A0A093KD69_STRCA Loading...

G1/S-specific cyclin-D1

AlphaFold DB , UniProt , Accession A0A093KD69, Species STRCA (Struthio camelus australis), Gene n/a, Length 292 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
1M38.8Very low46.5Very low222 Ų222157.3 Ų157.3100%1.09481%0.806SS**  083.30-90.6-174.1-76.700107.2
2E33.2Very low47.2Very low190 Ų190151.7 Ų151.789%0.88879%0.785SS**  trans-90.5111.9167.8-77-179.715800106.8Q4E2-Q4 PolarHBondContact O-N 2.64Å
3H44.6Very low48.3Very low165 Ų165147.5 Ų147.576%0.76476%0.763SS**  trans-78.891.7173.1-74.2-85.2000108.3L5H3-L5 PolarHBondContact O-N 3.4Å
4Q48.8Very low49.4Very low165 Ų165153.7 Ų153.777%0.77177%0.772SS**  trans-72.2104.5159.8-88.2-179.4-10.200108.2E2 L6E2-Q4 PolarHBondContact O-N 2.64Å; Q4-L6 VanDerWaalsContact C-N 3.35Å; Q4-L6 PolarHBondContact O-N 2.93Å
5L46.6Very low50.8Low165 Ų165156 Ų15686%0.86477%0.768SS**  trans-67.994.2165.5-75.2159.3000108H3 C7H3-L5 PolarHBondContact O-N 3.4Å; L5-C7 PolarHBondContact O-N 2.95Å
6L49.8Very low52.1Low137 Ų137152.3 Ų152.372%0.71777%0.77SS**  trans-78.1104.5167.6-74.8156.1000107.8Q4 C8Q4-L6 VanDerWaalsContact C-N 3.35Å; Q4-L6 PolarHBondContact O-N 2.93Å; L6-C8 PolarHBondContact O-N 3.02Å
7C47.1Very low53.1Low126 Ų126155.1 Ų155.185%0.85177%0.77SS**  trans-67.782.6162.8-63.40000108.4L5L5-C7 PolarHBondContact O-N 2.95Å
8C45.5Very low54.1Low72 Ų72153.4 Ų153.449%0.48676%0.764SS.*  trans-81.7113168.5-66.30000108.3L6 V10 T12L6-C8 PolarHBondContact O-N 3.02Å; C8-V10 PolarHBondContact O-N 3.34Å; C8-V10 VanDerWaalsContact O-N 3.1Å; C8-T12 HydrophobicContact CB-CG2 4.42Å
9E53.3Low55.3Low204 Ų204148.3 Ų148.395%0.95374%0.74SS**SBendtrans-68.76.7170.9-68.6-177.9155.500113.3
10V51.7Low56.2Low110 Ų110144.3 Ų144.367%0.66773%0.73SS**SBendtrans-111.3128.3173.6-173.60000106.5C8 T12C8-V10 PolarHBondContact O-N 3.34Å; C8-V10 VanDerWaalsContact O-N 3.1Å; V10-T12 PolarHBondContact O-N 3.11Å
11E52.3Low57.2Low174 Ų174142.4 Ų142.481%0.81372%0.722SS**  trans-56.191.6166.3-77.3-175.5160.800108.1I13E11-I13 PolarHBondContact O-N 3.03Å
12T55.2Low58.8Low90 Ų90136.7 Ų136.755%0.55270%0.696SS**  trans-70.4115.1172.635.20000105.8C8 V10 R14C8-T12 HydrophobicContact CB-CG2 4.42Å; V10-T12 PolarHBondContact O-N 3.11Å; T12-R14 PolarHBondContact O-N 3.48Å
13I60.8Low60.6Low97 Ų97129.1 Ų129.150%0.49766%0.661SS.*  trans-52.6111173-61.8172000106.5E11 R15E11-I13 PolarHBondContact O-N 3.03Å; I13-R15 HydrophobicContact CG2-CG 4.36Å; I13-R15 PolarHBondContact O-N 2.8Å
14R64Low62.4Low235 Ų235124.9 Ų124.989%0.88764%0.644SS**  trans-72.897.7-178.3-72.5-173.5179.9179.11.5108.1T12T12-R14 PolarHBondContact O-N 3.48Å
15R69.8Low64.1Low188 Ų188121.7 Ų121.771%0.70963%0.633SS**PPolyproline II helixtrans-81.4140.4173-65.4-171.4173.3134.7-1.3110I13 E74I13-R15 HydrophobicContact CG2-CG 4.36Å; I13-R15 PolarHBondContact O-N 2.8Å; R15-E74 IonicContact NH2-OE2 3.59Å
16A71.6Confident66.1Low97 Ų97122.6 Ų122.680%0.80263%0.625SS**PPolyproline II helixtrans-61.6148.1168.800000109.7
17Y70.6Confident68Low199 Ų199117.5 Ų117.578%0.7860%0.599SS**PPolyproline II helixtrans-66.7153.5171.660.8-92.3000110D19Y17-D19 PolarHBondContact O-N 2.94Å; Y17-D19 VanDerWaalsContact O-N 3.15Å
18L69.6Low70Confident126 Ų126112.1 Ų112.166%0.6656%0.562SS**  trans-62.6115.8176.1-165.986.2000109.7A20 L23L18-A20 PolarHBondContact O-N 2.93Å; L18-L23 HydrophobicContact CD1-CD1 4.24Å; L18-L23 HydrophobicContact CD2-CD1 3.45Å; L18-L23 VanDerWaalsContact CD2-CD1 3.45Å; L18-L23 HydrophobicContact CG-CD1 3.75Å
19D77.5Confident72.2Confident56 Ų56113.1 Ų113.130%0.29956%0.559SS.*  trans-85.4107.3173.7-175.9-3.6000109.5Y17 N21 L22Y17-D19 PolarHBondContact O-N 2.94Å; Y17-D19 VanDerWaalsContact O-N 3.15Å; D19-N21 PolarHBondContact O-N 2.97Å; D19-N21 VanDerWaalsContact O-N 3.08Å; D19-N21 VanDerWaalsContact OD1-CB 3.27Å; D19-N21 WeakPolarHBondContact OD1-CB 3.24Å; D19-N21 PolarHBondContact OD1-N 3.45Å; D19-N21 PolarHBondContact OD1-ND2 2.94Å; D19-L22 HydrophobicContact CB-CB 4.41Å; D19-L22 HydrophobicContact CB-CD1 3.86Å; D19-L22 HydrophobicContact CB-CG 3.85Å; D19-L22 WeakPolarHBondContact O-CB 3.47Å; D19-L22 PolarHBondContact O-N 2.94Å
20A74.3Confident74Confident67 Ų67107.5 Ų107.555%0.55454%0.539SS*.G310 helixtrans-56.2-25.8177.900000113L18 L22 L23L18-A20 PolarHBondContact O-N 2.93Å; A20-L22 VanDerWaalsContact C-N 3.25Å; A20-L22 PolarHBondContact O-N 2.74Å; A20-L23 PolarHBondContact O-N 3.21Å
21N75.5Confident75.9Confident105 Ų105103.2 Ų103.256%0.56151%0.512SS*.G310 helixtrans-69.3-25.6176.7-61.7-60.9000112.8D19 L23 N24 V27D19-N21 PolarHBondContact O-N 2.97Å; D19-N21 VanDerWaalsContact O-N 3.08Å; D19-N21 VanDerWaalsContact OD1-CB 3.27Å; D19-N21 WeakPolarHBondContact OD1-CB 3.24Å; D19-N21 PolarHBondContact OD1-N 3.45Å; D19-N21 PolarHBondContact OD1-ND2 2.94Å; N21-L23 PolarHBondContact O-N 3.23Å; N21-N24 PolarHBondContact O-ND2 2.98Å; N21-N24 VanDerWaalsContact O-ND2 3.1Å; N21-V27 WeakPolarHBondContact O-CG2 3.47Å
22L72.9Confident77.9Confident103 Ų10395.8 Ų95.854%0.53948%0.477SS..G310 helixtrans-77.1-8.6176.2-61.1-179.1000113D19 A20 V27D19-L22 HydrophobicContact CB-CB 4.41Å; D19-L22 HydrophobicContact CB-CD1 3.86Å; D19-L22 HydrophobicContact CB-CG 3.85Å; D19-L22 WeakPolarHBondContact O-CB 3.47Å; D19-L22 PolarHBondContact O-N 2.94Å; A20-L22 VanDerWaalsContact C-N 3.25Å; A20-L22 PolarHBondContact O-N 2.74Å; L22-V27 WeakPolarHBondContact O-CB 3.37Å; L22-V27 VanDerWaalsContact O-CG1 3.24Å; L22-V27 WeakPolarHBondContact O-CG1 3.38Å
23L71.7Confident79.6Confident31 Ų3198.1 Ų98.116%0.16248%0.48CS..G310 helixtrans-102.49-175.2-57170.2000113.2L18 A20 N21 T166 K167L18-L23 HydrophobicContact CD1-CD1 4.24Å; L18-L23 HydrophobicContact CD2-CD1 3.45Å; L18-L23 VanDerWaalsContact CD2-CD1 3.45Å; L18-L23 HydrophobicContact CG-CD1 3.75Å; A20-L23 PolarHBondContact O-N 3.21Å; N21-L23 PolarHBondContact O-N 3.23Å; L23-T166 HydrophobicContact CB-CG2 4.34Å; L23-T166 HydrophobicContact CD1-CG2 3.54Å; L23-T166 HydrophobicContact CD2-CG2 4.01Å; L23-T166 HydrophobicContact CG-CG2 4.15Å; L23-K167 WeakPolarHBondContact O-CE 3.19Å; L23-K167 PolarHBondContact O-NZ 3.43Å
24N82.5Confident81.1Confident75 Ų7594.9 Ų94.940%0.40147%0.468SS..SBendtrans-81.7154.4179.2-69.7-45000112N21 R26 V27 L28N21-N24 PolarHBondContact O-ND2 2.98Å; N21-N24 VanDerWaalsContact O-ND2 3.1Å; N24-R26 PolarHBondContact O-N 2.9Å; N24-R26 VanDerWaalsContact O-N 3.12Å; N24-V27 WeakPolarHBondContact O-CB 3.45Å; N24-V27 PolarHBondContact O-N 2.73Å; N24-L28 PolarHBondContact O-N 2.78Å
25D83.6Confident82.5Confident99 Ų9984.3 Ų84.353%0.52943%0.429SS..Hα-helixtrans-61.9-26.6-178.7-57.2-11.7000112.4V27 L28 Q29 K167D25-V27 VanDerWaalsContact C-N 3.29Å; D25-V27 PolarHBondContact O-N 3.22Å; D25-L28 PolarHBondContact O-N 3.3Å; D25-Q29 WeakPolarHBondContact O-CG 3.2Å; D25-Q29 PolarHBondContact O-N 3.2Å; D25-K167 IonicContact OD1-NZ 3.61Å; D25-K167 PolarHBondContact OD1-NZ 3.14Å
26R88.6Confident83.5Confident184 Ų18482.1 Ų82.169%0.69443%0.426SS*.Hα-helixtrans-60.4-39.1171.9-176.4-178.967138.30.8112.1N24 Q29 T30N24-R26 PolarHBondContact O-N 2.9Å; N24-R26 VanDerWaalsContact O-N 3.12Å; R26-Q29 PolarHBondContact O-N 2.99Å; R26-T30 PolarHBondContact O-N 3.16Å; R26-T30 VanDerWaalsContact O-N 3.13Å; R26-T30 PolarHBondContact O-OG1 3.22Å
27V89.7Confident84.3Confident29 Ų2981.9 Ų81.918%0.17642%0.415CS..Hα-helixtrans-72-44.3-179179.60000109.6N21 L22 N24 D25 Q29 T30 M31N21-V27 WeakPolarHBondContact O-CG2 3.47Å; L22-V27 WeakPolarHBondContact O-CB 3.37Å; L22-V27 VanDerWaalsContact O-CG1 3.24Å; L22-V27 WeakPolarHBondContact O-CG1 3.38Å; N24-V27 WeakPolarHBondContact O-CB 3.45Å; N24-V27 PolarHBondContact O-N 2.73Å; D25-V27 VanDerWaalsContact C-N 3.29Å; D25-V27 PolarHBondContact O-N 3.22Å; V27-Q29 VanDerWaalsContact C-N 3.3Å; V27-Q29 PolarHBondContact O-N 2.88Å; V27-T30 CarbonylContact O-C 3.54Å; V27-T30 WeakPolarHBondContact O-CA 3.49Å; V27-T30 WeakPolarHBondContact O-CB 3.5Å; V27-T30 PolarHBondContact O-N 2.99Å; V27-M31 HydrophobicContact CG1-CG 4.33Å; V27-M31 HydrophobicContact CG1-SD 4.07Å; V27-M31 VanDerWaalsContact O-CG 3.31Å; V27-M31 WeakPolarHBondContact O-CG 3.4Å; V27-M31 PolarHBondContact O-N 2.91Å
28L90.1Very high85.2Confident13 Ų1372.6 Ų72.67%0.06838%0.379CS..Hα-helixtrans-54.5-45.8171.6178.865.1000112.3N24 D25 T30 M31 L32 F160 V236N24-L28 PolarHBondContact O-N 2.78Å; D25-L28 PolarHBondContact O-N 3.3Å; L28-T30 PolarHBondContact O-N 2.91Å; L28-M31 WeakPolarHBondContact O-CB 3.41Å; L28-M31 PolarHBondContact O-N 3.36Å; L28-L32 HydrophobicContact CD1-CG 4.39Å; L28-L32 HydrophobicContact CG-CD1 4.22Å; L28-L32 WeakPolarHBondContact O-CG 3.39Å; L28-L32 PolarHBondContact O-N 3.18Å; L28-F160 HydrophobicContact CD1-CD1 3.94Å; L28-F160 HydrophobicContact CD1-CE1 3.92Å; L28-V236 HydrophobicContact CD2-CG1 3.41Å; L28-V236 VanDerWaalsContact CD2-CG1 3.41Å
29Q90.1Very high86.1Confident93 Ų9369.7 Ų69.744%0.43537%0.369SS..Hα-helixtrans-62.1-29.9175.8-71.9179.212.300113.1D25 R26 V27 K33D25-Q29 WeakPolarHBondContact O-CG 3.2Å; D25-Q29 PolarHBondContact O-N 3.2Å; R26-Q29 PolarHBondContact O-N 2.99Å; V27-Q29 VanDerWaalsContact C-N 3.3Å; V27-Q29 PolarHBondContact O-N 2.88Å; Q29-K33 VanDerWaalsContact O-CG 3.32Å; Q29-K33 WeakPolarHBondContact O-CG 3.01Å; Q29-K33 PolarHBondContact O-N 2.85Å
30T91.5Very high86.8Confident86 Ų8668.3 Ų68.353%0.52836%0.364SS..Hα-helixtrans-75.7-40.6176.4-54.60000110.5R26 V27 L28 K33 A34R26-T30 PolarHBondContact O-N 3.16Å; R26-T30 VanDerWaalsContact O-N 3.13Å; R26-T30 PolarHBondContact O-OG1 3.22Å; V27-T30 CarbonylContact O-C 3.54Å; V27-T30 WeakPolarHBondContact O-CA 3.49Å; V27-T30 WeakPolarHBondContact O-CB 3.5Å; V27-T30 PolarHBondContact O-N 2.99Å; L28-T30 PolarHBondContact O-N 2.91Å; T30-K33 PolarHBondContact O-N 3.41Å; T30-A34 WeakPolarHBondContact O-CB 3.44Å; T30-A34 PolarHBondContact O-N 3.26Å
31M92.7Very high87.6Confident20 Ų2067.5 Ų67.510%0.09935%0.354CS..Hα-helixtrans-60-47.1173.6-64.6164.170.100111.2V27 L28 K33 A34 E35 M155 D159 F160V27-M31 HydrophobicContact CG1-CG 4.33Å; V27-M31 HydrophobicContact CG1-SD 4.07Å; V27-M31 VanDerWaalsContact O-CG 3.31Å; V27-M31 WeakPolarHBondContact O-CG 3.4Å; V27-M31 PolarHBondContact O-N 2.91Å; L28-M31 WeakPolarHBondContact O-CB 3.41Å; L28-M31 PolarHBondContact O-N 3.36Å; M31-K33 VanDerWaalsContact C-N 3.31Å; M31-K33 PolarHBondContact O-N 3.41Å; M31-A34 WeakPolarHBondContact O-CB 3.47Å; M31-A34 PolarHBondContact O-N 3.32Å; M31-A34 VanDerWaalsContact O-N 3.08Å; M31-E35 PolarHBondContact O-N 3.49Å; M31-M155 HydrophobicContact CB-CE 3.8Å; M31-M155 HydrophobicContact CB-CG 4.48Å; M31-M155 HydrophobicContact CB-SD 4.19Å; M31-M155 HydrophobicContact CE-CE 3.54Å; M31-M155 HydrophobicContact CG-CE 3.56Å; M31-M155 HydrophobicContact CG-SD 4.15Å; M31-M155 WeakPolarHBondContact O-CG 3.32Å; M31-M155 HydrophobicContact SD-CE 4.34Å; M31-D159 HydrophobicContact CE-CB 3.8Å; M31-D159 VanDerWaalsContact CE-O 3.31Å; M31-D159 WeakPolarHBondContact CE-O 3.37Å; M31-F160 HydrophobicContact CB-CE1 3.88Å; M31-F160 HydrophobicContact CB-CZ 3.86Å; M31-F160 HydrophobicContact CE-CD1 4Å; M31-F160 HydrophobicContact CE-CE1 4.14Å; M31-F160 HydrophobicContact CE-CG 4.24Å
32L93.1Very high88.3Confident18 Ų1867 Ų679%0.09436%0.355CS..Hα-helixtrans-61-37.9176.9-69.3171.9000112.3L28 E35 F160L28-L32 HydrophobicContact CD1-CG 4.39Å; L28-L32 HydrophobicContact CG-CD1 4.22Å; L28-L32 WeakPolarHBondContact O-CG 3.39Å; L28-L32 PolarHBondContact O-N 3.18Å; L32-E35 WeakPolarHBondContact CD2-OE1 3.42Å; L32-E35 WeakPolarHBondContact O-CG 3.35Å; L32-F160 HydrophobicContact CD2-CE1 3.72Å; L32-F160 HydrophobicContact CD2-CZ 4.11Å; L32-F160 HydrophobicContact CG-CE1 4.14Å
33K92Very high89.2Confident140 Ų14064.9 Ų64.961%0.60935%0.348SS*.Hα-helixtrans-70.6-35.2173.3-72.5174.8-179.4-1790112.5Q29 T30 M31Q29-K33 VanDerWaalsContact O-CG 3.32Å; Q29-K33 WeakPolarHBondContact O-CG 3.01Å; Q29-K33 PolarHBondContact O-N 2.85Å; T30-K33 PolarHBondContact O-N 3.41Å; M31-K33 VanDerWaalsContact C-N 3.31Å; M31-K33 PolarHBondContact O-N 3.41Å
34A92.1Very high90.3Very high29 Ų2963.4 Ų63.424%0.2434%0.34CS..Hα-helixtrans-69.2-37.5-17900000111.9T30 M31 E36 T37 M155T30-A34 WeakPolarHBondContact O-CB 3.44Å; T30-A34 PolarHBondContact O-N 3.26Å; M31-A34 WeakPolarHBondContact O-CB 3.47Å; M31-A34 PolarHBondContact O-N 3.32Å; M31-A34 VanDerWaalsContact O-N 3.08Å; A34-E36 VanDerWaalsContact C-N 3.3Å; A34-E36 PolarHBondContact O-N 3.13Å; A34-T37 PolarHBondContact O-N 3.29Å; A34-T37 PolarHBondContact O-OG1 2.99Å; A34-M155 HydrophobicContact CB-CG 3.76Å; A34-M155 HydrophobicContact CB-SD 4.15Å
35E93.5Very high90.9Very high13 Ų1361.8 Ų61.86%0.06133%0.33CS..Hα-helixtrans-63-34177.461.9173.6-167.400113.3M31 L32 T37 C38 S39 M155 F160 P200 S201M31-E35 PolarHBondContact O-N 3.49Å; L32-E35 WeakPolarHBondContact CD2-OE1 3.42Å; L32-E35 WeakPolarHBondContact O-CG 3.35Å; E35-T37 PolarHBondContact O-N 3.17Å; E35-C38 CarbonylContact O-C 3.56Å; E35-C38 PolarHBondContact O-N 3.32Å; E35-C38 VanDerWaalsContact O-N 3.13Å; E35-S39 PolarHBondContact O-N 2.92Å; E35-S39 PolarHBondContact O-OG 3.22Å; E35-M155 HydrophobicContact CB-CB 4.14Å; E35-M155 HydrophobicContact CB-CG 4.37Å; E35-F160 HydrophobicContact CG-CZ 4.45Å; E35-F160 WeakPolarHBondContact OE2-CE2 3.33Å; E35-F160 WeakPolarHBondContact OE2-CZ 3.37Å; E35-P200 HydrophobicContact CB-CG 4.25Å; E35-P200 WeakPolarHBondContact OE2-CD 3.32Å; E35-S201 VanDerWaalsContact CD-OG 3.29Å; E35-S201 WeakPolarHBondContact OE1-CB 3.34Å; E35-S201 PolarHBondContact OE1-OG 3.43Å; E35-S201 VanDerWaalsContact OE2-CB 3.25Å; E35-S201 WeakPolarHBondContact OE2-CB 3.27Å; E35-S201 PolarHBondContact OE2-N 3.38Å; E35-S201 PolarHBondContact OE2-OG 3.36Å
36E89.4Confident91.4Very high142 Ų14266.1 Ų66.166%0.66434%0.344SS*.Hα-helixtrans-60.1-35.4176.1-67.4175.9-173.700111.6A34 C38A34-E36 VanDerWaalsContact C-N 3.3Å; A34-E36 PolarHBondContact O-N 3.13Å; E36-C38 VanDerWaalsContact C-N 3.26Å; E36-C38 PolarHBondContact O-N 3.28Å
37T89.9Confident91.7Very high91 Ų9161.6 Ų61.656%0.55834%0.34SS*.Hα-helixtrans-73.1-18.9-179.472.40000113.8A34 E35A34-T37 PolarHBondContact O-N 3.29Å; A34-T37 PolarHBondContact O-OG1 2.99Å; E35-T37 PolarHBondContact O-N 3.17Å
38C88.5Confident92Very high4 Ų461.9 Ų61.93%0.02734%0.341CS..THydrogen-bonded Turntrans-114.520.7-175.9-69.70000112.4E35 E36 N83 R87 N151 A154E35-C38 CarbonylContact O-C 3.56Å; E35-C38 PolarHBondContact O-N 3.32Å; E35-C38 VanDerWaalsContact O-N 3.13Å; E36-C38 VanDerWaalsContact C-N 3.26Å; E36-C38 PolarHBondContact O-N 3.28Å; C38-N83 PolarHBondContact O-ND2 2.81Å; C38-R87 WeakPolarHBondContact O-CD 3.48Å; C38-N151 PolarHBondContact SG-ND2 2.8Å; C38-A154 HydrophobicContact CB-CB 3.7Å
39S89.8Confident92.3Very high65 Ų6561.7 Ų61.746%0.45534%0.34SS..PPolyproline II helixtrans-81.3129.2179.3-68.70000111.7E35E35-S39 PolarHBondContact O-N 2.92Å; E35-S39 PolarHBondContact O-OG 3.22Å
40P91.9Very high92.6Very high28 Ų2866.3 Ų66.318%0.18236%0.359CS..PPolyproline II helixtrans-74.2164.2173.532.2-35.2000112D86 R87 I196P40-D86 HydrophobicContact CB-CB 3.71Å; P40-D86 HydrophobicContact CG-CB 3.98Å; P40-R87 HydrophobicContact CB-CG 4.3Å; P40-I196 HydrophobicContact CB-CG2 4.37Å; P40-I196 HydrophobicContact CG-CG2 3.86Å
41S91.3Very high92.8Very high50 Ų5066.3 Ų66.335%0.3535%0.353SS..PPolyproline II helixtrans-81.3118.9175.4177.50000111.1S43 Y44 S90S41-S43 PolarHBondContact O-N 3.23Å; S41-Y44 WeakPolarHBondContact O-CD1 3.49Å; S41-Y44 PolarHBondContact O-N 3.16Å; S41-Y44 VanDerWaalsContact O-N 3.16Å; S41-S90 PolarHBondContact N-OG 3.27Å
42V89.3Confident93Very high95 Ų9565.5 Ų65.558%0.57635%0.348SS*.THydrogen-bonded Turntrans-57.2-29.1-178.7-173.60000113
43S92.1Very high93.2Very high57 Ų5768.7 Ų68.740%0.39937%0.365SS..THydrogen-bonded Turntrans-101.819-176660000114.1S41 F45 K46 C47S41-S43 PolarHBondContact O-N 3.23Å; S43-F45 PolarHBondContact O-N 2.84Å; S43-K46 PolarHBondContact O-N 3.23Å; S43-C47 WeakPolarHBondContact O-CB 3.32Å; S43-C47 PolarHBondContact O-N 3.48Å; S43-C47 PolarHBondContact OG-SG 3.04Å; S43-C47 VanDerWaalsContact OG-SG 3.4Å
44Y94.9Very high93.4Very high0 Ų064.6 Ų64.60%035%0.353CS..Hα-helixtrans-60-31.6-176.272.4-116.8000113.3S41 K46 V48 Q49 R57 D86 L89 S90 I196S41-Y44 WeakPolarHBondContact O-CD1 3.49Å; S41-Y44 PolarHBondContact O-N 3.16Å; S41-Y44 VanDerWaalsContact O-N 3.16Å; Y44-K46 PolarHBondContact O-N 3.44Å; Y44-V48 WeakPolarHBondContact O-CB 3.29Å; Y44-V48 PolarHBondContact O-N 2.76Å; Y44-Q49 HydrophobicContact CD2-CG 3.82Å; Y44-Q49 HydrophobicContact CE2-CG 4.37Å; Y44-Q49 PolarHBondContact O-N 2.94Å; Y44-R57 WeakPolarHBondContact OH-CD 3.21Å; Y44-D86 HydrophobicContact CE1-CB 4.07Å; Y44-D86 PolarHBondContact OH-OD1 2.9Å; Y44-L89 HydrophobicContact CD2-CB 3.87Å; Y44-L89 HydrophobicContact CE2-CB 3.79Å; Y44-L89 HydrophobicContact CE2-CD1 3.91Å; Y44-L89 HydrophobicContact CG-CB 4.34Å; Y44-S90 WeakPolarHBondContact CD1-OG 3.47Å; Y44-I196 HydrophobicContact CE1-CD1 4.03Å; Y44-I196 HydrophobicContact CE1-CG2 4.07Å
45F94.5Very high93.5Very high42 Ų4269.4 Ų69.418%0.18437%0.366CS..Hα-helixtrans-62.2-30.3175.5-74.6-69.9000113.3S43 I52 L53 P54 R57 V193 I196S43-F45 PolarHBondContact O-N 2.84Å; F45-I52 WeakPolarHBondContact CD1-O 3.33Å; F45-I52 HydrophobicContact CE1-CG2 4.14Å; F45-L53 VanDerWaalsContact CE1-C 3.48Å; F45-P54 HydrophobicContact CD1-CG 4.2Å; F45-P54 HydrophobicContact CD2-CG 4.25Å; F45-P54 HydrophobicContact CE1-CG 4.24Å; F45-P54 HydrophobicContact CE2-CG 4.29Å; F45-P54 HydrophobicContact CG-CG 4.2Å; F45-P54 HydrophobicContact CZ-CB 4.43Å; F45-P54 HydrophobicContact CZ-CG 4.29Å; F45-R57 HydrophobicContact CZ-CB 3.94Å; F45-R57 HydrophobicContact CZ-CG 4.45Å; F45-V193 HydrophobicContact CE2-CG1 4.02Å; F45-V193 HydrophobicContact CZ-CG1 4.28Å; F45-I196 HydrophobicContact CE2-CD1 3.95Å
46K93.4Very high93.7Very high189 Ų18970 Ų7082%0.82237%0.369SS*.Hα-helixtrans-93.5-38.3-179.2-175.4179.9178.4-177.70111.9S43 Y44S43-K46 PolarHBondContact O-N 3.23Å; Y44-K46 PolarHBondContact O-N 3.44Å
47C95.2Very high94Very high90 Ų9063.4 Ų63.461%0.60834%0.338SS*.Hα-helixtrans-95.8-26.3-168.1-62.60000113.7S43S43-C47 WeakPolarHBondContact O-CB 3.32Å; S43-C47 PolarHBondContact O-N 3.48Å; S43-C47 PolarHBondContact OG-SG 3.04Å; S43-C47 VanDerWaalsContact OG-SG 3.4Å
48V96.6Very high94.3Very high34 Ų3462 Ų6221%0.20632%0.324CS..THydrogen-bonded Turntrans-122.7-52.1-171.1-175.90000111Y44 L89Y44-V48 WeakPolarHBondContact O-CB 3.29Å; Y44-V48 PolarHBondContact O-N 2.76Å; V48-L89 WeakPolarHBondContact CG1-O 3.47Å
49Q97.3Very high94.7Very high10 Ų1067.4 Ų67.45%0.04735%0.35CS..  trans-77.5136.3-175.8-58.1-54.4-4200111.6Y44 I52 L89 E92Y44-Q49 HydrophobicContact CD2-CG 3.82Å; Y44-Q49 HydrophobicContact CE2-CG 4.37Å; Y44-Q49 PolarHBondContact O-N 2.94Å; Q49-I52 HydrophobicContact CB-CB 4.09Å; Q49-I52 HydrophobicContact CG-CB 4.18Å; Q49-I52 HydrophobicContact CG-CG1 4.5Å; Q49-L89 HydrophobicContact CG-CB 4.46Å; Q49-L89 PolarHBondContact NE2-O 3.45Å; Q49-E92 PolarHBondContact NE2-O 3.16Å
50K95.5Very high95Very high190 Ų19065.1 Ų65.183%0.82633%0.334SS*.SBendtrans-108.8-35.7177.5-61.7-178.9-177.81780112.6
51E96.3Very high95.3Very high86 Ų8663.8 Ų63.840%0.40233%0.325SS..SBendtrans-108-29-177.9-66.3-177-159.900113.2K95 K96E51-K95 WeakPolarHBondContact OE2-CA 3.2Å; E51-K96 HydrophobicContact CB-CB 4.44Å; E51-K96 PolarHBondContact OE2-N 3.29Å
52I97.1Very high95.6Very high2 Ų263.7 Ų63.71%0.0132%0.322CS..  trans-79.1125.2-175.9-48.6-55.3000109.4F45 Q49 L89 L94 K96 L99F45-I52 WeakPolarHBondContact CD1-O 3.33Å; F45-I52 HydrophobicContact CE1-CG2 4.14Å; Q49-I52 HydrophobicContact CB-CB 4.09Å; Q49-I52 HydrophobicContact CG-CB 4.18Å; Q49-I52 HydrophobicContact CG-CG1 4.5Å; I52-L89 HydrophobicContact CG1-CD2 4.49Å; I52-L94 HydrophobicContact CD1-CB 4.49Å; I52-L94 HydrophobicContact CG1-CB 4.24Å; I52-L94 WeakPolarHBondContact CG1-O 3.46Å; I52-K96 HydrophobicContact CD1-CB 4.21Å; I52-L99 HydrophobicContact CD1-CB 4.28Å; I52-L99 HydrophobicContact CD1-CD1 4.28Å; I52-L99 HydrophobicContact CD1-CD2 4.4Å; I52-L99 HydrophobicContact CG2-CD1 4.19Å; I52-L99 HydrophobicContact CG2-CD2 4.11Å
53L96.3Very high96Very high85 Ų8560.9 Ų60.945%0.44530%0.301SS..  trans-111.9156.3178.5-65.8173000111F45 Y55 M56 R57F45-L53 VanDerWaalsContact CE1-C 3.48Å; L53-Y55 VanDerWaalsContact C-N 3.27Å; L53-Y55 HydrophobicContact CB-CD1 3.72Å; L53-Y55 HydrophobicContact CB-CE1 3.64Å; L53-Y55 HydrophobicContact CD1-CD1 4.37Å; L53-Y55 HydrophobicContact CD1-CE1 3.61Å; L53-Y55 HydrophobicContact CG-CE1 4.26Å; L53-Y55 PolarHBondContact O-N 3.26Å; L53-Y55 VanDerWaalsContact O-N 3.16Å; L53-M56 HydrophobicContact CB-CG 4.38Å; L53-M56 HydrophobicContact CD1-CE 4.4Å; L53-M56 WeakPolarHBondContact O-CB 3.43Å; L53-M56 PolarHBondContact O-N 3.47Å; L53-R57 PolarHBondContact O-N 2.95Å
54P95.7Very high96.3Very high55 Ų5558.1 Ų58.136%0.35728%0.282SS..Hα-helixtrans-48.6-42.3179.9-3539.6000115F45 M56 R57 K58 V193F45-P54 HydrophobicContact CD1-CG 4.2Å; F45-P54 HydrophobicContact CD2-CG 4.25Å; F45-P54 HydrophobicContact CE1-CG 4.24Å; F45-P54 HydrophobicContact CE2-CG 4.29Å; F45-P54 HydrophobicContact CG-CG 4.2Å; F45-P54 HydrophobicContact CZ-CB 4.43Å; F45-P54 HydrophobicContact CZ-CG 4.29Å; P54-M56 VanDerWaalsContact C-N 3.32Å; P54-M56 PolarHBondContact O-N 2.89Å; P54-R57 WeakPolarHBondContact O-CB 3.06Å; P54-R57 PolarHBondContact O-N 2.9Å; P54-K58 PolarHBondContact O-N 3.16Å; P54-V193 HydrophobicContact CB-CG1 3.92Å; P54-V193 HydrophobicContact CB-CG2 4.42Å
