PolarHBondContact O-N 3.1Å; I102-M105 PolarHBondContact O-N 3.4Å; I102-M106 WeakPolarHBondContact O-CB 3.32Å; I102-M106 PolarHBondContact O-N 2.91Å
103G91.1Very high87.6Confident0 Ų065.3 Ų65.30%033%0.329CS..Hα-helixtrans-56.8-49.1174.600000112.2A69 W99 L100 F101 M106 M107A69-G103 WeakPolarHBondContact CB-O 3.25Å; W99-G103 PolarHBondContact O-N 2.87Å; L100-G103 PolarHBondContact O-N 3.47Å; F101-G103 VanDerWaalsContact C-N 3.31Å; F101-G103 PolarHBondContact O-N 3.28Å; G103-M106 PolarHBondContact O-N 3.23Å; G103-M107 WeakPolarHBondContact O-CB 3.44Å; G103-M107 PolarHBondContact O-N 2.75Å
104F90.6Very high88.7Confident48 Ų4859 Ų5921%0.21131%0.306CS..Hα-helixtrans-63.7-42.6176.2-83.5-55000112.8I73 L100 F101 I102 M106 M107 F108 L147 F151I73-F104 HydrophobicContact CD1-CD1 3.66Å; I73-F104 HydrophobicContact CD1-CE1 3.92Å; I73-F104 HydrophobicContact CD1-CG 4.18Å; I73-F104 HydrophobicContact CG1-CD1 4.3Å; I73-F104 HydrophobicContact CG1-CE1 4.45Å; I73-F104 HydrophobicContact CG1-CG 4.44Å; I73-F104 HydrophobicContact CG2-CE1 4.22Å; I73-F104 HydrophobicContact CG2-CZ 4.11Å; L100-F104 HydrophobicContact CD2-CD2 3.25Å; L100-F104 HydrophobicContact CD2-CE2 3.02Å; L100-F104 HydrophobicContact CD2-CG 4.34Å; L100-F104 HydrophobicContact CD2-CZ 3.95Å; L100-F104 WeakPolarHBondContact O-CD2 3.02Å; L100-F104 PolarHBondContact O-N 3.28Å; F101-F104 PolarHBondContact O-N 2.96Å; I102-F104 PolarHBondContact O-N 3.1Å; F104-M106 PolarHBondContact O-N 3.37Å; F104-M107 WeakPolarHBondContact O-CB 3.43Å; F104-M107 PolarHBondContact O-N 2.99Å; F104-F108 HydrophobicContact CB-CD2 4.44Å; F104-F108 HydrophobicContact CB-CE2 4.39Å; F104-F108 HydrophobicContact CD1-CE2 4.26Å; F104-F108 WeakPolarHBondContact O-CD2 3.38Å; F104-F108 PolarHBondContact O-N 3.19Å; F104-L147 HydrophobicContact CE1-CD2 4.27Å; F104-F151 HydrophobicContact CZ-CZ 4.42Å
105M94.4Very high89.6Confident110 Ų11057.1 Ų57.154%0.54229%0.291SS..Hα-helixtrans-59.6-45.4176.2-73.3-17574.200111.9F101 I102 M107 G109F101-M105 HydrophobicContact CD1-CG 4.35Å; F101-M105 HydrophobicContact CD1-SD 3.76Å; F101-M105 HydrophobicContact CE1-CG 4.05Å; F101-M105 HydrophobicContact CE1-SD 3.16Å; F101-M105 WeakPolarHBondContact CE1-SD 3.22Å; F101-M105 HydrophobicContact CE2-CG 4.39Å; F101-M105 HydrophobicContact CE2-SD 4.43Å; F101-M105 HydrophobicContact CZ-CG 4.06Å; F101-M105 HydrophobicContact CZ-SD 3.56Å; F101-M105 VanDerWaalsContact CZ-SD 3.56Å; F101-M105 WeakPolarHBondContact O-CG 3.4Å; F101-M105 PolarHBondContact O-N 2.89Å; I102-M105 PolarHBondContact O-N 3.4Å; M105-M107 VanDerWaalsContact C-N 3.3Å; M105-M107 PolarHBondContact O-N 2.85Å; M105-G109 PolarHBondContact O-N 3.03Å
106M93.3Very high90.2Very high54 Ų5465.3 Ų65.327%0.26632%0.315SS..Hα-helixtrans-63.7-38.7178-173.4179.9-6600111.4F65 I68 A69 M72 I102 G103 F104 S110F65-M106 HydrophobicContact CB-CG 4.31Å; F65-M106 HydrophobicContact CD1-CG 4.4Å; F65-M106 HydrophobicContact CD1-SD 4.04Å; I68-M106 HydrophobicContact CB-SD 4.19Å; I68-M106 HydrophobicContact CG2-SD 3.94Å; A69-M106 HydrophobicContact CB-CB 4.01Å; A69-M106 HydrophobicContact CB-CG 4.03Å; A69-M106 HydrophobicContact CB-SD 4.22Å; M72-M106 HydrophobicContact SD-CE 4.35Å; M72-M106 HydrophobicContact SD-SD 4.44Å; I102-M106 WeakPolarHBondContact O-CB 3.32Å; I102-M106 PolarHBondContact O-N 2.91Å; G103-M106 PolarHBondContact O-N 3.23Å; F104-M106 PolarHBondContact O-N 3.37Å; M106-S110 WeakPolarHBondContact O-CB 3.28Å; M106-S110 PolarHBondContact O-N 3.47Å; M106-S110 PolarHBondContact O-OG 3.08Å
107M93.5Very high90.5Very high0 Ų065.8 Ų65.80%032%0.315CS..Hα-helixtrans-65.9-49.8177.5-177.7158.5-76.700112.6A69 F70 I73 G103 F104 M105 G109 S110 F111 F143 S146A69-M107 HydrophobicContact CB-CB 3.81Å; A69-M107 HydrophobicContact CB-CE 3.98Å; F70-M107 HydrophobicContact CB-CE 4.16Å; I73-M107 HydrophobicContact CD1-CB 4.05Å; I73-M107 HydrophobicContact CD1-CE 3.66Å; I73-M107 HydrophobicContact CD1-CG 4.44Å; I73-M107 HydrophobicContact CD1-SD 3.48Å; I73-M107 WeakPolarHBondContact CD1-SD 3.41Å; G103-M107 WeakPolarHBondContact O-CB 3.44Å; G103-M107 PolarHBondContact O-N 2.75Å; F104-M107 WeakPolarHBondContact O-CB 3.43Å; F104-M107 PolarHBondContact O-N 2.99Å; M105-M107 VanDerWaalsContact C-N 3.3Å; M105-M107 PolarHBondContact O-N 2.85Å; M107-G109 VanDerWaalsContact C-N 3.34Å; M107-S110 PolarHBondContact O-N 3.46Å; M107-F111 WeakPolarHBondContact O-CB 3.21Å; M107-F111 PolarHBondContact O-N 3.4Å; M107-F143 HydrophobicContact CG-CD2 3.54Å; M107-F143 HydrophobicContact CG-CE2 4.09Å; M107-F143 HydrophobicContact SD-CD2 3.89Å; M107-F143 HydrophobicContact SD-CE2 4.4Å; M107-S146 VanDerWaalsContact CE-OG 3.28Å; M107-S146 WeakPolarHBondContact CE-OG 3.23Å; M107-S146 PolarHBondContact SD-OG 3Å
