A0A096N1M2_PAPAN Loading...

Olfactory receptor

AlphaFold DB , UniProt , Accession A0A096N1M2, Species PAPAN (Papio anubis, Olive baboon), Gene OR5AN1, Length 311 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M32Very low51.5Low246 Ų246132.8 Ų132.8100%1.21274%0.739SS**  0880-77.9167.617100108.1R3M1-R3 PolarHBondContact O-N 3.41Å
2T38.4Very low54Low149 Ų149130.5 Ų130.591%0.91471%0.712SS**  trans-69.1118.1172.6260000108.2G4T2-G4 PolarHBondContact O-N 3.45Å
3R37.8Very low56.2Low249 Ų249120.5 Ų120.594%0.9466%0.657SS**  trans-66.3102176.2-154.6178.4-169.8-172.62.5106.7M1 G5M1-R3 PolarHBondContact O-N 3.41Å; R3-G5 PolarHBondContact O-N 3.38Å
4G43Very low57.9Low77 Ų77114.5 Ų114.579%0.79463%0.626SS**  trans-62.596.8172.900000109.1T2T2-G4 PolarHBondContact O-N 3.45Å
5G41.1Very low59.4Low58 Ų58106.9 Ų106.960%0.59859%0.585SS**  trans-67.9131.6163.600000108R3 I7R3-G5 PolarHBondContact O-N 3.38Å; G5-I7 PolarHBondContact O-N 3.09Å
6N42.3Very low60.2Low159 Ų159102.8 Ų102.885%0.8556%0.561SS**  trans-56.5107.5165.9-96.2-14.7000107.7T8N6-T8 VanDerWaalsContact C-N 3.26Å; N6-T8 PolarHBondContact O-N 3.13Å
7I54.1Low60.9Low130 Ų13097.1 Ų97.167%0.66753%0.531SS*.  trans-78.186.3170.3-55.3174.9000105.6G5 E9 H168G5-I7 PolarHBondContact O-N 3.09Å; I7-E9 PolarHBondContact O-N 3.37Å; I7-H168 WeakPolarHBondContact CG2-NE2 3.48Å
8T59.3Low61.4Low111 Ų11191.7 Ų91.768%0.68150%0.502SS*.  trans-73115.8170.439.90000108.4N6 I10N6-T8 VanDerWaalsContact C-N 3.26Å; N6-T8 PolarHBondContact O-N 3.13Å; T8-I10 PolarHBondContact O-N 3.18Å
9E66.6Low61.7Low157 Ų15789.1 Ų89.173%0.73449%0.491SS*.  trans-60.1128.3175.8-164174.6-170.600110.2I7 T11I7-E9 PolarHBondContact O-N 3.37Å; E9-T11 PolarHBondContact O-N 3.49Å
10I73.9Confident62.2Low28 Ų2889.3 Ų89.314%0.14449%0.491CS..  trans-71.8112.1-179.2-64.1-179.3000109T8 Y12 F13 F169 G171 N173T8-I10 PolarHBondContact O-N 3.18Å; I10-Y12 WeakPolarHBondContact CG2-O 3.44Å; I10-F13 HydrophobicContact CG2-CD1 4.27Å; I10-F13 HydrophobicContact CG2-CE1 3.99Å; I10-F13 HydrophobicContact CG2-CZ 4.32Å; I10-F169 HydrophobicContact CD1-CB 3.95Å; I10-F169 WeakPolarHBondContact CD1-O 3.38Å; I10-G171 WeakPolarHBondContact CD1-O 3.35Å; I10-N173 HydrophobicContact CG2-CB 4.08Å
11T77.8Confident62.6Low97 Ų9788.1 Ų88.160%0.59548%0.482SS*.  trans-94.2-18.8-179.751.10000113.4E9 F95E9-T11 PolarHBondContact O-N 3.49Å; T11-F95 PolarHBondContact O-N 3.11Å
12Y81.6Confident64.5Low105 Ų10581 Ų8141%0.41245%0.454SS..EExtended strand (participates in β ladder)trans-147.1155.3-17968.3-86.5000112.1I10 V14 T92 I93 N173I10-Y12 WeakPolarHBondContact CG2-O 3.44Å; Y12-V14 HydrophobicContact CD2-CG2 4.46Å; Y12-V14 HydrophobicContact CE2-CG2 4.19Å; Y12-T92 HydrophobicContact CD2-CG2 3.72Å; Y12-T92 HydrophobicContact CE2-CG2 4.09Å; Y12-I93 CarbonylContact C-O 3.59Å; Y12-I93 VanDerWaalsContact CA-O 3.31Å; Y12-I93 WeakPolarHBondContact CA-O 3.22Å; Y12-N173 WeakPolarHBondContact CE2-ND2 3.47Å; Y12-N173 VanDerWaalsContact CZ-ND2 3.3Å; Y12-N173 WeakPolarHBondContact O-CB 3.37Å; Y12-N173 PolarHBondContact OH-ND2 3.03Å