55Y95.1Very high96.4Very high130 Ų13059.6 Ų59.651%0.5129%0.29SS..Hα-helixtrans-67.3-31.9179.580.2-91.5000112.6L53 K58 M59L53-Y55 VanDerWaalsContact C-N 3.27Å; L53-Y55 HydrophobicContact CB-CD1 3.72Å; L53-Y55 HydrophobicContact CB-CE1 3.64Å; L53-Y55 HydrophobicContact CD1-CD1 4.37Å; L53-Y55 HydrophobicContact CD1-CE1 3.61Å; L53-Y55 HydrophobicContact CG-CE1 4.26Å; L53-Y55 PolarHBondContact O-N 3.26Å; L53-Y55 VanDerWaalsContact O-N 3.16Å; Y55-K58 PolarHBondContact O-N 3.07Å; Y55-M59 HydrophobicContact CD2-CE 4.4Å; Y55-M59 HydrophobicContact CE2-CE 4.23Å; Y55-M59 WeakPolarHBondContact O-CG 3.33Å; Y55-M59 PolarHBondContact O-N 3.3Å
56M96.9Very high96.5Very high24 Ų2462.7 Ų62.712%0.11831%0.305CS..Hα-helixtrans-68.3-39176.9-59.6-179.917900110.8L53 P54 K58 M59 V60 K96 L99L53-M56 HydrophobicContact CB-CG 4.38Å; L53-M56 HydrophobicContact CD1-CE 4.4Å; L53-M56 WeakPolarHBondContact O-CB 3.43Å; L53-M56 PolarHBondContact O-N 3.47Å; P54-M56 VanDerWaalsContact C-N 3.32Å; P54-M56 PolarHBondContact O-N 2.89Å; M56-K58 VanDerWaalsContact C-N 3.35Å; M56-M59 PolarHBondContact O-N 3.49Å; M56-V60 PolarHBondContact O-N 3.01Å; M56-V60 VanDerWaalsContact O-N 3.07Å; M56-K96 HydrophobicContact CE-CB 4.46Å; M56-K96 HydrophobicContact CE-CD 4.43Å; M56-K96 HydrophobicContact SD-CB 4.09Å; M56-L99 HydrophobicContact CB-CD2 3.82Å
57R97Very high96.8Very high4 Ų453.8 Ų53.82%0.01527%0.267CS..Hα-helixtrans-59.7-46.8171-176.2-153.8177.1-98.24.2110.3Y44 F45 L53 P54 M59 V60 A61 M82 L85 D86 A190 T191Y44-R57 WeakPolarHBondContact OH-CD 3.21Å; F45-R57 HydrophobicContact CZ-CB 3.94Å; F45-R57 HydrophobicContact CZ-CG 4.45Å; L53-R57 PolarHBondContact O-N 2.95Å; P54-R57 WeakPolarHBondContact O-CB 3.06Å; P54-R57 PolarHBondContact O-N 2.9Å; R57-M59 PolarHBondContact O-N 3.37Å; R57-V60 PolarHBondContact O-N 3.14Å; R57-A61 VanDerWaalsContact O-CB 3.28Å; R57-A61 WeakPolarHBondContact O-CB 3.34Å; R57-A61 PolarHBondContact O-N 3.24Å; R57-M82 HydrophobicContact CG-CE 4.4Å; R57-M82 VanDerWaalsContact NH2-CE 3.27Å; R57-L85 HydrophobicContact CG-CD2 4.08Å; R57-D86 IonicContact CZ-OD1 3.71Å; R57-D86 IonicContact CZ-OD2 2.81Å; R57-D86 IonicContact NE-OD1 2.74Å; R57-D86 PolarHBondContact NE-OD1 2.98Å; R57-D86 IonicContact NE-OD2 3.55Å; R57-D86 IonicContact NH2-OD1 3.91Å; R57-D86 IonicContact NH2-OD2 3.61Å; R57-D86 PolarHBondContact NH2-OD2 3.5Å; R57-A190 PolarHBondContact NH1-O 3.38Å; R57-A190 PolarHBondContact NH2-O 2.7Å; R57-T191 PolarHBondContact NH1-O 2.94Å; R57-T191 VanDerWaalsContact NH1-O 3.15Å
58K95.6Very high96.9Very high61 Ų6150 Ų5027%0.26524%0.241SC..Hα-helixtrans-57.5-46.9177-174.5176.2177.8179.90111.5P54 Y55 M56 V60 A61 T62P54-K58 PolarHBondContact O-N 3.16Å; Y55-K58 PolarHBondContact O-N 3.07Å; M56-K58 VanDerWaalsContact C-N 3.35Å; K58-V60 PolarHBondContact O-N 2.88Å; K58-A61 PolarHBondContact O-N 3.08Å; K58-T62 PolarHBondContact O-N 3.47Å; K58-T62 PolarHBondContact O-OG1 2.61Å; K58-T62 VanDerWaalsContact O-OG1 3.1Å
59M96.3Very high96.8Very high118 Ų11854.4 Ų54.458%0.58126%0.259SS*.Hα-helixtrans-59.3-46.4178.1-67.8-163.7-4800112.6Y55 M56 R57 T62 W63Y55-M59 HydrophobicContact CD2-CE 4.4Å; Y55-M59 HydrophobicContact CE2-CE 4.23Å; Y55-M59 WeakPolarHBondContact O-CG 3.33Å; Y55-M59 PolarHBondContact O-N 3.3Å; M56-M59 PolarHBondContact O-N 3.49Å; R57-M59 PolarHBondContact O-N 3.37Å; M59-T62 PolarHBondContact O-N 3.26Å; M59-W63 PolarHBondContact O-N 2.95Å
60V97.7Very high96.8Very high17 Ų1760 Ų6010%0.10329%0.285CS..Hα-helixtrans-69.1-36178.5169.50000111.7M56 R57 K58 W63 M64 L85 L99M56-V60 PolarHBondContact O-N 3.01Å; M56-V60 VanDerWaalsContact O-N 3.07Å; R57-V60 PolarHBondContact O-N 3.14Å; K58-V60 PolarHBondContact O-N 2.88Å; V60-W63 HydrophobicContact CG1-CE3 4.3Å; V60-W63 PolarHBondContact O-N 3.26Å; V60-M64 HydrophobicContact CG1-CG 4.27Å; V60-M64 HydrophobicContact CG1-SD 3.78Å; V60-M64 WeakPolarHBondContact O-CB 3.45Å; V60-M64 WeakPolarHBondContact O-CG 3.5Å; V60-M64 PolarHBondContact O-N 2.91Å; V60-L85 HydrophobicContact CG1-CD1 4.11Å; V60-L99 HydrophobicContact CB-CD2 4.3Å; V60-L99 HydrophobicContact CB-CG 4.34Å; V60-L99 HydrophobicContact CG2-CB 4.44Å; V60-L99 HydrophobicContact CG2-CD2 3.74Å; V60-L99 HydrophobicContact CG2-CG 3.82Å
61A97.6Very high96.8Very high0 Ų053.4 Ų53.40%026%0.257CS..Hα-helixtrans-64.8-42.3175.100000112.1R57 K58 M64 L65 F78 M82 T191R57-A61 VanDerWaalsContact O-CB 3.28Å; R57-A61 WeakPolarHBondContact O-CB 3.34Å; R57-A61 PolarHBondContact O-N 3.24Å; K58-A61 PolarHBondContact O-N 3.08Å; A61-M64 PolarHBondContact O-N 2.98Å; A61-L65 WeakPolarHBondContact O-CB 3.35Å; A61-L65 PolarHBondContact O-N 3.19Å; A61-F78 VanDerWaalsContact O-CE2 3.22Å; A61-F78 WeakPolarHBondContact O-CE2 3.39Å; A61-M82 HydrophobicContact CB-CE 3.59Å; A61-M82 HydrophobicContact CB-SD 3.66Å; A61-T191 HydrophobicContact CB-CG2 4.29Å
62T96.6Very high96.7Very high48 Ų4858.1 Ų58.129%0.29428%0.277SS..Hα-helixtrans-62.2-47.7174.9-61.90000111.1K58 M59 M64 L65 E66K58-T62 PolarHBondContact O-N 3.47Å; K58-T62 PolarHBondContact O-OG1 2.61Å; K58-T62 VanDerWaalsContact O-OG1 3.1Å; M59-T62 PolarHBondContact O-N 3.26Å; T62-M64 VanDerWaalsContact C-N 3.35Å; T62-M64 PolarHBondContact O-N 2.83Å; T62-L65 WeakPolarHBondContact O-CB 3.38Å; T62-L65 PolarHBondContact O-N 2.81Å; T62-L65 VanDerWaalsContact O-N 3.16Å; T62-E66 WeakPolarHBondContact CG2-OE1 3.49Å; T62-E66 WeakPolarHBondContact O-CG 3.43Å; T62-E66 PolarHBondContact O-N 2.88Å
63W97.9Very high96.7Very high36 Ų3658.6 Ų58.614%0.13628%0.28CS..Hα-helixtrans-59-43.7174.4166.976.5000112.4M59 V60 L65 E66 V67 Q100 A104 M107 Y127 T128M59-W63 PolarHBondContact O-N 2.95Å; V60-W63 HydrophobicContact CG1-CE3 4.3Å; V60-W63 PolarHBondContact O-N 3.26Å; W63-L65 VanDerWaalsContact C-N 3.3Å; W63-L65 PolarHBondContact O-N 2.76Å; W63-E66 PolarHBondContact O-N 3.38Å; W63-V67 HydrophobicContact CD2-CG2 4.39Å; W63-V67 HydrophobicContact CZ2-CG2 4.06Å; W63-V67 VanDerWaalsContact O-CG2 3.31Å; W63-V67 WeakPolarHBondContact O-CG2 3.33Å; W63-V67 PolarHBondContact O-N 3.29Å; W63-Q100 HydrophobicContact CE3-CG 4.32Å; W63-Q100 HydrophobicContact CH2-CG 4.12Å; W63-Q100 HydrophobicContact CZ2-CG 4.35Å; W63-Q100 HydrophobicContact CZ3-CG 4.1Å; W63-A104 HydrophobicContact CH2-CB 3.93Å; W63-M107 HydrophobicContact CE3-CE 4.22Å; W63-M107 HydrophobicContact CH2-CE 3.33Å; W63-M107 HydrophobicContact CZ2-CE 4.03Å; W63-M107 HydrophobicContact CZ3-CE 3.45Å; W63-M107 VanDerWaalsContact CZ3-CE 3.45Å; W63-Y127 PolarHBondContact NE1-O 2.89Å; W63-T128 HydrophobicContact CH2-CG2 3.9Å; W63-T128 HydrophobicContact CZ2-CG2 3.59Å
64M98.6Very high96.6Very high0 Ų056.6 Ų56.60%027%0.269CS..Hα-helixtrans-60.7-39.7176.4-74.9166.963.700112.1V60 A61 T62 C68 F78 A81 M82 L85 C106 M107V60-M64 HydrophobicContact CG1-CG 4.27Å; V60-M64 HydrophobicContact CG1-SD 3.78Å; V60-M64 WeakPolarHBondContact O-CB 3.45Å; V60-M64 WeakPolarHBondContact O-CG 3.5Å; V60-M64 PolarHBondContact O-N 2.91Å; A61-M64 PolarHBondContact O-N 2.98Å; T62-M64 VanDerWaalsContact C-N 3.35Å; T62-M64 PolarHBondContact O-N 2.83Å; M64-C68 PolarHBondContact O-N 2.66Å; M64-C68 PolarHBondContact O-SG 2.97Å; M64-F78 HydrophobicContact CB-CD2 4.02Å; M64-F78 HydrophobicContact CB-CE2 3.85Å; M64-A81 HydrophobicContact CE-CB 3.49Å; M64-A81 VanDerWaalsContact CE-CB 3.49Å; M64-M82 HydrophobicContact CE-CG 4.41Å; M64-M82 HydrophobicContact CE-SD 3.72Å; M64-M82 HydrophobicContact SD-SD 3.88Å; M64-L85 HydrophobicContact SD-CD1 3.84Å; M64-C106 HydrophobicContact CE-CB 4.34Å; M64-M107 VanDerWaalsContact CA-SD 3.6Å; M64-M107 HydrophobicContact CB-CE 4.3Å; M64-M107 HydrophobicContact CB-CG 4.28Å; M64-M107 HydrophobicContact CB-SD 3.68Å; M64-M107 HydrophobicContact CE-CG 3.88Å; M64-M107 HydrophobicContact CG-CE 3.83Å; M64-M107 HydrophobicContact CG-CG 4.05Å; M64-M107 HydrophobicContact CG-SD 3.76Å
65L97.4Very high96.4Very high31 Ų3158.7 Ų58.716%0.16227%0.274CS..Hα-helixtrans-63.4-49.3176.3177.659.6000110.9A61 T62 W63 V67 C68 E69 F78 A187 T191A61-L65 WeakPolarHBondContact O-CB 3.35Å; A61-L65 PolarHBondContact O-N 3.19Å; T62-L65 WeakPolarHBondContact O-CB 3.38Å; T62-L65 PolarHBondContact O-N 2.81Å; T62-L65 VanDerWaalsContact O-N 3.16Å; W63-L65 VanDerWaalsContact C-N 3.3Å; W63-L65 PolarHBondContact O-N 2.76Å; L65-V67 VanDerWaalsContact C-N 3.31Å; L65-V67 PolarHBondContact O-N 3.19Å; L65-C68 PolarHBondContact O-N 3.14Å; L65-C68 VanDerWaalsContact O-N 3.1Å; L65-E69 HydrophobicContact CD1-CG 4.13Å; L65-E69 HydrophobicContact CG-CG 4.45Å; L65-E69 WeakPolarHBondContact O-CG 3.49Å; L65-E69 PolarHBondContact O-N 3.27Å; L65-F78 HydrophobicContact CB-CD1 4.49Å; L65-F78 HydrophobicContact CB-CD2 4.2Å; L65-F78 HydrophobicContact CB-CE1 4.14Å; L65-F78 HydrophobicContact CB-CE2 3.87Å; L65-F78 HydrophobicContact CB-CZ 3.83Å; L65-F78 HydrophobicContact CD1-CD1 3.79Å; L65-F78 HydrophobicContact CD1-CE1 3.98Å; L65-F78 HydrophobicContact CD1-CG 4.14Å; L65-F78 HydrophobicContact CD2-CE1 4.49Å; L65-F78 HydrophobicContact CG-CE1 4.44Å; L65-A187 HydrophobicContact CD1-CB 4.02Å; L65-A187 HydrophobicContact CD2-CB 4.36Å; L65-T191 HydrophobicContact CD2-CG2 4.36Å
66E97.4Very high96.4Very high106 Ų10654.8 Ų54.850%0.49526%0.26SS..Hα-helixtrans-56.1-44.6177.8-69.6165.1178.600111.7T62 W63 C68 E69 E70T62-E66 WeakPolarHBondContact CG2-OE1 3.49Å; T62-E66 WeakPolarHBondContact O-CG 3.43Å; T62-E66 PolarHBondContact O-N 2.88Å; W63-E66 PolarHBondContact O-N 3.38Å; E66-C68 PolarHBondContact O-N 2.88Å; E66-E69 PolarHBondContact O-N 2.96Å; E66-E70 WeakPolarHBondContact O-CB 3.38Å; E66-E70 PolarHBondContact O-N 3.29Å
67V97.9Very high96.4Very high3 Ų353.6 Ų53.62%0.01825%0.254CS..Hα-helixtrans-62.1-43.7176.5173.40000111.6W63 L65 E70 Q71 M107 L124 Y127W63-V67 HydrophobicContact CD2-CG2 4.39Å; W63-V67 HydrophobicContact CZ2-CG2 4.06Å; W63-V67 VanDerWaalsContact O-CG2 3.31Å; W63-V67 WeakPolarHBondContact O-CG2 3.33Å; W63-V67 PolarHBondContact O-N 3.29Å; L65-V67 VanDerWaalsContact C-N 3.31Å; L65-V67 PolarHBondContact O-N 3.19Å; V67-E70 PolarHBondContact O-N 3.12Å; V67-Q71 WeakPolarHBondContact O-CB 3.3Å; V67-Q71 PolarHBondContact O-N 3.49Å; V67-M107 HydrophobicContact CB-CE 4.19Å; V67-M107 HydrophobicContact CB-SD 4.11Å; V67-M107 HydrophobicContact CG1-CE 4.06Å; V67-M107 HydrophobicContact CG1-SD 4.09Å; V67-M107 HydrophobicContact CG2-CE 4.43Å; V67-L124 HydrophobicContact CG1-CD2 4.34Å; V67-Y127 HydrophobicContact CB-CG 4.43Å; V67-Y127 HydrophobicContact CG1-CD1 4.35Å; V67-Y127 HydrophobicContact CG1-CD2 3.7Å; V67-Y127 HydrophobicContact CG1-CE2 4.02Å; V67-Y127 HydrophobicContact CG1-CG 3.89Å; V67-Y127 HydrophobicContact CG2-CD1 3.71Å; V67-Y127 HydrophobicContact CG2-CD2 4.41Å; V67-Y127 HydrophobicContact CG2-CE1 4.39Å; V67-Y127 HydrophobicContact CG2-CG 3.74Å
68C97.7Very high96.5Very high9 Ų953.9 Ų53.96%0.06126%0.255CS..Hα-helixtrans-65.5-39.7178.4-67.70000111.6M64 L65 E66 K72 C73 F78M64-C68 PolarHBondContact O-N 2.66Å; M64-C68 PolarHBondContact O-SG 2.97Å; L65-C68 PolarHBondContact O-N 3.14Å; L65-C68 VanDerWaalsContact O-N 3.1Å; E66-C68 PolarHBondContact O-N 2.88Å; C68-K72 PolarHBondContact O-N 2.65Å; C68-C73 HydrophobicContact CB-CB 4.14Å; C68-C73 PolarHBondContact O-N 3.38Å; C68-F78 HydrophobicContact CB-CB 4.24Å
69E95.6Very high96.6Very high127 Ų12751.6 Ų51.659%0.59325%0.247SC*.Hα-helixtrans-66.5-44.2176.6-72.4-178.6156.700111.7L65 E66 Q71 K72L65-E69 HydrophobicContact CD1-CG 4.13Å; L65-E69 HydrophobicContact CG-CG 4.45Å; L65-E69 WeakPolarHBondContact O-CG 3.49Å; L65-E69 PolarHBondContact O-N 3.27Å; E66-E69 PolarHBondContact O-N 2.96Å; E69-Q71 VanDerWaalsContact C-N 3.34Å; E69-Q71 PolarHBondContact O-N 3.04Å; E69-K72 PolarHBondContact O-N 3.05Å; E69-K72 VanDerWaalsContact O-N 3.1Å
70E96.6Very high96.6Very high128 Ų12846.1 Ų46.160%0.59822%0.22SC*.Hα-helixtrans-65.7-37.9179.4-164.2-176.2133.800112E66 V67 K72 Y127E66-E70 WeakPolarHBondContact O-CB 3.38Å; E66-E70 PolarHBondContact O-N 3.29Å; V67-E70 PolarHBondContact O-N 3.12Å; E70-K72 VanDerWaalsContact C-N 3.27Å; E70-Y127 WeakPolarHBondContact CG-OH 3.34Å; E70-Y127 WeakPolarHBondContact OE1-CE1 3.47Å; E70-Y127 PolarHBondContact OE1-OH 3.07Å; E70-Y127 WeakPolarHBondContact OE2-CE1 3.49Å
71Q95.6Very high96.7Very high51 Ų5145.3 Ų45.324%0.23822%0.215CC..THydrogen-bonded Turntrans-81.7-4.2174.5-69.8-57.2-67.100114.2V67 E69 C73 L119 K123 Y127V67-Q71 WeakPolarHBondContact O-CB 3.3Å; V67-Q71 PolarHBondContact O-N 3.49Å; E69-Q71 VanDerWaalsContact C-N 3.34Å; E69-Q71 PolarHBondContact O-N 3.04Å; Q71-C73 PolarHBondContact O-N 3.22Å; Q71-L119 HydrophobicContact CB-CD2 3.8Å; Q71-L119 HydrophobicContact CG-CD2 3.75Å; Q71-K123 VanDerWaalsContact CD-CD 3.48Å; Q71-K123 HydrophobicContact CG-CD 4.25Å; Q71-Y127 HydrophobicContact CG-CE2 3.71Å; Q71-Y127 PolarHBondContact NE2-OH 3.19Å
72K95.3Very high96.7Very high185 Ų18545.5 Ų45.580%0.80422%0.216SC*.THydrogen-bonded Turntrans52.242.9-176.9-54.4177.6-178.3177.10111.6C68 E69 E70C68-K72 PolarHBondContact O-N 2.65Å; E69-K72 PolarHBondContact O-N 3.05Å; E69-K72 VanDerWaalsContact O-N 3.1Å; E70-K72 VanDerWaalsContact C-N 3.27Å
73C95.2Very high96.7Very high13 Ų1344.3 Ų44.39%0.08821%0.208CC..  trans-59.6156.4177.1-73.40000111C68 Q71 V77 E115C68-C73 HydrophobicContact CB-CB 4.14Å; C68-C73 PolarHBondContact O-N 3.38Å; Q71-C73 PolarHBondContact O-N 3.22Å; C73-V77 HydrophobicContact CB-CB 4.06Å; C73-V77 HydrophobicContact CB-CG1 4.31Å; C73-V77 HydrophobicContact CB-CG2 4.1Å; C73-E115 WeakPolarHBondContact CA-OE1 3.32Å; C73-E115 PolarHBondContact SG-OE2 3.29Å; C73-E115 VanDerWaalsContact SG-OE2 3.41Å
74E94.1Very high96.7Very high43 Ų4342.6 Ų42.620%0.20120%0.201CC..  trans-58141.7168.8-65-71.5175.800110.2R15 E76 V77 E115R15-E74 IonicContact NH2-OE2 3.59Å; E74-E76 PolarHBondContact O-N 3.01Å; E74-V77 HydrophobicContact CB-CG2 4.26Å; E74-V77 WeakPolarHBondContact O-CB 3.42Å; E74-V77 VanDerWaalsContact O-CG2 3.32Å; E74-V77 WeakPolarHBondContact O-CG2 3.25Å; E74-V77 PolarHBondContact O-N 3.24Å; E74-E115 HydrophobicContact CB-CG 4.41Å; E74-E115 HydrophobicContact CG-CG 4.26Å
75E92.6Very high96.7Very high99 Ų9942.6 Ų42.646%0.46320%0.201SC..THydrogen-bonded Turntrans-59-25.6-169.3-60.8-72.7166.700112.6P79 H158E75-P79 WeakPolarHBondContact O-CD 3.37Å; E75-H158 PolarHBondContact O-CE1 3.27Å
76E94.7Very high96.7Very high47 Ų4741.5 Ų41.522%0.2220%0.196CC..THydrogen-bonded Turntrans-75.4-19.2176.5-59.1116.292.500115.1E74 F78 L80 K114 T156 H158E74-E76 PolarHBondContact O-N 3.01Å; E76-F78 PolarHBondContact O-N 3.44Å; E76-L80 WeakPolarHBondContact O-CB 3.49Å; E76-L80 PolarHBondContact O-N 2.94Å; E76-K114 HydrophobicContact CB-CD 3.89Å; E76-K114 HydrophobicContact CB-CG 3.99Å; E76-K114 HydrophobicContact CG-CD 4.49Å; E76-K114 IonicContact OE1-NZ 2.76Å; E76-K114 PolarHBondContact OE1-NZ 2.91Å; E76-T156 HydrophobicContact CB-CG2 4.37Å; E76-H158 HydrophobicContact CG-CB 3.56Å
77V97.6Very high96.7Very high0 Ų037.4 Ų37.40%018%0.176CC..Hα-helixtrans-60.1-48.4-174.6174.30000110.6C73 E74 L80 A81 A110 K114 E115C73-V77 HydrophobicContact CB-CB 4.06Å; C73-V77 HydrophobicContact CB-CG1 4.31Å; C73-V77 HydrophobicContact CB-CG2 4.1Å; E74-V77 HydrophobicContact CB-CG2 4.26Å; E74-V77 WeakPolarHBondContact O-CB 3.42Å; E74-V77 VanDerWaalsContact O-CG2 3.32Å; E74-V77 WeakPolarHBondContact O-CG2 3.25Å; E74-V77 PolarHBondContact O-N 3.24Å; V77-L80 PolarHBondContact O-N 2.94Å; V77-A81 VanDerWaalsContact O-CB 3.29Å; V77-A81 WeakPolarHBondContact O-CB 3.36Å; V77-A81 PolarHBondContact O-N 3.45Å; V77-A110 HydrophobicContact CG1-CB 4.12Å; V77-A110 WeakPolarHBondContact O-CB 3.48Å; V77-K114 HydrophobicContact CG2-CB 3.94Å; V77-E115 HydrophobicContact CG2-CG 3.57Å
78F98.1Very high96.7Very high9 Ų937.5 Ų37.54%0.03918%0.176CC..Hα-helixtrans-66.6-52.3-176.4170.4-112.1000113.1A61 M64 L65 C68 E76 L80 A81 M82 A187 A190 T191A61-F78 VanDerWaalsContact O-CE2 3.22Å; A61-F78 WeakPolarHBondContact O-CE2 3.39Å; M64-F78 HydrophobicContact CB-CD2 4.02Å; M64-F78 HydrophobicContact CB-CE2 3.85Å; L65-F78 HydrophobicContact CB-CD1 4.49Å; L65-F78 HydrophobicContact CB-CD2 4.2Å; L65-F78 HydrophobicContact CB-CE1 4.14Å; L65-F78 HydrophobicContact CB-CE2 3.87Å; L65-F78 HydrophobicContact CB-CZ 3.83Å; L65-F78 HydrophobicContact CD1-CD1 3.79Å; L65-F78 HydrophobicContact CD1-CE1 3.98Å; L65-F78 HydrophobicContact CD1-CG 4.14Å; L65-F78 HydrophobicContact CD2-CE1 4.49Å; L65-F78 HydrophobicContact CG-CE1 4.44Å; C68-F78 HydrophobicContact CB-CB 4.24Å; E76-F78 PolarHBondContact O-N 3.44Å; F78-L80 VanDerWaalsContact C-N 3.27Å; F78-L80 PolarHBondContact O-N 3.29Å; F78-A81 PolarHBondContact O-N 3.23Å; F78-M82 HydrophobicContact CD2-CG 4.16Å; F78-M82 HydrophobicContact CE1-CG 4.44Å; F78-M82 HydrophobicContact CE2-CG 3.61Å; F78-M82 HydrophobicContact CE2-SD 3.99Å; F78-M82 HydrophobicContact CZ-CG 3.78Å; F78-M82 HydrophobicContact CZ-SD 4.38Å; F78-M82 PolarHBondContact O-N 3.49Å; F78-A187 HydrophobicContact CD1-CB 4.29Å; F78-A187 HydrophobicContact CE1-CB 4.26Å; F78-A190 HydrophobicContact CD1-CB 4.39Å; F78-A190 HydrophobicContact CE1-CB 3.66Å; F78-A190 HydrophobicContact CZ-CB 4.1Å; F78-T191 HydrophobicContact CE1-CG2 4.45Å; F78-T191 HydrophobicContact CZ-CG2 4.01Å
79P97.4Very high96.7Very high13 Ų1337 Ų378%0.08417%0.173CC..Hα-helixtrans-61.5-34.9177.1-25.636.4000113.3E75 M82 N83 V186E75-P79 WeakPolarHBondContact O-CD 3.37Å; P79-M82 PolarHBondContact O-N 3.43Å; P79-N83 PolarHBondContact O-N 3.2Å; P79-V186 HydrophobicContact CB-CG1 4.27Å; P79-V186 HydrophobicContact CG-CG1 3.69Å
80L97.8Very high96.8Very high3 Ų331.9 Ų31.92%0.01615%0.151CC..Hα-helixtrans-67.4-42.4175.8-176.359.8000111.5E76 V77 F78 M82 N83 Y84 A110 M113 K114 A154 T156E76-L80 WeakPolarHBondContact O-CB 3.49Å; E76-L80 PolarHBondContact O-N 2.94Å; V77-L80 PolarHBondContact O-N 2.94Å; F78-L80 VanDerWaalsContact C-N 3.27Å; F78-L80 PolarHBondContact O-N 3.29Å; L80-M82 VanDerWaalsContact C-N 3.3Å; L80-M82 PolarHBondContact O-N 2.95Å; L80-N83 WeakPolarHBondContact O-CB 3.07Å; L80-N83 PolarHBondContact O-N 3.25Å; L80-Y84 HydrophobicContact CD1-CD1 4.47Å; L80-Y84 HydrophobicContact CD1-CE1 3.68Å; L80-Y84 HydrophobicContact CD1-CE2 4.41Å; L80-Y84 HydrophobicContact CD2-CE2 4.4Å; L80-Y84 WeakPolarHBondContact CD2-OH 3.41Å; L80-Y84 HydrophobicContact CG-CE1 4.09Å; L80-Y84 HydrophobicContact CG-CE2 3.9Å; L80-Y84 PolarHBondContact O-N 2.84Å; L80-A110 HydrophobicContact CB-CB 4.1Å; L80-A110 HydrophobicContact CD2-CB 4.12Å; L80-A110 HydrophobicContact CG-CB 4.04Å; L80-M113 HydrophobicContact CD2-CB 4.06Å; L80-K114 HydrophobicContact CD2-CG 3.7Å; L80-A154 HydrophobicContact CD1-CB 3.9Å; L80-T156 HydrophobicContact CB-CG2 4.05Å; L80-T156 HydrophobicContact CD1-CG2 4.31Å
81A98.4Very high96.8Very high0 Ų030.4 Ų30.40%015%0.147CC..Hα-helixtrans-61.3-39.7174.200000111.7M64 V77 F78 Y84 L85 C106 M107 A110M64-A81 HydrophobicContact CE-CB 3.49Å; M64-A81 VanDerWaalsContact CE-CB 3.49Å; V77-A81 VanDerWaalsContact O-CB 3.29Å; V77-A81 WeakPolarHBondContact O-CB 3.36Å; V77-A81 PolarHBondContact O-N 3.45Å; F78-A81 PolarHBondContact O-N 3.23Å; A81-Y84 PolarHBondContact O-N 2.68Å; A81-L85 WeakPolarHBondContact O-CB 3.38Å; A81-L85 PolarHBondContact O-N 3.4Å; A81-C106 HydrophobicContact CB-CB 4.04Å; A81-C106 WeakPolarHBondContact O-CB 3.38Å; A81-M107 HydrophobicContact CB-CG 4.08Å; A81-A110 HydrophobicContact CB-CB 3.86Å
82M98.1Very high96.8Very high4 Ų430.9 Ų30.92%0.0215%0.149CC..Hα-helixtrans-65.2-39.2174-71.3-53.7-58.100112.4R57 A61 M64 F78 P79 L80 Y84 L85 D86 A190R57-M82 HydrophobicContact CG-CE 4.4Å; R57-M82 VanDerWaalsContact NH2-CE 3.27Å; A61-M82 HydrophobicContact CB-CE 3.59Å; A61-M82 HydrophobicContact CB-SD 3.66Å; M64-M82 HydrophobicContact CE-CG 4.41Å; M64-M82 HydrophobicContact CE-SD 3.72Å; M64-M82 HydrophobicContact SD-SD 3.88Å; F78-M82 HydrophobicContact CD2-CG 4.16Å; F78-M82 HydrophobicContact CE1-CG 4.44Å; F78-M82 HydrophobicContact CE2-CG 3.61Å; F78-M82 HydrophobicContact CE2-SD 3.99Å; F78-M82 HydrophobicContact CZ-CG 3.78Å; F78-M82 HydrophobicContact CZ-SD 4.38Å; F78-M82 PolarHBondContact O-N 3.49Å; P79-M82 PolarHBondContact O-N 3.43Å; L80-M82 VanDerWaalsContact C-N 3.3Å; L80-M82 PolarHBondContact O-N 2.95Å; M82-Y84 VanDerWaalsContact C-N 3.33Å; M82-Y84 PolarHBondContact O-N 2.98Å; M82-L85 HydrophobicContact CE-CD2 4.22Å; M82-L85 PolarHBondContact O-N 3.24Å; M82-D86 PolarHBondContact O-N 3.28Å; M82-A190 HydrophobicContact CB-CB 4.35Å; M82-A190 HydrophobicContact CG-CB 4.13Å
83N97.2Very high96.9Very high24 Ų2425.9 Ų25.913%0.12814%0.135CC..Hα-helixtrans-57.9-45172.1-179.5-95.3000111.6C38 P79 L80 R87 A154C38-N83 PolarHBondContact O-ND2 2.81Å; P79-N83 PolarHBondContact O-N 3.2Å; L80-N83 WeakPolarHBondContact O-CB 3.07Å; L80-N83 PolarHBondContact O-N 3.25Å; N83-R87 WeakPolarHBondContact O-CB 3.09Å; N83-R87 WeakPolarHBondContact O-CD 3.35Å; N83-R87 WeakPolarHBondContact O-CG 3.29Å; N83-R87 PolarHBondContact O-N 2.89Å; N83-R87 WeakPolarHBondContact OD1-CD 3.43Å; N83-R87 PolarHBondContact OD1-NH1 3.26Å; N83-A154 WeakPolarHBondContact OD1-CB 3.45Å