108F93Very high90.7Very high96 Ų9661 Ų6142%0.42130%0.298SS..Hα-helixtrans-65-39.1175.7-75.2-64.5000111.9F104 S110 F111 I112 F143F104-F108 HydrophobicContact CB-CD2 4.44Å; F104-F108 HydrophobicContact CB-CE2 4.39Å; F104-F108 HydrophobicContact CD1-CE2 4.26Å; F104-F108 WeakPolarHBondContact O-CD2 3.38Å; F104-F108 PolarHBondContact O-N 3.19Å; F108-S110 VanDerWaalsContact C-N 3.34Å; F108-S110 PolarHBondContact O-N 2.93Å; F108-F111 PolarHBondContact O-N 2.77Å; F108-I112 WeakPolarHBondContact O-CB 3.18Å; F108-I112 VanDerWaalsContact O-CG1 3.28Å; F108-I112 WeakPolarHBondContact O-CG1 3.47Å; F108-I112 PolarHBondContact O-N 2.68Å; F108-F143 AromaticContact CD1-CE2 3.86Å; F108-F143 HydrophobicContact CD1-CE2 3.86Å; F108-F143 HydrophobicContact CD1-CZ 4.36Å; F108-F143 AromaticContact CE1-CE2 3.52Å; F108-F143 HydrophobicContact CE1-CE2 3.52Å; F108-F143 AromaticContact CE1-CZ 3.65Å; F108-F143 HydrophobicContact CE1-CZ 3.65Å; F108-F143 HydrophobicContact CZ-CE2 4.08Å; F108-F143 HydrophobicContact CZ-CZ 4.2Å
109G93.6Very high90.8Very high44 Ų4461.7 Ų61.745%0.45430%0.298SS..Hα-helixtrans-60.3-43.5175.600000112.3M105 M107 G113M105-G109 PolarHBondContact O-N 3.03Å; M107-G109 VanDerWaalsContact C-N 3.34Å; G109-G113 PolarHBondContact O-N 3.49Å
110S91.7Very high90.6Very high10 Ų1056.4 Ų56.47%0.0728%0.284CS..Hα-helixtrans-66.6-42.3175.7-54.20000111.3C62 F65 M106 M107 F108 G113 S114C62-S110 PolarHBondContact SG-O 2.88Å; F65-S110 VanDerWaalsContact CB-OG 3.3Å; F65-S110 WeakPolarHBondContact CB-OG 3.18Å; M106-S110 WeakPolarHBondContact O-CB 3.28Å; M106-S110 PolarHBondContact O-N 3.47Å; M106-S110 PolarHBondContact O-OG 3.08Å; M107-S110 PolarHBondContact O-N 3.46Å; F108-S110 VanDerWaalsContact C-N 3.34Å; F108-S110 PolarHBondContact O-N 2.93Å; S110-G113 PolarHBondContact O-N 3.36Å; S110-S114 WeakPolarHBondContact O-CB 3.04Å; S110-S114 PolarHBondContact O-N 3.34Å
111F92.5Very high90.3Very high44 Ų4457.4 Ų57.419%0.19329%0.294CS..Hα-helixtrans-62.8-49.2177.9-173.7-114.8000112.4M107 F108 G113 S114 I115 F136 A140M107-F111 WeakPolarHBondContact O-CB 3.21Å; M107-F111 PolarHBondContact O-N 3.4Å; F108-F111 PolarHBondContact O-N 2.77Å; F111-G113 VanDerWaalsContact C-N 3.34Å; F111-G113 PolarHBondContact O-N 3.03Å; F111-S114 PolarHBondContact O-N 2.88Å; F111-S114 PolarHBondContact O-OG 3.27Å; F111-I115 HydrophobicContact CD1-CD1 4.19Å; F111-I115 HydrophobicContact CE1-CD1 3.87Å; F111-I115 HydrophobicContact CZ-CD1 4.22Å; F111-I115 PolarHBondContact O-N 2.8Å; F111-I115 VanDerWaalsContact O-N 3.17Å; F111-F136 AromaticContact CE2-CE2 3.91Å; F111-F136 HydrophobicContact CE2-CE2 3.91Å; F111-F136 HydrophobicContact CE2-CZ 4.47Å; F111-F136 HydrophobicContact CZ-CE2 4.1Å; F111-A140 HydrophobicContact CE2-CB 3.94Å
112I92.8Very high89.9Confident111 Ų11151.8 Ų51.857%0.56927%0.27SS*.Hα-helixtrans-64.1-40.9177-64.6165.4000110.7F108 S114 I115 W116F108-I112 WeakPolarHBondContact O-CB 3.18Å; F108-I112 VanDerWaalsContact O-CG1 3.28Å; F108-I112 WeakPolarHBondContact O-CG1 3.47Å; F108-I112 PolarHBondContact O-N 2.68Å; I112-S114 VanDerWaalsContact C-N 3.3Å; I112-S114 PolarHBondContact O-N 3.36Å; I112-I115 WeakPolarHBondContact O-CB 3.3Å; I112-I115 PolarHBondContact O-N 3.19Å; I112-W116 PolarHBondContact O-N 2.81Å
113G91.1Very high89.5Confident27 Ų2750.9 Ų50.928%0.27827%0.267SS..Hα-helixtrans-58.6-40.9174.500000112.5G109 S110 F111 I115 W116 I117G109-G113 PolarHBondContact O-N 3.49Å; S110-G113 PolarHBondContact O-N 3.36Å; F111-G113 VanDerWaalsContact C-N 3.34Å; F111-G113 PolarHBondContact O-N 3.03Å; G113-I115 PolarHBondContact O-N 3.33Å; G113-W116 WeakPolarHBondContact O-CB 3.27Å; G113-W116 PolarHBondContact O-N 2.94Å; G113-I117 WeakPolarHBondContact O-CG1 3.48Å; G113-I117 PolarHBondContact O-N 3.32Å
114S89.6Confident89.1Confident0 Ų058.2 Ų58.20%030%0.304CS..Hα-helixtrans-65.6-36.2176.878.70000113S110 F111 I112 I117 L118S110-S114 WeakPolarHBondContact O-CB 3.04Å; S110-S114 PolarHBondContact O-N 3.34Å; F111-S114 PolarHBondContact O-N 2.88Å; F111-S114 PolarHBondContact O-OG 3.27Å; I112-S114 VanDerWaalsContact C-N 3.3Å; I112-S114 PolarHBondContact O-N 3.36Å; S114-I117 PolarHBondContact O-N 3.22Å; S114-L118 PolarHBondContact O-N 3.42Å