13F82.4Confident66.5Low0 Ų085.6 Ų85.60%045%0.454CS..EExtended strand (participates in β ladder)trans-117.3145.9172-62.4-75.9000110.8I10 T92 I93 F95 C98 F169 N173 I175 L185 L188I10-F13 HydrophobicContact CG2-CD1 4.27Å; I10-F13 HydrophobicContact CG2-CE1 3.99Å; I10-F13 HydrophobicContact CG2-CZ 4.32Å; F13-T92 CarbonylContact O-C 3.52Å; F13-T92 WeakPolarHBondContact O-CA 3.23Å; F13-I93 HydrophobicContact CB-CG2 3.94Å; F13-I93 PolarHBondContact N-O 3.33Å; F13-I93 PolarHBondContact O-N 3.09Å; F13-F95 HydrophobicContact CE2-CB 4.41Å; F13-F95 AromaticContact CE2-CD2 3.58Å; F13-F95 HydrophobicContact CE2-CD2 3.58Å; F13-F95 HydrophobicContact CE2-CE2 4.33Å; F13-F95 HydrophobicContact CE2-CG 4.43Å; F13-F95 AromaticContact CZ-CD2 3.9Å; F13-F95 HydrophobicContact CZ-CD2 3.9Å; F13-F95 HydrophobicContact CZ-CE2 4.39Å; F13-C98 HydrophobicContact CD2-CB 3.98Å; F13-C98 HydrophobicContact CE2-CB 4.25Å; F13-F169 HydrophobicContact CZ-CD1 4.39Å; F13-F169 HydrophobicContact CZ-CG 4.43Å; F13-N173 CarbonylContact C-O 3.45Å; F13-N173 VanDerWaalsContact CA-O 3.31Å; F13-N173 WeakPolarHBondContact CA-O 3.46Å; F13-I175 HydrophobicContact CB-CD1 3.68Å; F13-I175 HydrophobicContact CB-CG1 4.18Å; F13-I175 HydrophobicContact CD1-CD1 3.93Å; F13-I175 HydrophobicContact CD1-CG1 4.16Å; F13-I175 HydrophobicContact CD2-CD1 4.18Å; F13-I175 HydrophobicContact CG-CD1 3.69Å; F13-I175 HydrophobicContact CG-CG1 4.31Å; F13-L185 HydrophobicContact CE1-CD2 4.31Å; F13-L185 HydrophobicContact CE2-CD2 4.02Å; F13-L185 HydrophobicContact CZ-CD2 3.88Å; F13-L188 HydrophobicContact CD1-CD1 3.96Å; F13-L188 HydrophobicContact CE1-CD1 3.87Å
14V80.6Confident68.4Low37 Ų3777 Ų7722%0.22443%0.426CS..EExtended strand (participates in β ladder)trans-96.6115.1173-176.30000108.3Y12 L16 Q91 T92 N173 V174 I175Y12-V14 HydrophobicContact CD2-CG2 4.46Å; Y12-V14 HydrophobicContact CE2-CG2 4.19Å; V14-L16 PolarHBondContact O-N 3.14Å; V14-Q91 CarbonylContact C-O 3.23Å; V14-Q91 WeakPolarHBondContact CA-O 3.5Å; V14-T92 HydrophobicContact CG2-CG2 4.2Å; V14-N173 PolarHBondContact N-O 2.91Å; V14-V174 HydrophobicContact CB-CG2 4.39Å; V14-I175 PolarHBondContact O-N 3.5Å
15L79.6Confident70.2Confident1 Ų175.1 Ų75.11%0.00540%0.398CS..EExtended strand (participates in β ladder)trans-89.897.7178.5-70.7165.2000109.6G17 N85 Q91 I93 I175 H177L15-G17 PolarHBondContact O-N 3.06Å; L15-N85 WeakPolarHBondContact CD1-ND2 3.38Å; L15-Q91 PolarHBondContact N-O 3.15Å; L15-Q91 WeakPolarHBondContact O-CB 3.45Å; L15-Q91 PolarHBondContact O-OE1 3.08Å; L15-I93 HydrophobicContact CD1-CB 3.82Å; L15-I93 HydrophobicContact CD1-CD1 4.35Å; L15-I93 HydrophobicContact CD1-CG2 3.65Å; L15-I93 HydrophobicContact CD2-CG2 4.43Å; L15-I93 HydrophobicContact CG-CG2 3.87Å; L15-I175 HydrophobicContact CD2-CB 4.04Å; L15-I175 HydrophobicContact CD2-CD1 4.35Å; L15-I175 HydrophobicContact CD2-CG2 3.85Å; L15-H177 CarbonylContact C-O 3.6Å
16L73.1Confident72.2Confident41 Ų4177.2 Ų77.222%0.21540%0.399CS..  trans-66.8-22.7-173-132.995.4000113.9V14 F18 S19 V174 I175V14-L16 PolarHBondContact O-N 3.14Å; L16-F18 PolarHBondContact O-N 3.3Å; L16-F18 VanDerWaalsContact O-N 3.08Å; L16-S19 WeakPolarHBondContact O-CB 3.42Å; L16-S19 PolarHBondContact O-N 3.08Å; L16-S19 PolarHBondContact O-OG 3.42Å; L16-V174 HydrophobicContact CD1-CG1 3.51Å; L16-I175 PolarHBondContact N-O 3.01Å