84Y98.4Very high97Very high0 Ų026 Ų260%014%0.135CC..Hα-helixtrans-63.3-43.3176.4-61.5-22.6000112.5L80 A81 M82 R87 F88 V109 A110 L148 L152L80-Y84 HydrophobicContact CD1-CD1 4.47Å; L80-Y84 HydrophobicContact CD1-CE1 3.68Å; L80-Y84 HydrophobicContact CD1-CE2 4.41Å; L80-Y84 HydrophobicContact CD2-CE2 4.4Å; L80-Y84 WeakPolarHBondContact CD2-OH 3.41Å; L80-Y84 HydrophobicContact CG-CE1 4.09Å; L80-Y84 HydrophobicContact CG-CE2 3.9Å; L80-Y84 PolarHBondContact O-N 2.84Å; A81-Y84 PolarHBondContact O-N 2.68Å; M82-Y84 VanDerWaalsContact C-N 3.33Å; M82-Y84 PolarHBondContact O-N 2.98Å; Y84-R87 PolarHBondContact O-N 2.87Å; Y84-F88 VanDerWaalsContact O-CB 3.29Å; Y84-F88 WeakPolarHBondContact O-CB 3.42Å; Y84-F88 PolarHBondContact O-N 2.69Å; Y84-V109 HydrophobicContact CD2-CB 4.35Å; Y84-V109 HydrophobicContact CD2-CG1 4.28Å; Y84-V109 HydrophobicContact CE2-CB 4.09Å; Y84-V109 HydrophobicContact CE2-CG1 3.7Å; Y84-A110 HydrophobicContact CD2-CB 4.32Å; Y84-A110 HydrophobicContact CE2-CB 3.9Å; Y84-L148 HydrophobicContact CD1-CD1 3.76Å; Y84-L148 HydrophobicContact CG-CD1 4.08Å; Y84-L152 HydrophobicContact CE1-CB 4.42Å; Y84-L152 HydrophobicContact CE1-CD2 4.12Å; Y84-L152 PolarHBondContact OH-O 3.45Å
85L98.3Very high97.1Very high0 Ų030.1 Ų30.10%015%0.152CC..Hα-helixtrans-59.3-52.5178.6-176.9149.6000110.6R57 V60 M64 A81 M82 R87 F88 L89 L102 C106R57-L85 HydrophobicContact CG-CD2 4.08Å; V60-L85 HydrophobicContact CG1-CD1 4.11Å; M64-L85 HydrophobicContact SD-CD1 3.84Å; A81-L85 WeakPolarHBondContact O-CB 3.38Å; A81-L85 PolarHBondContact O-N 3.4Å; M82-L85 HydrophobicContact CE-CD2 4.22Å; M82-L85 PolarHBondContact O-N 3.24Å; L85-R87 PolarHBondContact O-N 3.08Å; L85-F88 PolarHBondContact O-N 2.99Å; L85-L89 HydrophobicContact CD2-CD1 3.55Å; L85-L89 HydrophobicContact CD2-CG 4.35Å; L85-L89 HydrophobicContact CG-CD1 4.32Å; L85-L89 WeakPolarHBondContact O-CG 3.48Å; L85-L89 PolarHBondContact O-N 3.49Å; L85-L102 HydrophobicContact CG-CD2 4.34Å; L85-C106 PolarHBondContact N-SG 2.91Å; L85-C106 VanDerWaalsContact N-SG 3.45Å
86D97.6Very high97.3Very high8 Ų831.7 Ų31.74%0.04316%0.157CC..Hα-helixtrans-67.2-37.6-177.7-72.2-42.8000112.5P40 Y44 R57 M82 L89 S90P40-D86 HydrophobicContact CB-CB 3.71Å; P40-D86 HydrophobicContact CG-CB 3.98Å; Y44-D86 HydrophobicContact CE1-CB 4.07Å; Y44-D86 PolarHBondContact OH-OD1 2.9Å; R57-D86 IonicContact CZ-OD1 3.71Å; R57-D86 IonicContact CZ-OD2 2.81Å; R57-D86 IonicContact NE-OD1 2.74Å; R57-D86 PolarHBondContact NE-OD1 2.98Å; R57-D86 IonicContact NE-OD2 3.55Å; R57-D86 IonicContact NH2-OD1 3.91Å; R57-D86 IonicContact NH2-OD2 3.61Å; R57-D86 PolarHBondContact NH2-OD2 3.5Å; M82-D86 PolarHBondContact O-N 3.28Å; D86-L89 PolarHBondContact O-N 3.25Å; D86-S90 WeakPolarHBondContact O-CB 3.42Å; D86-S90 PolarHBondContact O-N 2.82Å; D86-S90 PolarHBondContact O-OG 3.3Å
87R97Very high97.3Very high20 Ų2034 Ų348%0.07518%0.179CC..Hα-helixtrans-66.5-39.9174.9-73.3168.365.4-162.2-4.2111.8C38 P40 N83 Y84 L85 S90 L91 L148 N151C38-R87 WeakPolarHBondContact O-CD 3.48Å; P40-R87 HydrophobicContact CB-CG 4.3Å; N83-R87 WeakPolarHBondContact O-CB 3.09Å; N83-R87 WeakPolarHBondContact O-CD 3.35Å; N83-R87 WeakPolarHBondContact O-CG 3.29Å; N83-R87 PolarHBondContact O-N 2.89Å; N83-R87 WeakPolarHBondContact OD1-CD 3.43Å; N83-R87 PolarHBondContact OD1-NH1 3.26Å; Y84-R87 PolarHBondContact O-N 2.87Å; L85-R87 PolarHBondContact O-N 3.08Å; R87-S90 WeakPolarHBondContact O-CB 3.39Å; R87-S90 PolarHBondContact O-N 3.25Å; R87-L91 WeakPolarHBondContact O-CG 3.2Å; R87-L91 PolarHBondContact O-N 3.07Å; R87-L148 HydrophobicContact CB-CD2 3.59Å; R87-N151 PolarHBondContact NH1-O 3.29Å; R87-N151 PolarHBondContact NH2-O 2.5Å
88F98.1Very high97.3Very high4 Ų438.8 Ų38.82%0.01820%0.197CC..Hα-helixtrans-64.3-46.7175.7-173.1-85000111.2Y84 L85 S90 L91 E92 L94 L102 M140 L143 L144 K147Y84-F88 VanDerWaalsContact O-CB 3.29Å; Y84-F88 WeakPolarHBondContact O-CB 3.42Å; Y84-F88 PolarHBondContact O-N 2.69Å; L85-F88 PolarHBondContact O-N 2.99Å; F88-S90 PolarHBondContact O-N 2.81Å; F88-L91 PolarHBondContact O-N 3.38Å; F88-E92 HydrophobicContact CD1-CB 4.38Å; F88-E92 HydrophobicContact CE1-CB 3.81Å; F88-E92 HydrophobicContact CE2-CG 4.44Å; F88-E92 HydrophobicContact CZ-CB 3.93Å; F88-E92 HydrophobicContact CZ-CG 4.17Å; F88-E92 PolarHBondContact O-N 3.2Å; F88-L94 HydrophobicContact CE1-CD1 4.2Å; F88-L102 HydrophobicContact CB-CD1 4.15Å; F88-L102 HydrophobicContact CB-CD2 4.32Å; F88-L102 HydrophobicContact CD1-CD1 3.78Å; F88-L102 HydrophobicContact CD1-CD2 3.55Å; F88-L102 HydrophobicContact CD1-CG 4.35Å; F88-L102 HydrophobicContact CD2-CD1 4.3Å; F88-L102 HydrophobicContact CE1-CD1 4.27Å; F88-L102 HydrophobicContact CE1-CD2 4.23Å; F88-L102 HydrophobicContact CG-CD1 3.79Å; F88-L102 HydrophobicContact CG-CD2 4.18Å; F88-M140 HydrophobicContact CE1-CE 3.88Å; F88-M140 HydrophobicContact CE2-CE 4.15Å; F88-M140 HydrophobicContact CZ-CE 3.6Å; F88-L143 HydrophobicContact CE2-CD2 4.42Å; F88-L143 HydrophobicContact CE2-CG 4.11Å; F88-L143 HydrophobicContact CZ-CD2 4.07Å; F88-L143 HydrophobicContact CZ-CG 4.25Å; F88-L144 HydrophobicContact CB-CD1 3.85Å; F88-L144 HydrophobicContact CD2-CD1 3.59Å; F88-L144 HydrophobicContact CE2-CD1 4.5Å; F88-L144 HydrophobicContact CG-CD1 4.01Å; F88-K147 HydrophobicContact CD2-CB 4.16Å; F88-K147 HydrophobicContact CE2-CB 4.09Å; F88-K147 HydrophobicContact CE2-CG 3.98Å
89L97.5Very high97.3Very high0 Ų038.6 Ų38.60%020%0.196CC..Hα-helixtrans-65-20.8176.4-66.3179.6000113Y44 V48 Q49 I52 L85 D86 L91 L94 L99 L102Y44-L89 HydrophobicContact CD2-CB 3.87Å; Y44-L89 HydrophobicContact CE2-CB 3.79Å; Y44-L89 HydrophobicContact CE2-CD1 3.91Å; Y44-L89 HydrophobicContact CG-CB 4.34Å; V48-L89 WeakPolarHBondContact CG1-O 3.47Å; Q49-L89 HydrophobicContact CG-CB 4.46Å; Q49-L89 PolarHBondContact NE2-O 3.45Å; I52-L89 HydrophobicContact CG1-CD2 4.49Å; L85-L89 HydrophobicContact CD2-CD1 3.55Å; L85-L89 HydrophobicContact CD2-CG 4.35Å; L85-L89 HydrophobicContact CG-CD1 4.32Å; L85-L89 WeakPolarHBondContact O-CG 3.48Å; L85-L89 PolarHBondContact O-N 3.49Å; D86-L89 PolarHBondContact O-N 3.25Å; L89-L91 VanDerWaalsContact C-N 3.29Å; L89-L94 HydrophobicContact CD2-CB 3.95Å; L89-L94 HydrophobicContact CD2-CD2 4.08Å; L89-L99 HydrophobicContact CD1-CD1 4.32Å; L89-L99 HydrophobicContact CD2-CD1 4.37Å; L89-L102 HydrophobicContact CD2-CD2 3.95Å; L89-L102 HydrophobicContact CG-CD2 4.17Å
90S96.7Very high97.3Very high19 Ų1941.1 Ų41.113%0.13321%0.207CC..THydrogen-bonded Turntrans-74.6-17.4172-60.20000113.8S41 Y44 D86 R87 F88S41-S90 PolarHBondContact N-OG 3.27Å; Y44-S90 WeakPolarHBondContact CD1-OG 3.47Å; D86-S90 WeakPolarHBondContact O-CB 3.42Å; D86-S90 PolarHBondContact O-N 2.82Å; D86-S90 PolarHBondContact O-OG 3.3Å; R87-S90 WeakPolarHBondContact O-CB 3.39Å; R87-S90 PolarHBondContact O-N 3.25Å; F88-S90 PolarHBondContact O-N 2.81Å
91L96.6Very high97.4Very high97 Ų9741.3 Ų41.351%0.50821%0.208SC..THydrogen-bonded Turntrans-111.9-39.5-173.9-63.6172.5000112.5R87 F88 L89 K147 L148R87-L91 WeakPolarHBondContact O-CG 3.2Å; R87-L91 PolarHBondContact O-N 3.07Å; F88-L91 PolarHBondContact O-N 3.38Å; L89-L91 VanDerWaalsContact C-N 3.29Å; L91-K147 WeakPolarHBondContact CD1-O 3.2Å; L91-L148 HydrophobicContact CD1-CD2 4.41Å
92E96.9Very high97.4Very high60 Ų6041.3 Ų41.328%0.2821%0.208SC..SBendtrans-125.8129.6-169.7-67.9-65.8141.400112Q49 F88 L94 K147Q49-E92 PolarHBondContact NE2-O 3.16Å; F88-E92 HydrophobicContact CD1-CB 4.38Å; F88-E92 HydrophobicContact CE1-CB 3.81Å; F88-E92 HydrophobicContact CE2-CG 4.44Å; F88-E92 HydrophobicContact CZ-CB 3.93Å; F88-E92 HydrophobicContact CZ-CG 4.17Å; F88-E92 PolarHBondContact O-N 3.2Å; E92-L94 PolarHBondContact O-N 3.42Å; E92-K147 VanDerWaalsContact CD-CE 3.45Å; E92-K147 VanDerWaalsContact CD-NZ 3.28Å; E92-K147 HydrophobicContact CG-CD 3.76Å; E92-K147 HydrophobicContact CG-CG 4.09Å; E92-K147 WeakPolarHBondContact OE1-CD 3.46Å; E92-K147 WeakPolarHBondContact OE1-CE 3.47Å; E92-K147 IonicContact OE1-NZ 2.64Å; E92-K147 PolarHBondContact OE1-NZ 3.1Å; E92-K147 IonicContact OE2-NZ 3.65Å
93P96.8Very high97.4Very high81 Ų8141.1 Ų41.153%0.52621%0.207SC..  trans-67.2129.4171.728.3-32.8000110.3
94L97.1Very high97.5Very high16 Ų1640 Ų408%0.08420%0.201CC..  trans-115.4143.7-179-164.874.5000111.2I52 F88 L89 E92 R98 L99 L102 M140I52-L94 HydrophobicContact CD1-CB 4.49Å; I52-L94 HydrophobicContact CG1-CB 4.24Å; I52-L94 WeakPolarHBondContact CG1-O 3.46Å; F88-L94 HydrophobicContact CE1-CD1 4.2Å; L89-L94 HydrophobicContact CD2-CB 3.95Å; L89-L94 HydrophobicContact CD2-CD2 4.08Å; E92-L94 PolarHBondContact O-N 3.42Å; L94-R98 HydrophobicContact CD1-CB 3.88Å; L94-R98 HydrophobicContact CD2-CB 4.49Å; L94-R98 HydrophobicContact CG-CB 4.13Å; L94-L99 HydrophobicContact CD2-CB 4.27Å; L94-L99 HydrophobicContact CD2-CD1 3.85Å; L94-L102 HydrophobicContact CD2-CB 3.97Å; L94-L102 HydrophobicContact CD2-CD2 3.72Å; L94-M140 HydrophobicContact CD1-CE 4.41Å
95K97.3Very high97.5Very high128 Ų12840 Ų4056%0.55720%0.201SC*.  trans-75.9144.8169-66.7-174.5176.8-177.60110.2E51 S97 R98E51-K95 WeakPolarHBondContact OE2-CA 3.2Å; K95-S97 PolarHBondContact O-N 2.93Å; K95-S97 VanDerWaalsContact O-N 3.14Å; K95-R98 PolarHBondContact O-N 3.44Å
96K95.4Very high97.5Very high132 Ų13240 Ų4057%0.57420%0.201SC*.G310 helixtrans-55.8-34.8179.467.6-176.7-178.9177.40113.5E51 I52 M56 R98 L99E51-K96 HydrophobicContact CB-CB 4.44Å; E51-K96 PolarHBondContact OE2-N 3.29Å; I52-K96 HydrophobicContact CD1-CB 4.21Å; M56-K96 HydrophobicContact CE-CB 4.46Å; M56-K96 HydrophobicContact CE-CD 4.43Å; M56-K96 HydrophobicContact SD-CB 4.09Å; K96-R98 PolarHBondContact O-N 2.88Å; K96-L99 WeakPolarHBondContact O-CB 3.38Å; K96-L99 PolarHBondContact O-N 3.13Å
97S95.7Very high97.6Very high97 Ų9739.6 Ų39.668%0.67820%0.199SC*.G310 helixtrans-68.3-17.1178.859.70000114.2K95K95-S97 PolarHBondContact O-N 2.93Å; K95-S97 VanDerWaalsContact O-N 3.14Å
98R97.4Very high97.6Very high99 Ų9939.3 Ų39.337%0.37420%0.198SC..G310 helixtrans-101.71.5179.4-58.9-165.378.3-174.43.8113.1L94 K95 K96 L101 L102L94-R98 HydrophobicContact CD1-CB 3.88Å; L94-R98 HydrophobicContact CD2-CB 4.49Å; L94-R98 HydrophobicContact CG-CB 4.13Å; K95-R98 PolarHBondContact O-N 3.44Å; K96-R98 PolarHBondContact O-N 2.88Å; R98-L101 PolarHBondContact O-N 3.48Å; R98-L102 PolarHBondContact O-N 3Å
99L97.9Very high97.7Very high5 Ų539.3 Ų39.33%0.02620%0.198CC..Hα-helixtrans-66.8-41.4-176.8-170.266.7000112I52 M56 V60 L89 L94 K96 L102 G103I52-L99 HydrophobicContact CD1-CB 4.28Å; I52-L99 HydrophobicContact CD1-CD1 4.28Å; I52-L99 HydrophobicContact CD1-CD2 4.4Å; I52-L99 HydrophobicContact CG2-CD1 4.19Å; I52-L99 HydrophobicContact CG2-CD2 4.11Å; M56-L99 HydrophobicContact CB-CD2 3.82Å; V60-L99 HydrophobicContact CB-CD2 4.3Å; V60-L99 HydrophobicContact CB-CG 4.34Å; V60-L99 HydrophobicContact CG2-CB 4.44Å; V60-L99 HydrophobicContact CG2-CD2 3.74Å; V60-L99 HydrophobicContact CG2-CG 3.82Å; L89-L99 HydrophobicContact CD1-CD1 4.32Å; L89-L99 HydrophobicContact CD2-CD1 4.37Å; L94-L99 HydrophobicContact CD2-CB 4.27Å; L94-L99 HydrophobicContact CD2-CD1 3.85Å; K96-L99 WeakPolarHBondContact O-CB 3.38Å; K96-L99 PolarHBondContact O-N 3.13Å; L99-L102 PolarHBondContact O-N 3.45Å; L99-G103 PolarHBondContact O-N 2.69Å
100Q98.1Very high97.7Very high67 Ų6739.3 Ų39.331%0.31320%0.198SC..Hα-helixtrans-66-38.7175.9-166.5175.624.700111.7W63 L102 G103 A104 T128 S131W63-Q100 HydrophobicContact CE3-CG 4.32Å; W63-Q100 HydrophobicContact CH2-CG 4.12Å; W63-Q100 HydrophobicContact CZ2-CG 4.35Å; W63-Q100 HydrophobicContact CZ3-CG 4.1Å; Q100-L102 PolarHBondContact O-N 3.3Å; Q100-G103 PolarHBondContact O-N 3.05Å; Q100-A104 WeakPolarHBondContact O-CB 3.4Å; Q100-A104 PolarHBondContact O-N 3.02Å; Q100-T128 HydrophobicContact CG-CG2 3.98Å; Q100-S131 PolarHBondContact OE1-OG 2.89Å
101L98.6Very high97.8Very high6 Ų638.4 Ų38.43%0.03119%0.192CC..Hα-helixtrans-59.3-45.7172.2176.762.6000111.7R98 A104 T105 I132 E136 L137 M140R98-L101 PolarHBondContact O-N 3.48Å; L101-A104 PolarHBondContact O-N 3.12Å; L101-T105 WeakPolarHBondContact O-CB 3.35Å; L101-T105 PolarHBondContact O-N 3.46Å; L101-T105 PolarHBondContact O-OG1 3.17Å; L101-I132 HydrophobicContact CB-CG2 3.9Å; L101-I132 HydrophobicContact CD1-CB 4.09Å; L101-I132 HydrophobicContact CD1-CD1 3.83Å; L101-I132 HydrophobicContact CD1-CG2 3.98Å; L101-I132 HydrophobicContact CG-CG2 4.47Å; L101-E136 HydrophobicContact CD1-CB 4.23Å; L101-E136 HydrophobicContact CD2-CB 4.39Å; L101-L137 HydrophobicContact CD1-CB 4.4Å; L101-M140 HydrophobicContact CD1-CB 4.32Å; L101-M140 HydrophobicContact CD2-CB 4.24Å; L101-M140 HydrophobicContact CD2-CG 4.35Å; L101-M140 HydrophobicContact CD2-SD 4.46Å; L101-M140 HydrophobicContact CG-CB 4.12Å; L101-M140 HydrophobicContact CG-CG 4.08Å
102L98.6Very high97.8Very high0 Ų038.1 Ų38.10%019%0.187CC..Hα-helixtrans-60.6-46.8174.9175.963.3000110.8L85 F88 L89 L94 R98 L99 Q100 A104 T105 C106 M140 L144L85-L102 HydrophobicContact CG-CD2 4.34Å; F88-L102 HydrophobicContact CB-CD1 4.15Å; F88-L102 HydrophobicContact CB-CD2 4.32Å; F88-L102 HydrophobicContact CD1-CD1 3.78Å; F88-L102 HydrophobicContact CD1-CD2 3.55Å; F88-L102 HydrophobicContact CD1-CG 4.35Å; F88-L102 HydrophobicContact CD2-CD1 4.3Å; F88-L102 HydrophobicContact CE1-CD1 4.27Å; F88-L102 HydrophobicContact CE1-CD2 4.23Å; F88-L102 HydrophobicContact CG-CD1 3.79Å; F88-L102 HydrophobicContact CG-CD2 4.18Å; L89-L102 HydrophobicContact CD2-CD2 3.95Å; L89-L102 HydrophobicContact CG-CD2 4.17Å; L94-L102 HydrophobicContact CD2-CB 3.97Å; L94-L102 HydrophobicContact CD2-CD2 3.72Å; R98-L102 PolarHBondContact O-N 3Å; L99-L102 PolarHBondContact O-N 3.45Å; Q100-L102 PolarHBondContact O-N 3.3Å; L102-A104 PolarHBondContact O-N 3.33Å; L102-T105 WeakPolarHBondContact O-CB 3.4Å; L102-T105 PolarHBondContact O-N 2.75Å; L102-C106 PolarHBondContact O-N 3.18Å; L102-C106 PolarHBondContact O-SG 3.4Å; L102-M140 HydrophobicContact CB-CE 4.08Å; L102-M140 HydrophobicContact CD1-CE 3.61Å; L102-M140 HydrophobicContact CG-CE 4.37Å; L102-L144 HydrophobicContact CD1-CD1 4.14Å
103G98.5Very high97.9Very high0 Ų039.4 Ų39.40%019%0.194CC..Hα-helixtrans-57.7-48.4177.600000113L99 Q100 T105 C106 M107L99-G103 PolarHBondContact O-N 2.69Å; Q100-G103 PolarHBondContact O-N 3.05Å; G103-T105 VanDerWaalsContact C-N 3.31Å; G103-T105 PolarHBondContact O-N 3.27Å; G103-C106 PolarHBondContact O-N 3.01Å; G103-M107 PolarHBondContact O-N 2.91Å
104A98.7Very high97.8Very high0 Ų038.4 Ų38.40%018%0.181CC..Hα-helixtrans-57.5-44.7174.700000111.7W63 Q100 L101 L102 M107 F108 L124 I132 L137W63-A104 HydrophobicContact CH2-CB 3.93Å; Q100-A104 WeakPolarHBondContact O-CB 3.4Å; Q100-A104 PolarHBondContact O-N 3.02Å; L101-A104 PolarHBondContact O-N 3.12Å; L102-A104 PolarHBondContact O-N 3.33Å; A104-M107 PolarHBondContact O-N 3.12Å; A104-F108 WeakPolarHBondContact O-CB 3.36Å; A104-F108 PolarHBondContact O-N 3.19Å; A104-L124 WeakPolarHBondContact O-CD1 3.49Å; A104-I132 HydrophobicContact CB-CD1 3.63Å; A104-L137 HydrophobicContact CB-CD1 4.22Å
105T98.8Very high97.5Very high0 Ų039.2 Ų39.20%019%0.185CC..Hα-helixtrans-65.3-40.3179-53.30000111.8L101 L102 G103 F108 V109 M140 E141 L144L101-T105 WeakPolarHBondContact O-CB 3.35Å; L101-T105 PolarHBondContact O-N 3.46Å; L101-T105 PolarHBondContact O-OG1 3.17Å; L102-T105 WeakPolarHBondContact O-CB 3.4Å; L102-T105 PolarHBondContact O-N 2.75Å; G103-T105 VanDerWaalsContact C-N 3.31Å; G103-T105 PolarHBondContact O-N 3.27Å; T105-F108 WeakPolarHBondContact O-CB 3.24Å; T105-F108 PolarHBondContact O-N 3.2Å; T105-V109 WeakPolarHBondContact O-CG2 3.31Å; T105-V109 PolarHBondContact O-N 3.38Å; T105-M140 HydrophobicContact CG2-CB 4.07Å; T105-M140 HydrophobicContact CG2-CG 4.01Å; T105-M140 WeakPolarHBondContact OG1-CB 3.39Å; T105-M140 WeakPolarHBondContact OG1-CG 3.2Å; T105-E141 HydrophobicContact CG2-CB 3.96Å; T105-E141 VanDerWaalsContact CG2-N 3.3Å; T105-L144 HydrophobicContact CG2-CB 4.28Å; T105-L144 HydrophobicContact CG2-CD2 3.85Å
106C98.8Very high97.2Very high0 Ų038.5 Ų38.50%019%0.191CC..Hα-helixtrans-62.5-42.9176-70.70000111.6M64 A81 L85 L102 G103 V109 A110M64-C106 HydrophobicContact CE-CB 4.34Å; A81-C106 HydrophobicContact CB-CB 4.04Å; A81-C106 WeakPolarHBondContact O-CB 3.38Å; L85-C106 PolarHBondContact N-SG 2.91Å; L85-C106 VanDerWaalsContact N-SG 3.45Å; L102-C106 PolarHBondContact O-N 3.18Å; L102-C106 PolarHBondContact O-SG 3.4Å; G103-C106 PolarHBondContact O-N 3.01Å; C106-V109 PolarHBondContact O-N 3.43Å; C106-A110 VanDerWaalsContact O-CB 3.23Å; C106-A110 WeakPolarHBondContact O-CB 3.45Å; C106-A110 PolarHBondContact O-N 3.19Å
107M98.6Very high97.1Very high0 Ų038.2 Ų38.20%020%0.195CC..Hα-helixtrans-62.8-43.2173.6-68.6-170.1-70.100111.6W63 M64 V67 A81 G103 A104 V109 A110 S111 L119 L124W63-M107 HydrophobicContact CE3-CE 4.22Å; W63-M107 HydrophobicContact CH2-CE 3.33Å; W63-M107 HydrophobicContact CZ2-CE 4.03Å; W63-M107 HydrophobicContact CZ3-CE 3.45Å; W63-M107 VanDerWaalsContact CZ3-CE 3.45Å; M64-M107 VanDerWaalsContact CA-SD 3.6Å; M64-M107 HydrophobicContact CB-CE 4.3Å; M64-M107 HydrophobicContact CB-CG 4.28Å; M64-M107 HydrophobicContact CB-SD 3.68Å; M64-M107 HydrophobicContact CE-CG 3.88Å; M64-M107 HydrophobicContact CG-CE 3.83Å; M64-M107 HydrophobicContact CG-CG 4.05Å; M64-M107 HydrophobicContact CG-SD 3.76Å; V67-M107 HydrophobicContact CB-CE 4.19Å; V67-M107 HydrophobicContact CB-SD 4.11Å; V67-M107 HydrophobicContact CG1-CE 4.06Å; V67-M107 HydrophobicContact CG1-SD 4.09Å; V67-M107 HydrophobicContact CG2-CE 4.43Å; A81-M107 HydrophobicContact CB-CG 4.08Å; G103-M107 PolarHBondContact O-N 2.91Å; A104-M107 PolarHBondContact O-N 3.12Å; M107-V109 PolarHBondContact O-N 3.02Å; M107-A110 PolarHBondContact O-N 2.89Å; M107-S111 WeakPolarHBondContact O-CB 3.4Å; M107-S111 PolarHBondContact O-N 2.91Å; M107-L119 HydrophobicContact CB-CD1 4.45Å; M107-L124 HydrophobicContact CB-CD2 4.28Å; M107-L124 HydrophobicContact CE-CD2 3.84Å
108F98.7Very high97.1Very high15 Ų1536 Ų367%0.06618%0.178CC..Hα-helixtrans-57-48.8177.1-172.6-128.1000112.4A104 T105 K112 L119 A121 L124 L137 L138 E141A104-F108 WeakPolarHBondContact O-CB 3.36Å; A104-F108 PolarHBondContact O-N 3.19Å; T105-F108 WeakPolarHBondContact O-CB 3.24Å; T105-F108 PolarHBondContact O-N 3.2Å; F108-K112 VanDerWaalsContact CZ-NZ 3.26Å; F108-K112 WeakPolarHBondContact O-CG 3.46Å; F108-K112 PolarHBondContact O-N 2.92Å; F108-K112 VanDerWaalsContact O-N 3.17Å; F108-L119 VanDerWaalsContact CD2-O 3.22Å; F108-L119 WeakPolarHBondContact CD2-O 3.23Å; F108-L119 WeakPolarHBondContact CE2-O 3.31Å; F108-A121 HydrophobicContact CE2-CB 4.31Å; F108-A121 HydrophobicContact CZ-CB 4.27Å; F108-L124 HydrophobicContact CB-CD1 3.51Å; F108-L124 HydrophobicContact CD2-CD1 3.88Å; F108-L124 HydrophobicContact CG-CD1 4.08Å; F108-L137 HydrophobicContact CB-CD2 4.06Å; F108-L137 HydrophobicContact CD1-CD2 3.38Å; F108-L137 HydrophobicContact CD2-CD2 4.36Å; F108-L137 HydrophobicContact CE1-CD2 3.73Å; F108-L137 HydrophobicContact CG-CD2 3.7Å; F108-L137 HydrophobicContact CZ-CD2 4.38Å; F108-L138 HydrophobicContact CE1-CD2 3.92Å; F108-L138 HydrophobicContact CZ-CD2 4.23Å; F108-E141 WeakPolarHBondContact CE1-OE2 3.41Å
109V98.7Very high97Very high3 Ų331.9 Ų31.92%0.01816%0.163CC..Hα-helixtrans-69.7-40.2179.6177.60000111.1Y84 T105 C106 M107 K112 M113 E141 L144 V145 L152Y84-V109 HydrophobicContact CD2-CB 4.35Å; Y84-V109 HydrophobicContact CD2-CG1 4.28Å; Y84-V109 HydrophobicContact CE2-CB 4.09Å; Y84-V109 HydrophobicContact CE2-CG1 3.7Å; T105-V109 WeakPolarHBondContact O-CG2 3.31Å; T105-V109 PolarHBondContact O-N 3.38Å; C106-V109 PolarHBondContact O-N 3.43Å; M107-V109 PolarHBondContact O-N 3.02Å; V109-K112 PolarHBondContact O-N 3.35Å; V109-M113 VanDerWaalsContact O-CG 3.32Å; V109-M113 WeakPolarHBondContact O-CG 3.2Å; V109-M113 PolarHBondContact O-N 3.45Å; V109-E141 HydrophobicContact CG2-CG 3.9Å; V109-L144 HydrophobicContact CB-CD2 4.43Å; V109-L144 HydrophobicContact CG2-CD2 4.05Å; V109-V145 HydrophobicContact CG1-CG2 4.26Å; V109-V145 HydrophobicContact CG2-CG2 4.16Å; V109-L152 HydrophobicContact CG1-CD1 3.86Å; V109-L152 HydrophobicContact CG1-CD2 4.01Å; V109-L152 HydrophobicContact CG1-CG 4.49Å
110A98.4Very high97Very high0 Ų035.1 Ų35.10%018%0.183CC..Hα-helixtrans-65.2-42.3178.800000111.9V77 L80 A81 Y84 C106 M107 K112 M113 K114V77-A110 HydrophobicContact CG1-CB 4.12Å; V77-A110 WeakPolarHBondContact O-CB 3.48Å; L80-A110 HydrophobicContact CB-CB 4.1Å; L80-A110 HydrophobicContact CD2-CB 4.12Å; L80-A110 HydrophobicContact CG-CB 4.04Å; A81-A110 HydrophobicContact CB-CB 3.86Å; Y84-A110 HydrophobicContact CD2-CB 4.32Å; Y84-A110 HydrophobicContact CE2-CB 3.9Å; C106-A110 VanDerWaalsContact O-CB 3.23Å; C106-A110 WeakPolarHBondContact O-CB 3.45Å; C106-A110 PolarHBondContact O-N 3.19Å; M107-A110 PolarHBondContact O-N 2.89Å; A110-K112 PolarHBondContact O-N 3.49Å; A110-M113 WeakPolarHBondContact O-CB 3.41Å; A110-M113 PolarHBondContact O-N 2.83Å; A110-K114 PolarHBondContact O-N 3.32Å
111S98Very high97Very high0 Ų032.6 Ų32.60%017%0.174CC..Hα-helixtrans-59.3-43.6175.4175.80000111.7M107 M113 K114 E115 P118 L119M107-S111 WeakPolarHBondContact O-CB 3.4Å; M107-S111 PolarHBondContact O-N 2.91Å; S111-M113 PolarHBondContact O-N 2.99Å; S111-K114 PolarHBondContact O-N 3.32Å; S111-E115 VanDerWaalsContact CB-OE2 3.22Å; S111-E115 WeakPolarHBondContact CB-OE2 3.36Å; S111-E115 WeakPolarHBondContact O-CB 3.46Å; S111-E115 PolarHBondContact O-N 3.46Å; S111-E115 PolarHBondContact OG-OE2 3.44Å; S111-P118 WeakPolarHBondContact OG-CA 3.32Å; S111-P118 WeakPolarHBondContact OG-CB 3.45Å; S111-L119 PolarHBondContact OG-N 3.48Å