115I92.1Very high88.6Confident59 Ų5959.2 Ų59.230%0.30332%0.315SS..Hα-helixtrans-64.1-44172.9-64.9168.7000110F111 I112 G113 I117 L118 F119 F136F111-I115 HydrophobicContact CD1-CD1 4.19Å; F111-I115 HydrophobicContact CE1-CD1 3.87Å; F111-I115 HydrophobicContact CZ-CD1 4.22Å; F111-I115 PolarHBondContact O-N 2.8Å; F111-I115 VanDerWaalsContact O-N 3.17Å; I112-I115 WeakPolarHBondContact O-CB 3.3Å; I112-I115 PolarHBondContact O-N 3.19Å; G113-I115 PolarHBondContact O-N 3.33Å; I115-I117 PolarHBondContact O-N 2.78Å; I115-L118 PolarHBondContact O-N 3.06Å; I115-F119 HydrophobicContact CG2-CD2 3.81Å; I115-F119 HydrophobicContact CG2-CE2 4.04Å; I115-F119 WeakPolarHBondContact O-CD2 3.49Å; I115-F119 PolarHBondContact O-N 2.88Å; I115-F136 HydrophobicContact CD1-CE2 4.3Å; I115-F136 HydrophobicContact CG1-CD2 3.84Å; I115-F136 HydrophobicContact CG1-CE2 3.59Å
116W89.9Confident87.9Confident194 Ų19463.2 Ų63.274%0.73533%0.329SS*.Hα-helixtrans-62.3-42.2176.6-177.8-94.8000112.2I112 G113 L118 F119 G120I112-W116 PolarHBondContact O-N 2.81Å; G113-W116 WeakPolarHBondContact O-CB 3.27Å; G113-W116 PolarHBondContact O-N 2.94Å; W116-L118 PolarHBondContact O-N 2.87Å; W116-F119 PolarHBondContact O-N 2.65Å; W116-G120 WeakPolarHBondContact O-CA 3.38Å; W116-G120 PolarHBondContact O-N 3.48Å
117I86.9Confident87Confident22 Ų2266.4 Ų66.411%0.11334%0.342CS..Iπ-helixtrans-60.4-46.9176.1-69.5162000110.2F59 C62 G113 S114 I115 A121 Y122 V135F59-I117 HydrophobicContact CD1-CB 4.49Å; F59-I117 HydrophobicContact CD1-CD1 3.64Å; F59-I117 HydrophobicContact CD1-CG1 3.87Å; F59-I117 HydrophobicContact CD1-CG2 3.77Å; F59-I117 HydrophobicContact CE1-CB 4.5Å; F59-I117 HydrophobicContact CE1-CD1 4.18Å; F59-I117 HydrophobicContact CE1-CG1 3.9Å; F59-I117 HydrophobicContact CE1-CG2 3.83Å; F59-I117 HydrophobicContact CG-CG2 4.15Å; F59-I117 HydrophobicContact CZ-CG2 4.25Å; C62-I117 HydrophobicContact CB-CD1 4.33Å; G113-I117 WeakPolarHBondContact O-CG1 3.48Å; G113-I117 PolarHBondContact O-N 3.32Å; S114-I117 PolarHBondContact O-N 3.22Å; I115-I117 PolarHBondContact O-N 2.78Å; I117-A121 HydrophobicContact CG2-CB 4.49Å; I117-A121 VanDerWaalsContact O-CB 3.23Å; I117-A121 WeakPolarHBondContact O-CB 3.4Å; I117-A121 PolarHBondContact O-N 2.86Å; I117-Y122 HydrophobicContact CG2-CD2 4.14Å; I117-Y122 HydrophobicContact CG2-CE2 3.83Å; I117-Y122 WeakPolarHBondContact O-CD2 3.32Å; I117-V135 HydrophobicContact CD1-CG1 4.44Å
118L87.1Confident86.3Confident13 Ų1371.5 Ų71.57%0.06837%0.369CS..Iπ-helixtrans-56.6-54.6178174.463.5000111.7S114 I115 W116 Y122 V123 V129 L133 F136S114-L118 PolarHBondContact O-N 3.42Å; I115-L118 PolarHBondContact O-N 3.06Å; W116-L118 PolarHBondContact O-N 2.87Å; L118-Y122 WeakPolarHBondContact O-CB 3.47Å; L118-Y122 PolarHBondContact O-N 3.48Å; L118-V123 WeakPolarHBondContact O-CG2 3.41Å; L118-V123 PolarHBondContact O-N 3.42Å; L118-V129 HydrophobicContact CD1-CG1 3.8Å; L118-L133 HydrophobicContact CD1-CD2 4.06Å; L118-L133 HydrophobicContact CD1-CG 3.87Å; L118-L133 HydrophobicContact CD2-CD2 4.3Å; L118-F136 HydrophobicContact CB-CB 4.49Å; L118-F136 HydrophobicContact CD2-CB 4.19Å; L118-F136 HydrophobicContact CD2-CD1 4.39Å; L118-F136 HydrophobicContact CD2-CG 4.14Å
119F86.9Confident85.8Confident112 Ų11269.5 Ų69.549%0.49136%0.364SS..Iπ-helixtrans-80.1-45.5-174-73.8-73.3000113.6I115 W116 V123 M124I115-F119 HydrophobicContact CG2-CD2 3.81Å; I115-F119 HydrophobicContact CG2-CE2 4.04Å; I115-F119 WeakPolarHBondContact O-CD2 3.49Å; I115-F119 PolarHBondContact O-N 2.88Å; W116-F119 PolarHBondContact O-N 2.65Å; F119-V123 HydrophobicContact CD1-CB 4.14Å; F119-V123 HydrophobicContact CD1-CG1 4.26Å; F119-V123 HydrophobicContact CD1-CG2 4.01Å; F119-V123 HydrophobicContact CE1-CG2 4.46Å; F119-V123 PolarHBondContact O-N 2.85Å; F119-M124 WeakPolarHBondContact O-CG 3.21Å; F119-M124 PolarHBondContact O-N 2.92Å
120G84.1Confident85.2Confident22 Ų2269.4 Ų69.423%0.22736%0.36CS..Iπ-helixtrans-77.4-40-174.200000113.7W116 P125W116-G120 WeakPolarHBondContact O-CA 3.38Å; W116-G120 PolarHBondContact O-N 3.48Å; G120-P125 WeakPolarHBondContact O-CD 3.3Å
121A80.2Confident84.7Confident33 Ų3369 Ų6927%0.27336%0.356SS..Iπ-helixtrans-91.8-27-176.400000113.6F59 I117 P125F59-A121 HydrophobicContact CZ-CB 4.15Å; I117-A121 HydrophobicContact CG2-CB 4.49Å; I117-A121 VanDerWaalsContact O-CB 3.23Å; I117-A121 WeakPolarHBondContact O-CB 3.4Å; I117-A121 PolarHBondContact O-N 2.86Å; A121-P125 WeakPolarHBondContact O-CG 3.34Å