17G71.1Confident74.2Confident5 Ų574 Ų745%0.05238%0.384CS..THydrogen-bonded Turntrans36.6-112.2175.800000115L15 H177 R273L15-G17 PolarHBondContact O-N 3.06Å; G17-H177 PolarHBondContact N-O 3.33Å; G17-R273 WeakPolarHBondContact O-CD 3.5Å; G17-R273 PolarHBondContact O-NH1 3.45Å
18F70.6Confident75.5Confident1 Ų168.8 Ų68.80%0.00436%0.358CS..THydrogen-bonded Turntrans-113.422.5-178.8-61.7-83.4000114L16 D20 F21 L28 F32 F86 F178 R273 F274 V277L16-F18 PolarHBondContact O-N 3.3Å; L16-F18 VanDerWaalsContact O-N 3.08Å; F18-D20 PolarHBondContact O-N 3.33Å; F18-F21 HydrophobicContact CD1-CD2 4.45Å; F18-F21 PolarHBondContact O-N 2.7Å; F18-L28 HydrophobicContact CB-CD1 3.7Å; F18-L28 HydrophobicContact CD1-CD1 4.02Å; F18-L28 HydrophobicContact CD2-CD1 4.44Å; F18-L28 HydrophobicContact CG-CD1 3.8Å; F18-F32 HydrophobicContact CE2-CE2 4.33Å; F18-F32 HydrophobicContact CE2-CZ 4.35Å; F18-F86 HydrophobicContact CB-CE1 4.06Å; F18-F86 AromaticContact CD2-CE1 3.97Å; F18-F86 HydrophobicContact CD2-CE1 3.97Å; F18-F86 AromaticContact CD2-CZ 3.85Å; F18-F86 HydrophobicContact CD2-CZ 3.85Å; F18-F86 HydrophobicContact CG-CE1 4.47Å; F18-F178 HydrophobicContact CE2-CD1 4.09Å; F18-R273 HydrophobicContact CE1-CB 4.26Å; F18-R273 HydrophobicContact CZ-CB 4.43Å; F18-R273 WeakPolarHBondContact CZ-O 3.48Å; F18-F274 HydrophobicContact CD1-CE1 4.23Å; F18-F274 HydrophobicContact CD1-CE2 4.21Å; F18-F274 AromaticContact CD1-CZ 3.94Å; F18-F274 HydrophobicContact CD1-CZ 3.94Å; F18-F274 AromaticContact CE1-CD1 3.88Å; F18-F274 HydrophobicContact CE1-CD1 3.88Å; F18-F274 HydrophobicContact CE1-CD2 4.12Å; F18-F274 AromaticContact CE1-CE1 3.79Å; F18-F274 HydrophobicContact CE1-CE1 3.79Å; F18-F274 HydrophobicContact CE1-CE2 4.02Å; F18-F274 HydrophobicContact CE1-CG 4.05Å; F18-F274 AromaticContact CE1-CZ 3.85Å; F18-F274 HydrophobicContact CE1-CZ 3.85Å; F18-V277 HydrophobicContact CE2-CG2 3.81Å; F18-V277 HydrophobicContact CZ-CG2 3.46Å; F18-V277 VanDerWaalsContact CZ-CG2 3.46Å
19S67.8Low76.7Confident41 Ų4165.7 Ų65.729%0.28734%0.335SS..THydrogen-bonded Turntrans-67.5-21.3-171.7-520000113.6L16 F21 Q91L16-S19 WeakPolarHBondContact O-CB 3.42Å; L16-S19 PolarHBondContact O-N 3.08Å; L16-S19 PolarHBondContact O-OG 3.42Å; S19-F21 PolarHBondContact O-N 2.87Å; S19-Q91 PolarHBondContact OG-NE2 3.32Å; S19-Q91 PolarHBondContact OG-OE1 3.06Å
20D69.8Low77.6Confident93 Ų9361.8 Ų61.850%0.49732%0.322SS..THydrogen-bonded Turntrans-67.9-8.6173.4-54.7-38.2000112.5F18 P22 R273F18-D20 PolarHBondContact O-N 3.33Å; D20-P22 VanDerWaalsContact C-CD 3.4Å; D20-P22 WeakPolarHBondContact O-CD 3.45Å; D20-R273 IonicContact OD2-CZ 3.56Å; D20-R273 IonicContact OD2-NH1 2.72Å; D20-R273 PolarHBondContact OD2-NH1 2.94Å; D20-R273 IonicContact OD2-NH2 3.5Å