112K97.9Very high96.9Very high91 Ų9139.2 Ų39.240%0.39621%0.205SC..Hα-helixtrans-60.3-27.5173-72.5177.9-176.5-1790114.2F108 V109 A110 P118 E141F108-K112 VanDerWaalsContact CZ-NZ 3.26Å; F108-K112 WeakPolarHBondContact O-CG 3.46Å; F108-K112 PolarHBondContact O-N 2.92Å; F108-K112 VanDerWaalsContact O-N 3.17Å; V109-K112 PolarHBondContact O-N 3.35Å; A110-K112 PolarHBondContact O-N 3.49Å; K112-P118 HydrophobicContact CB-CG 4.48Å; K112-P118 HydrophobicContact CG-CB 3.93Å; K112-P118 HydrophobicContact CG-CG 4.14Å; K112-E141 VanDerWaalsContact NZ-CD 3.32Å; K112-E141 IonicContact NZ-OE1 3.38Å; K112-E141 PolarHBondContact NZ-OE1 3.09Å; K112-E141 IonicContact NZ-OE2 3.72Å; K112-E141 PolarHBondContact NZ-OE2 3.15Å
113M97.2Very high96.8Very high88 Ų8843.2 Ų43.243%0.43322%0.222SC..Hα-helixtrans-86.8-26.9-178.5-67.9-62.5-6000113.2L80 V109 A110 S111 L152L80-M113 HydrophobicContact CD2-CB 4.06Å; V109-M113 VanDerWaalsContact O-CG 3.32Å; V109-M113 WeakPolarHBondContact O-CG 3.2Å; V109-M113 PolarHBondContact O-N 3.45Å; A110-M113 WeakPolarHBondContact O-CB 3.41Å; A110-M113 PolarHBondContact O-N 2.83Å; S111-M113 PolarHBondContact O-N 2.99Å; M113-L152 HydrophobicContact CE-CB 4.1Å; M113-L152 HydrophobicContact CG-CB 4.34Å; M113-L152 HydrophobicContact SD-CB 4.09Å; M113-L152 HydrophobicContact SD-CD1 4.23Å
114K94.9Very high96.7Very high59 Ų5943.2 Ų43.226%0.25722%0.222SC..Hα-helixtrans-120.3-21.9-168.5-70.9-65.6-164.4158.10114.4E76 V77 L80 A110 S111 D159E76-K114 HydrophobicContact CB-CD 3.89Å; E76-K114 HydrophobicContact CB-CG 3.99Å; E76-K114 HydrophobicContact CG-CD 4.49Å; E76-K114 IonicContact OE1-NZ 2.76Å; E76-K114 PolarHBondContact OE1-NZ 2.91Å; V77-K114 HydrophobicContact CG2-CB 3.94Å; L80-K114 HydrophobicContact CD2-CG 3.7Å; A110-K114 PolarHBondContact O-N 3.32Å; S111-K114 PolarHBondContact O-N 3.32Å; K114-D159 IonicContact NZ-OD1 3.52Å
115E92.1Very high96.7Very high34 Ų3443.4 Ų43.416%0.15922%0.224CC..  trans-102.2148.8-176.9-57.6-166.289.300112.5C73 E74 V77 S111C73-E115 WeakPolarHBondContact CA-OE1 3.32Å; C73-E115 PolarHBondContact SG-OE2 3.29Å; C73-E115 VanDerWaalsContact SG-OE2 3.41Å; E74-E115 HydrophobicContact CB-CG 4.41Å; E74-E115 HydrophobicContact CG-CG 4.26Å; V77-E115 HydrophobicContact CG2-CG 3.57Å; S111-E115 VanDerWaalsContact CB-OE2 3.22Å; S111-E115 WeakPolarHBondContact CB-OE2 3.36Å; S111-E115 WeakPolarHBondContact O-CB 3.46Å; S111-E115 PolarHBondContact O-N 3.46Å; S111-E115 PolarHBondContact OG-OE2 3.44Å
116T90.6Very high96.6Very high113 Ų11348.4 Ų48.469%0.69325%0.249SC*.SBendtrans-70.8-38.4172.3-58.30000111.2
117I92.7Very high96.5Very high126 Ų12650.3 Ų50.365%0.64626%0.257SS*.SBendtrans-121.797.8176.5-56.8175.5000107.2
118P95.9Very high96.4Very high49 Ų4950.6 Ų50.632%0.31826%0.258SS..PPolyproline II helixtrans-68.3156.2-175.8-23.735.6000113.6S111 K112 T120S111-P118 WeakPolarHBondContact OG-CA 3.32Å; S111-P118 WeakPolarHBondContact OG-CB 3.45Å; K112-P118 HydrophobicContact CB-CG 4.48Å; K112-P118 HydrophobicContact CG-CB 3.93Å; K112-P118 HydrophobicContact CG-CG 4.14Å; P118-T120 PolarHBondContact O-N 3.07Å
119L95.8Very high96.2Very high13 Ų1357 Ų577%0.06829%0.293CS..PPolyproline II helixtrans-54.4133.4168.3-63.5177.8000110.1Q71 M107 F108 S111 L124Q71-L119 HydrophobicContact CB-CD2 3.8Å; Q71-L119 HydrophobicContact CG-CD2 3.75Å; M107-L119 HydrophobicContact CB-CD1 4.45Å; F108-L119 VanDerWaalsContact CD2-O 3.22Å; F108-L119 WeakPolarHBondContact CD2-O 3.23Å; F108-L119 WeakPolarHBondContact CE2-O 3.31Å; S111-L119 PolarHBondContact OG-N 3.48Å; L119-L124 HydrophobicContact CB-CD1 4.24Å; L119-L124 HydrophobicContact CB-CG 4.3Å; L119-L124 HydrophobicContact CD1-CD2 4.03Å; L119-L124 HydrophobicContact CD1-CG 4.5Å
120T97.4Very high96Very high73 Ų7362.1 Ų62.145%0.44832%0.321SS..PPolyproline II helixtrans-82.5149.8176.7670000110.8P118 E122 K123 L124P118-T120 PolarHBondContact O-N 3.07Å; T120-E122 VanDerWaalsContact C-N 3.26Å; T120-E122 PolarHBondContact O-N 3Å; T120-K123 PolarHBondContact O-N 3.38Å; T120-K123 VanDerWaalsContact OG1-CB 3.29Å; T120-K123 WeakPolarHBondContact OG1-CB 3.29Å; T120-K123 PolarHBondContact OG1-N 3.12Å; T120-L124 PolarHBondContact O-N 2.94Å; T120-L124 VanDerWaalsContact O-N 3.08Å
121A97.4Very high95.9Very high15 Ų1565.7 Ų65.712%0.12435%0.345CS..Hα-helixtrans-58.2-40.7176.200000111.8F108 K123 L124 C125 P134 L137F108-A121 HydrophobicContact CE2-CB 4.31Å; F108-A121 HydrophobicContact CZ-CB 4.27Å; A121-K123 VanDerWaalsContact C-N 3.35Å; A121-K123 PolarHBondContact O-N 2.69Å; A121-L124 PolarHBondContact O-N 2.92Å; A121-C125 PolarHBondContact O-N 3.49Å; A121-C125 PolarHBondContact O-SG 2.99Å; A121-P134 HydrophobicContact CB-CB 4.28Å; A121-L137 HydrophobicContact CB-CD2 4.11Å
122E97.2Very high95.8Very high144 Ų14466.2 Ų66.267%0.67335%0.348SS*.Hα-helixtrans-59.4-44.3176.5-66.6179176.100112T120 C125 I126 P134T120-E122 VanDerWaalsContact C-N 3.26Å; T120-E122 PolarHBondContact O-N 3Å; E122-C125 WeakPolarHBondContact O-CB 3.39Å; E122-C125 PolarHBondContact O-N 3.16Å; E122-I126 WeakPolarHBondContact O-CG1 3.13Å; E122-I126 PolarHBondContact O-N 2.92Å; E122-P134 HydrophobicContact CG-CG 4.44Å
123K96.2Very high95.7Very high84 Ų8468.9 Ų68.937%0.36536%0.356SS..Hα-helixtrans-66.6-40.8-179.9-171.5175.9-72.1-179.90111.9Q71 T120 A121 C125 I126 Y127Q71-K123 VanDerWaalsContact CD-CD 3.48Å; Q71-K123 HydrophobicContact CG-CD 4.25Å; T120-K123 PolarHBondContact O-N 3.38Å; T120-K123 VanDerWaalsContact OG1-CB 3.29Å; T120-K123 WeakPolarHBondContact OG1-CB 3.29Å; T120-K123 PolarHBondContact OG1-N 3.12Å; A121-K123 VanDerWaalsContact C-N 3.35Å; A121-K123 PolarHBondContact O-N 2.69Å; K123-C125 VanDerWaalsContact C-N 3.3Å; K123-C125 PolarHBondContact O-N 3.33Å; K123-I126 WeakPolarHBondContact O-CB 3.13Å; K123-I126 PolarHBondContact O-N 3.4Å; K123-I126 VanDerWaalsContact O-N 3.16Å; K123-Y127 HydrophobicContact CD-CE2 4.21Å; K123-Y127 HydrophobicContact CG-CD2 4.13Å; K123-Y127 HydrophobicContact CG-CE2 3.87Å; K123-Y127 VanDerWaalsContact O-CD2 3.3Å; K123-Y127 WeakPolarHBondContact O-CD2 3.23Å; K123-Y127 PolarHBondContact O-N 3.5Å; K123-Y127 VanDerWaalsContact O-N 3.12Å
124L97.4Very high95.8Very high1 Ų167 Ų671%0.00535%0.35CS..Hα-helixtrans-62.9-37.3174.2-75.6170000112.1V67 A104 M107 F108 L119 T120 A121 I126 Y127 T128 L137V67-L124 HydrophobicContact CG1-CD2 4.34Å; A104-L124 WeakPolarHBondContact O-CD1 3.49Å; M107-L124 HydrophobicContact CB-CD2 4.28Å; M107-L124 HydrophobicContact CE-CD2 3.84Å; F108-L124 HydrophobicContact CB-CD1 3.51Å; F108-L124 HydrophobicContact CD2-CD1 3.88Å; F108-L124 HydrophobicContact CG-CD1 4.08Å; L119-L124 HydrophobicContact CB-CD1 4.24Å; L119-L124 HydrophobicContact CB-CG 4.3Å; L119-L124 HydrophobicContact CD1-CD2 4.03Å; L119-L124 HydrophobicContact CD1-CG 4.5Å; T120-L124 PolarHBondContact O-N 2.94Å; T120-L124 VanDerWaalsContact O-N 3.08Å; A121-L124 PolarHBondContact O-N 2.92Å; L124-I126 VanDerWaalsContact C-N 3.34Å; L124-I126 PolarHBondContact O-N 3.18Å; L124-Y127 PolarHBondContact O-N 3.31Å; L124-T128 WeakPolarHBondContact O-CG2 3.49Å; L124-T128 PolarHBondContact O-N 3.04Å; L124-L137 HydrophobicContact CB-CD1 3.82Å; L124-L137 HydrophobicContact CD1-CD1 4.12Å
125C97.3Very high95.9Very high4 Ų467.1 Ų67.13%0.02735%0.353CS..Hα-helixtrans-61.7-40.9172.2-710000112.1A121 E122 K123 Y127 T128 N130 I132 P134A121-C125 PolarHBondContact O-N 3.49Å; A121-C125 PolarHBondContact O-SG 2.99Å; E122-C125 WeakPolarHBondContact O-CB 3.39Å; E122-C125 PolarHBondContact O-N 3.16Å; K123-C125 VanDerWaalsContact C-N 3.3Å; K123-C125 PolarHBondContact O-N 3.33Å; C125-Y127 VanDerWaalsContact C-N 3.33Å; C125-Y127 PolarHBondContact O-N 3.23Å; C125-T128 PolarHBondContact O-N 2.87Å; C125-T128 VanDerWaalsContact O-N 3.09Å; C125-T128 PolarHBondContact O-OG1 3.45Å; C125-N130 WeakPolarHBondContact O-CA 3.31Å; C125-N130 PolarHBondContact O-N 3.31Å; C125-I132 WeakPolarHBondContact CB-O 3.43Å; C125-I132 PolarHBondContact SG-O 3.34Å; C125-P134 VanDerWaalsContact SG-CD 3.58Å; C125-P134 VanDerWaalsContact SG-N 3.37Å
126I97.6Very high96.2Very high104 Ų10469 Ų6953%0.53336%0.362SS..Hα-helixtrans-58.8-44.9175.5-67.1166.5000110.8E122 K123 L124 T128 D129E122-I126 WeakPolarHBondContact O-CG1 3.13Å; E122-I126 PolarHBondContact O-N 2.92Å; K123-I126 WeakPolarHBondContact O-CB 3.13Å; K123-I126 PolarHBondContact O-N 3.4Å; K123-I126 VanDerWaalsContact O-N 3.16Å; L124-I126 VanDerWaalsContact C-N 3.34Å; L124-I126 PolarHBondContact O-N 3.18Å; I126-T128 PolarHBondContact O-N 3.2Å; I126-T128 VanDerWaalsContact O-N 3.08Å; I126-D129 WeakPolarHBondContact O-CA 3.34Å; I126-D129 PolarHBondContact O-N 3.4Å
127Y97.6Very high96.6Very high41 Ų4163.6 Ų63.616%0.16133%0.329CS..THydrogen-bonded Turntrans-64.2-11.9177.6-82.8-63.1000115.5W63 V67 E70 Q71 K123 L124 C125W63-Y127 PolarHBondContact NE1-O 2.89Å; V67-Y127 HydrophobicContact CB-CG 4.43Å; V67-Y127 HydrophobicContact CG1-CD1 4.35Å; V67-Y127 HydrophobicContact CG1-CD2 3.7Å; V67-Y127 HydrophobicContact CG1-CE2 4.02Å; V67-Y127 HydrophobicContact CG1-CG 3.89Å; V67-Y127 HydrophobicContact CG2-CD1 3.71Å; V67-Y127 HydrophobicContact CG2-CD2 4.41Å; V67-Y127 HydrophobicContact CG2-CE1 4.39Å; V67-Y127 HydrophobicContact CG2-CG 3.74Å; E70-Y127 WeakPolarHBondContact CG-OH 3.34Å; E70-Y127 WeakPolarHBondContact OE1-CE1 3.47Å; E70-Y127 PolarHBondContact OE1-OH 3.07Å; E70-Y127 WeakPolarHBondContact OE2-CE1 3.49Å; Q71-Y127 HydrophobicContact CG-CE2 3.71Å; Q71-Y127 PolarHBondContact NE2-OH 3.19Å; K123-Y127 HydrophobicContact CD-CE2 4.21Å; K123-Y127 HydrophobicContact CG-CD2 4.13Å; K123-Y127 HydrophobicContact CG-CE2 3.87Å; K123-Y127 VanDerWaalsContact O-CD2 3.3Å; K123-Y127 WeakPolarHBondContact O-CD2 3.23Å; K123-Y127 PolarHBondContact O-N 3.5Å; K123-Y127 VanDerWaalsContact O-N 3.12Å; L124-Y127 PolarHBondContact O-N 3.31Å; C125-Y127 VanDerWaalsContact C-N 3.33Å; C125-Y127 PolarHBondContact O-N 3.23Å
128T95.2Very high96.8Very high5 Ų561.4 Ų61.43%0.03132%0.318CS..THydrogen-bonded Turntrans-99.315.8173.567.90000112.6W63 Q100 L124 C125 I126 N130 S131 I132W63-T128 HydrophobicContact CH2-CG2 3.9Å; W63-T128 HydrophobicContact CZ2-CG2 3.59Å; Q100-T128 HydrophobicContact CG-CG2 3.98Å; L124-T128 WeakPolarHBondContact O-CG2 3.49Å; L124-T128 PolarHBondContact O-N 3.04Å; C125-T128 PolarHBondContact O-N 2.87Å; C125-T128 VanDerWaalsContact O-N 3.09Å; C125-T128 PolarHBondContact O-OG1 3.45Å; I126-T128 PolarHBondContact O-N 3.2Å; I126-T128 VanDerWaalsContact O-N 3.08Å; T128-N130 PolarHBondContact O-N 3.36Å; T128-S131 WeakPolarHBondContact CB-OG 3.29Å; T128-S131 WeakPolarHBondContact O-CB 3.38Å; T128-S131 PolarHBondContact O-N 2.95Å; T128-S131 PolarHBondContact O-OG 3.24Å; T128-S131 PolarHBondContact OG1-N 3.36Å; T128-I132 HydrophobicContact CG2-CD1 3.89Å; T128-I132 HydrophobicContact CG2-CG1 3.8Å; T128-I132 VanDerWaalsContact OG1-CG1 3.24Å; T128-I132 WeakPolarHBondContact OG1-CG1 3.46Å; T128-I132 PolarHBondContact OG1-N 3.14Å
129D95.6Very high97Very high150 Ų15065 Ų6580%0.80233%0.331SS*.THydrogen-bonded Turntrans51.836.7-167.9-71-30.3000112.6I126 S131I126-D129 WeakPolarHBondContact O-CA 3.34Å; I126-D129 PolarHBondContact O-N 3.4Å; D129-S131 PolarHBondContact O-N 3.23Å; D129-S131 VanDerWaalsContact O-N 3.14Å
130N94.7Very high97.1Very high111 Ų11164.5 Ų64.559%0.59433%0.328SS*.THydrogen-bonded Turntrans5624.4-175.1-54-74000114.2C125 T128 I132C125-N130 WeakPolarHBondContact O-CA 3.31Å; C125-N130 PolarHBondContact O-N 3.31Å; T128-N130 PolarHBondContact O-N 3.36Å; N130-I132 PolarHBondContact O-N 2.99Å
131S94.6Very high97.1Very high74 Ų7462.4 Ų62.452%0.51731%0.313SS..SBendtrans-69.4-19.7173.764.30000113Q100 T128 D129Q100-S131 PolarHBondContact OE1-OG 2.89Å; T128-S131 WeakPolarHBondContact CB-OG 3.29Å; T128-S131 WeakPolarHBondContact O-CB 3.38Å; T128-S131 PolarHBondContact O-N 2.95Å; T128-S131 PolarHBondContact O-OG 3.24Å; T128-S131 PolarHBondContact OG1-N 3.36Å; D129-S131 PolarHBondContact O-N 3.23Å; D129-S131 VanDerWaalsContact O-N 3.14Å
132I96.3Very high97.2Very high12 Ų1267 Ų676%0.06234%0.335CS..SBendtrans-118.3150.7169.762.9163.1000110.9L101 A104 C125 T128 N130 L137L101-I132 HydrophobicContact CB-CG2 3.9Å; L101-I132 HydrophobicContact CD1-CB 4.09Å; L101-I132 HydrophobicContact CD1-CD1 3.83Å; L101-I132 HydrophobicContact CD1-CG2 3.98Å; L101-I132 HydrophobicContact CG-CG2 4.47Å; A104-I132 HydrophobicContact CB-CD1 3.63Å; C125-I132 WeakPolarHBondContact CB-O 3.43Å; C125-I132 PolarHBondContact SG-O 3.34Å; T128-I132 HydrophobicContact CG2-CD1 3.89Å; T128-I132 HydrophobicContact CG2-CG1 3.8Å; T128-I132 VanDerWaalsContact OG1-CG1 3.24Å; T128-I132 WeakPolarHBondContact OG1-CG1 3.46Å; T128-I132 PolarHBondContact OG1-N 3.14Å; N130-I132 PolarHBondContact O-N 2.99Å; I132-L137 HydrophobicContact CD1-CD1 4.05Å
133R97.1Very high97.2Very high146 Ų14663.2 Ų63.255%0.55132%0.319SS*.  trans-103.9154.2177.2-61175.561.5-115.2-8.4112.2D135 E136 L137R133-D135 VanDerWaalsContact C-N 3.26Å; R133-D135 WeakPolarHBondContact CB-OD1 3.24Å; R133-D135 IonicContact CZ-OD1 2.69Å; R133-D135 IonicContact CZ-OD2 3.13Å; R133-D135 IonicContact NE-OD1 3.51Å; R133-D135 VanDerWaalsContact NH1-CG 3.29Å; R133-D135 IonicContact NH1-OD1 3.51Å; R133-D135 PolarHBondContact NH1-OD1 2.7Å; R133-D135 IonicContact NH1-OD2 3.05Å; R133-D135 PolarHBondContact NH1-OD2 3.5Å; R133-D135 IonicContact NH2-OD1 3.57Å; R133-D135 PolarHBondContact NH2-OD1 3.47Å; R133-D135 IonicContact NH2-OD2 2.66Å; R133-D135 PolarHBondContact O-N 3.46Å; R133-E136 HydrophobicContact CB-CG 4.35Å; R133-E136 PolarHBondContact N-OE2 2.98Å; R133-E136 WeakPolarHBondContact O-CB 3.45Å; R133-E136 PolarHBondContact O-N 3.5Å; R133-L137 PolarHBondContact O-N 3.24Å; R133-L137 VanDerWaalsContact O-N 3.12Å
134P97.9Very high97.4Very high48 Ų4859.2 Ų59.231%0.31230%0.302SS..Hα-helixtrans-58.2-35.3-178.3-27.635.6000113.9A121 E122 C125 E136 L137 L138A121-P134 HydrophobicContact CB-CB 4.28Å; E122-P134 HydrophobicContact CG-CG 4.44Å; C125-P134 VanDerWaalsContact SG-CD 3.58Å; C125-P134 VanDerWaalsContact SG-N 3.37Å; P134-E136 VanDerWaalsContact C-N 3.34Å; P134-E136 PolarHBondContact O-N 2.86Å; P134-L137 PolarHBondContact O-N 3.4Å; P134-L138 VanDerWaalsContact O-CG 3.3Å; P134-L138 WeakPolarHBondContact O-CG 3.47Å; P134-L138 PolarHBondContact O-N 3.14Å
135D97.9Very high97.4Very high62 Ų6259.6 Ų59.633%0.33230%0.304SS..Hα-helixtrans-64.5-37.4176.154.1-55.1000112.6R133 Q139R133-D135 VanDerWaalsContact C-N 3.26Å; R133-D135 WeakPolarHBondContact CB-OD1 3.24Å; R133-D135 IonicContact CZ-OD1 2.69Å; R133-D135 IonicContact CZ-OD2 3.13Å; R133-D135 IonicContact NE-OD1 3.51Å; R133-D135 VanDerWaalsContact NH1-CG 3.29Å; R133-D135 IonicContact NH1-OD1 3.51Å; R133-D135 PolarHBondContact NH1-OD1 2.7Å; R133-D135 IonicContact NH1-OD2 3.05Å; R133-D135 PolarHBondContact NH1-OD2 3.5Å; R133-D135 IonicContact NH2-OD1 3.57Å; R133-D135 PolarHBondContact NH2-OD1 3.47Å; R133-D135 IonicContact NH2-OD2 2.66Å; R133-D135 PolarHBondContact O-N 3.46Å; D135-Q139 WeakPolarHBondContact O-CB 3.28Å; D135-Q139 VanDerWaalsContact O-CG 3.27Å; D135-Q139 WeakPolarHBondContact O-CG 3.18Å; D135-Q139 PolarHBondContact O-N 2.92Å
136E97.8Very high97.4Very high73 Ų7363.8 Ų63.834%0.34133%0.326SS..Hα-helixtrans-67.7-39.4175-60.5179.8116.400111.3L101 R133 P134 Q139 M140L101-E136 HydrophobicContact CD1-CB 4.23Å; L101-E136 HydrophobicContact CD2-CB 4.39Å; R133-E136 HydrophobicContact CB-CG 4.35Å; R133-E136 PolarHBondContact N-OE2 2.98Å; R133-E136 WeakPolarHBondContact O-CB 3.45Å; R133-E136 PolarHBondContact O-N 3.5Å; P134-E136 VanDerWaalsContact C-N 3.34Å; P134-E136 PolarHBondContact O-N 2.86Å; E136-Q139 PolarHBondContact O-N 3.44Å; E136-M140 VanDerWaalsContact O-CB 3.32Å; E136-M140 WeakPolarHBondContact O-CB 3.37Å; E136-M140 PolarHBondContact O-N 2.93Å
137L98.4Very high97.4Very high0 Ų062.4 Ų62.40%032%0.317CS..Hα-helixtrans-63.7-46.1177-169155.5000111L101 A104 F108 A121 L124 I132 R133 P134 Q139 M140 E141L101-L137 HydrophobicContact CD1-CB 4.4Å; A104-L137 HydrophobicContact CB-CD1 4.22Å; F108-L137 HydrophobicContact CB-CD2 4.06Å; F108-L137 HydrophobicContact CD1-CD2 3.38Å; F108-L137 HydrophobicContact CD2-CD2 4.36Å; F108-L137 HydrophobicContact CE1-CD2 3.73Å; F108-L137 HydrophobicContact CG-CD2 3.7Å; F108-L137 HydrophobicContact CZ-CD2 4.38Å; A121-L137 HydrophobicContact CB-CD2 4.11Å; L124-L137 HydrophobicContact CB-CD1 3.82Å; L124-L137 HydrophobicContact CD1-CD1 4.12Å; I132-L137 HydrophobicContact CD1-CD1 4.05Å; R133-L137 PolarHBondContact O-N 3.24Å; R133-L137 VanDerWaalsContact O-N 3.12Å; P134-L137 PolarHBondContact O-N 3.4Å; L137-Q139 PolarHBondContact O-N 2.96Å; L137-M140 PolarHBondContact O-N 3.34Å; L137-E141 PolarHBondContact O-N 3.3Å
138L98.4Very high97.4Very high80 Ų8060.7 Ų60.742%0.41931%0.31SS..Hα-helixtrans-65.7-37.1177.6-66.7176.1000112.5F108 P134 E141 L142F108-L138 HydrophobicContact CE1-CD2 3.92Å; F108-L138 HydrophobicContact CZ-CD2 4.23Å; P134-L138 VanDerWaalsContact O-CG 3.3Å; P134-L138 WeakPolarHBondContact O-CG 3.47Å; P134-L138 PolarHBondContact O-N 3.14Å; L138-E141 PolarHBondContact O-N 2.74Å; L138-L142 PolarHBondContact O-N 3.06Å
139Q98.4Very high97.5Very high125 Ų12569 Ų6958%0.58435%0.346SS*.Hα-helixtrans-66.6-40.7173.1-73.8176.310.200111.8D135 E136 L137 E141 L142 L143D135-Q139 WeakPolarHBondContact O-CB 3.28Å; D135-Q139 VanDerWaalsContact O-CG 3.27Å; D135-Q139 WeakPolarHBondContact O-CG 3.18Å; D135-Q139 PolarHBondContact O-N 2.92Å; E136-Q139 PolarHBondContact O-N 3.44Å; L137-Q139 PolarHBondContact O-N 2.96Å; Q139-E141 VanDerWaalsContact C-N 3.32Å; Q139-L142 PolarHBondContact O-N 3.28Å; Q139-L143 PolarHBondContact O-N 3.27Å; Q139-L143 VanDerWaalsContact O-N 3.16Å
140M98.4Very high97.6Very high2 Ų270.5 Ų70.51%0.0134%0.34CS..Hα-helixtrans-67.2-34.6177-166.868.6-168.800111.5F88 L94 L101 L102 T105 E136 L137 L143 L144F88-M140 HydrophobicContact CE1-CE 3.88Å; F88-M140 HydrophobicContact CE2-CE 4.15Å; F88-M140 HydrophobicContact CZ-CE 3.6Å; L94-M140 HydrophobicContact CD1-CE 4.41Å; L101-M140 HydrophobicContact CD1-CB 4.32Å; L101-M140 HydrophobicContact CD2-CB 4.24Å; L101-M140 HydrophobicContact CD2-CG 4.35Å; L101-M140 HydrophobicContact CD2-SD 4.46Å; L101-M140 HydrophobicContact CG-CB 4.12Å; L101-M140 HydrophobicContact CG-CG 4.08Å; L102-M140 HydrophobicContact CB-CE 4.08Å; L102-M140 HydrophobicContact CD1-CE 3.61Å; L102-M140 HydrophobicContact CG-CE 4.37Å; T105-M140 HydrophobicContact CG2-CB 4.07Å; T105-M140 HydrophobicContact CG2-CG 4.01Å; T105-M140 WeakPolarHBondContact OG1-CB 3.39Å; T105-M140 WeakPolarHBondContact OG1-CG 3.2Å; E136-M140 VanDerWaalsContact O-CB 3.32Å; E136-M140 WeakPolarHBondContact O-CB 3.37Å; E136-M140 PolarHBondContact O-N 2.93Å; L137-M140 PolarHBondContact O-N 3.34Å; M140-L143 HydrophobicContact CE-CD2 4.3Å; M140-L143 PolarHBondContact O-N 2.83Å; M140-L143 HydrophobicContact SD-CD2 4.01Å; M140-L144 WeakPolarHBondContact O-CB 3.44Å; M140-L144 PolarHBondContact O-N 3.45Å
141E98.7Very high97.7Very high30 Ų3067.8 Ų67.814%0.1433%0.326CS..Hα-helixtrans-57.8-50.6173.6170.1175.4-132.500110.9T105 F108 V109 K112 L137 L138 Q139 L143 L144 V145T105-E141 HydrophobicContact CG2-CB 3.96Å; T105-E141 VanDerWaalsContact CG2-N 3.3Å; F108-E141 WeakPolarHBondContact CE1-OE2 3.41Å; V109-E141 HydrophobicContact CG2-CG 3.9Å; K112-E141 VanDerWaalsContact NZ-CD 3.32Å; K112-E141 IonicContact NZ-OE1 3.38Å; K112-E141 PolarHBondContact NZ-OE1 3.09Å; K112-E141 IonicContact NZ-OE2 3.72Å; K112-E141 PolarHBondContact NZ-OE2 3.15Å; L137-E141 PolarHBondContact O-N 3.3Å; L138-E141 PolarHBondContact O-N 2.74Å; Q139-E141 VanDerWaalsContact C-N 3.32Å; E141-L143 VanDerWaalsContact C-N 3.26Å; E141-L143 PolarHBondContact O-N 3.4Å; E141-L144 PolarHBondContact O-N 3.1Å; E141-V145 HydrophobicContact CG-CG2 4.28Å; E141-V145 WeakPolarHBondContact O-CG2 3.5Å; E141-V145 PolarHBondContact O-N 3.4Å
142L98.3Very high97.7Very high110 Ų11065.1 Ų65.158%0.57631%0.306SS*.Hα-helixtrans-58.7-40.9177.6-67.8172.8000111.3L138 Q139 N146L138-L142 PolarHBondContact O-N 3.06Å; Q139-L142 PolarHBondContact O-N 3.28Å; L142-N146 VanDerWaalsContact O-CB 3.24Å; L142-N146 WeakPolarHBondContact O-CB 3.44Å; L142-N146 VanDerWaalsContact O-CG 3.24Å; L142-N146 PolarHBondContact O-N 3.03Å; L142-N146 PolarHBondContact O-ND2 2.88Å
143L98.4Very high97.6Very high66 Ų6668.1 Ų68.135%0.34633%0.332SS..Hα-helixtrans-65.3-48.3176.7-178.362.2000111.5F88 Q139 M140 E141 N146 K147F88-L143 HydrophobicContact CE2-CD2 4.42Å; F88-L143 HydrophobicContact CE2-CG 4.11Å; F88-L143 HydrophobicContact CZ-CD2 4.07Å; F88-L143 HydrophobicContact CZ-CG 4.25Å; Q139-L143 PolarHBondContact O-N 3.27Å; Q139-L143 VanDerWaalsContact O-N 3.16Å; M140-L143 HydrophobicContact CE-CD2 4.3Å; M140-L143 PolarHBondContact O-N 2.83Å; M140-L143 HydrophobicContact SD-CD2 4.01Å; E141-L143 VanDerWaalsContact C-N 3.26Å; E141-L143 PolarHBondContact O-N 3.4Å; L143-N146 PolarHBondContact O-N 3.44Å; L143-K147 HydrophobicContact CD1-CG 3.96Å; L143-K147 HydrophobicContact CG-CG 4.37Å; L143-K147 WeakPolarHBondContact O-CB 3.44Å; L143-K147 WeakPolarHBondContact O-CG 3.41Å; L143-K147 PolarHBondContact O-N 3.1Å