122Y81.1Confident84.3Confident7 Ų766.9 Ų66.93%0.02735%0.347CS..Iπ-helixtrans-115.8-49.2-174.2-66.4-76.5000114.1I54 F59 I117 L118 K126 K127 D128 P131I54-Y122 WeakPolarHBondContact O-CE1 3.25Å; I54-Y122 PolarHBondContact O-OH 3.35Å; F59-Y122 HydrophobicContact CD2-CE2 4.36Å; F59-Y122 WeakPolarHBondContact CD2-OH 3.11Å; F59-Y122 HydrophobicContact CE2-CE2 4.05Å; F59-Y122 AromaticContact CE2-CZ 3.98Å; F59-Y122 WeakPolarHBondContact CE2-OH 3.29Å; I117-Y122 HydrophobicContact CG2-CD2 4.14Å; I117-Y122 HydrophobicContact CG2-CE2 3.83Å; I117-Y122 WeakPolarHBondContact O-CD2 3.32Å; L118-Y122 WeakPolarHBondContact O-CB 3.47Å; L118-Y122 PolarHBondContact O-N 3.48Å; Y122-K126 PolarHBondContact O-N 3.41Å; Y122-K127 HydrophobicContact CD1-CB 4.35Å; Y122-K127 PolarHBondContact O-N 2.97Å; Y122-K127 VanDerWaalsContact O-N 3.14Å; Y122-D128 WeakPolarHBondContact CD1-O 3.42Å; Y122-P131 HydrophobicContact CD1-CG 3.91Å; Y122-P131 HydrophobicContact CE1-CB 4.08Å; Y122-P131 HydrophobicContact CE1-CG 3.39Å
123V84.1Confident84Confident62 Ų6264.8 Ų64.838%0.37634%0.337SS..Iπ-helixtrans-72.3-48-177176.80000112.4L118 F119 K126 V129L118-V123 WeakPolarHBondContact O-CG2 3.41Å; L118-V123 PolarHBondContact O-N 3.42Å; F119-V123 HydrophobicContact CD1-CB 4.14Å; F119-V123 HydrophobicContact CD1-CG1 4.26Å; F119-V123 HydrophobicContact CD1-CG2 4.01Å; F119-V123 HydrophobicContact CE1-CG2 4.46Å; F119-V123 PolarHBondContact O-N 2.85Å; V123-K126 PolarHBondContact O-N 3.38Å; V123-V129 HydrophobicContact CG2-CG1 4.05Å; V123-V129 HydrophobicContact CG2-CG2 4.44Å
124M82.1Confident84Confident155 Ų15564 Ų6476%0.76433%0.327SS*.THydrogen-bonded Turntrans-62.2-44.7-179.7-79.1-175.5164.400113.2F119 K126F119-M124 WeakPolarHBondContact O-CG 3.21Å; F119-M124 PolarHBondContact O-N 2.92Å; M124-K126 PolarHBondContact O-N 3.25Å
125P80.6Confident83.9Confident68 Ų6864 Ų6444%0.44233%0.327SS..THydrogen-bonded Turntrans-78.32.1179-17.435.8000113.9G120 A121 K127G120-P125 WeakPolarHBondContact O-CD 3.3Å; A121-P125 WeakPolarHBondContact O-CG 3.34Å; P125-K127 HydrophobicContact CB-CD 4.5Å; P125-K127 HydrophobicContact CB-CG 4.21Å; P125-K127 PolarHBondContact O-N 3.46Å
126K78.9Confident83.9Confident194 Ų19463.3 Ų63.384%0.84332%0.323SS*.THydrogen-bonded Turntrans52.537.2-175.2-57.4-178.7-178.8177.30113.3Y122 V123 M124Y122-K126 PolarHBondContact O-N 3.41Å; V123-K126 PolarHBondContact O-N 3.38Å; M124-K126 PolarHBondContact O-N 3.25Å
127K75Confident84.1Confident121 Ų12158.4 Ų58.453%0.52631%0.306SS..  trans-83172.6171.4-73.7-175.8175.8-173.90109.9Y122 P125 V129Y122-K127 HydrophobicContact CD1-CB 4.35Å; Y122-K127 PolarHBondContact O-N 2.97Å; Y122-K127 VanDerWaalsContact O-N 3.14Å; P125-K127 HydrophobicContact CB-CD 4.5Å; P125-K127 HydrophobicContact CB-CG 4.21Å; P125-K127 PolarHBondContact O-N 3.46Å; K127-V129 WeakPolarHBondContact O-CG2 3.36Å; K127-V129 PolarHBondContact O-N 2.88Å; K127-V129 VanDerWaalsContact O-N 3.12Å
128D78.8Confident84.4Confident107 Ų10757.3 Ų57.357%0.57230%0.301SS*.  trans-56.7118.8173.5-71.5-31.7000110.6Y122 A130 P131Y122-D128 WeakPolarHBondContact CD1-O 3.42Å; D128-A130 VanDerWaalsContact C-N 3.33Å; D128-P131 VanDerWaalsContact O-CD 3.32Å; D128-P131 WeakPolarHBondContact O-CD 3.33Å; D128-P131 WeakPolarHBondContact O-CG 3.15Å
129V81.9Confident84.7Confident54 Ų5456.7 Ų56.733%0.32730%0.298SS..SBendtrans-81.1-17.6-172.5-172.60000112L118 V123 K127 G132 L133L118-V129 HydrophobicContact CD1-CG1 3.8Å; V123-V129 HydrophobicContact CG2-CG1 4.05Å; V123-V129 HydrophobicContact CG2-CG2 4.44Å; K127-V129 WeakPolarHBondContact O-CG2 3.36Å; K127-V129 PolarHBondContact O-N 2.88Å; K127-V129 VanDerWaalsContact O-N 3.12Å; V129-G132 PolarHBondContact O-N 3.48Å; V129-G132 VanDerWaalsContact O-N 3.11Å; V129-L133 HydrophobicContact CG1-CD1 3.95Å; V129-L133 HydrophobicContact CG1-CG 4.05Å; V129-L133 PolarHBondContact O-N 2.89Å
130A80.9Confident85Confident43 Ų4351.8 Ų51.836%0.35528%0.278SS..Hα-helixtrans-51.4-50.4-179.200000114.7Y49 D128 G132 L133 A134Y49-A130 HydrophobicContact CE2-CB 3.99Å; Y49-A130 WeakPolarHBondContact OH-CB 3.12Å; D128-A130 VanDerWaalsContact C-N 3.33Å; A130-G132 PolarHBondContact O-N 2.94Å; A130-L133 PolarHBondContact O-N 2.85Å; A130-A134 PolarHBondContact O-N 3.39Å