21F72.1Confident78.1Confident66 Ų6663.6 Ų63.629%0.28934%0.335SS..  trans-122.561.6-175.7-56-77.1000113.8F18 S19 R23 I24 I25 F274F18-F21 HydrophobicContact CD1-CD2 4.45Å; F18-F21 PolarHBondContact O-N 2.7Å; S19-F21 PolarHBondContact O-N 2.87Å; F21-R23 PolarHBondContact O-N 3.35Å; F21-R23 VanDerWaalsContact O-N 3.1Å; F21-I24 HydrophobicContact CB-CD1 3.78Å; F21-I24 HydrophobicContact CB-CG1 3.57Å; F21-I24 HydrophobicContact CG-CD1 4.19Å; F21-I24 HydrophobicContact CG-CG1 4.48Å; F21-I24 WeakPolarHBondContact O-CG1 3.3Å; F21-I24 PolarHBondContact O-N 3.19Å; F21-I24 VanDerWaalsContact O-N 3.15Å; F21-I25 PolarHBondContact O-N 2.96Å; F21-F274 HydrophobicContact CE2-CE2 4.08Å; F21-F274 HydrophobicContact CZ-CE2 4.36Å
22P72.4Confident78.3Confident96 Ų9659.2 Ų59.262%0.62331%0.308SS*.THydrogen-bonded Turntrans-61.4-26.5-174.724.6-34.5000113.5D20 I24 I25D20-P22 VanDerWaalsContact C-CD 3.4Å; D20-P22 WeakPolarHBondContact O-CD 3.45Å; P22-I24 VanDerWaalsContact C-N 3.33Å; P22-I24 PolarHBondContact O-N 2.93Å; P22-I25 WeakPolarHBondContact O-CG2 3.43Å
23R78.3Confident78.6Confident245 Ų24557.1 Ų57.193%0.92530%0.303SS*.THydrogen-bonded Turntrans-70.3-24.3-179.9-67.8-175.8-176.6-177.71.4114.3F21F21-R23 PolarHBondContact O-N 3.35Å; F21-R23 VanDerWaalsContact O-N 3.1Å
24I79Confident78.8Confident68 Ų6861 Ų6135%0.34933%0.327SS..THydrogen-bonded Turntrans-1142-177.159169.5000112.6F21 P22 T26 V27 L28 F274F21-I24 HydrophobicContact CB-CD1 3.78Å; F21-I24 HydrophobicContact CB-CG1 3.57Å; F21-I24 HydrophobicContact CG-CD1 4.19Å; F21-I24 HydrophobicContact CG-CG1 4.48Å; F21-I24 WeakPolarHBondContact O-CG1 3.3Å; F21-I24 PolarHBondContact O-N 3.19Å; F21-I24 VanDerWaalsContact O-N 3.15Å; P22-I24 VanDerWaalsContact C-N 3.33Å; P22-I24 PolarHBondContact O-N 2.93Å; I24-T26 VanDerWaalsContact C-N 3.29Å; I24-T26 PolarHBondContact O-N 3.24Å; I24-V27 WeakPolarHBondContact O-CB 3.39Å; I24-V27 PolarHBondContact O-N 3.36Å; I24-L28 HydrophobicContact CD1-CD1 4.02Å; I24-L28 HydrophobicContact CD1-CG 4.4Å; I24-L28 HydrophobicContact CG1-CD1 4.06Å; I24-L28 HydrophobicContact CG1-CG 4.41Å; I24-L28 WeakPolarHBondContact O-CG 3.3Å; I24-L28 PolarHBondContact O-N 2.81Å; I24-F274 HydrophobicContact CD1-CZ 4.33Å
25I81.3Confident78.9Confident39 Ų3960.5 Ų60.520%0.232%0.322CS..Hα-helixtrans-59.6-39.2-175-157.2164.3000112.2F21 P22 V27 L28 F29 F86F21-I25 PolarHBondContact O-N 2.96Å; P22-I25 WeakPolarHBondContact O-CG2 3.43Å; I25-V27 VanDerWaalsContact C-N 3.34Å; I25-V27 PolarHBondContact O-N 3.47Å; I25-L28 PolarHBondContact O-N 3.01Å; I25-F29 WeakPolarHBondContact O-CB 3.29Å; I25-F29 PolarHBondContact O-N 3.41Å; I25-F86 HydrophobicContact CD1-CD1 4.01Å; I25-F86 HydrophobicContact CG1-CB 4.25Å; I25-F86 HydrophobicContact CG1-CD1 3.71Å; I25-F86 HydrophobicContact CG1-CE1 4.42Å; I25-F86 HydrophobicContact CG1-CG 4.21Å
26T82.6Confident79.2Confident102 Ų10262.9 Ų62.963%0.62633%0.332SS*.Hα-helixtrans-64.7-38.9175.8-48.40000112I24 T30I24-T26 VanDerWaalsContact C-N 3.29Å; I24-T26 PolarHBondContact O-N 3.24Å; T26-T30 WeakPolarHBondContact O-CB 3.34Å; T26-T30 PolarHBondContact O-N 3.16Å; T26-T30 PolarHBondContact O-OG1 2.92Å
27V84.6Confident80Confident90 Ų9065.6 Ų65.655%0.54535%0.345SS..Hα-helixtrans-67.8-44.5176.9178.40000110I24 I25 T30 T31I24-V27 WeakPolarHBondContact O-CB 3.39Å; I24-V27 PolarHBondContact O-N 3.36Å; I25-V27 VanDerWaalsContact C-N 3.34Å; I25-V27 PolarHBondContact O-N 3.47Å; V27-T30 PolarHBondContact O-N 3.09Å; V27-T31 VanDerWaalsContact O-CB 3.29Å; V27-T31 WeakPolarHBondContact O-CB 3.12Å; V27-T31 PolarHBondContact O-N 3.49Å; V27-T31 PolarHBondContact O-OG1 2.91Å