144L98.6Very high97.5Very high0 Ų061.5 Ų61.50%031%0.309CS..Hα-helixtrans-57.6-56.3-179.5175.962.4000110.9F88 L102 T105 V109 M140 E141 N146 K147 L148F88-L144 HydrophobicContact CB-CD1 3.85Å; F88-L144 HydrophobicContact CD2-CD1 3.59Å; F88-L144 HydrophobicContact CE2-CD1 4.5Å; F88-L144 HydrophobicContact CG-CD1 4.01Å; L102-L144 HydrophobicContact CD1-CD1 4.14Å; T105-L144 HydrophobicContact CG2-CB 4.28Å; T105-L144 HydrophobicContact CG2-CD2 3.85Å; V109-L144 HydrophobicContact CB-CD2 4.43Å; V109-L144 HydrophobicContact CG2-CD2 4.05Å; M140-L144 WeakPolarHBondContact O-CB 3.44Å; M140-L144 PolarHBondContact O-N 3.45Å; E141-L144 PolarHBondContact O-N 3.1Å; L144-N146 VanDerWaalsContact C-N 3.32Å; L144-N146 PolarHBondContact O-N 3.45Å; L144-K147 PolarHBondContact O-N 3.03Å; L144-L148 HydrophobicContact CD1-CD1 3.8Å; L144-L148 HydrophobicContact CD1-CG 4.12Å; L144-L148 HydrophobicContact CG-CD1 4.23Å; L144-L148 WeakPolarHBondContact O-CG 3.27Å; L144-L148 PolarHBondContact O-N 3.47Å
145V98.4Very high97.3Very high9 Ų960.7 Ų60.76%0.05530%0.301CS..Hα-helixtrans-62.4-40.7-175.9176.90000111.1V109 E141 L148 K149 W150 L152V109-V145 HydrophobicContact CG1-CG2 4.26Å; V109-V145 HydrophobicContact CG2-CG2 4.16Å; E141-V145 HydrophobicContact CG-CG2 4.28Å; E141-V145 WeakPolarHBondContact O-CG2 3.5Å; E141-V145 PolarHBondContact O-N 3.4Å; V145-L148 CarbonylContact O-C 3.53Å; V145-L148 PolarHBondContact O-N 3.32Å; V145-K149 PolarHBondContact O-N 2.92Å; V145-K149 VanDerWaalsContact O-N 3.11Å; V145-W150 HydrophobicContact CG1-CB 4.37Å; V145-W150 HydrophobicContact CG1-CD2 3.34Å; V145-W150 HydrophobicContact CG1-CE3 3.63Å; V145-W150 HydrophobicContact CG1-CG 3.7Å; V145-W150 HydrophobicContact CG1-CH2 4.24Å; V145-W150 HydrophobicContact CG1-CZ2 3.99Å; V145-W150 HydrophobicContact CG1-CZ3 4.07Å; V145-W150 PolarHBondContact O-N 2.97Å; V145-L152 HydrophobicContact CG1-CD1 4.14Å; V145-L152 HydrophobicContact CG2-CD1 4.16Å; V145-L152 HydrophobicContact CG2-CD2 4.33Å
146N97.9Very high97.2Very high92 Ų9257.9 Ų57.949%0.49229%0.286SS..Hα-helixtrans-67.5-40.4177.2-75.9-42.5000112.6L142 L143 L144 L148 K149 W150L142-N146 VanDerWaalsContact O-CB 3.24Å; L142-N146 WeakPolarHBondContact O-CB 3.44Å; L142-N146 VanDerWaalsContact O-CG 3.24Å; L142-N146 PolarHBondContact O-N 3.03Å; L142-N146 PolarHBondContact O-ND2 2.88Å; L143-N146 PolarHBondContact O-N 3.44Å; L144-N146 VanDerWaalsContact C-N 3.32Å; L144-N146 PolarHBondContact O-N 3.45Å; N146-L148 VanDerWaalsContact C-N 3.31Å; N146-L148 PolarHBondContact O-N 2.95Å; N146-K149 PolarHBondContact O-N 3.4Å; N146-W150 PolarHBondContact OD1-NE1 2.88Å; N146-W150 VanDerWaalsContact OD1-NE1 3.16Å
147K97.9Very high97.1Very high75 Ų7554.9 Ų54.933%0.32627%0.273SS..Hα-helixtrans-66.3-35.2176.5-70.8-68.2179.6175.80112F88 L91 E92 L143 L144 K149F88-K147 HydrophobicContact CD2-CB 4.16Å; F88-K147 HydrophobicContact CE2-CB 4.09Å; F88-K147 HydrophobicContact CE2-CG 3.98Å; L91-K147 WeakPolarHBondContact CD1-O 3.2Å; E92-K147 VanDerWaalsContact CD-CE 3.45Å; E92-K147 VanDerWaalsContact CD-NZ 3.28Å; E92-K147 HydrophobicContact CG-CD 3.76Å; E92-K147 HydrophobicContact CG-CG 4.09Å; E92-K147 WeakPolarHBondContact OE1-CD 3.46Å; E92-K147 WeakPolarHBondContact OE1-CE 3.47Å; E92-K147 IonicContact OE1-NZ 2.64Å; E92-K147 PolarHBondContact OE1-NZ 3.1Å; E92-K147 IonicContact OE2-NZ 3.65Å; L143-K147 HydrophobicContact CD1-CG 3.96Å; L143-K147 HydrophobicContact CG-CG 4.37Å; L143-K147 WeakPolarHBondContact O-CB 3.44Å; L143-K147 WeakPolarHBondContact O-CG 3.41Å; L143-K147 PolarHBondContact O-N 3.1Å; L144-K147 PolarHBondContact O-N 3.03Å; K147-K149 PolarHBondContact O-N 2.9Å
148L97.1Very high96.9Very high5 Ų555.3 Ų55.33%0.02628%0.275CS..THydrogen-bonded Turntrans-793172.4-60.1-173.7000113.5Y84 R87 L91 L144 V145 N146 W150 N151 L152Y84-L148 HydrophobicContact CD1-CD1 3.76Å; Y84-L148 HydrophobicContact CG-CD1 4.08Å; R87-L148 HydrophobicContact CB-CD2 3.59Å; L91-L148 HydrophobicContact CD1-CD2 4.41Å; L144-L148 HydrophobicContact CD1-CD1 3.8Å; L144-L148 HydrophobicContact CD1-CG 4.12Å; L144-L148 HydrophobicContact CG-CD1 4.23Å; L144-L148 WeakPolarHBondContact O-CG 3.27Å; L144-L148 PolarHBondContact O-N 3.47Å; V145-L148 CarbonylContact O-C 3.53Å; V145-L148 PolarHBondContact O-N 3.32Å; N146-L148 VanDerWaalsContact C-N 3.31Å; N146-L148 PolarHBondContact O-N 2.95Å; L148-W150 PolarHBondContact O-N 2.85Å; L148-N151 WeakPolarHBondContact O-CB 3.19Å; L148-N151 PolarHBondContact O-N 2.84Å; L148-L152 HydrophobicContact CD1-CD2 4.25Å
149K97.3Very high96.7Very high179 Ų17953.5 Ų53.578%0.77827%0.266SS*.THydrogen-bonded Turntrans52.637-178.8-56.4-179.7-179.1177.10112.9V145 N146 K147 N151V145-K149 PolarHBondContact O-N 2.92Å; V145-K149 VanDerWaalsContact O-N 3.11Å; N146-K149 PolarHBondContact O-N 3.4Å; K147-K149 PolarHBondContact O-N 2.9Å; K149-N151 PolarHBondContact O-N 3.08Å
150W97.1Very high96.5Very high182 Ų18247.6 Ų47.669%0.68924%0.238SC*.THydrogen-bonded Turntrans59.411.9-176.7-62.672.2000114.6V145 N146 L148 L152V145-W150 HydrophobicContact CG1-CB 4.37Å; V145-W150 HydrophobicContact CG1-CD2 3.34Å; V145-W150 HydrophobicContact CG1-CE3 3.63Å; V145-W150 HydrophobicContact CG1-CG 3.7Å; V145-W150 HydrophobicContact CG1-CH2 4.24Å; V145-W150 HydrophobicContact CG1-CZ2 3.99Å; V145-W150 HydrophobicContact CG1-CZ3 4.07Å; V145-W150 PolarHBondContact O-N 2.97Å; N146-W150 PolarHBondContact OD1-NE1 2.88Å; N146-W150 VanDerWaalsContact OD1-NE1 3.16Å; L148-W150 PolarHBondContact O-N 2.85Å; W150-L152 PolarHBondContact O-N 3.41Å
151N95.9Very high96.3Very high54 Ų5447.5 Ų47.529%0.28924%0.238SC..  trans-80.273.4174.1-172.511.7000109.9C38 R87 L148 K149C38-N151 PolarHBondContact SG-ND2 2.8Å; R87-N151 PolarHBondContact NH1-O 3.29Å; R87-N151 PolarHBondContact NH2-O 2.5Å; L148-N151 WeakPolarHBondContact O-CB 3.19Å; L148-N151 PolarHBondContact O-N 2.84Å; K149-N151 PolarHBondContact O-N 3.08Å
152L96.2Very high96Very high17 Ų1749.2 Ų49.29%0.08925%0.246CC..  trans-94.4-22.8-176.2-58-178.4000112.6Y84 V109 M113 V145 L148 W150 A154Y84-L152 HydrophobicContact CE1-CB 4.42Å; Y84-L152 HydrophobicContact CE1-CD2 4.12Å; Y84-L152 PolarHBondContact OH-O 3.45Å; V109-L152 HydrophobicContact CG1-CD1 3.86Å; V109-L152 HydrophobicContact CG1-CD2 4.01Å; V109-L152 HydrophobicContact CG1-CG 4.49Å; M113-L152 HydrophobicContact CE-CB 4.1Å; M113-L152 HydrophobicContact CG-CB 4.34Å; M113-L152 HydrophobicContact SD-CB 4.09Å; M113-L152 HydrophobicContact SD-CD1 4.23Å; V145-L152 HydrophobicContact CG1-CD1 4.14Å; V145-L152 HydrophobicContact CG2-CD1 4.16Å; V145-L152 HydrophobicContact CG2-CD2 4.33Å; L148-L152 HydrophobicContact CD1-CD2 4.25Å; W150-L152 PolarHBondContact O-N 3.41Å; L152-A154 PolarHBondContact O-N 3.19Å
153A93.8Very high95.6Very high75 Ų7544.3 Ų44.362%0.6222%0.22SC*.  trans-77.955.8179.100000112.1
154A94.1Very high95.3Very high7 Ų741.2 Ų41.26%0.05820%0.204CC..  trans-73.1143175.800000110.7C38 L80 N83 L152C38-A154 HydrophobicContact CB-CB 3.7Å; L80-A154 HydrophobicContact CD1-CB 3.9Å; N83-A154 WeakPolarHBondContact OD1-CB 3.45Å; L152-A154 PolarHBondContact O-N 3.19Å
155M94.4Very high94.9Very high32 Ų3241.3 Ų41.316%0.15820%0.204CC..  trans-68.6136.1172.2-59.9-54.1-48.200110M31 A34 E35 D159 F160 P200M31-M155 HydrophobicContact CB-CE 3.8Å; M31-M155 HydrophobicContact CB-CG 4.48Å; M31-M155 HydrophobicContact CB-SD 4.19Å; M31-M155 HydrophobicContact CE-CE 3.54Å; M31-M155 HydrophobicContact CG-CE 3.56Å; M31-M155 HydrophobicContact CG-SD 4.15Å; M31-M155 WeakPolarHBondContact O-CG 3.32Å; M31-M155 HydrophobicContact SD-CE 4.34Å; A34-M155 HydrophobicContact CB-CG 3.76Å; A34-M155 HydrophobicContact CB-SD 4.15Å; E35-M155 HydrophobicContact CB-CB 4.14Å; E35-M155 HydrophobicContact CB-CG 4.37Å; M155-D159 HydrophobicContact CE-CB 3.44Å; M155-D159 VanDerWaalsContact CE-CB 3.44Å; M155-F160 HydrophobicContact CB-CE2 3.92Å; M155-P200 VanDerWaalsContact O-CG 3.32Å; M155-P200 WeakPolarHBondContact O-CG 3.33Å
156T95.3Very high94.4Very high3 Ų343.3 Ų43.32%0.01822%0.216CC..  trans-107.4157.5175.668.70000110.1E76 L80 H158 D159 F160E76-T156 HydrophobicContact CB-CG2 4.37Å; L80-T156 HydrophobicContact CB-CG2 4.05Å; L80-T156 HydrophobicContact CD1-CG2 4.31Å; T156-H158 PolarHBondContact O-N 2.92Å; T156-D159 WeakPolarHBondContact CA-OD2 3.22Å; T156-D159 WeakPolarHBondContact CB-OD2 3.2Å; T156-D159 PolarHBondContact N-OD2 3.07Å; T156-D159 PolarHBondContact O-N 3.43Å; T156-D159 VanDerWaalsContact O-N 3.12Å; T156-D159 VanDerWaalsContact OG1-CG 3.29Å; T156-D159 PolarHBondContact OG1-N 3.16Å; T156-D159 PolarHBondContact OG1-OD2 3.02Å; T156-F160 WeakPolarHBondContact O-CD2 3.39Å
157P96.4Very high93.9Very high10 Ų1042.7 Ų42.77%0.06521%0.209CC..Hα-helixtrans-57.3-31.3174.5-26.936.8000112.8D159 F160 I161 V186 P200 I203 A204P157-D159 VanDerWaalsContact C-N 3.33Å; P157-D159 PolarHBondContact O-N 3.42Å; P157-F160 PolarHBondContact O-N 2.9Å; P157-F160 VanDerWaalsContact O-N 3.16Å; P157-I161 WeakPolarHBondContact O-CG1 3.45Å; P157-I161 PolarHBondContact O-N 3.08Å; P157-V186 HydrophobicContact CB-CB 4.38Å; P157-V186 HydrophobicContact CB-CG1 3.82Å; P157-V186 HydrophobicContact CB-CG2 3.57Å; P157-V186 HydrophobicContact CG-CG1 3.84Å; P157-V186 HydrophobicContact CG-CG2 4.35Å; P157-P200 HydrophobicContact CG-CB 4.12Å; P157-I203 HydrophobicContact CB-CB 4.5Å; P157-I203 HydrophobicContact CB-CG2 4.33Å; P157-I203 HydrophobicContact CG-CB 4.21Å; P157-I203 HydrophobicContact CG-CG2 4.1Å; P157-A204 HydrophobicContact CB-CB 4.03Å; P157-A204 VanDerWaalsContact O-CB 3.28Å; P157-A204 WeakPolarHBondContact O-CB 3.12Å
158H94.4Very high93.3Very high9 Ų939.3 Ų39.34%0.04220%0.195CC..Hα-helixtrans-59.4-40.8176.4-65.4106.1000113.1E75 E76 T156 F160 I161 E162 Q183E75-H158 PolarHBondContact O-CE1 3.27Å; E76-H158 HydrophobicContact CG-CB 3.56Å; T156-H158 PolarHBondContact O-N 2.92Å; H158-F160 PolarHBondContact O-N 3.44Å; H158-I161 PolarHBondContact O-N 3.25Å; H158-E162 PolarHBondContact O-N 2.85Å; H158-Q183 WeakPolarHBondContact NE2-CG 3.19Å
159D92.9Very high92.8Very high42 Ų4243.4 Ų43.423%0.22522%0.222CC..Hα-helixtrans-60.7-35.7178.3-56-60.9000111.1M31 K114 M155 T156 P157 H163M31-D159 HydrophobicContact CE-CB 3.8Å; M31-D159 VanDerWaalsContact CE-O 3.31Å; M31-D159 WeakPolarHBondContact CE-O 3.37Å; K114-D159 IonicContact NZ-OD1 3.52Å; M155-D159 HydrophobicContact CE-CB 3.44Å; M155-D159 VanDerWaalsContact CE-CB 3.44Å; T156-D159 WeakPolarHBondContact CA-OD2 3.22Å; T156-D159 WeakPolarHBondContact CB-OD2 3.2Å; T156-D159 PolarHBondContact N-OD2 3.07Å; T156-D159 PolarHBondContact O-N 3.43Å; T156-D159 VanDerWaalsContact O-N 3.12Å; T156-D159 VanDerWaalsContact OG1-CG 3.29Å; T156-D159 PolarHBondContact OG1-N 3.16Å; T156-D159 PolarHBondContact OG1-OD2 3.02Å; P157-D159 VanDerWaalsContact C-N 3.33Å; P157-D159 PolarHBondContact O-N 3.42Å; D159-H163 PolarHBondContact O-N 3.46Å
160F95Very high92.3Very high0 Ų035.9 Ų35.90%019%0.19CC..Hα-helixtrans-77.9-38.9175.8-70.1-79.8000112.8L28 M31 L32 E35 M155 T156 P157 H158 E162 H163 F164 P200 A204L28-F160 HydrophobicContact CD1-CD1 3.94Å; L28-F160 HydrophobicContact CD1-CE1 3.92Å; M31-F160 HydrophobicContact CB-CE1 3.88Å; M31-F160 HydrophobicContact CB-CZ 3.86Å; M31-F160 HydrophobicContact CE-CD1 4Å; M31-F160 HydrophobicContact CE-CE1 4.14Å; M31-F160 HydrophobicContact CE-CG 4.24Å; L32-F160 HydrophobicContact CD2-CE1 3.72Å; L32-F160 HydrophobicContact CD2-CZ 4.11Å; L32-F160 HydrophobicContact CG-CE1 4.14Å; E35-F160 HydrophobicContact CG-CZ 4.45Å; E35-F160 WeakPolarHBondContact OE2-CE2 3.33Å; E35-F160 WeakPolarHBondContact OE2-CZ 3.37Å; M155-F160 HydrophobicContact CB-CE2 3.92Å; T156-F160 WeakPolarHBondContact O-CD2 3.39Å; P157-F160 PolarHBondContact O-N 2.9Å; P157-F160 VanDerWaalsContact O-N 3.16Å; H158-F160 PolarHBondContact O-N 3.44Å; F160-E162 VanDerWaalsContact C-N 3.34Å; F160-E162 PolarHBondContact O-N 3.07Å; F160-H163 WeakPolarHBondContact O-CB 3.28Å; F160-H163 PolarHBondContact O-N 2.86Å; F160-H163 VanDerWaalsContact O-N 3.17Å; F160-F164 HydrophobicContact CB-CE1 4.37Å; F160-F164 HydrophobicContact CB-CE2 3.89Å; F160-F164 HydrophobicContact CB-CZ 3.77Å; F160-F164 HydrophobicContact CD1-CE1 4.42Å; F160-F164 HydrophobicContact CD1-CZ 4.18Å; F160-F164 HydrophobicContact CG-CZ 4.38Å; F160-F164 WeakPolarHBondContact O-CD1 3.33Å; F160-F164 VanDerWaalsContact O-CD2 3.29Å; F160-F164 WeakPolarHBondContact O-CD2 3.22Å; F160-F164 WeakPolarHBondContact O-CG 3.32Å; F160-F164 PolarHBondContact O-N 3.41Å; F160-P200 HydrophobicContact CD2-CB 4.21Å; F160-P200 HydrophobicContact CE2-CB 4.02Å; F160-A204 HydrophobicContact CB-CB 3.56Å
161I94.8Very high91.9Very high0 Ų030.1 Ų30.10%018%0.181CC..Hα-helixtrans-56.1-49.1176.1-70.8167.4000110.3P157 H158 H163 F164 L165 A182 V186 A204 V208P157-I161 WeakPolarHBondContact O-CG1 3.45Å; P157-I161 PolarHBondContact O-N 3.08Å; H158-I161 PolarHBondContact O-N 3.25Å; I161-H163 VanDerWaalsContact C-N 3.31Å; I161-H163 PolarHBondContact O-N 3.46Å; I161-F164 PolarHBondContact O-N 3.48Å; I161-L165 HydrophobicContact CG2-CD1 3.75Å; I161-L165 HydrophobicContact CG2-CG 4.2Å; I161-L165 WeakPolarHBondContact O-CB 3.09Å; I161-L165 WeakPolarHBondContact O-CG 3.29Å; I161-L165 PolarHBondContact O-N 2.89Å; I161-A182 HydrophobicContact CD1-CB 3.81Å; I161-A182 HydrophobicContact CG1-CB 4.41Å; I161-V186 HydrophobicContact CD1-CG2 3.73Å; I161-A204 HydrophobicContact CG1-CB 3.92Å; I161-V208 HydrophobicContact CG1-CG2 4Å; I161-V208 HydrophobicContact CG2-CG2 4.33Å
162E90.9Very high91.5Very high67 Ų6732.9 Ų32.931%0.31319%0.192SC..Hα-helixtrans-62.5-39.4178.2-67.3-49.7127.500112.1H158 F160 F164 T166 R179H158-E162 PolarHBondContact O-N 2.85Å; F160-E162 VanDerWaalsContact C-N 3.34Å; F160-E162 PolarHBondContact O-N 3.07Å; E162-F164 PolarHBondContact O-N 3.18Å; E162-T166 WeakPolarHBondContact O-CB 3.29Å; E162-T166 PolarHBondContact O-N 3.3Å; E162-T166 VanDerWaalsContact O-N 3.07Å; E162-T166 PolarHBondContact O-OG1 3.47Å; E162-R179 WeakPolarHBondContact OE1-CD 3.36Å; E162-R179 IonicContact OE1-CZ 3.6Å; E162-R179 IonicContact OE1-NE 2.78Å; E162-R179 PolarHBondContact OE1-NE 3.35Å; E162-R179 IonicContact OE1-NH2 2.7Å; E162-R179 IonicContact OE2-CZ 2.81Å; E162-R179 IonicContact OE2-NE 3.74Å; E162-R179 PolarHBondContact OE2-NE 3.04Å; E162-R179 IonicContact OE2-NH2 3.37Å; E162-R179 PolarHBondContact OE2-NH2 3.23Å
163H90.8Very high91.2Very high7 Ų738.3 Ų38.33%0.03222%0.221CC..Hα-helixtrans-62.2-43.6175.5-164.391000111.6D159 F160 I161 K167D159-H163 PolarHBondContact O-N 3.46Å; F160-H163 WeakPolarHBondContact O-CB 3.28Å; F160-H163 PolarHBondContact O-N 2.86Å; F160-H163 VanDerWaalsContact O-N 3.17Å; I161-H163 VanDerWaalsContact C-N 3.31Å; I161-H163 PolarHBondContact O-N 3.46Å; H163-K167 WeakPolarHBondContact O-CG 3.42Å; H163-K167 PolarHBondContact O-N 2.96Å
164F92.2Very high91Very high1 Ų136.6 Ų36.60%0.00420%0.203CC..Hα-helixtrans-65.7-50.8178.5-57.9-23.9000111.2F160 I161 E162 T166 K167 M168 A204 A205 V208 L233 V236 I237F160-F164 HydrophobicContact CB-CE1 4.37Å; F160-F164 HydrophobicContact CB-CE2 3.89Å; F160-F164 HydrophobicContact CB-CZ 3.77Å; F160-F164 HydrophobicContact CD1-CE1 4.42Å; F160-F164 HydrophobicContact CD1-CZ 4.18Å; F160-F164 HydrophobicContact CG-CZ 4.38Å; F160-F164 WeakPolarHBondContact O-CD1 3.33Å; F160-F164 VanDerWaalsContact O-CD2 3.29Å; F160-F164 WeakPolarHBondContact O-CD2 3.22Å; F160-F164 WeakPolarHBondContact O-CG 3.32Å; F160-F164 PolarHBondContact O-N 3.41Å; I161-F164 PolarHBondContact O-N 3.48Å; E162-F164 PolarHBondContact O-N 3.18Å; F164-T166 PolarHBondContact O-N 2.84Å; F164-K167 PolarHBondContact O-N 3.33Å; F164-M168 HydrophobicContact CB-CE 4.14Å; F164-M168 WeakPolarHBondContact O-CG 3.41Å; F164-M168 PolarHBondContact O-N 2.98Å; F164-A204 HydrophobicContact CE2-CB 3.81Å; F164-A205 HydrophobicContact CE2-CB 3.96Å; F164-A205 HydrophobicContact CZ-CB 4.44Å; F164-V208 HydrophobicContact CD2-CG2 4.43Å; F164-L233 HydrophobicContact CB-CD2 3.98Å; F164-L233 HydrophobicContact CD1-CD2 3.92Å; F164-L233 HydrophobicContact CD2-CD2 3.81Å; F164-L233 HydrophobicContact CE1-CD2 4.39Å; F164-L233 HydrophobicContact CE2-CD2 4.27Å; F164-L233 HydrophobicContact CG-CD2 3.63Å; F164-V236 HydrophobicContact CD1-CG1 3.96Å; F164-V236 HydrophobicContact CE1-CG1 3.62Å; F164-I237 HydrophobicContact CE1-CG2 3.93Å; F164-I237 HydrophobicContact CZ-CG2 3.48Å; F164-I237 VanDerWaalsContact CZ-CG2 3.48Å
165L90.9Very high90.9Very high1 Ų137.4 Ų37.41%0.00521%0.205CC..Hα-helixtrans-59.2-33.7-179.2-70.3177.1000112.6I161 K167 M168 K175 I178 R179I161-L165 HydrophobicContact CG2-CD1 3.75Å; I161-L165 HydrophobicContact CG2-CG 4.2Å; I161-L165 WeakPolarHBondContact O-CB 3.09Å; I161-L165 WeakPolarHBondContact O-CG 3.29Å; I161-L165 PolarHBondContact O-N 2.89Å; L165-K167 VanDerWaalsContact C-N 3.3Å; L165-K167 PolarHBondContact O-N 3.01Å; L165-M168 HydrophobicContact CD2-SD 4.34Å; L165-M168 PolarHBondContact O-N 3.12Å; L165-K175 HydrophobicContact CB-CD 4.4Å; L165-K175 HydrophobicContact CD2-CB 4.38Å; L165-K175 HydrophobicContact CD2-CG 4.39Å; L165-K175 WeakPolarHBondContact O-CE 3.49Å; L165-K175 PolarHBondContact O-NZ 2.9Å; L165-I178 HydrophobicContact CD2-CB 4.16Å; L165-I178 HydrophobicContact CD2-CG2 3.82Å; L165-R179 HydrophobicContact CD1-CB 3.82Å; L165-R179 HydrophobicContact CD1-CG 4.43Å
166T88.1Confident90.7Very high51 Ų5140.8 Ų40.831%0.31322%0.221SC..Hα-helixtrans-64.1-36.2175.3-57.70000112.1L23 E162 F164 M168L23-T166 HydrophobicContact CB-CG2 4.34Å; L23-T166 HydrophobicContact CD1-CG2 3.54Å; L23-T166 HydrophobicContact CD2-CG2 4.01Å; L23-T166 HydrophobicContact CG-CG2 4.15Å; E162-T166 WeakPolarHBondContact O-CB 3.29Å; E162-T166 PolarHBondContact O-N 3.3Å; E162-T166 VanDerWaalsContact O-N 3.07Å; E162-T166 PolarHBondContact O-OG1 3.47Å; F164-T166 PolarHBondContact O-N 2.84Å; T166-M168 VanDerWaalsContact C-N 3.32Å
167K86.1Confident90.6Very high80 Ų8044.7 Ų44.735%0.34824%0.241SC..Hα-helixtrans-81.6-12.3-179.4-60.5-81.2178169.40112.8L23 D25 H163 F164 L165 F232L23-K167 WeakPolarHBondContact O-CE 3.19Å; L23-K167 PolarHBondContact O-NZ 3.43Å; D25-K167 IonicContact OD1-NZ 3.61Å; D25-K167 PolarHBondContact OD1-NZ 3.14Å; H163-K167 WeakPolarHBondContact O-CG 3.42Å; H163-K167 PolarHBondContact O-N 2.96Å; F164-K167 PolarHBondContact O-N 3.33Å; L165-K167 VanDerWaalsContact C-N 3.3Å; L165-K167 PolarHBondContact O-N 3.01Å; K167-F232 HydrophobicContact CB-CZ 3.81Å
168M86.4Confident90.4Very high3 Ų344.2 Ų44.22%0.01524%0.238CC..SBendtrans-86.2129.5179-61.9-176-175.100111.2F164 L165 T166 L170 K175 V208 F223 L229 F232 L233F164-M168 HydrophobicContact CB-CE 4.14Å; F164-M168 WeakPolarHBondContact O-CG 3.41Å; F164-M168 PolarHBondContact O-N 2.98Å; L165-M168 HydrophobicContact CD2-SD 4.34Å; L165-M168 PolarHBondContact O-N 3.12Å; T166-M168 VanDerWaalsContact C-N 3.32Å; M168-L170 HydrophobicContact CB-CD1 3.85Å; M168-L170 HydrophobicContact CB-CG 3.89Å; M168-L170 PolarHBondContact O-N 3.42Å; M168-L170 HydrophobicContact SD-CD1 4.09Å; M168-K175 WeakPolarHBondContact O-CE 3.13Å; M168-V208 HydrophobicContact CE-CG1 3.73Å; M168-F223 HydrophobicContact CB-CE1 4.12Å; M168-F223 HydrophobicContact CG-CE1 3.93Å; M168-L229 HydrophobicContact CE-CD1 3.48Å; M168-L229 VanDerWaalsContact CE-CD1 3.48Å; M168-L229 HydrophobicContact SD-CD1 4.32Å; M168-F232 HydrophobicContact CE-CE1 4.44Å; M168-L233 HydrophobicContact CE-CD1 4.48Å; M168-L233 HydrophobicContact CE-CD2 4.1Å
169P85.3Confident90.4Very high91 Ų9145.5 Ų45.559%0.59124%0.242SC*.  trans-78.867.6178.433.9-35.5000111F223P169-F223 HydrophobicContact CG-CD1 4.2Å; P169-F223 HydrophobicContact CG-CD2 4.31Å; P169-F223 HydrophobicContact CG-CE1 4.46Å; P169-F223 HydrophobicContact CG-CG 4.14Å
170L86.8Confident90.5Very high21 Ų2150.2 Ų50.211%0.1126%0.261CS..  trans-119.5155.3-177.4-56.8175.6000111.4M168 K175 I178 L224M168-L170 HydrophobicContact CB-CD1 3.85Å; M168-L170 HydrophobicContact CB-CG 3.89Å; M168-L170 PolarHBondContact O-N 3.42Å; M168-L170 HydrophobicContact SD-CD1 4.09Å; L170-K175 HydrophobicContact CB-CG 3.89Å; L170-K175 HydrophobicContact CD1-CG 4.45Å; L170-K175 VanDerWaalsContact O-CE 3.24Å; L170-K175 WeakPolarHBondContact O-CE 3.3Å; L170-I178 HydrophobicContact CD1-CD1 3.64Å; L170-L224 HydrophobicContact CD1-CD1 4.31Å; L170-L224 HydrophobicContact CD1-CD2 4Å; L170-L224 HydrophobicContact CD2-CD1 3.66Å; L170-L224 HydrophobicContact CD2-CD2 4.01Å; L170-L224 HydrophobicContact CD2-CG 3.87Å
171A88.9Confident90.4Very high61 Ų6153.8 Ų53.850%0.50428%0.277SS..  trans-65.2147.5168.500000110.6D173 T174 K175A171-D173 VanDerWaalsContact C-N 3.27Å; A171-D173 PolarHBondContact O-N 3.16Å; A171-T174 WeakPolarHBondContact O-CB 3.22Å; A171-T174 PolarHBondContact O-N 2.95Å; A171-T174 VanDerWaalsContact O-N 3.09Å; A171-K175 PolarHBondContact O-N 3.09Å
172E88.5Confident90.5Very high113 Ų11353.8 Ų53.853%0.52828%0.277SS..Hα-helixtrans-60.9-34.5-177.8-72-53.913600112.9T174 K175 Q176E172-T174 VanDerWaalsContact C-N 3.34Å; E172-T174 PolarHBondContact O-N 3.03Å; E172-K175 PolarHBondContact O-N 2.97Å; E172-K175 WeakPolarHBondContact OE1-CD 3.49Å; E172-K175 IonicContact OE1-NZ 3.19Å; E172-K175 PolarHBondContact OE1-NZ 3.4Å; E172-Q176 WeakPolarHBondContact O-CB 3.47Å; E172-Q176 PolarHBondContact O-N 2.72Å