131P81.9Confident85.5Confident0 Ų053.3 Ų53.30%028%0.278CS..Hα-helixtrans-63.1-38175.623.4-36.2000113.2Y49 I54 Y122 D128 L133 A134 V135Y49-P131 HydrophobicContact CD2-CB 4.37Å; I54-P131 HydrophobicContact CG2-CG 4.39Å; Y122-P131 HydrophobicContact CD1-CG 3.91Å; Y122-P131 HydrophobicContact CE1-CB 4.08Å; Y122-P131 HydrophobicContact CE1-CG 3.39Å; D128-P131 VanDerWaalsContact O-CD 3.32Å; D128-P131 WeakPolarHBondContact O-CD 3.33Å; D128-P131 WeakPolarHBondContact O-CG 3.15Å; P131-L133 VanDerWaalsContact C-N 3.34Å; P131-L133 PolarHBondContact O-N 2.93Å; P131-A134 PolarHBondContact O-N 2.89Å; P131-V135 WeakPolarHBondContact O-CG2 3.33Å; P131-V135 PolarHBondContact O-N 2.91Å
132G83.8Confident86.2Confident0 Ų051.8 Ų51.80%027%0.265CS..Hα-helixtrans-63.5-39.9175.500000112.6V129 A130 F136V129-G132 PolarHBondContact O-N 3.48Å; V129-G132 VanDerWaalsContact O-N 3.11Å; A130-G132 PolarHBondContact O-N 2.94Å; G132-F136 WeakPolarHBondContact O-CB 3.16Å; G132-F136 PolarHBondContact O-N 2.64Å; G132-F136 VanDerWaalsContact O-N 3.1Å
133L87.6Confident86.8Confident67 Ų6752.5 Ų52.535%0.35127%0.269SS..Hα-helixtrans-65.8-41.5175.5-78.9162.7000111.3L118 V129 A130 P131 V135 F136 F137L118-L133 HydrophobicContact CD1-CD2 4.06Å; L118-L133 HydrophobicContact CD1-CG 3.87Å; L118-L133 HydrophobicContact CD2-CD2 4.3Å; V129-L133 HydrophobicContact CG1-CD1 3.95Å; V129-L133 HydrophobicContact CG1-CG 4.05Å; V129-L133 PolarHBondContact O-N 2.89Å; A130-L133 PolarHBondContact O-N 2.85Å; P131-L133 VanDerWaalsContact C-N 3.34Å; P131-L133 PolarHBondContact O-N 2.93Å; L133-V135 PolarHBondContact O-N 3.04Å; L133-F136 PolarHBondContact O-N 3.46Å; L133-F137 HydrophobicContact CB-CD2 4.23Å; L133-F137 HydrophobicContact CB-CE2 4.28Å; L133-F137 HydrophobicContact CD2-CE2 3.91Å; L133-F137 WeakPolarHBondContact O-CB 3.28Å; L133-F137 WeakPolarHBondContact O-CD2 3.48Å; L133-F137 PolarHBondContact O-N 3.28Å
134A89.6Confident87.2Confident10 Ų1054.5 Ų54.58%0.08327%0.272CS..Hα-helixtrans-59-46.1177.800000112.2I41 A45 A130 P131 F136 F137 Q138I41-A134 HydrophobicContact CG2-CB 3.92Å; A45-A134 HydrophobicContact CB-CB 3.5Å; A45-A134 VanDerWaalsContact CB-CB 3.5Å; A130-A134 PolarHBondContact O-N 3.39Å; P131-A134 PolarHBondContact O-N 2.89Å; A134-F136 PolarHBondContact O-N 2.9Å; A134-F137 PolarHBondContact O-N 3.07Å; A134-Q138 WeakPolarHBondContact O-CB 3.38Å; A134-Q138 PolarHBondContact O-N 2.83Å
135V89.2Confident87.7Confident0 Ų047.1 Ų47.10%024%0.236CC..Hα-helixtrans-64.6-40.6177.5176.20000111.6M42 F59 I117 P131 L133 N139M42-V135 HydrophobicContact CE-CG2 4.18Å; M42-V135 HydrophobicContact SD-CG2 4.14Å; F59-V135 HydrophobicContact CB-CG2 4.15Å; I117-V135 HydrophobicContact CD1-CG1 4.44Å; P131-V135 WeakPolarHBondContact O-CG2 3.33Å; P131-V135 PolarHBondContact O-N 2.91Å; L133-V135 PolarHBondContact O-N 3.04Å; V135-N139 PolarHBondContact O-N 3.2Å; V135-N139 PolarHBondContact O-ND2 2.88Å
136F92.3Very high88.2Confident46 Ų4643.9 Ų43.920%0.20222%0.215CC..Hα-helixtrans-63.8-49.8175.4171.5-104.7000111.7F111 I115 L118 G132 L133 A134 Q138 N139 A140F111-F136 AromaticContact CE2-CE2 3.91Å; F111-F136 HydrophobicContact CE2-CE2 3.91Å; F111-F136 HydrophobicContact CE2-CZ 4.47Å; F111-F136 HydrophobicContact CZ-CE2 4.1Å; I115-F136 HydrophobicContact CD1-CE2 4.3Å; I115-F136 HydrophobicContact CG1-CD2 3.84Å; I115-F136 HydrophobicContact CG1-CE2 3.59Å; L118-F136 HydrophobicContact CB-CB 4.49Å; L118-F136 HydrophobicContact CD2-CB 4.19Å; L118-F136 HydrophobicContact CD2-CD1 4.39Å; L118-F136 HydrophobicContact CD2-CG 4.14Å; G132-F136 WeakPolarHBondContact O-CB 3.16Å; G132-F136 PolarHBondContact O-N 2.64Å; G132-F136 VanDerWaalsContact O-N 3.1Å; L133-F136 PolarHBondContact O-N 3.46Å; A134-F136 PolarHBondContact O-N 2.9Å; F136-Q138 PolarHBondContact O-N 3.16Å; F136-N139 PolarHBondContact O-N 2.66Å; F136-A140 WeakPolarHBondContact O-CB 3.48Å; F136-A140 PolarHBondContact O-N 2.97Å
137F92.3Very high88.7Confident90 Ų9036.6 Ų36.640%0.39519%0.185SC..Hα-helixtrans-63.5-39.9179.8-81.8-61.8000112.1I41 L133 A134 N139 A140 F141I41-F137 HydrophobicContact CD1-CB 4.29Å; L133-F137 HydrophobicContact CB-CD2 4.23Å; L133-F137 HydrophobicContact CB-CE2 4.28Å; L133-F137 HydrophobicContact CD2-CE2 3.91Å; L133-F137 WeakPolarHBondContact O-CB 3.28Å; L133-F137 WeakPolarHBondContact O-CD2 3.48Å; L133-F137 PolarHBondContact O-N 3.28Å; A134-F137 PolarHBondContact O-N 3.07Å; F137-N139 PolarHBondContact O-N 3.27Å; F137-A140 PolarHBondContact O-N 2.9Å; F137-F141 HydrophobicContact CB-CD2 4.22Å; F137-F141 HydrophobicContact CB-CE2 3.99Å; F137-F141 HydrophobicContact CD1-CE2 4.06Å; F137-F141 HydrophobicContact CD1-CZ 4.38Å; F137-F141 HydrophobicContact CG-CE2 4.38Å; F137-F141 WeakPolarHBondContact O-CB 3.28Å; F137-F141 WeakPolarHBondContact O-CD2 3.36Å; F137-F141 WeakPolarHBondContact O-CG 3.49Å; F137-F141 PolarHBondContact O-N 3.25Å