28L81.1Confident80.6Confident22 Ų2268.6 Ų68.612%0.11536%0.363CS..Hα-helixtrans-61.4-50.8176.1-68.9175.7000111F18 I24 I25 T30 T31 F32 F86 F274F18-L28 HydrophobicContact CB-CD1 3.7Å; F18-L28 HydrophobicContact CD1-CD1 4.02Å; F18-L28 HydrophobicContact CD2-CD1 4.44Å; F18-L28 HydrophobicContact CG-CD1 3.8Å; I24-L28 HydrophobicContact CD1-CD1 4.02Å; I24-L28 HydrophobicContact CD1-CG 4.4Å; I24-L28 HydrophobicContact CG1-CD1 4.06Å; I24-L28 HydrophobicContact CG1-CG 4.41Å; I24-L28 WeakPolarHBondContact O-CG 3.3Å; I24-L28 PolarHBondContact O-N 2.81Å; I25-L28 PolarHBondContact O-N 3.01Å; L28-T30 VanDerWaalsContact C-N 3.34Å; L28-T30 PolarHBondContact O-N 3.18Å; L28-T31 PolarHBondContact O-N 3.48Å; L28-T31 VanDerWaalsContact O-N 3.15Å; L28-F32 HydrophobicContact CB-CD2 4.2Å; L28-F32 HydrophobicContact CB-CE2 4.09Å; L28-F32 HydrophobicContact CD2-CE2 4.13Å; L28-F32 WeakPolarHBondContact O-CB 3.32Å; L28-F32 WeakPolarHBondContact O-CD2 3.48Å; L28-F32 PolarHBondContact O-N 2.93Å; L28-F86 HydrophobicContact CB-CZ 4.4Å; L28-F274 HydrophobicContact CD2-CE1 4.31Å
29F85.1Confident81.3Confident45 Ų4568.8 Ų68.820%0.19736%0.364CS..Hα-helixtrans-53.1-51.3176.7176.1-92.5000111.5I25 T31 F32 L33 L83 F86 L87I25-F29 WeakPolarHBondContact O-CB 3.29Å; I25-F29 PolarHBondContact O-N 3.41Å; F29-T31 VanDerWaalsContact C-N 3.33Å; F29-T31 PolarHBondContact O-N 2.86Å; F29-F32 PolarHBondContact O-N 3.15Å; F29-L33 HydrophobicContact CE1-CD2 4.02Å; F29-L33 HydrophobicContact CZ-CD2 4.37Å; F29-L33 VanDerWaalsContact O-CB 3.24Å; F29-L33 WeakPolarHBondContact O-CB 3.26Å; F29-L33 PolarHBondContact O-N 3.21Å; F29-L83 HydrophobicContact CD2-CB 4.48Å; F29-L83 HydrophobicContact CD2-CD2 3.77Å; F29-L83 HydrophobicContact CE2-CB 4.14Å; F29-L83 HydrophobicContact CE2-CD2 3.97Å; F29-L83 HydrophobicContact CG-CD2 4.41Å; F29-F86 HydrophobicContact CB-CB 4.3Å; F29-F86 HydrophobicContact CB-CD2 4.01Å; F29-F86 HydrophobicContact CB-CG 4.43Å; F29-F86 HydrophobicContact CD2-CB 3.91Å; F29-F86 HydrophobicContact CD2-CD2 4.02Å; F29-F86 HydrophobicContact CD2-CG 4.46Å; F29-L87 HydrophobicContact CD2-CD2 4.19Å; F29-L87 HydrophobicContact CD2-CG 4.27Å; F29-L87 HydrophobicContact CE2-CD1 3.77Å; F29-L87 HydrophobicContact CE2-CD2 3.87Å; F29-L87 HydrophobicContact CE2-CG 3.75Å; F29-L87 HydrophobicContact CZ-CD1 4.02Å; F29-L87 HydrophobicContact CZ-CD2 4.15Å; F29-L87 HydrophobicContact CZ-CG 4.32Å
30T85.6Confident82.3Confident75 Ų7568.2 Ų68.246%0.4636%0.358SS..Hα-helixtrans-60.8-44.5179.5-54.20000111.1T26 V27 L28 L33 V34T26-T30 WeakPolarHBondContact O-CB 3.34Å; T26-T30 PolarHBondContact O-N 3.16Å; T26-T30 PolarHBondContact O-OG1 2.92Å; V27-T30 PolarHBondContact O-N 3.09Å; L28-T30 VanDerWaalsContact C-N 3.34Å; L28-T30 PolarHBondContact O-N 3.18Å; T30-L33 PolarHBondContact O-N 3.34Å; T30-V34 WeakPolarHBondContact O-CG2 3.41Å; T30-V34 PolarHBondContact O-N 2.64Å