173D89.8Confident90.7Very high130 Ų13052 Ų5270%0.69527%0.269SS*.Hα-helixtrans-61.1-43.3174.9-62.6-26.4000111.6A171 Q176 I177A171-D173 VanDerWaalsContact C-N 3.27Å; A171-D173 PolarHBondContact O-N 3.16Å; D173-Q176 PolarHBondContact O-N 3.09Å; D173-I177 WeakPolarHBondContact O-CG1 3.35Å; D173-I177 PolarHBondContact O-N 2.67Å; D173-I177 VanDerWaalsContact O-N 3.12Å
174T89.2Confident90.9Very high40 Ų4055.2 Ų55.225%0.24529%0.289CS..Hα-helixtrans-65.6-42176-49.80000111.2A171 E172 Q176 I177 I178 L217A171-T174 WeakPolarHBondContact O-CB 3.22Å; A171-T174 PolarHBondContact O-N 2.95Å; A171-T174 VanDerWaalsContact O-N 3.09Å; E172-T174 VanDerWaalsContact C-N 3.34Å; E172-T174 PolarHBondContact O-N 3.03Å; T174-Q176 VanDerWaalsContact C-N 3.3Å; T174-Q176 PolarHBondContact O-N 2.88Å; T174-I177 PolarHBondContact O-N 2.95Å; T174-I178 HydrophobicContact CG2-CD1 4.04Å; T174-I178 WeakPolarHBondContact O-CG1 3.41Å; T174-I178 PolarHBondContact O-N 2.87Å; T174-L217 HydrophobicContact CG2-CD1 3.82Å; T174-L217 HydrophobicContact CG2-CD2 4.4Å
175K91Very high91.1Very high23 Ų2356 Ų5610%0.129%0.293CS..Hα-helixtrans-61.4-39.9175.8-67-178.5-170.5168.30111.4L165 M168 L170 A171 E172 I177 I178 R179L165-K175 HydrophobicContact CB-CD 4.4Å; L165-K175 HydrophobicContact CD2-CB 4.38Å; L165-K175 HydrophobicContact CD2-CG 4.39Å; L165-K175 WeakPolarHBondContact O-CE 3.49Å; L165-K175 PolarHBondContact O-NZ 2.9Å; M168-K175 WeakPolarHBondContact O-CE 3.13Å; L170-K175 HydrophobicContact CB-CG 3.89Å; L170-K175 HydrophobicContact CD1-CG 4.45Å; L170-K175 VanDerWaalsContact O-CE 3.24Å; L170-K175 WeakPolarHBondContact O-CE 3.3Å; A171-K175 PolarHBondContact O-N 3.09Å; E172-K175 PolarHBondContact O-N 2.97Å; E172-K175 WeakPolarHBondContact OE1-CD 3.49Å; E172-K175 IonicContact OE1-NZ 3.19Å; E172-K175 PolarHBondContact OE1-NZ 3.4Å; K175-I177 PolarHBondContact O-N 3.28Å; K175-I178 PolarHBondContact O-N 3.39Å; K175-R179 WeakPolarHBondContact O-CB 3.32Å; K175-R179 PolarHBondContact O-N 2.94Å
176Q91.5Very high91.4Very high103 Ų10356.1 Ų56.148%0.48129%0.293SS..Hα-helixtrans-63.8-39.9177.8-175.161.319.100112.3E172 D173 T174 K180E172-Q176 WeakPolarHBondContact O-CB 3.47Å; E172-Q176 PolarHBondContact O-N 2.72Å; D173-Q176 PolarHBondContact O-N 3.09Å; T174-Q176 VanDerWaalsContact C-N 3.3Å; T174-Q176 PolarHBondContact O-N 2.88Å; Q176-K180 PolarHBondContact O-N 3.33Å; Q176-K180 VanDerWaalsContact O-N 3.09Å
177I92.3Very high91.8Very high86 Ų8654.4 Ų54.444%0.44128%0.284SS..Hα-helixtrans-65-51.5174.7-62165.8000109.7D173 T174 K175 R179 K180 H181 L215D173-I177 WeakPolarHBondContact O-CG1 3.35Å; D173-I177 PolarHBondContact O-N 2.67Å; D173-I177 VanDerWaalsContact O-N 3.12Å; T174-I177 PolarHBondContact O-N 2.95Å; K175-I177 PolarHBondContact O-N 3.28Å; I177-R179 VanDerWaalsContact C-N 3.29Å; I177-R179 PolarHBondContact O-N 3.44Å; I177-K180 PolarHBondContact O-N 3.4Å; I177-H181 PolarHBondContact O-CD2 3.24Å; I177-H181 VanDerWaalsContact O-CD2 3.25Å; I177-H181 PolarHBondContact O-N 3.41Å; I177-H181 VanDerWaalsContact O-N 3.1Å; I177-L215 HydrophobicContact CG2-CD1 3.57Å; I177-L215 HydrophobicContact CG2-CD2 4.02Å; I177-L215 HydrophobicContact CG2-CG 4.46Å
178I93.1Very high92.2Very high0 Ų052 Ų520%028%0.275CS..Hα-helixtrans-57.1-44.9178.9-65.7166.5000110.8L165 L170 T174 K175 K180 H181 A182 V208 A211 V212 L215 L217L165-I178 HydrophobicContact CD2-CB 4.16Å; L165-I178 HydrophobicContact CD2-CG2 3.82Å; L170-I178 HydrophobicContact CD1-CD1 3.64Å; T174-I178 HydrophobicContact CG2-CD1 4.04Å; T174-I178 WeakPolarHBondContact O-CG1 3.41Å; T174-I178 PolarHBondContact O-N 2.87Å; K175-I178 PolarHBondContact O-N 3.39Å; I178-K180 PolarHBondContact O-N 3.3Å; I178-H181 PolarHBondContact O-N 3.49Å; I178-A182 VanDerWaalsContact O-CB 3.28Å; I178-A182 WeakPolarHBondContact O-CB 3.32Å; I178-A182 PolarHBondContact O-N 2.99Å; I178-V208 HydrophobicContact CG2-CG1 4.21Å; I178-A211 HydrophobicContact CG2-CB 4.2Å; I178-V212 HydrophobicContact CD1-CG2 3.84Å; I178-V212 HydrophobicContact CG1-CG2 4.18Å; I178-V212 HydrophobicContact CG2-CG2 4.35Å; I178-L215 HydrophobicContact CG1-CD1 4.38Å; I178-L217 HydrophobicContact CD1-CD1 3.89Å; I178-L217 HydrophobicContact CG1-CD1 3.78Å
179R94.6Very high92.6Very high35 Ų3551.9 Ų51.913%0.13227%0.274CS..Hα-helixtrans-53.7-53.6176.9179.6-175.7-68.8107.33.5111E162 L165 K175 I177 H181 A182 Q183E162-R179 WeakPolarHBondContact OE1-CD 3.36Å; E162-R179 IonicContact OE1-CZ 3.6Å; E162-R179 IonicContact OE1-NE 2.78Å; E162-R179 PolarHBondContact OE1-NE 3.35Å; E162-R179 IonicContact OE1-NH2 2.7Å; E162-R179 IonicContact OE2-CZ 2.81Å; E162-R179 IonicContact OE2-NE 3.74Å; E162-R179 PolarHBondContact OE2-NE 3.04Å; E162-R179 IonicContact OE2-NH2 3.37Å; E162-R179 PolarHBondContact OE2-NH2 3.23Å; L165-R179 HydrophobicContact CD1-CB 3.82Å; L165-R179 HydrophobicContact CD1-CG 4.43Å; K175-R179 WeakPolarHBondContact O-CB 3.32Å; K175-R179 PolarHBondContact O-N 2.94Å; I177-R179 VanDerWaalsContact C-N 3.29Å; I177-R179 PolarHBondContact O-N 3.44Å; R179-H181 PolarHBondContact O-N 3.35Å; R179-A182 PolarHBondContact O-N 3.37Å; R179-Q183 HydrophobicContact CG-CG 4.4Å; R179-Q183 WeakPolarHBondContact O-CB 3.33Å; R179-Q183 WeakPolarHBondContact O-CG 3.33Å; R179-Q183 PolarHBondContact O-N 2.98Å; R179-Q183 PolarHBondContact O-OE1 2.97Å
180K93.6Very high93.1Very high141 Ų14148.2 Ų48.261%0.61325%0.252SS*.Hα-helixtrans-58.7-45.3-179.2-172.9178.1178.6178.30112.2Q176 I177 I178 Q183 T184Q176-K180 PolarHBondContact O-N 3.33Å; Q176-K180 VanDerWaalsContact O-N 3.09Å; I177-K180 PolarHBondContact O-N 3.4Å; I178-K180 PolarHBondContact O-N 3.3Å; K180-Q183 PolarHBondContact O-N 3.01Å; K180-T184 PolarHBondContact O-N 3.16Å; K180-T184 PolarHBondContact O-OG1 2.95Å
181H94.4Very high93.5Very high76 Ų7647.6 Ų47.635%0.35225%0.249SC..Hα-helixtrans-66.4-42.5178-78.9-83.5000112.3I177 I178 R179 Q183 T184 F185 A211I177-H181 PolarHBondContact O-CD2 3.24Å; I177-H181 VanDerWaalsContact O-CD2 3.25Å; I177-H181 PolarHBondContact O-N 3.41Å; I177-H181 VanDerWaalsContact O-N 3.1Å; I178-H181 PolarHBondContact O-N 3.49Å; R179-H181 PolarHBondContact O-N 3.35Å; H181-Q183 VanDerWaalsContact C-N 3.34Å; H181-Q183 PolarHBondContact O-N 3.08Å; H181-T184 WeakPolarHBondContact O-CB 3.34Å; H181-T184 PolarHBondContact O-N 3.02Å; H181-F185 VanDerWaalsContact O-CD2 3.23Å; H181-F185 WeakPolarHBondContact O-CD2 3.48Å; H181-F185 PolarHBondContact O-N 2.95Å; H181-F185 VanDerWaalsContact O-N 3.1Å; H181-A211 HydrophobicContact CB-CB 3.69Å
182A96.4Very high93.6Very high0 Ų045.8 Ų45.80%023%0.231CC..Hα-helixtrans-63.9-38.9177.400000111.8I161 I178 R179 T184 F185 V186 V208I161-A182 HydrophobicContact CD1-CB 3.81Å; I161-A182 HydrophobicContact CG1-CB 4.41Å; I178-A182 VanDerWaalsContact O-CB 3.28Å; I178-A182 WeakPolarHBondContact O-CB 3.32Å; I178-A182 PolarHBondContact O-N 2.99Å; R179-A182 PolarHBondContact O-N 3.37Å; A182-T184 PolarHBondContact O-N 3.32Å; A182-F185 PolarHBondContact O-N 2.79Å; A182-V186 WeakPolarHBondContact O-CG2 3.43Å; A182-V186 PolarHBondContact O-N 3.5Å; A182-V208 HydrophobicContact CB-CG2 4.15Å
183Q95.7Very high93.6Very high29 Ų2942.9 Ų42.914%0.13622%0.221CC..Hα-helixtrans-58.7-45.2174.1-72.8169-34.900111.6H158 R179 K180 H181 F185 V186 A187H158-Q183 WeakPolarHBondContact NE2-CG 3.19Å; R179-Q183 HydrophobicContact CG-CG 4.4Å; R179-Q183 WeakPolarHBondContact O-CB 3.33Å; R179-Q183 WeakPolarHBondContact O-CG 3.33Å; R179-Q183 PolarHBondContact O-N 2.98Å; R179-Q183 PolarHBondContact O-OE1 2.97Å; K180-Q183 PolarHBondContact O-N 3.01Å; H181-Q183 VanDerWaalsContact C-N 3.34Å; H181-Q183 PolarHBondContact O-N 3.08Å; Q183-F185 VanDerWaalsContact C-N 3.34Å; Q183-F185 PolarHBondContact O-N 2.92Å; Q183-V186 WeakPolarHBondContact O-CB 3.22Å; Q183-V186 PolarHBondContact O-N 3.01Å; Q183-A187 PolarHBondContact O-N 3.49Å
184T94.7Very high93.5Very high75 Ų7542.4 Ų42.446%0.4621%0.213SC..Hα-helixtrans-59.7-43.2174.3-54.50000112K180 H181 A182 A187 L188K180-T184 PolarHBondContact O-N 3.16Å; K180-T184 PolarHBondContact O-OG1 2.95Å; H181-T184 WeakPolarHBondContact O-CB 3.34Å; H181-T184 PolarHBondContact O-N 3.02Å; A182-T184 PolarHBondContact O-N 3.32Å; T184-A187 PolarHBondContact O-N 3.29Å; T184-L188 HydrophobicContact CG2-CD1 4.43Å; T184-L188 WeakPolarHBondContact O-CG 3.48Å; T184-L188 PolarHBondContact O-N 2.89Å
185F96.3Very high93.2Very high18 Ų1840.8 Ų40.88%0.07920%0.202CC..Hα-helixtrans-65.8-39.2176.7-65.8-42.7000112.8H181 A182 Q183 A187 L188 C189 S207 A210 A211 I251 L255H181-F185 VanDerWaalsContact O-CD2 3.23Å; H181-F185 WeakPolarHBondContact O-CD2 3.48Å; H181-F185 PolarHBondContact O-N 2.95Å; H181-F185 VanDerWaalsContact O-N 3.1Å; A182-F185 PolarHBondContact O-N 2.79Å; Q183-F185 VanDerWaalsContact C-N 3.34Å; Q183-F185 PolarHBondContact O-N 2.92Å; F185-A187 VanDerWaalsContact C-N 3.35Å; F185-A187 PolarHBondContact O-N 3.18Å; F185-L188 HydrophobicContact CD1-CD1 4.24Å; F185-L188 PolarHBondContact O-N 2.98Å; F185-C189 WeakPolarHBondContact O-CB 3.49Å; F185-C189 PolarHBondContact O-N 2.97Å; F185-C189 PolarHBondContact O-SG 3.23Å; F185-S207 WeakPolarHBondContact CB-OG 3.36Å; F185-S207 WeakPolarHBondContact CD2-O 3.32Å; F185-A210 HydrophobicContact CD2-CB 4.03Å; F185-A210 HydrophobicContact CE2-CB 3.84Å; F185-A210 HydrophobicContact CZ-CB 4.39Å; F185-A211 HydrophobicContact CD2-CB 4.39Å; F185-A211 HydrophobicContact CE2-CB 4.08Å; F185-I251 HydrophobicContact CB-CG2 3.83Å; F185-I251 HydrophobicContact CD1-CG2 3.65Å; F185-I251 HydrophobicContact CD2-CG2 4.45Å; F185-I251 HydrophobicContact CE1-CG2 4.36Å; F185-I251 HydrophobicContact CG-CG2 3.73Å; F185-L255 HydrophobicContact CE1-CB 4.44Å; F185-L255 HydrophobicContact CE1-CD1 4.14Å; F185-L255 HydrophobicContact CE1-CD2 3.83Å; F185-L255 HydrophobicContact CE1-CG 4.34Å; F185-L255 HydrophobicContact CZ-CD2 4.35Å
186V97.2Very high93.1Very high2 Ų240.4 Ų40.41%0.01220%0.201CC..Hα-helixtrans-59.4-46.3174.2166.70000111P79 P157 I161 A182 Q183 C189 A190 I203P79-V186 HydrophobicContact CB-CG1 4.27Å; P79-V186 HydrophobicContact CG-CG1 3.69Å; P157-V186 HydrophobicContact CB-CB 4.38Å; P157-V186 HydrophobicContact CB-CG1 3.82Å; P157-V186 HydrophobicContact CB-CG2 3.57Å; P157-V186 HydrophobicContact CG-CG1 3.84Å; P157-V186 HydrophobicContact CG-CG2 4.35Å; I161-V186 HydrophobicContact CD1-CG2 3.73Å; A182-V186 WeakPolarHBondContact O-CG2 3.43Å; A182-V186 PolarHBondContact O-N 3.5Å; Q183-V186 WeakPolarHBondContact O-CB 3.22Å; Q183-V186 PolarHBondContact O-N 3.01Å; V186-C189 PolarHBondContact O-N 3.03Å; V186-A190 PolarHBondContact O-N 2.71Å; V186-I203 HydrophobicContact CG2-CG2 4.26Å
187A95.4Very high92.8Very high16 Ų1638.5 Ų38.513%0.13220%0.199CC..Hα-helixtrans-60.8-46.3176.800000111.4L65 F78 Q183 T184 F185 C189 A190 T191L65-A187 HydrophobicContact CD1-CB 4.02Å; L65-A187 HydrophobicContact CD2-CB 4.36Å; F78-A187 HydrophobicContact CD1-CB 4.29Å; F78-A187 HydrophobicContact CE1-CB 4.26Å; Q183-A187 PolarHBondContact O-N 3.49Å; T184-A187 PolarHBondContact O-N 3.29Å; F185-A187 VanDerWaalsContact C-N 3.35Å; F185-A187 PolarHBondContact O-N 3.18Å; A187-C189 PolarHBondContact O-N 3.22Å; A187-A190 PolarHBondContact O-N 2.94Å; A187-T191 PolarHBondContact O-N 3.06Å
188L94.6Very high92.8Very high29 Ų2936.1 Ų36.115%0.15219%0.187CC..Hα-helixtrans-56.9-49.6175-74.7171.6000111.7T184 F185 A190 T191 L254 L255T184-L188 HydrophobicContact CG2-CD1 4.43Å; T184-L188 WeakPolarHBondContact O-CG 3.48Å; T184-L188 PolarHBondContact O-N 2.89Å; F185-L188 HydrophobicContact CD1-CD1 4.24Å; F185-L188 PolarHBondContact O-N 2.98Å; L188-A190 VanDerWaalsContact C-N 3.3Å; L188-A190 PolarHBondContact O-N 2.94Å; L188-T191 PolarHBondContact O-N 3.16Å; L188-T191 VanDerWaalsContact O-N 3.14Å; L188-T191 PolarHBondContact O-OG1 3.48Å; L188-L254 HydrophobicContact CB-CD2 4.16Å; L188-L254 WeakPolarHBondContact O-CD2 3.37Å; L188-L255 HydrophobicContact CD1-CB 4.48Å; L188-L255 HydrophobicContact CD1-CD1 3.69Å
189C96Very high92.8Very high0 Ų038.1 Ų38.10%020%0.2CC..Hα-helixtrans-56.5-43.6178.1-67.70000112.1F185 V186 A187 T191 D192 F195 I203 I251F185-C189 WeakPolarHBondContact O-CB 3.49Å; F185-C189 PolarHBondContact O-N 2.97Å; F185-C189 PolarHBondContact O-SG 3.23Å; V186-C189 PolarHBondContact O-N 3.03Å; A187-C189 PolarHBondContact O-N 3.22Å; C189-T191 PolarHBondContact O-N 2.73Å; C189-D192 PolarHBondContact O-N 3.21Å; C189-D192 VanDerWaalsContact O-N 3.09Å; C189-F195 HydrophobicContact CB-CB 4.12Å; C189-F195 HydrophobicContact CB-CD1 3.84Å; C189-F195 HydrophobicContact CB-CD2 4.08Å; C189-F195 HydrophobicContact CB-CE1 4.28Å; C189-F195 HydrophobicContact CB-CE2 4.49Å; C189-F195 HydrophobicContact CB-CG 3.73Å; C189-F195 WeakPolarHBondContact O-CB 3.5Å; C189-F195 VanDerWaalsContact SG-CE1 3.54Å; C189-I203 HydrophobicContact CB-CG2 3.84Å; C189-I251 VanDerWaalsContact SG-CG1 3.57Å
190A95.4Very high92.8Very high14 Ų1437.4 Ų37.412%0.11620%0.2CC..Hα-helixtrans-61.8-29.7-178.100000112.5R57 F78 M82 V186 A187 L188R57-A190 PolarHBondContact NH1-O 3.38Å; R57-A190 PolarHBondContact NH2-O 2.7Å; F78-A190 HydrophobicContact CD1-CB 4.39Å; F78-A190 HydrophobicContact CE1-CB 3.66Å; F78-A190 HydrophobicContact CZ-CB 4.1Å; M82-A190 HydrophobicContact CB-CB 4.35Å; M82-A190 HydrophobicContact CG-CB 4.13Å; V186-A190 PolarHBondContact O-N 2.71Å; A187-A190 PolarHBondContact O-N 2.94Å; L188-A190 VanDerWaalsContact C-N 3.3Å; L188-A190 PolarHBondContact O-N 2.94Å
191T93.8Very high93Very high8 Ų830.9 Ų30.95%0.04917%0.172CC..Hα-helixtrans-73.6-25.8176.370.50000114R57 A61 L65 F78 A187 L188 C189R57-T191 PolarHBondContact NH1-O 2.94Å; R57-T191 VanDerWaalsContact NH1-O 3.15Å; A61-T191 HydrophobicContact CB-CG2 4.29Å; L65-T191 HydrophobicContact CD2-CG2 4.36Å; F78-T191 HydrophobicContact CE1-CG2 4.45Å; F78-T191 HydrophobicContact CZ-CG2 4.01Å; A187-T191 PolarHBondContact O-N 3.06Å; L188-T191 PolarHBondContact O-N 3.16Å; L188-T191 VanDerWaalsContact O-N 3.14Å; L188-T191 PolarHBondContact O-OG1 3.48Å; C189-T191 PolarHBondContact O-N 2.73Å
192D92.8Very high93Very high24 Ų2428.2 Ų28.213%0.12816%0.16CC..SBendtrans-96.4141.8-173.7-166.9-78.3000112.5C189 K194 F195 L254C189-D192 PolarHBondContact O-N 3.21Å; C189-D192 VanDerWaalsContact O-N 3.09Å; D192-K194 VanDerWaalsContact C-N 3.32Å; D192-K194 PolarHBondContact O-N 3.23Å; D192-K194 WeakPolarHBondContact OD1-CB 3.31Å; D192-K194 WeakPolarHBondContact OD1-CG 3.38Å; D192-K194 PolarHBondContact OD1-N 3.41Å; D192-F195 HydrophobicContact CB-CD2 4.14Å; D192-L254 HydrophobicContact CB-CD1 3.91Å; D192-L254 HydrophobicContact CB-CD2 3.74Å
193V88.4Confident93Very high51 Ų5129 Ų2931%0.30916%0.164SC..G310 helixtrans-73.1-22.3-176.5-67.30000113.8F45 P54 F195 I196F45-V193 HydrophobicContact CE2-CG1 4.02Å; F45-V193 HydrophobicContact CZ-CG1 4.28Å; P54-V193 HydrophobicContact CB-CG1 3.92Å; P54-V193 HydrophobicContact CB-CG2 4.42Å; V193-F195 PolarHBondContact O-N 3.15Å; V193-I196 HydrophobicContact CB-CD1 3.97Å; V193-I196 HydrophobicContact CG1-CD1 4.05Å; V193-I196 WeakPolarHBondContact O-CB 3.35Å; V193-I196 WeakPolarHBondContact O-CG1 3.42Å; V193-I196 PolarHBondContact O-N 3.47Å
194K86.6Confident93.1Very high121 Ų12127.7 Ų27.753%0.52616%0.158SC..G310 helixtrans-62.8-27178.6-65.7171.9-177176.50112D192 S197D192-K194 VanDerWaalsContact C-N 3.32Å; D192-K194 PolarHBondContact O-N 3.23Å; D192-K194 WeakPolarHBondContact OD1-CB 3.31Å; D192-K194 WeakPolarHBondContact OD1-CG 3.38Å; D192-K194 PolarHBondContact OD1-N 3.41Å; K194-S197 PolarHBondContact O-OG 2.97Å
195F83.8Confident93.2Very high6 Ų624.1 Ų24.13%0.02614%0.136CC..G310 helixtrans-89.3-3.5-176.9-68.5-89.7000113.9C189 D192 V193 S197 N198 I203 Q250 I251 L254C189-F195 HydrophobicContact CB-CB 4.12Å; C189-F195 HydrophobicContact CB-CD1 3.84Å; C189-F195 HydrophobicContact CB-CD2 4.08Å; C189-F195 HydrophobicContact CB-CE1 4.28Å; C189-F195 HydrophobicContact CB-CE2 4.49Å; C189-F195 HydrophobicContact CB-CG 3.73Å; C189-F195 WeakPolarHBondContact O-CB 3.5Å; C189-F195 VanDerWaalsContact SG-CE1 3.54Å; D192-F195 HydrophobicContact CB-CD2 4.14Å; V193-F195 PolarHBondContact O-N 3.15Å; F195-S197 PolarHBondContact O-N 3.45Å; F195-N198 HydrophobicContact CD1-CB 4.49Å; F195-N198 WeakPolarHBondContact CD1-ND2 3.45Å; F195-N198 PolarHBondContact O-N 3.23Å; F195-N198 VanDerWaalsContact O-N 3.08Å; F195-I203 HydrophobicContact CB-CD1 4.22Å; F195-I203 HydrophobicContact CD1-CG1 4.18Å; F195-Q250 HydrophobicContact CE2-CB 4.43Å; F195-Q250 HydrophobicContact CZ-CB 3.78Å; F195-I251 HydrophobicContact CE1-CD1 4.31Å; F195-I251 HydrophobicContact CE1-CG1 3.67Å; F195-I251 HydrophobicContact CZ-CG1 3.6Å; F195-L254 HydrophobicContact CD2-CD2 4.4Å; F195-L254 HydrophobicContact CE2-CD2 3.91Å
196I87.9Confident93.2Very high14 Ų1423.2 Ų23.27%0.07213%0.132CC..G310 helixtrans-59.5-33.2174.2-63.4170000111.1P40 Y44 F45 V193P40-I196 HydrophobicContact CB-CG2 4.37Å; P40-I196 HydrophobicContact CG-CG2 3.86Å; Y44-I196 HydrophobicContact CE1-CD1 4.03Å; Y44-I196 HydrophobicContact CE1-CG2 4.07Å; F45-I196 HydrophobicContact CE2-CD1 3.95Å; V193-I196 HydrophobicContact CB-CD1 3.97Å; V193-I196 HydrophobicContact CG1-CD1 4.05Å; V193-I196 WeakPolarHBondContact O-CB 3.35Å; V193-I196 WeakPolarHBondContact O-CG1 3.42Å; V193-I196 PolarHBondContact O-N 3.47Å
197S85.8Confident93.2Very high63 Ų6323.1 Ų23.144%0.44113%0.132SC..G310 helixtrans-81-14.6178.753.30000114.5K194 F195K194-S197 PolarHBondContact O-OG 2.97Å; F195-S197 PolarHBondContact O-N 3.45Å
198N91.4Very high93.2Very high36 Ų3622.4 Ų22.419%0.19313%0.125CC..SBendtrans-89.8129.3-176-68-38.7000109.5F195 M202 I203F195-N198 HydrophobicContact CD1-CB 4.49Å; F195-N198 WeakPolarHBondContact CD1-ND2 3.45Å; F195-N198 PolarHBondContact O-N 3.23Å; F195-N198 VanDerWaalsContact O-N 3.08Å; N198-M202 HydrophobicContact CB-CG 4.42Å; N198-I203 HydrophobicContact CB-CD1 4.26Å; N198-I203 HydrophobicContact CB-CG1 3.82Å
199P93.8Very high93.2Very high43 Ų4321 Ų2128%0.27912%0.118SC..  trans-66154.1174.527-32.9000110.8S201 M202 I203P199-S201 PolarHBondContact O-N 3.17Å; P199-S201 VanDerWaalsContact O-N 3.16Å; P199-M202 HydrophobicContact CG-CB 3.8Å; P199-M202 WeakPolarHBondContact O-CB 3.42Å; P199-M202 PolarHBondContact O-N 2.81Å; P199-I203 PolarHBondContact O-N 3.07Å; P199-I203 VanDerWaalsContact O-N 3.12Å
200P95.8Very high93.1Very high19 Ų1921.1 Ų21.112%0.12312%0.119CC..Hα-helixtrans-49.9-38.6177-2833.6000114.2E35 M155 P157 F160 M202 I203 A204E35-P200 HydrophobicContact CB-CG 4.25Å; E35-P200 WeakPolarHBondContact OE2-CD 3.32Å; M155-P200 VanDerWaalsContact O-CG 3.32Å; M155-P200 WeakPolarHBondContact O-CG 3.33Å; P157-P200 HydrophobicContact CG-CB 4.12Å; F160-P200 HydrophobicContact CD2-CB 4.21Å; F160-P200 HydrophobicContact CE2-CB 4.02Å; P200-M202 PolarHBondContact O-N 3.37Å; P200-I203 PolarHBondContact O-N 2.75Å; P200-A204 VanDerWaalsContact O-CB 3.29Å; P200-A204 WeakPolarHBondContact O-CB 3.32Å; P200-A204 PolarHBondContact O-N 3.4Å
201S96.2Very high93Very high5 Ų520.5 Ų20.54%0.03511%0.114CC..Hα-helixtrans-59.4-42.4175.461.90000113.4E35 P199 A205E35-S201 VanDerWaalsContact CD-OG 3.29Å; E35-S201 WeakPolarHBondContact OE1-CB 3.34Å; E35-S201 PolarHBondContact OE1-OG 3.43Å; E35-S201 VanDerWaalsContact OE2-CB 3.25Å; E35-S201 WeakPolarHBondContact OE2-CB 3.27Å; E35-S201 PolarHBondContact OE2-N 3.38Å; E35-S201 PolarHBondContact OE2-OG 3.36Å; P199-S201 PolarHBondContact O-N 3.17Å; P199-S201 VanDerWaalsContact O-N 3.16Å; S201-A205 WeakPolarHBondContact O-CB 3.37Å; S201-A205 PolarHBondContact O-N 3.49Å
202M95.9Very high92.8Very high20 Ų2020.1 Ų20.110%0.09911%0.112CC..Hα-helixtrans-69.1-41.7177.8-177.666.873.700111.6N198 P199 P200 A205 G206 I237 C239 C243 L244 C247N198-M202 HydrophobicContact CB-CG 4.42Å; P199-M202 HydrophobicContact CG-CB 3.8Å; P199-M202 WeakPolarHBondContact O-CB 3.42Å; P199-M202 PolarHBondContact O-N 2.81Å; P200-M202 PolarHBondContact O-N 3.37Å; M202-A205 PolarHBondContact O-N 3.32Å; M202-G206 PolarHBondContact O-N 2.89Å; M202-I237 HydrophobicContact SD-CD1 4.32Å; M202-C239 HydrophobicContact CE-CB 3.6Å; M202-C243 HydrophobicContact CE-CB 3.98Å; M202-L244 HydrophobicContact SD-CB 4.38Å; M202-L244 HydrophobicContact SD-CD1 4.21Å; M202-C247 HydrophobicContact CG-CB 4.08Å; M202-C247 HydrophobicContact SD-CB 4.06Å
203I96.4Very high92.6Very high17 Ų1721.9 Ų21.99%0.08712%0.119CC..Hα-helixtrans-64.1-44.7177.3-61.4177.2000110.1P157 V186 C189 F195 N198 P199 P200 S207P157-I203 HydrophobicContact CB-CB 4.5Å; P157-I203 HydrophobicContact CB-CG2 4.33Å; P157-I203 HydrophobicContact CG-CB 4.21Å; P157-I203 HydrophobicContact CG-CG2 4.1Å; V186-I203 HydrophobicContact CG2-CG2 4.26Å; C189-I203 HydrophobicContact CB-CG2 3.84Å; F195-I203 HydrophobicContact CB-CD1 4.22Å; F195-I203 HydrophobicContact CD1-CG1 4.18Å; N198-I203 HydrophobicContact CB-CD1 4.26Å; N198-I203 HydrophobicContact CB-CG1 3.82Å; P199-I203 PolarHBondContact O-N 3.07Å; P199-I203 VanDerWaalsContact O-N 3.12Å; P200-I203 PolarHBondContact O-N 2.75Å; I203-S207 WeakPolarHBondContact O-CB 3.49Å; I203-S207 PolarHBondContact O-N 3.46Å; I203-S207 PolarHBondContact O-OG 3.23Å
204A97Very high92.4Very high0 Ų022 Ų220%013%0.131CC..Hα-helixtrans-60-49.4176.700000111.9P157 F160 I161 F164 P200 S207 V208P157-A204 HydrophobicContact CB-CB 4.03Å; P157-A204 VanDerWaalsContact O-CB 3.28Å; P157-A204 WeakPolarHBondContact O-CB 3.12Å; F160-A204 HydrophobicContact CB-CB 3.56Å; I161-A204 HydrophobicContact CG1-CB 3.92Å; F164-A204 HydrophobicContact CE2-CB 3.81Å; P200-A204 VanDerWaalsContact O-CB 3.29Å; P200-A204 WeakPolarHBondContact O-CB 3.32Å; P200-A204 PolarHBondContact O-N 3.4Å; A204-S207 PolarHBondContact O-N 3.2Å; A204-V208 WeakPolarHBondContact O-CG2 3.49Å; A204-V208 PolarHBondContact O-N 2.7Å