138Q93.1Very high89.4Confident0 Ų033.6 Ų33.60%017%0.174CC..Hα-helixtrans-53.6-54.3172178.8-169.627.900110.9G38 M42 A134 F136 A140 F141 I142G38-Q138 WeakPolarHBondContact O-CG 3.42Å; M42-Q138 HydrophobicContact CG-CB 3.73Å; M42-Q138 HydrophobicContact CG-CG 3.63Å; M42-Q138 VanDerWaalsContact CG-NE2 3.28Å; M42-Q138 HydrophobicContact SD-CB 4.04Å; M42-Q138 HydrophobicContact SD-CG 4.45Å; M42-Q138 PolarHBondContact SD-OE1 3.16Å; A134-Q138 WeakPolarHBondContact O-CB 3.38Å; A134-Q138 PolarHBondContact O-N 2.83Å; F136-Q138 PolarHBondContact O-N 3.16Å; Q138-A140 VanDerWaalsContact C-N 3.33Å; Q138-A140 PolarHBondContact O-N 3.38Å; Q138-F141 PolarHBondContact O-N 3.46Å; Q138-I142 HydrophobicContact CG-CD1 3.69Å; Q138-I142 VanDerWaalsContact O-CG1 3.28Å; Q138-I142 WeakPolarHBondContact O-CG1 3.48Å; Q138-I142 PolarHBondContact O-N 3.48Å
139N93.6Very high89.8Confident0 Ų032.2 Ų32.20%016%0.162CC..Hα-helixtrans-64.5-38.5-177.4-81.8-79000111.9C62 S66 V135 F136 F137 F143C62-N139 PolarHBondContact O-OD1 3.49Å; C62-N139 PolarHBondContact SG-ND2 2.92Å; C62-N139 VanDerWaalsContact SG-ND2 3.42Å; S66-N139 WeakPolarHBondContact CB-OD1 3.46Å; V135-N139 PolarHBondContact O-N 3.2Å; V135-N139 PolarHBondContact O-ND2 2.88Å; F136-N139 PolarHBondContact O-N 2.66Å; F137-N139 PolarHBondContact O-N 3.27Å; N139-F143 WeakPolarHBondContact O-CB 3.45Å; N139-F143 PolarHBondContact O-N 2.94Å
140A94.4Very high90Very high8 Ų830.1 Ų30.17%0.06615%0.148CC..Hα-helixtrans-62.5-47.4175.600000111.9F111 F136 F137 Q138 I142 F143 F144F111-A140 HydrophobicContact CE2-CB 3.94Å; F136-A140 WeakPolarHBondContact O-CB 3.48Å; F136-A140 PolarHBondContact O-N 2.97Å; F137-A140 PolarHBondContact O-N 2.9Å; Q138-A140 VanDerWaalsContact C-N 3.33Å; Q138-A140 PolarHBondContact O-N 3.38Å; A140-I142 PolarHBondContact O-N 3.31Å; A140-F143 WeakPolarHBondContact O-CB 3.38Å; A140-F143 PolarHBondContact O-N 3.44Å; A140-F144 HydrophobicContact CB-CE2 4.43Å; A140-F144 WeakPolarHBondContact O-CD2 3.2Å; A140-F144 PolarHBondContact O-N 3.29Å
141F94.4Very high90Very high55 Ų5535 Ų3524%0.24116%0.161CC..Hα-helixtrans-65.7-39.2180-73.4-53.8000112.5L34 I41 F137 Q138 F144 S145L34-F141 HydrophobicContact CD2-CD1 3.81Å; L34-F141 HydrophobicContact CD2-CE1 4.27Å; L34-F141 WeakPolarHBondContact O-CB 3.47Å; I41-F141 HydrophobicContact CD1-CD2 3.69Å; I41-F141 HydrophobicContact CD1-CE2 3.34Å; I41-F141 HydrophobicContact CD1-CZ 4.47Å; F137-F141 HydrophobicContact CB-CD2 4.22Å; F137-F141 HydrophobicContact CB-CE2 3.99Å; F137-F141 HydrophobicContact CD1-CE2 4.06Å; F137-F141 HydrophobicContact CD1-CZ 4.38Å; F137-F141 HydrophobicContact CG-CE2 4.38Å; F137-F141 WeakPolarHBondContact O-CB 3.28Å; F137-F141 WeakPolarHBondContact O-CD2 3.36Å; F137-F141 WeakPolarHBondContact O-CG 3.49Å; F137-F141 PolarHBondContact O-N 3.25Å; Q138-F141 PolarHBondContact O-N 3.46Å; F141-F144 PolarHBondContact O-N 3.02Å; F141-S145 WeakPolarHBondContact O-CB 3.47Å; F141-S145 PolarHBondContact O-N 3.43Å
142I93.9Very high89.7Confident0 Ų035.9 Ų35.90%017%0.171CC..Hα-helixtrans-69.7-36.4176.8-63.8172.1000110.9F35 S66 T67 F70 Q138 A140 S145 S146F35-I142 HydrophobicContact CD2-CG1 4.11Å; F35-I142 HydrophobicContact CD2-CG2 4.28Å; F35-I142 HydrophobicContact CE2-CG1 4.47Å; F35-I142 HydrophobicContact CE2-CG2 4.38Å; S66-I142 VanDerWaalsContact OG-CG2 3.3Å; S66-I142 WeakPolarHBondContact OG-CG2 3.28Å; T67-I142 HydrophobicContact CG2-CD1 3.54Å; T67-I142 HydrophobicContact CG2-CG2 4.28Å; F70-I142 HydrophobicContact CB-CG2 4.05Å; Q138-I142 HydrophobicContact CG-CD1 3.69Å; Q138-I142 VanDerWaalsContact O-CG1 3.28Å; Q138-I142 WeakPolarHBondContact O-CG1 3.48Å; Q138-I142 PolarHBondContact O-N 3.48Å; A140-I142 PolarHBondContact O-N 3.31Å; I142-S145 PolarHBondContact O-N 2.84Å; I142-S146 PolarHBondContact O-N 2.99Å