31T82.9Confident83.2Confident67 Ų6766.2 Ų66.241%0.41135%0.354SS..Hα-helixtrans-62.2-50.1179.8-58.30000111.2V27 L28 F29 L33 V34 I35V27-T31 VanDerWaalsContact O-CB 3.29Å; V27-T31 WeakPolarHBondContact O-CB 3.12Å; V27-T31 PolarHBondContact O-N 3.49Å; V27-T31 PolarHBondContact O-OG1 2.91Å; L28-T31 PolarHBondContact O-N 3.48Å; L28-T31 VanDerWaalsContact O-N 3.15Å; F29-T31 VanDerWaalsContact C-N 3.33Å; F29-T31 PolarHBondContact O-N 2.86Å; T31-L33 VanDerWaalsContact C-N 3.33Å; T31-L33 PolarHBondContact O-N 3.47Å; T31-V34 PolarHBondContact O-N 3.37Å; T31-I35 HydrophobicContact CG2-CD1 3.8Å; T31-I35 WeakPolarHBondContact O-CB 3.26Å; T31-I35 WeakPolarHBondContact O-CG1 3.31Å; T31-I35 PolarHBondContact O-N 3.35Å
32F82.6Confident83.8Confident5 Ų567.2 Ų67.22%0.02236%0.356CS..Hα-helixtrans-65.5-35.1179.2-74.5-61.1000113.2F18 L28 F29 I35 Y36 M82 L83 F86 V277F18-F32 HydrophobicContact CE2-CE2 4.33Å; F18-F32 HydrophobicContact CE2-CZ 4.35Å; L28-F32 HydrophobicContact CB-CD2 4.2Å; L28-F32 HydrophobicContact CB-CE2 4.09Å; L28-F32 HydrophobicContact CD2-CE2 4.13Å; L28-F32 WeakPolarHBondContact O-CB 3.32Å; L28-F32 WeakPolarHBondContact O-CD2 3.48Å; L28-F32 PolarHBondContact O-N 2.93Å; F29-F32 PolarHBondContact O-N 3.15Å; F32-I35 PolarHBondContact O-N 2.82Å; F32-Y36 VanDerWaalsContact O-CB 3.28Å; F32-Y36 WeakPolarHBondContact O-CB 3.21Å; F32-Y36 PolarHBondContact O-N 3.25Å; F32-M82 HydrophobicContact CB-CE 3.81Å; F32-M82 HydrophobicContact CD1-CE 3.31Å; F32-M82 HydrophobicContact CD1-SD 4.35Å; F32-M82 HydrophobicContact CD2-CE 3.84Å; F32-M82 HydrophobicContact CD2-SD 4.27Å; F32-M82 HydrophobicContact CE1-CE 3.73Å; F32-M82 HydrophobicContact CE1-SD 4.25Å; F32-M82 HydrophobicContact CE2-CE 4.24Å; F32-M82 HydrophobicContact CE2-SD 4.21Å; F32-M82 HydrophobicContact CG-CE 3.37Å; F32-M82 HydrophobicContact CG-SD 4.36Å; F32-M82 HydrophobicContact CZ-CE 4.2Å; F32-M82 HydrophobicContact CZ-SD 4.21Å; F32-L83 HydrophobicContact CB-CD2 3.7Å; F32-F86 AromaticContact CD2-CE2 3.6Å; F32-F86 HydrophobicContact CD2-CE2 3.6Å; F32-F86 AromaticContact CD2-CZ 3.96Å; F32-F86 HydrophobicContact CD2-CZ 3.96Å; F32-F86 HydrophobicContact CE2-CE2 4.17Å; F32-F86 HydrophobicContact CE2-CZ 4.04Å; F32-F86 HydrophobicContact CG-CE2 4.47Å; F32-V277 HydrophobicContact CE1-CB 4.2Å; F32-V277 HydrophobicContact CE1-CG1 3.41Å; F32-V277 VanDerWaalsContact CE1-CG1 3.41Å; F32-V277 HydrophobicContact CE1-CG2 3.84Å; F32-V277 HydrophobicContact CZ-CB 4.12Å; F32-V277 HydrophobicContact CZ-CG1 3.59Å; F32-V277 HydrophobicContact CZ-CG2 3.44Å; F32-V277 VanDerWaalsContact CZ-CG2 3.44Å
33L87.6Confident84.7Confident61 Ų6162.6 Ų62.632%0.31933%0.326SS..Hα-helixtrans-65.4-45.8176.5-178.466.7000111.1F29 T30 T31 Y36 I37 L83F29-L33 HydrophobicContact CE1-CD2 4.02Å; F29-L33 HydrophobicContact CZ-CD2 4.37Å; F29-L33 VanDerWaalsContact O-CB 3.24Å; F29-L33 WeakPolarHBondContact O-CB 3.26Å; F29-L33 PolarHBondContact O-N 3.21Å; T30-L33 PolarHBondContact O-N 3.34Å; T31-L33 VanDerWaalsContact C-N 3.33Å; T31-L33 PolarHBondContact O-N 3.47Å; L33-Y36 PolarHBondContact O-N 3.4Å; L33-I37 HydrophobicContact CD1-CD1 4.06Å; L33-I37 HydrophobicContact CD1-CG1 4.45Å; L33-I37 HydrophobicContact CG-CD1 4.03Å; L33-I37 WeakPolarHBondContact O-CG1 3.24Å; L33-I37 PolarHBondContact O-N 2.92Å; L33-L83 HydrophobicContact CB-CD1 4.41Å; L33-L83 HydrophobicContact CB-CD2 4.18Å; L33-L83 HydrophobicContact CD1-CD1 3.91Å