205A96.3Very high92.3Very high0 Ų018.6 Ų18.60%012%0.118CC..Hα-helixtrans-63.7-46.8-179.200000111.5F164 S201 M202 S207 V208 V209 L233 I237 L244F164-A205 HydrophobicContact CE2-CB 3.96Å; F164-A205 HydrophobicContact CZ-CB 4.44Å; S201-A205 WeakPolarHBondContact O-CB 3.37Å; S201-A205 PolarHBondContact O-N 3.49Å; M202-A205 PolarHBondContact O-N 3.32Å; A205-S207 VanDerWaalsContact C-N 3.3Å; A205-S207 PolarHBondContact O-N 2.93Å; A205-V208 PolarHBondContact O-N 3.29Å; A205-V209 WeakPolarHBondContact O-CG2 3.48Å; A205-V209 PolarHBondContact O-N 3.46Å; A205-L233 HydrophobicContact CB-CB 4.25Å; A205-L233 HydrophobicContact CB-CD1 4.3Å; A205-I237 HydrophobicContact CB-CD1 3.7Å; A205-L244 HydrophobicContact CB-CD1 3.57Å; A205-L244 HydrophobicContact CB-CD2 4.45Å
206G96.2Very high92.2Very high0 Ų024.4 Ų24.40%015%0.145CC..Hα-helixtrans-59.3-41.6176.600000112.2M202 V209 A210M202-G206 PolarHBondContact O-N 2.89Å; G206-V209 PolarHBondContact O-N 3.45Å; G206-A210 WeakPolarHBondContact O-CB 3.44Å; G206-A210 PolarHBondContact O-N 2.97Å
207S96.9Very high91.7Very high0 Ų025.8 Ų25.80%015%0.152CC..Hα-helixtrans-66.3-39.3178.9-63.70000112.4F185 I203 A204 A205 A211F185-S207 WeakPolarHBondContact CB-OG 3.36Å; F185-S207 WeakPolarHBondContact CD2-O 3.32Å; I203-S207 WeakPolarHBondContact O-CB 3.49Å; I203-S207 PolarHBondContact O-N 3.46Å; I203-S207 PolarHBondContact O-OG 3.23Å; A204-S207 PolarHBondContact O-N 3.2Å; A205-S207 VanDerWaalsContact C-N 3.3Å; A205-S207 PolarHBondContact O-N 2.93Å; S207-A211 VanDerWaalsContact O-CB 3.3Å; S207-A211 WeakPolarHBondContact O-CB 3.27Å; S207-A211 PolarHBondContact O-N 2.88Å
208V95.8Very high90.9Very high0 Ų023.6 Ų23.60%014%0.14CC..Hα-helixtrans-68.7-42.4175.4171.80000111.4I161 F164 M168 I178 A182 A204 A205 A211 V212 L233I161-V208 HydrophobicContact CG1-CG2 4Å; I161-V208 HydrophobicContact CG2-CG2 4.33Å; F164-V208 HydrophobicContact CD2-CG2 4.43Å; M168-V208 HydrophobicContact CE-CG1 3.73Å; I178-V208 HydrophobicContact CG2-CG1 4.21Å; A182-V208 HydrophobicContact CB-CG2 4.15Å; A204-V208 WeakPolarHBondContact O-CG2 3.49Å; A204-V208 PolarHBondContact O-N 2.7Å; A205-V208 PolarHBondContact O-N 3.29Å; V208-A211 PolarHBondContact O-N 2.87Å; V208-V212 WeakPolarHBondContact O-CG2 3.36Å; V208-V212 PolarHBondContact O-N 3.47Å; V208-L233 HydrophobicContact CB-CD1 4.4Å; V208-L233 HydrophobicContact CG1-CD1 4.24Å
209V94.1Very high90Very high0 Ų028.5 Ų28.50%017%0.166CC..Hα-helixtrans-60.4-49.8175175.30000110.4A205 G206 A211 V212 Q213 Y226 L229 L233 L244 Q248A205-V209 WeakPolarHBondContact O-CG2 3.48Å; A205-V209 PolarHBondContact O-N 3.46Å; G206-V209 PolarHBondContact O-N 3.45Å; V209-A211 VanDerWaalsContact C-N 3.31Å; V209-A211 PolarHBondContact O-N 2.89Å; V209-V212 PolarHBondContact O-N 3.49Å; V209-Q213 HydrophobicContact CG1-CG 4.36Å; V209-Q213 WeakPolarHBondContact O-CG 3.38Å; V209-Q213 PolarHBondContact O-N 3.34Å; V209-Y226 HydrophobicContact CG1-CD2 4.16Å; V209-Y226 HydrophobicContact CG1-CE2 3.76Å; V209-L229 HydrophobicContact CG2-CD2 4.23Å; V209-L229 HydrophobicContact CG2-CG 4.21Å; V209-L233 HydrophobicContact CG2-CD1 3.71Å; V209-L244 HydrophobicContact CG2-CD2 4.43Å; V209-Q248 HydrophobicContact CB-CG 4.45Å; V209-Q248 HydrophobicContact CG1-CG 3.97Å
210A93.9Very high88.8Confident2 Ų232.8 Ų32.82%0.01719%0.192CC..Hα-helixtrans-59.7-40178.400000112F185 G206 Q213 G214 Q248 I251F185-A210 HydrophobicContact CD2-CB 4.03Å; F185-A210 HydrophobicContact CE2-CB 3.84Å; F185-A210 HydrophobicContact CZ-CB 4.39Å; G206-A210 WeakPolarHBondContact O-CB 3.44Å; G206-A210 PolarHBondContact O-N 2.97Å; A210-Q213 PolarHBondContact O-N 3.07Å; A210-G214 PolarHBondContact O-N 3.46Å; A210-Q248 HydrophobicContact CB-CG 4.17Å; A210-I251 HydrophobicContact CB-CG2 4.25Å
211A93.6Very high87.7Confident1 Ų134.6 Ų34.61%0.00820%0.2CC..Hα-helixtrans-63.7-46.8176.400000112.2I178 H181 F185 S207 V208 V209 Q213 L215I178-A211 HydrophobicContact CG2-CB 4.2Å; H181-A211 HydrophobicContact CB-CB 3.69Å; F185-A211 HydrophobicContact CD2-CB 4.39Å; F185-A211 HydrophobicContact CE2-CB 4.08Å; S207-A211 VanDerWaalsContact O-CB 3.3Å; S207-A211 WeakPolarHBondContact O-CB 3.27Å; S207-A211 PolarHBondContact O-N 2.88Å; V208-A211 PolarHBondContact O-N 2.87Å; V209-A211 VanDerWaalsContact C-N 3.31Å; V209-A211 PolarHBondContact O-N 2.89Å; A211-Q213 VanDerWaalsContact C-N 3.33Å; A211-Q213 PolarHBondContact O-N 2.71Å; A211-L215 WeakPolarHBondContact O-CB 3.46Å; A211-L215 WeakPolarHBondContact O-CD1 3.32Å; A211-L215 WeakPolarHBondContact O-CG 3.35Å; A211-L215 PolarHBondContact O-N 3Å; A211-L215 VanDerWaalsContact O-N 3.11Å
212V90.6Very high86.8Confident0 Ų040 Ų400%023%0.233CC..Hα-helixtrans-64-39.9179.1170.60000111.6I178 V208 V209 H216 L217 L224 L229I178-V212 HydrophobicContact CD1-CG2 3.84Å; I178-V212 HydrophobicContact CG1-CG2 4.18Å; I178-V212 HydrophobicContact CG2-CG2 4.35Å; V208-V212 WeakPolarHBondContact O-CG2 3.36Å; V208-V212 PolarHBondContact O-N 3.47Å; V209-V212 PolarHBondContact O-N 3.49Å; V212-H216 PolarHBondContact O-N 3.49Å; V212-L217 HydrophobicContact CG1-CB 4.29Å; V212-L217 PolarHBondContact O-N 3.1Å; V212-L224 HydrophobicContact CG1-CB 3.85Å; V212-L224 HydrophobicContact CG1-CD1 4.39Å; V212-L224 HydrophobicContact CG1-CD2 4.18Å; V212-L224 HydrophobicContact CG1-CG 4.38Å; V212-L224 HydrophobicContact CG2-CD2 4.28Å; V212-L229 HydrophobicContact CB-CD2 3.72Å; V212-L229 HydrophobicContact CG1-CD2 3.83Å; V212-L229 HydrophobicContact CG2-CD2 3.76Å
213Q88.6Confident85.7Confident61 Ų6142 Ų4229%0.28524%0.241SC..Hα-helixtrans-67.7-51176.9-69.8-57.2-62.800112.1V209 A210 A211 L215 H216 Y226V209-Q213 HydrophobicContact CG1-CG 4.36Å; V209-Q213 WeakPolarHBondContact O-CG 3.38Å; V209-Q213 PolarHBondContact O-N 3.34Å; A210-Q213 PolarHBondContact O-N 3.07Å; A211-Q213 VanDerWaalsContact C-N 3.33Å; A211-Q213 PolarHBondContact O-N 2.71Å; Q213-L215 PolarHBondContact O-N 2.65Å; Q213-H216 PolarHBondContact O-N 3.01Å; Q213-Y226 VanDerWaalsContact CD-CD2 3.43Å; Q213-Y226 HydrophobicContact CG-CD2 3.74Å; Q213-Y226 HydrophobicContact CG-CE2 4.21Å
214G84.6Confident84.8Confident54 Ų5441.3 Ų41.356%0.55724%0.238SC*.Hα-helixtrans-61.1-28.9-179.500000113.6A210 H216A210-G214 PolarHBondContact O-N 3.46Å; G214-H216 VanDerWaalsContact C-N 3.34Å; G214-H216 PolarHBondContact O-ND1 3.1Å
215L84.2Confident84.1Confident49 Ų4942.8 Ų42.826%0.25725%0.248SC..THydrogen-bonded Turntrans-85.5-1.3176.2-67.1169000114.1I177 I178 A211 Q213 L217I177-L215 HydrophobicContact CG2-CD1 3.57Å; I177-L215 HydrophobicContact CG2-CD2 4.02Å; I177-L215 HydrophobicContact CG2-CG 4.46Å; I178-L215 HydrophobicContact CG1-CD1 4.38Å; A211-L215 WeakPolarHBondContact O-CB 3.46Å; A211-L215 WeakPolarHBondContact O-CD1 3.32Å; A211-L215 WeakPolarHBondContact O-CG 3.35Å; A211-L215 PolarHBondContact O-N 3Å; A211-L215 VanDerWaalsContact O-N 3.11Å; Q213-L215 PolarHBondContact O-N 2.65Å; L215-L217 HydrophobicContact CB-CD1 3.93Å; L215-L217 HydrophobicContact CB-CD2 4.41Å; L215-L217 HydrophobicContact CB-CG 3.66Å; L215-L217 HydrophobicContact CD1-CD1 3.92Å; L215-L217 PolarHBondContact O-N 3.14Å; L215-L217 VanDerWaalsContact O-N 3.12Å
216H80.9Confident83.4Confident129 Ų12945.7 Ų45.760%0.59726%0.26SS*.THydrogen-bonded Turntrans54.427.9-177.6-56.377.9000113.6V212 Q213 G214 G218 D219V212-H216 PolarHBondContact O-N 3.49Å; Q213-H216 PolarHBondContact O-N 3.01Å; G214-H216 VanDerWaalsContact C-N 3.34Å; G214-H216 PolarHBondContact O-ND1 3.1Å; H216-G218 PolarHBondContact O-N 3.07Å; H216-D219 PolarHBondContact O-N 2.97Å
217L76.8Confident82.8Confident42 Ų4253.3 Ų53.322%0.2230%0.295CS..G310 helixtrans-72.3-19.2-177.2-63.2174000112.7T174 I178 V212 L215 D219 T220 N221 L224T174-L217 HydrophobicContact CG2-CD1 3.82Å; T174-L217 HydrophobicContact CG2-CD2 4.4Å; I178-L217 HydrophobicContact CD1-CD1 3.89Å; I178-L217 HydrophobicContact CG1-CD1 3.78Å; V212-L217 HydrophobicContact CG1-CB 4.29Å; V212-L217 PolarHBondContact O-N 3.1Å; L215-L217 HydrophobicContact CB-CD1 3.93Å; L215-L217 HydrophobicContact CB-CD2 4.41Å; L215-L217 HydrophobicContact CB-CG 3.66Å; L215-L217 HydrophobicContact CD1-CD1 3.92Å; L215-L217 PolarHBondContact O-N 3.14Å; L215-L217 VanDerWaalsContact O-N 3.12Å; L217-D219 PolarHBondContact O-N 3.26Å; L217-T220 PolarHBondContact O-N 3.38Å; L217-N221 PolarHBondContact O-N 3.36Å; L217-L224 HydrophobicContact CB-CD1 3.67Å; L217-L224 HydrophobicContact CD1-CD1 4.42Å
218G68.8Low82.2Confident18 Ų1856.3 Ų56.319%0.18632%0.316CS..G310 helixtrans-65.7-23.3175.700000114H216 T220 L224H216-G218 PolarHBondContact O-N 3.07Å; G218-T220 VanDerWaalsContact C-N 3.3Å; G218-T220 PolarHBondContact O-N 3Å; G218-L224 WeakPolarHBondContact CA-O 3.23Å
219D72.5Confident81.8Confident138 Ų13856.3 Ų56.374%0.73832%0.316SS*.G310 helixtrans-73.6-25.7-179.9-65.6-18.7000112.1H216 L217H216-D219 PolarHBondContact O-N 2.97Å; L217-D219 PolarHBondContact O-N 3.26Å
220T69Low81.5Confident134 Ų13456.5 Ų56.582%0.82232%0.317SS*.THydrogen-bonded Turntrans-101.5-24.6-175.9-52.20000112.5L217 G218L217-T220 PolarHBondContact O-N 3.38Å; G218-T220 VanDerWaalsContact C-N 3.3Å; G218-T220 PolarHBondContact O-N 3Å
221N74Confident81.3Confident56 Ų5661.3 Ų61.330%0.29934%0.339SS..  trans-131.7115.2-176.8-171.1-26.8000111.7L217 F223 L224 S225L217-N221 PolarHBondContact O-N 3.36Å; N221-F223 PolarHBondContact O-N 3.42Å; N221-F223 WeakPolarHBondContact OD1-CB 3.42Å; N221-F223 PolarHBondContact OD1-N 3.49Å; N221-L224 HydrophobicContact CB-CB 4.2Å; N221-L224 HydrophobicContact CB-CD1 4.15Å; N221-L224 HydrophobicContact CB-CG 4.13Å; N221-L224 CarbonylContact O-C 3.52Å; N221-L224 WeakPolarHBondContact O-CA 3.32Å; N221-L224 WeakPolarHBondContact O-CB 3.41Å; N221-L224 PolarHBondContact O-N 3.35Å; N221-S225 PolarHBondContact O-N 2.74Å
222T75.6Confident81.1Confident119 Ų11963.5 Ų63.573%0.7335%0.348SS*.G310 helixtrans-59-30.9-178.9-45.50000113.4L224 S225T222-L224 VanDerWaalsContact C-N 3.28Å; T222-L224 PolarHBondContact O-N 2.95Å; T222-S225 WeakPolarHBondContact O-CB 3.48Å; T222-S225 PolarHBondContact O-N 3.2Å; T222-S225 VanDerWaalsContact O-N 3.13Å; T222-S225 PolarHBondContact O-OG 3.1Å
223F74.4Confident81.2Confident61 Ų6163.5 Ų63.527%0.26835%0.348SS..G310 helixtrans-66.4-33.3174.9-179.4-91.6000111.9M168 P169 N221 S225 F232M168-F223 HydrophobicContact CB-CE1 4.12Å; M168-F223 HydrophobicContact CG-CE1 3.93Å; P169-F223 HydrophobicContact CG-CD1 4.2Å; P169-F223 HydrophobicContact CG-CD2 4.31Å; P169-F223 HydrophobicContact CG-CE1 4.46Å; P169-F223 HydrophobicContact CG-CG 4.14Å; N221-F223 PolarHBondContact O-N 3.42Å; N221-F223 WeakPolarHBondContact OD1-CB 3.42Å; N221-F223 PolarHBondContact OD1-N 3.49Å; F223-S225 PolarHBondContact O-N 3.29Å; F223-F232 HydrophobicContact CZ-CD1 4.35Å; F223-F232 HydrophobicContact CZ-CG 4.4Å
224L76.8Confident81.4Confident3 Ų360.8 Ų60.82%0.01634%0.336CS..G310 helixtrans-84.34.5175.2-63.3-175.5000113.1L170 V212 L217 G218 N221 T222 Y226L170-L224 HydrophobicContact CD1-CD1 4.31Å; L170-L224 HydrophobicContact CD1-CD2 4Å; L170-L224 HydrophobicContact CD2-CD1 3.66Å; L170-L224 HydrophobicContact CD2-CD2 4.01Å; L170-L224 HydrophobicContact CD2-CG 3.87Å; V212-L224 HydrophobicContact CG1-CB 3.85Å; V212-L224 HydrophobicContact CG1-CD1 4.39Å; V212-L224 HydrophobicContact CG1-CD2 4.18Å; V212-L224 HydrophobicContact CG1-CG 4.38Å; V212-L224 HydrophobicContact CG2-CD2 4.28Å; L217-L224 HydrophobicContact CB-CD1 3.67Å; L217-L224 HydrophobicContact CD1-CD1 4.42Å; G218-L224 WeakPolarHBondContact CA-O 3.23Å; N221-L224 HydrophobicContact CB-CB 4.2Å; N221-L224 HydrophobicContact CB-CD1 4.15Å; N221-L224 HydrophobicContact CB-CG 4.13Å; N221-L224 CarbonylContact O-C 3.52Å; N221-L224 WeakPolarHBondContact O-CA 3.32Å; N221-L224 WeakPolarHBondContact O-CB 3.41Å; N221-L224 PolarHBondContact O-N 3.35Å; T222-L224 VanDerWaalsContact C-N 3.28Å; T222-L224 PolarHBondContact O-N 2.95Å; L224-Y226 PolarHBondContact O-N 2.97Å
225S82.3Confident81.6Confident31 Ų3164.1 Ų64.122%0.21734%0.337CS..SBendtrans-56.7139.8170.169.10000109.3N221 T222 F223 Q227 C228 L229N221-S225 PolarHBondContact O-N 2.74Å; T222-S225 WeakPolarHBondContact O-CB 3.48Å; T222-S225 PolarHBondContact O-N 3.2Å; T222-S225 VanDerWaalsContact O-N 3.13Å; T222-S225 PolarHBondContact O-OG 3.1Å; F223-S225 PolarHBondContact O-N 3.29Å; S225-Q227 PolarHBondContact O-N 2.92Å; S225-Q227 VanDerWaalsContact O-N 3.14Å; S225-C228 PolarHBondContact O-N 3.46Å; S225-C228 VanDerWaalsContact O-N 3.1Å; S225-C228 WeakPolarHBondContact OG-CB 3.37Å; S225-C228 PolarHBondContact OG-SG 3.34Å; S225-L229 PolarHBondContact O-N 2.93Å
226Y81.1Confident81.9Confident62 Ų6263.1 Ų63.124%0.24333%0.333CS..Hα-helixtrans-50.1-45-173.1179.2-109.7000113V209 Q213 L224 T230 R245 Q248V209-Y226 HydrophobicContact CG1-CD2 4.16Å; V209-Y226 HydrophobicContact CG1-CE2 3.76Å; Q213-Y226 VanDerWaalsContact CD-CD2 3.43Å; Q213-Y226 HydrophobicContact CG-CD2 3.74Å; Q213-Y226 HydrophobicContact CG-CE2 4.21Å; L224-Y226 PolarHBondContact O-N 2.97Å; Y226-T230 VanDerWaalsContact O-CB 3.32Å; Y226-T230 WeakPolarHBondContact O-CB 3.46Å; Y226-T230 PolarHBondContact O-N 3.49Å; Y226-T230 PolarHBondContact O-OG1 3.45Å; Y226-R245 WeakPolarHBondContact OH-CG 3.38Å; Y226-Q248 PolarHBondContact OH-OE1 3.24Å
227Q83.5Confident82.3Confident159 Ų15957.7 Ų57.774%0.74331%0.308SS*.Hα-helixtrans-67.1-44.9-178.1-66.9178.7-13.800112S225 H231S225-Q227 PolarHBondContact O-N 2.92Å; S225-Q227 VanDerWaalsContact O-N 3.14Å; Q227-H231 WeakPolarHBondContact O-CB 3.16Å; Q227-H231 PolarHBondContact O-N 3.09Å
228C85.3Confident83Confident63 Ų6362.8 Ų62.843%0.42633%0.329SS..Hα-helixtrans-66.2-43.9179.7-69.80000111.7S225 H231 F232S225-C228 PolarHBondContact O-N 3.46Å; S225-C228 VanDerWaalsContact O-N 3.1Å; S225-C228 WeakPolarHBondContact OG-CB 3.37Å; S225-C228 PolarHBondContact OG-SG 3.34Å; C228-H231 PolarHBondContact O-N 3.18Å; C228-F232 VanDerWaalsContact O-CB 3.23Å; C228-F232 WeakPolarHBondContact O-CB 3.28Å; C228-F232 PolarHBondContact O-N 3.05Å
229L87.8Confident84Confident0 Ų063.3 Ų63.30%033%0.329CS..Hα-helixtrans-66.2-47.7-178.7-179.361.5000111.9M168 V209 V212 S225 H231 F232 L233M168-L229 HydrophobicContact CE-CD1 3.48Å; M168-L229 VanDerWaalsContact CE-CD1 3.48Å; M168-L229 HydrophobicContact SD-CD1 4.32Å; V209-L229 HydrophobicContact CG2-CD2 4.23Å; V209-L229 HydrophobicContact CG2-CG 4.21Å; V212-L229 HydrophobicContact CB-CD2 3.72Å; V212-L229 HydrophobicContact CG1-CD2 3.83Å; V212-L229 HydrophobicContact CG2-CD2 3.76Å; S225-L229 PolarHBondContact O-N 2.93Å; L229-H231 VanDerWaalsContact C-N 3.32Å; L229-H231 PolarHBondContact O-N 3.27Å; L229-F232 PolarHBondContact O-N 3.41Å; L229-L233 HydrophobicContact CD1-CD1 3.83Å; L229-L233 HydrophobicContact CD1-CG 4.05Å; L229-L233 HydrophobicContact CG-CD1 4.05Å; L229-L233 WeakPolarHBondContact O-CB 3.44Å; L229-L233 WeakPolarHBondContact O-CG 3.49Å; L229-L233 PolarHBondContact O-N 3.36Å
230T88.1Confident84.9Confident5 Ų560.9 Ų60.93%0.03132%0.316CS..Hα-helixtrans-63.1-40.1178.2-58.90000111Y226 S234 P241 L244Y226-T230 VanDerWaalsContact O-CB 3.32Å; Y226-T230 WeakPolarHBondContact O-CB 3.46Å; Y226-T230 PolarHBondContact O-N 3.49Å; Y226-T230 PolarHBondContact O-OG1 3.45Å; T230-S234 VanDerWaalsContact O-CB 3.23Å; T230-S234 WeakPolarHBondContact O-CB 3.39Å; T230-S234 PolarHBondContact O-N 3.49Å; T230-S234 PolarHBondContact O-OG 3.04Å; T230-P241 HydrophobicContact CG2-CB 4.5Å; T230-L244 HydrophobicContact CG2-CB 4.46Å; T230-L244 HydrophobicContact CG2-CD2 3.88Å; T230-L244 HydrophobicContact CG2-CG 4.18Å
231H89.3Confident85.9Confident102 Ų10256.5 Ų56.547%0.47229%0.29SS..Hα-helixtrans-67.1-43.2175.3-166.468.2000112.5Q227 C228 L229 S234 Q235Q227-H231 WeakPolarHBondContact O-CB 3.16Å; Q227-H231 PolarHBondContact O-N 3.09Å; C228-H231 PolarHBondContact O-N 3.18Å; L229-H231 VanDerWaalsContact C-N 3.32Å; L229-H231 PolarHBondContact O-N 3.27Å; H231-S234 WeakPolarHBondContact CA-OG 3.43Å; H231-S234 PolarHBondContact O-OG 3.43Å; H231-Q235 PolarHBondContact CD2-NE2 3.2Å; H231-Q235 PolarHBondContact NE2-NE2 3.5Å; H231-Q235 VanDerWaalsContact O-CG 3.31Å; H231-Q235 WeakPolarHBondContact O-CG 3.38Å; H231-Q235 PolarHBondContact O-N 3.37Å
232F89.9Confident86.8Confident48 Ų4858.3 Ų58.321%0.21130%0.299CS..Hα-helixtrans-59.5-52.9175.9169.5-105.9000111.4K167 M168 F223 C228 L229 S234 Q235 V236K167-F232 HydrophobicContact CB-CZ 3.81Å; M168-F232 HydrophobicContact CE-CE1 4.44Å; F223-F232 HydrophobicContact CZ-CD1 4.35Å; F223-F232 HydrophobicContact CZ-CG 4.4Å; C228-F232 VanDerWaalsContact O-CB 3.23Å; C228-F232 WeakPolarHBondContact O-CB 3.28Å; C228-F232 PolarHBondContact O-N 3.05Å; L229-F232 PolarHBondContact O-N 3.41Å; F232-S234 PolarHBondContact O-N 3.01Å; F232-Q235 PolarHBondContact O-N 3.35Å; F232-V236 HydrophobicContact CD2-CG2 4.16Å; F232-V236 HydrophobicContact CE1-CG2 4.18Å; F232-V236 HydrophobicContact CE2-CG2 3.76Å; F232-V236 HydrophobicContact CZ-CG2 3.77Å; F232-V236 WeakPolarHBondContact O-CG2 3.35Å; F232-V236 PolarHBondContact O-N 2.78Å
233L91.7Very high87.6Confident0 Ų055.9 Ų55.90%029%0.287CS..Hα-helixtrans-66.8-39.2-177.3-69.7176.1000112.3F164 M168 A205 V208 V209 L229 Q235 V236 I237 L244F164-L233 HydrophobicContact CB-CD2 3.98Å; F164-L233 HydrophobicContact CD1-CD2 3.92Å; F164-L233 HydrophobicContact CD2-CD2 3.81Å; F164-L233 HydrophobicContact CE1-CD2 4.39Å; F164-L233 HydrophobicContact CE2-CD2 4.27Å; F164-L233 HydrophobicContact CG-CD2 3.63Å; M168-L233 HydrophobicContact CE-CD1 4.48Å; M168-L233 HydrophobicContact CE-CD2 4.1Å; A205-L233 HydrophobicContact CB-CB 4.25Å; A205-L233 HydrophobicContact CB-CD1 4.3Å; V208-L233 HydrophobicContact CB-CD1 4.4Å; V208-L233 HydrophobicContact CG1-CD1 4.24Å; V209-L233 HydrophobicContact CG2-CD1 3.71Å; L229-L233 HydrophobicContact CD1-CD1 3.83Å; L229-L233 HydrophobicContact CD1-CG 4.05Å; L229-L233 HydrophobicContact CG-CD1 4.05Å; L229-L233 WeakPolarHBondContact O-CB 3.44Å; L229-L233 WeakPolarHBondContact O-CG 3.49Å; L229-L233 PolarHBondContact O-N 3.36Å; L233-Q235 VanDerWaalsContact C-N 3.34Å; L233-Q235 PolarHBondContact O-N 2.97Å; L233-V236 PolarHBondContact O-N 2.87Å; L233-I237 WeakPolarHBondContact O-CG1 3.36Å; L233-I237 PolarHBondContact O-N 3.32Å; L233-L244 HydrophobicContact CB-CD2 3.91Å
234S91.9Very high88.5Confident4 Ų453 Ų533%0.02827%0.274CS..Hα-helixtrans-62.5-38.5175.154.20000112.7T230 H231 F232 K238 C239T230-S234 VanDerWaalsContact O-CB 3.23Å; T230-S234 WeakPolarHBondContact O-CB 3.39Å; T230-S234 PolarHBondContact O-N 3.49Å; T230-S234 PolarHBondContact O-OG 3.04Å; H231-S234 WeakPolarHBondContact CA-OG 3.43Å; H231-S234 PolarHBondContact O-OG 3.43Å; F232-S234 PolarHBondContact O-N 3.01Å; S234-K238 CarbonylContact O-C 3.6Å; S234-K238 VanDerWaalsContact O-CA 3.29Å; S234-K238 WeakPolarHBondContact O-CA 3.23Å; S234-K238 PolarHBondContact O-N 3.37Å; S234-C239 PolarHBondContact O-N 3.5Å
235Q90.3Very high89.2Confident124 Ų12457.1 Ų57.158%0.57929%0.29SS*.Hα-helixtrans-64.5-42.1171.9-74.4-174.9-6.600112.3H231 F232 L233 K238H231-Q235 PolarHBondContact CD2-NE2 3.2Å; H231-Q235 PolarHBondContact NE2-NE2 3.5Å; H231-Q235 VanDerWaalsContact O-CG 3.31Å; H231-Q235 WeakPolarHBondContact O-CG 3.38Å; H231-Q235 PolarHBondContact O-N 3.37Å; F232-Q235 PolarHBondContact O-N 3.35Å; L233-Q235 VanDerWaalsContact C-N 3.34Å; L233-Q235 PolarHBondContact O-N 2.97Å; Q235-K238 PolarHBondContact O-N 2.9Å
236V88.9Confident89.7Confident28 Ų2857.4 Ų57.417%0.1729%0.294CS..Hα-helixtrans-64.4-46.3-179169.30000111.3L28 F164 F232 L233 K238L28-V236 HydrophobicContact CD2-CG1 3.41Å; L28-V236 VanDerWaalsContact CD2-CG1 3.41Å; F164-V236 HydrophobicContact CD1-CG1 3.96Å; F164-V236 HydrophobicContact CE1-CG1 3.62Å; F232-V236 HydrophobicContact CD2-CG2 4.16Å; F232-V236 HydrophobicContact CE1-CG2 4.18Å; F232-V236 HydrophobicContact CE2-CG2 3.76Å; F232-V236 HydrophobicContact CZ-CG2 3.77Å; F232-V236 WeakPolarHBondContact O-CG2 3.35Å; F232-V236 PolarHBondContact O-N 2.78Å; L233-V236 PolarHBondContact O-N 2.87Å; V236-K238 VanDerWaalsContact C-N 3.34Å
237I91.1Very high90.3Very high14 Ų1454.6 Ų54.67%0.07228%0.283CS..Hα-helixtrans-87.8-2.8179.673.9-172.8000113.5F164 M202 A205 L233 C239F164-I237 HydrophobicContact CE1-CG2 3.93Å; F164-I237 HydrophobicContact CZ-CG2 3.48Å; F164-I237 VanDerWaalsContact CZ-CG2 3.48Å; M202-I237 HydrophobicContact SD-CD1 4.32Å; A205-I237 HydrophobicContact CB-CD1 3.7Å; L233-I237 WeakPolarHBondContact O-CG1 3.36Å; L233-I237 PolarHBondContact O-N 3.32Å; I237-C239 VanDerWaalsContact C-N 3.32Å; I237-C239 HydrophobicContact CD1-CB 4.09Å; I237-C239 WeakPolarHBondContact CD1-SG 3.46Å; I237-C239 HydrophobicContact CG1-CB 3.79Å; I237-C239 WeakPolarHBondContact CG1-SG 3.3Å; I237-C239 PolarHBondContact O-N 2.81Å
238K89.7Confident90.9Very high150 Ų15047.6 Ų47.665%0.65225%0.25SS*.THydrogen-bonded Turntrans56.541.4-177.6-53.9178.8-179.3178.80113.2S234 Q235 V236S234-K238 CarbonylContact O-C 3.6Å; S234-K238 VanDerWaalsContact O-CA 3.29Å; S234-K238 WeakPolarHBondContact O-CA 3.23Å; S234-K238 PolarHBondContact O-N 3.37Å; Q235-K238 PolarHBondContact O-N 2.9Å; V236-K238 VanDerWaalsContact C-N 3.34Å