143F93.8Very high89.2Confident22 Ų2240.3 Ų40.310%0.09619%0.188CC..Hα-helixtrans-60.6-52.8171.9178.4-93.9000111.6M107 F108 N139 A140 S145 S146 L147M107-F143 HydrophobicContact CG-CD2 3.54Å; M107-F143 HydrophobicContact CG-CE2 4.09Å; M107-F143 HydrophobicContact SD-CD2 3.89Å; M107-F143 HydrophobicContact SD-CE2 4.4Å; F108-F143 AromaticContact CD1-CE2 3.86Å; F108-F143 HydrophobicContact CD1-CE2 3.86Å; F108-F143 HydrophobicContact CD1-CZ 4.36Å; F108-F143 AromaticContact CE1-CE2 3.52Å; F108-F143 HydrophobicContact CE1-CE2 3.52Å; F108-F143 AromaticContact CE1-CZ 3.65Å; F108-F143 HydrophobicContact CE1-CZ 3.65Å; F108-F143 HydrophobicContact CZ-CE2 4.08Å; F108-F143 HydrophobicContact CZ-CZ 4.2Å; N139-F143 WeakPolarHBondContact O-CB 3.45Å; N139-F143 PolarHBondContact O-N 2.94Å; A140-F143 WeakPolarHBondContact O-CB 3.38Å; A140-F143 PolarHBondContact O-N 3.44Å; F143-S145 VanDerWaalsContact C-N 3.33Å; F143-S145 PolarHBondContact O-N 3.02Å; F143-S146 PolarHBondContact O-N 3.32Å; F143-S146 PolarHBondContact O-OG 3.44Å; F143-L147 HydrophobicContact CD1-CD1 3.88Å; F143-L147 HydrophobicContact CE1-CD1 3.27Å; F143-L147 HydrophobicContact CE1-CG 4.19Å; F143-L147 HydrophobicContact CE2-CD1 4.49Å; F143-L147 HydrophobicContact CZ-CD1 3.62Å; F143-L147 HydrophobicContact CZ-CG 4.31Å; F143-L147 WeakPolarHBondContact O-CG 3.47Å; F143-L147 PolarHBondContact O-N 2.87Å; F143-L147 VanDerWaalsContact O-N 3.15Å
144F93.1Very high88.1Confident104 Ų10439.1 Ų39.146%0.45618%0.183SC..Hα-helixtrans-65.5-37.8178.5-70.8-60000112.4L34 A140 F141 S146 L147 I148L34-F144 HydrophobicContact CD1-CB 4.48Å; A140-F144 HydrophobicContact CB-CE2 4.43Å; A140-F144 WeakPolarHBondContact O-CD2 3.2Å; A140-F144 PolarHBondContact O-N 3.29Å; F141-F144 PolarHBondContact O-N 3.02Å; F144-S146 VanDerWaalsContact C-N 3.3Å; F144-S146 PolarHBondContact O-N 2.85Å; F144-L147 PolarHBondContact O-N 3.3Å; F144-I148 WeakPolarHBondContact O-CB 3.34Å; F144-I148 WeakPolarHBondContact O-CD1 3.38Å; F144-I148 VanDerWaalsContact O-CG1 3.25Å; F144-I148 WeakPolarHBondContact O-CG1 3.25Å; F144-I148 PolarHBondContact O-N 2.89Å
145S92.6Very high86.6Confident0 Ų040.7 Ų40.70%019%0.189CC..Hα-helixtrans-56.5-45173.6177.70000111.4A31 F70 F141 I142 F143 I148 Y149A31-S145 WeakPolarHBondContact CB-O 3.5Å; A31-S145 WeakPolarHBondContact O-CB 3.33Å; A31-S145 PolarHBondContact O-OG 3.48Å; F70-S145 WeakPolarHBondContact CE2-OG 3.35Å; F141-S145 WeakPolarHBondContact O-CB 3.47Å; F141-S145 PolarHBondContact O-N 3.43Å; I142-S145 PolarHBondContact O-N 2.84Å; F143-S145 VanDerWaalsContact C-N 3.33Å; F143-S145 PolarHBondContact O-N 3.02Å; S145-I148 PolarHBondContact O-N 3.16Å; S145-Y149 VanDerWaalsContact O-CB 3.32Å; S145-Y149 WeakPolarHBondContact O-CB 3.32Å; S145-Y149 PolarHBondContact O-N 3.16Å
146S91.3Very high84.6Confident0 Ų045 Ų450%021%0.211CC..Hα-helixtrans-64.9-42.9179.187.10000112.2N74 M107 I142 F143 F144 Y149 K150N74-S146 PolarHBondContact OD1-O 3.46Å; M107-S146 VanDerWaalsContact CE-OG 3.28Å; M107-S146 WeakPolarHBondContact CE-OG 3.23Å; M107-S146 PolarHBondContact SD-OG 3Å; I142-S146 PolarHBondContact O-N 2.99Å; F143-S146 PolarHBondContact O-N 3.32Å; F143-S146 PolarHBondContact O-OG 3.44Å; F144-S146 VanDerWaalsContact C-N 3.3Å; F144-S146 PolarHBondContact O-N 2.85Å; S146-Y149 PolarHBondContact O-N 3.46Å; S146-K150 WeakPolarHBondContact O-CB 3.46Å; S146-K150 PolarHBondContact O-N 2.92Å
147L89.6Confident82.4Confident42 Ų4246.7 Ų46.722%0.2222%0.222CC..Hα-helixtrans-66.3-43.8-180-64.6-179.3000110.8F104 F143 F144 K150 F151F104-L147 HydrophobicContact CE1-CD2 4.27Å; F143-L147 HydrophobicContact CD1-CD1 3.88Å; F143-L147 HydrophobicContact CE1-CD1 3.27Å; F143-L147 HydrophobicContact CE1-CG 4.19Å; F143-L147 HydrophobicContact CE2-CD1 4.49Å; F143-L147 HydrophobicContact CZ-CD1 3.62Å; F143-L147 HydrophobicContact CZ-CG 4.31Å; F143-L147 WeakPolarHBondContact O-CG 3.47Å; F143-L147 PolarHBondContact O-N 2.87Å; F143-L147 VanDerWaalsContact O-N 3.15Å; F144-L147 PolarHBondContact O-N 3.3Å; L147-K150 PolarHBondContact O-N 3.45Å; L147-F151 HydrophobicContact CB-CD2 4.25Å; L147-F151 HydrophobicContact CD2-CD2 4.17Å; L147-F151 HydrophobicContact CD2-CE2 3.72Å; L147-F151 WeakPolarHBondContact O-CB 3.48Å; L147-F151 WeakPolarHBondContact O-CD2 3.13Å; L147-F151 PolarHBondContact O-N 3.36Å
148I89.3Confident79.9Confident57 Ų5754.3 Ų54.329%0.29225%0.249SC..Hα-helixtrans-65.4-42.3178.5-69.4164.3000110.4V30 A31 L34 F144 S145 G152V30-I148 HydrophobicContact CB-CG2 4.34Å; V30-I148 HydrophobicContact CG1-CD1 4.14Å; V30-I148 HydrophobicContact CG1-CG2 4.13Å; A31-I148 HydrophobicContact CB-CG2 4.26Å; L34-I148 HydrophobicContact CD1-CD1 3.37Å; F144-I148 WeakPolarHBondContact O-CB 3.34Å; F144-I148 WeakPolarHBondContact O-CD1 3.38Å; F144-I148 VanDerWaalsContact O-CG1 3.25Å; F144-I148 WeakPolarHBondContact O-CG1 3.25Å; F144-I148 PolarHBondContact O-N 2.89Å; S145-I148 PolarHBondContact O-N 3.16Å; I148-G152 WeakPolarHBondContact O-CA 3.38Å; I148-G152 PolarHBondContact O-N 3.41Å