34V86.9Confident85.3Confident82 Ų8255 Ų5550%0.49730%0.304SS..Hα-helixtrans-61.5-46.7176.3170.30000110.6T30 T31 Y36 I37 T38T30-V34 WeakPolarHBondContact O-CG2 3.41Å; T30-V34 PolarHBondContact O-N 2.64Å; T31-V34 PolarHBondContact O-N 3.37Å; V34-Y36 VanDerWaalsContact C-N 3.33Å; V34-Y36 PolarHBondContact O-N 3.32Å; V34-I37 PolarHBondContact O-N 3.42Å; V34-T38 HydrophobicContact CG1-CG2 4.26Å; V34-T38 WeakPolarHBondContact O-CB 3.28Å; V34-T38 VanDerWaalsContact O-CG2 3.26Å; V34-T38 WeakPolarHBondContact O-CG2 3.44Å; V34-T38 PolarHBondContact O-N 2.53Å; V34-T38 PolarHBondContact O-OG1 2.93Å
35I82.3Confident85.8Confident25 Ų2555.2 Ų55.213%0.12831%0.311CS..Hα-helixtrans-56.5-46.7175.5-74.5174.7000110.9T31 F32 T38 S39 V281 M285T31-I35 HydrophobicContact CG2-CD1 3.8Å; T31-I35 WeakPolarHBondContact O-CB 3.26Å; T31-I35 WeakPolarHBondContact O-CG1 3.31Å; T31-I35 PolarHBondContact O-N 3.35Å; F32-I35 PolarHBondContact O-N 2.82Å; I35-T38 WeakPolarHBondContact CA-OG1 2.86Å; I35-T38 PolarHBondContact O-OG1 2.81Å; I35-T38 VanDerWaalsContact O-OG1 3.07Å; I35-S39 VanDerWaalsContact O-CB 3.3Å; I35-S39 WeakPolarHBondContact O-CB 3.22Å; I35-S39 PolarHBondContact O-N 3.32Å; I35-S39 PolarHBondContact O-OG 3.41Å; I35-V281 HydrophobicContact CG2-CG1 3.37Å; I35-M285 HydrophobicContact CB-CE 4.23Å; I35-M285 HydrophobicContact CB-SD 3.89Å; I35-M285 HydrophobicContact CG1-CE 3.95Å; I35-M285 HydrophobicContact CG1-SD 4.28Å; I35-M285 HydrophobicContact CG2-CE 4.03Å; I35-M285 HydrophobicContact CG2-CG 3.65Å; I35-M285 HydrophobicContact CG2-SD 3.34Å; I35-M285 WeakPolarHBondContact CG2-SD 3.48Å
36Y86.1Confident86.1Confident51 Ų5153.7 Ų53.720%0.230%0.303CS..Hα-helixtrans-60.8-52178.9176.6-116.4000112.8F32 L33 V34 T38 S39 L40 I75 V79 P80 L83F32-Y36 VanDerWaalsContact O-CB 3.28Å; F32-Y36 WeakPolarHBondContact O-CB 3.21Å; F32-Y36 PolarHBondContact O-N 3.25Å; L33-Y36 PolarHBondContact O-N 3.4Å; V34-Y36 VanDerWaalsContact C-N 3.33Å; V34-Y36 PolarHBondContact O-N 3.32Å; Y36-T38 PolarHBondContact O-N 3.04Å; Y36-S39 PolarHBondContact O-N 3.41Å; Y36-L40 HydrophobicContact CD1-CD1 4.12Å; Y36-L40 HydrophobicContact CD2-CD1 4.07Å; Y36-L40 HydrophobicContact CD2-CG 4.36Å; Y36-L40 HydrophobicContact CE1-CD1 3.54Å; Y36-L40 HydrophobicContact CE2-CD1 3.47Å; Y36-L40 VanDerWaalsContact CE2-CD1 3.47Å; Y36-L40 HydrophobicContact CE2-CG 3.98Å; Y36-L40 HydrophobicContact CG-CD1 4.37Å; Y36-L40 WeakPolarHBondContact O-CB 3.45Å; Y36-L40 PolarHBondContact O-N 2.97Å; Y36-L40 WeakPolarHBondContact OH-CD1 3.08Å; Y36-I75 HydrophobicContact CD2-CB 4.36Å; Y36-I75 HydrophobicContact CD2-CG1 4.36Å; Y36-I75 HydrophobicContact CE2-CG1 4.29Å; Y36-V79 HydrophobicContact CD2-CB 3.88Å; Y36-V79 HydrophobicContact CD2-CG1 3.99Å; Y36-V79 HydrophobicContact CE2-CB 4.5Å; Y36-V79 HydrophobicContact CG-CB 4.43Å; Y36-V79 HydrophobicContact CG-CG1 4.04Å; Y36-P80 HydrophobicContact CE2-CG 3.94Å; Y36-L83 HydrophobicContact CD1-CD1 4.49Å