239C91.1Very high91.2Very high28 Ų2849.8 Ų49.819%0.18925%0.254CS..  trans-107.2166.6174.880.60000111.9M202 S234 I237M202-C239 HydrophobicContact CE-CB 3.6Å; S234-C239 PolarHBondContact O-N 3.5Å; I237-C239 VanDerWaalsContact C-N 3.32Å; I237-C239 HydrophobicContact CD1-CB 4.09Å; I237-C239 WeakPolarHBondContact CD1-SG 3.46Å; I237-C239 HydrophobicContact CG1-CB 3.79Å; I237-C239 WeakPolarHBondContact CG1-SG 3.3Å; I237-C239 PolarHBondContact O-N 2.81Å
240D91.3Very high91.6Very high87 Ų8753.2 Ų53.247%0.46527%0.27SS..  trans-67.7129.7166.5-165.6-42.8000109.7D242 C243 L244D240-D242 PolarHBondContact O-N 3Å; D240-D242 WeakPolarHBondContact OD1-CB 3.49Å; D240-D242 PolarHBondContact OD1-N 3.13Å; D240-C243 HydrophobicContact CB-CB 4.29Å; D240-C243 WeakPolarHBondContact O-CB 3.43Å; D240-C243 PolarHBondContact O-N 3.19Å; D240-L244 PolarHBondContact O-N 2.75Å
241P90.8Very high91.8Very high43 Ų4353 Ų5328%0.27927%0.269SS..Hα-helixtrans-52.7-31.6173.2-24.431.3000114T230 L244 R245T230-P241 HydrophobicContact CG2-CB 4.5Å; P241-L244 PolarHBondContact O-N 3.32Å; P241-R245 PolarHBondContact O-N 3.46Å
242D91.3Very high92Very high93 Ų9351.3 Ų51.350%0.49726%0.261SS..Hα-helixtrans-72.3-33.3178.8-69.2-29.7000111.7D240 R245 A246D240-D242 PolarHBondContact O-N 3Å; D240-D242 WeakPolarHBondContact OD1-CB 3.49Å; D240-D242 PolarHBondContact OD1-N 3.13Å; D242-R245 PolarHBondContact O-N 2.92Å; D242-R245 IonicContact OD1-CZ 2.85Å; D242-R245 IonicContact OD1-NH1 2.88Å; D242-R245 PolarHBondContact OD1-NH1 2.84Å; D242-R245 IonicContact OD1-NH2 3.52Å; D242-A246 WeakPolarHBondContact O-CB 3.41Å; D242-A246 PolarHBondContact O-N 3.46Å
243C92.4Very high92.2Very high69 Ų6952 Ų5247%0.46627%0.272SS..Hα-helixtrans-65.4-40.4171-66.90000111.6M202 D240 A246 C247M202-C243 HydrophobicContact CE-CB 3.98Å; D240-C243 HydrophobicContact CB-CB 4.29Å; D240-C243 WeakPolarHBondContact O-CB 3.43Å; D240-C243 PolarHBondContact O-N 3.19Å; C243-A246 PolarHBondContact O-N 3.1Å; C243-C247 WeakPolarHBondContact O-CB 3.44Å; C243-C247 PolarHBondContact O-N 3.2Å
244L93.8Very high92.2Very high1 Ų152.6 Ų52.61%0.00528%0.275CS..Hα-helixtrans-65-42176.7178.856.3000111.4M202 A205 V209 T230 L233 D240 P241 C247 Q248M202-L244 HydrophobicContact SD-CB 4.38Å; M202-L244 HydrophobicContact SD-CD1 4.21Å; A205-L244 HydrophobicContact CB-CD1 3.57Å; A205-L244 HydrophobicContact CB-CD2 4.45Å; V209-L244 HydrophobicContact CG2-CD2 4.43Å; T230-L244 HydrophobicContact CG2-CB 4.46Å; T230-L244 HydrophobicContact CG2-CD2 3.88Å; T230-L244 HydrophobicContact CG2-CG 4.18Å; L233-L244 HydrophobicContact CB-CD2 3.91Å; D240-L244 PolarHBondContact O-N 2.75Å; P241-L244 PolarHBondContact O-N 3.32Å; L244-C247 WeakPolarHBondContact O-CB 3.48Å; L244-C247 PolarHBondContact O-N 3.09Å; L244-Q248 PolarHBondContact O-N 3.47Å
245R92.3Very high92.2Very high89 Ų8954.9 Ų54.934%0.33629%0.287SS..Hα-helixtrans-60.8-47.7173.6-178.5176.3-47.2120.210.9111.7Y226 P241 D242 C247 Q248 E249Y226-R245 WeakPolarHBondContact OH-CG 3.38Å; P241-R245 PolarHBondContact O-N 3.46Å; D242-R245 PolarHBondContact O-N 2.92Å; D242-R245 IonicContact OD1-CZ 2.85Å; D242-R245 IonicContact OD1-NH1 2.88Å; D242-R245 PolarHBondContact OD1-NH1 2.84Å; D242-R245 IonicContact OD1-NH2 3.52Å; R245-C247 VanDerWaalsContact C-N 3.27Å; R245-C247 PolarHBondContact O-N 3.24Å; R245-Q248 WeakPolarHBondContact O-CB 3.24Å; R245-Q248 PolarHBondContact O-N 2.98Å; R245-E249 HydrophobicContact CG-CG 4.46Å; R245-E249 WeakPolarHBondContact CG-OE1 3.33Å; R245-E249 WeakPolarHBondContact O-CG 3.36Å; R245-E249 PolarHBondContact O-N 3.39Å
246A93.1Very high92.3Very high37 Ų3754.3 Ų54.331%0.30628%0.284SS..Hα-helixtrans-61.4-36.7177.400000112.3D242 C243 Q250D242-A246 WeakPolarHBondContact O-CB 3.41Å; D242-A246 PolarHBondContact O-N 3.46Å; C243-A246 PolarHBondContact O-N 3.1Å; A246-Q250 WeakPolarHBondContact O-CB 3.15Å; A246-Q250 WeakPolarHBondContact O-CG 3.48Å; A246-Q250 PolarHBondContact O-N 3.19Å; A246-Q250 VanDerWaalsContact O-N 3.1Å; A246-Q250 PolarHBondContact O-NE2 3.21Å
247C93.9Very high92.3Very high3 Ų354.9 Ų54.92%0.0229%0.29CS..Hα-helixtrans-63-48.7173.8-175.30000111.1M202 C243 L244 R245 E249 Q250 I251M202-C247 HydrophobicContact CG-CB 4.08Å; M202-C247 HydrophobicContact SD-CB 4.06Å; C243-C247 WeakPolarHBondContact O-CB 3.44Å; C243-C247 PolarHBondContact O-N 3.2Å; L244-C247 WeakPolarHBondContact O-CB 3.48Å; L244-C247 PolarHBondContact O-N 3.09Å; R245-C247 VanDerWaalsContact C-N 3.27Å; R245-C247 PolarHBondContact O-N 3.24Å; C247-E249 PolarHBondContact O-N 3.25Å; C247-Q250 WeakPolarHBondContact O-CB 3.19Å; C247-Q250 PolarHBondContact O-N 3.48Å; C247-I251 WeakPolarHBondContact O-CG1 3.44Å; C247-I251 PolarHBondContact O-N 3.1Å
248Q94.4Very high92.2Very high11 Ų1155.6 Ų55.65%0.05130%0.296CS..Hα-helixtrans-57.4-49.5176.4177.4-142.2-17.900111.9V209 A210 Y226 L244 R245 Q250 I251 E252V209-Q248 HydrophobicContact CB-CG 4.45Å; V209-Q248 HydrophobicContact CG1-CG 3.97Å; A210-Q248 HydrophobicContact CB-CG 4.17Å; Y226-Q248 PolarHBondContact OH-OE1 3.24Å; L244-Q248 PolarHBondContact O-N 3.47Å; R245-Q248 WeakPolarHBondContact O-CB 3.24Å; R245-Q248 PolarHBondContact O-N 2.98Å; Q248-Q250 PolarHBondContact O-N 3.33Å; Q248-I251 WeakPolarHBondContact O-CA 3.4Å; Q248-I251 WeakPolarHBondContact O-CB 3.38Å; Q248-I251 PolarHBondContact O-N 3.41Å; Q248-E252 PolarHBondContact NE2-OE1 3.41Å; Q248-E252 PolarHBondContact O-N 3.46Å
249E93.3Very high92.2Very high109 Ų10952.9 Ų52.951%0.50929%0.288SS..Hα-helixtrans-59.8-36.5178.8-71.1171.5-174.500111.8R245 C247 E252 S253R245-E249 HydrophobicContact CG-CG 4.46Å; R245-E249 WeakPolarHBondContact CG-OE1 3.33Å; R245-E249 WeakPolarHBondContact O-CG 3.36Å; R245-E249 PolarHBondContact O-N 3.39Å; C247-E249 PolarHBondContact O-N 3.25Å; E249-E252 PolarHBondContact O-N 3.24Å; E249-S253 VanDerWaalsContact O-CB 3.32Å; E249-S253 WeakPolarHBondContact O-CB 3.41Å; E249-S253 PolarHBondContact O-N 3.11Å
250Q94.3Very high92.1Very high72 Ų7259.1 Ų59.134%0.33631%0.308SS..Hα-helixtrans-65.9-37.5173.9-73.4171.14200112.4F195 A246 C247 Q248 L254F195-Q250 HydrophobicContact CE2-CB 4.43Å; F195-Q250 HydrophobicContact CZ-CB 3.78Å; A246-Q250 WeakPolarHBondContact O-CB 3.15Å; A246-Q250 WeakPolarHBondContact O-CG 3.48Å; A246-Q250 PolarHBondContact O-N 3.19Å; A246-Q250 VanDerWaalsContact O-N 3.1Å; A246-Q250 PolarHBondContact O-NE2 3.21Å; C247-Q250 WeakPolarHBondContact O-CB 3.19Å; C247-Q250 PolarHBondContact O-N 3.48Å; Q248-Q250 PolarHBondContact O-N 3.33Å; Q250-L254 VanDerWaalsContact O-CB 3.27Å; Q250-L254 WeakPolarHBondContact O-CB 3.36Å; Q250-L254 PolarHBondContact O-N 3.19Å
251I94.3Very high91.8Very high1 Ų159.6 Ų59.61%0.00531%0.307CS..Hα-helixtrans-65.6-46.5176.5-66.6172.8000110.3F185 C189 F195 A210 C247 Q248 L254 L255F185-I251 HydrophobicContact CB-CG2 3.83Å; F185-I251 HydrophobicContact CD1-CG2 3.65Å; F185-I251 HydrophobicContact CD2-CG2 4.45Å; F185-I251 HydrophobicContact CE1-CG2 4.36Å; F185-I251 HydrophobicContact CG-CG2 3.73Å; C189-I251 VanDerWaalsContact SG-CG1 3.57Å; F195-I251 HydrophobicContact CE1-CD1 4.31Å; F195-I251 HydrophobicContact CE1-CG1 3.67Å; F195-I251 HydrophobicContact CZ-CG1 3.6Å; A210-I251 HydrophobicContact CB-CG2 4.25Å; C247-I251 WeakPolarHBondContact O-CG1 3.44Å; C247-I251 PolarHBondContact O-N 3.1Å; Q248-I251 WeakPolarHBondContact O-CA 3.4Å; Q248-I251 WeakPolarHBondContact O-CB 3.38Å; Q248-I251 PolarHBondContact O-N 3.41Å; I251-L254 WeakPolarHBondContact O-CB 3.17Å; I251-L254 PolarHBondContact O-N 3.29Å; I251-L255 PolarHBondContact O-N 3.48Å
252E92.6Very high91.4Very high67 Ų6760.1 Ų60.131%0.31332%0.315SS..Hα-helixtrans-63.2-45.1178.7-70.2171.817900111.3Q248 E249 L254 L255 E256Q248-E252 PolarHBondContact NE2-OE1 3.41Å; Q248-E252 PolarHBondContact O-N 3.46Å; E249-E252 PolarHBondContact O-N 3.24Å; E252-L254 VanDerWaalsContact C-N 3.3Å; E252-L254 PolarHBondContact O-N 2.88Å; E252-L255 WeakPolarHBondContact O-CB 3.33Å; E252-L255 PolarHBondContact O-N 3.05Å; E252-E256 PolarHBondContact O-N 3.03Å
253S93.6Very high90.9Very high63 Ų6361.7 Ų61.744%0.44132%0.319SS..Hα-helixtrans-60.9-39.1174.3-178.50000112.3E249 S257E249-S253 VanDerWaalsContact O-CB 3.32Å; E249-S253 WeakPolarHBondContact O-CB 3.41Å; E249-S253 PolarHBondContact O-N 3.11Å; S253-S257 PolarHBondContact O-N 2.95Å
254L92.6Very high90Very high11 Ų1164.9 Ų64.96%0.05833%0.327CS..Hα-helixtrans-65.1-45.3176.4-176.663000110.9L188 D192 F195 Q250 I251 E252 E256 S257 S258L188-L254 HydrophobicContact CB-CD2 4.16Å; L188-L254 WeakPolarHBondContact O-CD2 3.37Å; D192-L254 HydrophobicContact CB-CD1 3.91Å; D192-L254 HydrophobicContact CB-CD2 3.74Å; F195-L254 HydrophobicContact CD2-CD2 4.4Å; F195-L254 HydrophobicContact CE2-CD2 3.91Å; Q250-L254 VanDerWaalsContact O-CB 3.27Å; Q250-L254 WeakPolarHBondContact O-CB 3.36Å; Q250-L254 PolarHBondContact O-N 3.19Å; I251-L254 WeakPolarHBondContact O-CB 3.17Å; I251-L254 PolarHBondContact O-N 3.29Å; E252-L254 VanDerWaalsContact C-N 3.3Å; E252-L254 PolarHBondContact O-N 2.88Å; L254-E256 PolarHBondContact O-N 3.02Å; L254-S257 PolarHBondContact O-N 3.11Å; L254-S257 PolarHBondContact O-OG 3.25Å; L254-S258 PolarHBondContact O-N 3.4Å; L254-S258 PolarHBondContact O-OG 3.02Å
255L91.8Very high88.5Confident53 Ų5370.9 Ų70.928%0.27736%0.355SS..Hα-helixtrans-56.4-50.3175.4179.271.4000111.3F185 L188 I251 E252 S257 S258 L259F185-L255 HydrophobicContact CE1-CB 4.44Å; F185-L255 HydrophobicContact CE1-CD1 4.14Å; F185-L255 HydrophobicContact CE1-CD2 3.83Å; F185-L255 HydrophobicContact CE1-CG 4.34Å; F185-L255 HydrophobicContact CZ-CD2 4.35Å; L188-L255 HydrophobicContact CD1-CB 4.48Å; L188-L255 HydrophobicContact CD1-CD1 3.69Å; I251-L255 PolarHBondContact O-N 3.48Å; E252-L255 WeakPolarHBondContact O-CB 3.33Å; E252-L255 PolarHBondContact O-N 3.05Å; L255-S257 VanDerWaalsContact C-N 3.28Å; L255-S257 PolarHBondContact O-N 3.43Å; L255-S258 PolarHBondContact O-N 3.47Å; L255-L259 HydrophobicContact CD1-CD1 4.42Å; L255-L259 HydrophobicContact CD1-CG 4.45Å; L255-L259 HydrophobicContact CG-CD1 4.07Å; L255-L259 HydrophobicContact CG-CG 4.46Å; L255-L259 WeakPolarHBondContact O-CG 3.18Å; L255-L259 PolarHBondContact O-N 2.68Å
256E91.3Very high87Confident111 Ų11171.5 Ų71.552%0.51937%0.365SS..Hα-helixtrans-57.5-42.6178.1-73.4-176.4-17400112E252 L254 L259 R260E252-E256 PolarHBondContact O-N 3.03Å; L254-E256 PolarHBondContact O-N 3.02Å; E256-L259 PolarHBondContact O-N 3.08Å; E256-R260 WeakPolarHBondContact O-CG 3.34Å; E256-R260 PolarHBondContact O-N 3.4Å; E256-R260 VanDerWaalsContact O-N 3.09Å
257S90.4Very high85.2Confident41 Ų4174 Ų7429%0.28738%0.376SS..Hα-helixtrans-65.4-39.8178.779.10000112.4S253 L254 L255 R260 Q261S253-S257 PolarHBondContact O-N 2.95Å; L254-S257 PolarHBondContact O-N 3.11Å; L254-S257 PolarHBondContact O-OG 3.25Å; L255-S257 VanDerWaalsContact C-N 3.28Å; L255-S257 PolarHBondContact O-N 3.43Å; S257-R260 PolarHBondContact O-N 3.3Å; S257-Q261 WeakPolarHBondContact O-CG 3.5Å; S257-Q261 PolarHBondContact O-N 3.24Å
258S89.2Confident83.1Confident28 Ų2876.5 Ų76.520%0.19639%0.393CS..Hα-helixtrans-68.2-40.5177.6-65.20000111.7L254 L255 R260 Q261 A262L254-S258 PolarHBondContact O-N 3.4Å; L254-S258 PolarHBondContact O-OG 3.02Å; L255-S258 PolarHBondContact O-N 3.47Å; S258-R260 PolarHBondContact O-N 2.81Å; S258-Q261 PolarHBondContact O-N 2.92Å; S258-A262 PolarHBondContact O-N 2.67Å
259L88.4Confident80.9Confident94 Ų9478.2 Ų78.249%0.49241%0.407SS..Hα-helixtrans-62.6-41.7175.3-70.6172.8000111.9L255 E256 A262 Q263L255-L259 HydrophobicContact CD1-CD1 4.42Å; L255-L259 HydrophobicContact CD1-CG 4.45Å; L255-L259 HydrophobicContact CG-CD1 4.07Å; L255-L259 HydrophobicContact CG-CG 4.46Å; L255-L259 WeakPolarHBondContact O-CG 3.18Å; L255-L259 PolarHBondContact O-N 2.68Å; E256-L259 PolarHBondContact O-N 3.08Å; L259-A262 PolarHBondContact O-N 3.08Å; L259-Q263 VanDerWaalsContact O-CG 3.31Å; L259-Q263 WeakPolarHBondContact O-CG 3.32Å; L259-Q263 PolarHBondContact O-N 3.44Å
260R89.8Confident78.7Confident159 Ų15979.2 Ų79.260%0.641%0.412SS*.Hα-helixtrans-64-40.7174.8-71178.4-172.2-179.27.2112.2E256 S257 S258 Q263 Q264E256-R260 WeakPolarHBondContact O-CG 3.34Å; E256-R260 PolarHBondContact O-N 3.4Å; E256-R260 VanDerWaalsContact O-N 3.09Å; S257-R260 PolarHBondContact O-N 3.3Å; S258-R260 PolarHBondContact O-N 2.81Å; R260-Q263 PolarHBondContact O-N 3.48Å; R260-Q264 WeakPolarHBondContact O-CG 3.31Å; R260-Q264 PolarHBondContact O-N 3.13Å
261Q84.3Confident76.3Confident97 Ų9779.6 Ų79.645%0.45342%0.419SS..Hα-helixtrans-63.5-43.8176.5-75.8169.716.100111.5S257 S258 Q263 Q264 H265S257-Q261 WeakPolarHBondContact O-CG 3.5Å; S257-Q261 PolarHBondContact O-N 3.24Å; S258-Q261 PolarHBondContact O-N 2.92Å; Q261-Q263 PolarHBondContact O-N 3.12Å; Q261-Q264 PolarHBondContact O-N 3.41Å; Q261-H265 PolarHBondContact O-N 3.38Å
262A83.4Confident73.9Confident53 Ų5386.5 Ų86.544%0.43845%0.449SS..Hα-helixtrans-62.5-42.1176.700000112.3S258 L259 H265 N266S258-A262 PolarHBondContact O-N 2.67Å; L259-A262 PolarHBondContact O-N 3.08Å; A262-H265 PolarHBondContact O-N 3.09Å; A262-N266 PolarHBondContact O-N 3.15Å
263Q79.8Confident71.5Confident127 Ų12787.4 Ų87.459%0.59346%0.459SS*.Hα-helixtrans-63.8-42.4176.5-73.3171.8-11.200112.4L259 R260 Q261 H265 N266 V267L259-Q263 VanDerWaalsContact O-CG 3.31Å; L259-Q263 WeakPolarHBondContact O-CG 3.32Å; L259-Q263 PolarHBondContact O-N 3.44Å; R260-Q263 PolarHBondContact O-N 3.48Å; Q261-Q263 PolarHBondContact O-N 3.12Å; Q263-H265 VanDerWaalsContact C-N 3.35Å; Q263-N266 PolarHBondContact O-N 2.71Å; Q263-V267 WeakPolarHBondContact O-CG2 3.48Å; Q263-V267 PolarHBondContact O-N 3.01Å; Q263-V267 VanDerWaalsContact O-N 3.11Å
264Q73.1Confident69.4Low136 Ų13689.1 Ų89.164%0.63647%0.466SS*.Hα-helixtrans-65-38.8176.9-73172.9-2.700112.1R260 Q261 V267 S268R260-Q264 WeakPolarHBondContact O-CG 3.31Å; R260-Q264 PolarHBondContact O-N 3.13Å; Q261-Q264 PolarHBondContact O-N 3.41Å; Q264-V267 PolarHBondContact O-N 3.26Å; Q264-S268 WeakPolarHBondContact O-CB 3.35Å; Q264-S268 PolarHBondContact O-N 3.38Å; Q264-S268 PolarHBondContact O-OG 3.35Å
265H63.8Low67.2Low126 Ų12695.1 Ų95.158%0.58349%0.494SS*.Hα-helixtrans-64.7-43.2176.7-159.2-83.1000111.4Q261 A262 Q263 V267 S268 S269Q261-H265 PolarHBondContact O-N 3.38Å; A262-H265 PolarHBondContact O-N 3.09Å; Q263-H265 VanDerWaalsContact C-N 3.35Å; H265-V267 PolarHBondContact O-N 3.29Å; H265-S268 WeakPolarHBondContact CA-OG 3.36Å; H265-S268 PolarHBondContact O-N 3.33Å; H265-S268 PolarHBondContact O-OG 2.86Å; H265-S269 WeakPolarHBondContact O-CB 3.46Å; H265-S269 PolarHBondContact O-N 3.43Å; H265-S269 PolarHBondContact O-OG 3.23Å
266N58.8Low64.9Low102 Ų10298.3 Ų98.355%0.54551%0.512SS..Hα-helixtrans-61.2-43.9176.1-76.8-5.3000112.4A262 Q263 S268 S269 E270A262-N266 PolarHBondContact O-N 3.15Å; Q263-N266 PolarHBondContact O-N 2.71Å; N266-S268 VanDerWaalsContact C-N 3.34Å; N266-S268 PolarHBondContact O-N 3.43Å; N266-S269 PolarHBondContact O-N 3.12Å; N266-E270 WeakPolarHBondContact O-CG 3.46Å; N266-E270 PolarHBondContact O-N 3.29Å
267V55.5Low62.6Low91 Ų91100.6 Ų100.655%0.55252%0.522SS*.Hα-helixtrans-64.6-37.8177.3176.20000111.7Q263 Q264 H265 T271Q263-V267 WeakPolarHBondContact O-CG2 3.48Å; Q263-V267 PolarHBondContact O-N 3.01Å; Q263-V267 VanDerWaalsContact O-N 3.11Å; Q264-V267 PolarHBondContact O-N 3.26Å; H265-V267 PolarHBondContact O-N 3.29Å; V267-T271 PolarHBondContact O-N 3.47Å; V267-T271 VanDerWaalsContact O-N 3.08Å; V267-T271 PolarHBondContact O-OG1 3.38Å
268S49.9Very low60.5Low54 Ų54102 Ų10238%0.37854%0.537SS..Hα-helixtrans-72.4-26.5176.771.90000114.2Q264 H265 N266 T271 K272Q264-S268 WeakPolarHBondContact O-CB 3.35Å; Q264-S268 PolarHBondContact O-N 3.38Å; Q264-S268 PolarHBondContact O-OG 3.35Å; H265-S268 WeakPolarHBondContact CA-OG 3.36Å; H265-S268 PolarHBondContact O-N 3.33Å; H265-S268 PolarHBondContact O-OG 2.86Å; N266-S268 VanDerWaalsContact C-N 3.34Å; N266-S268 PolarHBondContact O-N 3.43Å; S268-T271 WeakPolarHBondContact CA-OG1 3.47Å; S268-T271 PolarHBondContact O-OG1 3.45Å; S268-K272 PolarHBondContact O-N 3.37Å
269S49.5Very low58.4Low47 Ų47107.9 Ų107.933%0.32957%0.566SS.*Hα-helixtrans-73.9-43175.2-49.70000110.1H265 N266 K272 T273H265-S269 WeakPolarHBondContact O-CB 3.46Å; H265-S269 PolarHBondContact O-N 3.43Å; H265-S269 PolarHBondContact O-OG 3.23Å; N266-S269 PolarHBondContact O-N 3.12Å; S269-K272 PolarHBondContact O-N 3.26Å; S269-T273 PolarHBondContact O-N 3.31Å; S269-T273 VanDerWaalsContact O-N 3.12Å; S269-T273 PolarHBondContact O-OG1 3.12Å; S269-T273 VanDerWaalsContact O-OG1 3.13Å
270E45.5Very low56.4Low131 Ų131110.9 Ų110.961%0.61258%0.581SS**Hα-helixtrans-66.2-37.9176.5-74.5178.9172.700112.5N266 T273 V274N266-E270 WeakPolarHBondContact O-CG 3.46Å; N266-E270 PolarHBondContact O-N 3.29Å; E270-T273 VanDerWaalsContact CA-OG1 3.29Å; E270-T273 WeakPolarHBondContact CA-OG1 3.31Å; E270-T273 PolarHBondContact O-N 3.18Å; E270-T273 PolarHBondContact O-OG1 2.92Å; E270-V274 VanDerWaalsContact O-CG2 3.31Å; E270-V274 WeakPolarHBondContact O-CG2 3.29Å; E270-V274 PolarHBondContact O-N 2.8Å
271T45.5Very low54.2Low79 Ų79107.9 Ų107.949%0.48559%0.585SS.*Hα-helixtrans-68.5-36.1175.820.10000112.7V267 S268 V274 E275V267-T271 PolarHBondContact O-N 3.47Å; V267-T271 VanDerWaalsContact O-N 3.08Å; V267-T271 PolarHBondContact O-OG1 3.38Å; S268-T271 WeakPolarHBondContact CA-OG1 3.47Å; S268-T271 PolarHBondContact O-OG1 3.45Å; T271-V274 PolarHBondContact O-N 3.1Å; T271-E275 PolarHBondContact O-N 3.22Å; T271-E275 VanDerWaalsContact O-N 3.15Å
272K43.3Very low51.9Low146 Ų146109.1 Ų109.164%0.63560%0.603SS**Hα-helixtrans-67.2-38.4173.9-81.4-177.5175-178.70113.1S268 S269 V274 E275 D276S268-K272 PolarHBondContact O-N 3.37Å; S269-K272 PolarHBondContact O-N 3.26Å; K272-V274 VanDerWaalsContact C-N 3.28Å; K272-V274 PolarHBondContact O-N 3.37Å; K272-E275 PolarHBondContact O-N 3.37Å; K272-D276 PolarHBondContact O-N 3.04Å; K272-D276 VanDerWaalsContact O-N 3.08Å
273T42.6Very low49.7Very low86 Ų86112.8 Ų112.853%0.52862%0.62SS.*Hα-helixtrans-65.7-30.4175.240.10000113.1S269 E270 E277S269-T273 PolarHBondContact O-N 3.31Å; S269-T273 VanDerWaalsContact O-N 3.12Å; S269-T273 PolarHBondContact O-OG1 3.12Å; S269-T273 VanDerWaalsContact O-OG1 3.13Å; E270-T273 VanDerWaalsContact CA-OG1 3.29Å; E270-T273 WeakPolarHBondContact CA-OG1 3.31Å; E270-T273 PolarHBondContact O-N 3.18Å; E270-T273 PolarHBondContact O-OG1 2.92Å; T273-E277 PolarHBondContact O-N 3.17Å
274V48.3Very low47.7Very low99 Ų99112.8 Ų112.860%0.663%0.631SS**Hα-helixtrans-77.8-32.7177.5175.30000112E270 T271 K272 A278E270-V274 VanDerWaalsContact O-CG2 3.31Å; E270-V274 WeakPolarHBondContact O-CG2 3.29Å; E270-V274 PolarHBondContact O-N 2.8Å; T271-V274 PolarHBondContact O-N 3.1Å; K272-V274 VanDerWaalsContact C-N 3.28Å; K272-V274 PolarHBondContact O-N 3.37Å; V274-A278 PolarHBondContact O-N 3.21Å
275E46.1Very low46.2Very low138 Ų138112.4 Ų112.465%0.64564%0.638SS**Hα-helixtrans-72.2-38.7174.6-73.7-178.2167.400112.3T271 K272 A278T271-E275 PolarHBondContact O-N 3.22Å; T271-E275 VanDerWaalsContact O-N 3.15Å; K272-E275 PolarHBondContact O-N 3.37Å; E275-A278 PolarHBondContact O-N 3.32Å
276D44.9Very low45.1Very low120 Ų120113.4 Ų113.464%0.64265%0.648SS**Hα-helixtrans-72-28.2177-80.9-22.3000113.3K272K272-D276 PolarHBondContact O-N 3.04Å; K272-D276 VanDerWaalsContact O-N 3.08Å
277E43.4Very low44.4Very low159 Ų159114.8 Ų114.874%0.74366%0.659SS**Hα-helixtrans-75.4-25.4173.1-82.5-165.2162.400113.2T273T273-E277 PolarHBondContact O-N 3.17Å
278A45.7Very low43.9Very low71 Ų71120.6 Ų120.659%0.58767%0.671SS**Hα-helixtrans-75.1-23.6-179.400000113.5V274 E275V274-A278 PolarHBondContact O-N 3.21Å; E275-A278 PolarHBondContact O-N 3.32Å
279D43.8Very low43.5Very low150 Ų150125.4 Ų125.480%0.80269%0.693SS**THydrogen-bonded Turntrans-90.2-2.5-176.2-101.4-8.3000114.4
280L47.1Very low43Very low157 Ų157129.8 Ų129.882%0.82272%0.718SS**THydrogen-bonded Turntrans-105.34.7-177.2-81.7162.6000115.7
281S43.5Very low42.6Very low96 Ų96131.1 Ų131.167%0.67173%0.729SS**  trans-114.967.7178.872.10000114.2
282C36.9Very low42.4Very low124 Ų124138.7 Ų138.784%0.83876%0.764SS**  trans-139.185.4160.9-83.80000111.2
283T36.3Very low42.3Very low130 Ų130138.4 Ų138.480%0.79877%0.771SS**  trans-105114.915750.90000108.8
284P39Very low42.3Very low126 Ų126141.1 Ų141.182%0.81878%0.783SS**  trans-83.6114.4173.220.5-9.4000109.6D286P284-D286 PolarHBondContact O-N 3.49Å
285T40.9Very low42Very low129 Ų129143.4 Ų143.479%0.79179%0.793SS**  trans-90.398.2172.3-31.70000108.7
286D39.6Very low41.8Very low146 Ų146143.8 Ų143.878%0.78180%0.802SS**  trans-122.594.4169.1-139.7-5.1000108.6P284P284-D286 PolarHBondContact O-N 3.49Å
287V45.1Very low41.6Very low131 Ų131145.3 Ų145.379%0.79481%0.812SS**  trans-119.193.5174.5-1740000107.3
288R46Very low41.4Very low213 Ų213144.3 Ų144.380%0.80482%0.817SS**  trans-120.1114157.8-69.7-172.8179.1-172.40.8107
289D40.1Very low41.1Very low156 Ų156149.6 Ų149.683%0.83483%0.833SS**  trans166.2105132.7-80.2-18.7000109.8
290V40Very low40.9Very low139 Ų139149.5 Ų149.584%0.84284%0.836SS**  trans-115.2116159.6178.20000106
291N37Very low40.4Very low158 Ų158148.9 Ų148.985%0.84584%0.837SS**  trans-135.7109.8161.8-92.8-28.8000108.7
292I40.6Very low40.1Very low239 Ų239153.7 Ų153.7100%1.22685%0.852SS**  trans-122.50141.6-63.8178.4000105.3

Retrieved 292 of 292 residues in 91.1 ms (Link to these results)