149Y87.6Confident77.4Confident79 Ų7960.1 Ų60.131%0.3131%0.309SS..Hα-helixtrans-66.1-43.6177-164.3-89000111.9A31 N74 S145 S146 R153A31-Y149 HydrophobicContact CB-CD2 3.84Å; A31-Y149 HydrophobicContact CB-CG 4.27Å; N74-Y149 HydrophobicContact CB-CD1 3.61Å; N74-Y149 HydrophobicContact CB-CE1 3.87Å; N74-Y149 VanDerWaalsContact OD1-CD1 3.22Å; N74-Y149 WeakPolarHBondContact OD1-CD1 3.48Å; S145-Y149 VanDerWaalsContact O-CB 3.32Å; S145-Y149 WeakPolarHBondContact O-CB 3.32Å; S145-Y149 PolarHBondContact O-N 3.16Å; S146-Y149 PolarHBondContact O-N 3.46Å; Y149-R153 WeakPolarHBondContact O-CB 3.25Å
150K85.6Confident76.5Confident10 Ų1063.2 Ų63.24%0.04332%0.324CS..Hα-helixtrans-71-47-176.9-174.662.7170-161.10113.2I73 N74 V76 N78 S146 L147I73-K150 HydrophobicContact CG2-CB 4.16Å; I73-K150 HydrophobicContact CG2-CD 4.01Å; I73-K150 HydrophobicContact CG2-CG 3.95Å; I73-K150 PolarHBondContact O-NZ 3.4Å; N74-K150 PolarHBondContact OD1-N 3.31Å; V76-K150 PolarHBondContact O-NZ 3.36Å; N78-K150 PolarHBondContact ND2-O 3.26Å; N78-K150 WeakPolarHBondContact OD1-CE 3.06Å; S146-K150 WeakPolarHBondContact O-CB 3.46Å; S146-K150 PolarHBondContact O-N 2.92Å; L147-K150 PolarHBondContact O-N 3.45Å
151F82.3Confident75.6Confident144 Ų14466.1 Ų66.163%0.63234%0.338SS*.Hα-helixtrans-96.1-26.1-174.7-64.3-64.8000113.7F104 L147 R153F104-F151 HydrophobicContact CZ-CZ 4.42Å; L147-F151 HydrophobicContact CB-CD2 4.25Å; L147-F151 HydrophobicContact CD2-CD2 4.17Å; L147-F151 HydrophobicContact CD2-CE2 3.72Å; L147-F151 WeakPolarHBondContact O-CB 3.48Å; L147-F151 WeakPolarHBondContact O-CD2 3.13Å; L147-F151 PolarHBondContact O-N 3.36Å; F151-R153 VanDerWaalsContact C-N 3.28Å
152G75.3Confident74.6Confident19 Ų1966.7 Ų66.720%0.19634%0.343CS..Hα-helixtrans-72.6-23.1176.300000112.8I148I148-G152 WeakPolarHBondContact O-CA 3.38Å; I148-G152 PolarHBondContact O-N 3.41Å
153R73.7Confident73.4Confident94 Ų9470.6 Ų70.636%0.35536%0.363SS..  trans-85.5115.2177.5-157177.480.4125.6-3.5111.2N24 Y149 F151 E155N24-R153 HydrophobicContact CB-CG 4.19Å; N24-R153 WeakPolarHBondContact OD1-CA 3.35Å; Y149-R153 WeakPolarHBondContact O-CB 3.25Å; F151-R153 VanDerWaalsContact C-N 3.28Å; R153-E155 IonicContact CZ-OE1 3.66Å; R153-E155 IonicContact NH2-OE1 2.65Å; R153-E155 PolarHBondContact NH2-OE1 3.4Å
154T63.1Low72.2Confident42 Ų4273.6 Ų73.626%0.25838%0.38SS..  trans-84113.4162.526.40000110.1R23 N24 N156R23-T154 PolarHBondContact NE-OG1 2.88Å; R23-T154 PolarHBondContact NH2-OG1 2.78Å; N24-T154 PolarHBondContact ND2-O 3.33Å; N24-T154 PolarHBondContact OD1-N 3.02Å; N24-T154 PolarHBondContact OD1-O 2.87Å; N24-T154 PolarHBondContact OD1-OG1 3.01Å; T154-N156 PolarHBondContact O-N 3.13Å
155E59.3Low70.8Confident43 Ų4371.6 Ų71.620%0.20138%0.375CS..  trans-74.2101.8161.6-71.6171.4-166.700106.4S77 N78 G79 R153 L157S77-E155 VanDerWaalsContact CA-OE1 3.23Å; S77-E155 WeakPolarHBondContact CA-OE1 3.16Å; S77-E155 WeakPolarHBondContact CB-OE1 3.26Å; S77-E155 VanDerWaalsContact OG-CD 3.28Å; S77-E155 PolarHBondContact OG-OE1 3.46Å; S77-E155 PolarHBondContact OG-OE2 3.47Å; N78-E155 WeakPolarHBondContact CA-OE2 3.43Å; N78-E155 VanDerWaalsContact N-CD 3.27Å; N78-E155 PolarHBondContact N-OE1 3.32Å; N78-E155 PolarHBondContact N-OE2 3.44Å; G79-E155 PolarHBondContact N-OE2 3.1Å; R153-E155 IonicContact CZ-OE1 3.66Å; R153-E155 IonicContact NH2-OE1 2.65Å; R153-E155 PolarHBondContact NH2-OE1 3.4Å; E155-L157 PolarHBondContact O-N 2.89Å
156N47.1Very low69.2Low89 Ų8976.7 Ų76.748%0.47640%0.401SS..  trans-61.6107.9163.8-70.3-20.6000105.7T154 W158T154-N156 PolarHBondContact O-N 3.13Å; N156-W158 PolarHBondContact O-N 2.88Å
157L45.5Very low67.5Low82 Ų8282.6 Ų82.643%0.42943%0.432SS..  trans-67.390.1166.7-8695.4000106.9D84 E155 G159D84-L157 HydrophobicContact CB-CD2 3.75Å; D84-L157 WeakPolarHBondContact OD2-CD2 3.42Å; E155-L157 PolarHBondContact O-N 2.89Å; L157-G159 VanDerWaalsContact C-N 3.27Å; L157-G159 PolarHBondContact O-N 3.01Å
158W40.5Very low65.7Low251 Ų25186 Ų8695%0.95145%0.45SS*.  trans-81.589.6151.8-84.291.5000106.6N156N156-W158 PolarHBondContact O-N 2.88Å
159G38.7Very low63.5Low122 Ų12288.6 Ų88.6100%1.25846%0.464SS*.  trans156.40-177.700000110.7L157L157-G159 VanDerWaalsContact C-N 3.27Å; L157-G159 PolarHBondContact O-N 3.01Å

Retrieved 159 of 159 residues in 497.9 ms (Link to these results)