37I89.3Confident86.6Confident98 Ų9850.2 Ų50.250%0.50328%0.28SS..Hα-helixtrans-63.7-44.7-178-65.9170.8000110.3L33 V34 L40 A41L33-I37 HydrophobicContact CD1-CD1 4.06Å; L33-I37 HydrophobicContact CD1-CG1 4.45Å; L33-I37 HydrophobicContact CG-CD1 4.03Å; L33-I37 WeakPolarHBondContact O-CG1 3.24Å; L33-I37 PolarHBondContact O-N 2.92Å; V34-I37 PolarHBondContact O-N 3.42Å; I37-L40 PolarHBondContact O-N 3.33Å; I37-A41 WeakPolarHBondContact O-CB 3.2Å; I37-A41 PolarHBondContact O-N 3.25Å
38T85Confident86.9Confident69 Ų6949.1 Ų49.142%0.42327%0.274SS..Hα-helixtrans-65.9-42179.653.50000112V34 I35 Y36 W42V34-T38 HydrophobicContact CG1-CG2 4.26Å; V34-T38 WeakPolarHBondContact O-CB 3.28Å; V34-T38 VanDerWaalsContact O-CG2 3.26Å; V34-T38 WeakPolarHBondContact O-CG2 3.44Å; V34-T38 PolarHBondContact O-N 2.53Å; V34-T38 PolarHBondContact O-OG1 2.93Å; I35-T38 WeakPolarHBondContact CA-OG1 2.86Å; I35-T38 PolarHBondContact O-OG1 2.81Å; I35-T38 VanDerWaalsContact O-OG1 3.07Å; Y36-T38 PolarHBondContact O-N 3.04Å; T38-W42 WeakPolarHBondContact O-CB 3.03Å; T38-W42 PolarHBondContact O-N 3.24Å
39S84.2Confident87.3Confident4 Ų448.6 Ų48.63%0.02827%0.271CS..Hα-helixtrans-57.3-51.1173.5-65.60000112.6I35 Y36 W42 N43 M285I35-S39 VanDerWaalsContact O-CB 3.3Å; I35-S39 WeakPolarHBondContact O-CB 3.22Å; I35-S39 PolarHBondContact O-N 3.32Å; I35-S39 PolarHBondContact O-OG 3.41Å; Y36-S39 PolarHBondContact O-N 3.41Å; S39-W42 PolarHBondContact O-N 3.5Å; S39-N43 WeakPolarHBondContact O-CB 3.05Å; S39-N43 PolarHBondContact O-N 2.92Å; S39-N43 PolarHBondContact O-ND2 3.01Å; S39-N43 VanDerWaalsContact O-ND2 3.13Å; S39-M285 WeakPolarHBondContact OG-CG 3.46Å; S39-M285 PolarHBondContact OG-SD 2.91Å
40L88.9Confident87.6Confident30 Ų3046.8 Ų46.816%0.15726%0.264CS..Hα-helixtrans-61.8-51.4-178.5-86.6175.3000110.2Y36 I37 W42 N43 L44 V72 I75Y36-L40 HydrophobicContact CD1-CD1 4.12Å; Y36-L40 HydrophobicContact CD2-CD1 4.07Å; Y36-L40 HydrophobicContact CD2-CG 4.36Å; Y36-L40 HydrophobicContact CE1-CD1 3.54Å; Y36-L40 HydrophobicContact CE2-CD1 3.47Å; Y36-L40 VanDerWaalsContact CE2-CD1 3.47Å; Y36-L40 HydrophobicContact CE2-CG 3.98Å; Y36-L40 HydrophobicContact CG-CD1 4.37Å; Y36-L40 WeakPolarHBondContact O-CB 3.45Å; Y36-L40 PolarHBondContact O-N 2.97Å; Y36-L40 WeakPolarHBondContact OH-CD1 3.08Å; I37-L40 PolarHBondContact O-N 3.33Å; L40-W42 VanDerWaalsContact C-N 3.27Å; L40-W42 PolarHBondContact O-N 2.94Å; L40-N43 PolarHBondContact O-N 2.91Å; L40-L44 VanDerWaalsContact O-CB 3.25Å; L40-L44 WeakPolarHBondContact O-CB 3.25Å; L40-L44 WeakPolarHBondContact O-CG 3.33Å; L40-L44 PolarHBondContact O-N 2.89Å; L40-V72 HydrophobicContact CD2-CB 4.47Å; L40-V72 HydrophobicContact CD2-CG1 3.83Å; L40-V72 HydrophobicContact CD2-CG2 4.29Å; L40-I75 HydrophobicContact CB-CD1 4.39Å; L40-I75 HydrophobicContact CD2-CD1 3.82Å; L40-I75 HydrophobicContact CD2-CG1 4.27Å; L40-I75 HydrophobicContact CG-CD1 3.66Å; L40-I75 HydrophobicContact CG-CG1 4.36Å
41A89.1Confident87.8Confident51 Ų5151.9 Ų51.942%0.42127%0.274SS..Hα-helixtrans-56.8-44.5179.400000110.8I37 S45I37-A41 WeakPolarHBondContact O-CB 3.2Å; I37-A41 PolarHBondContact O-N 3.25Å; A41-S45 WeakPolarHBondContact O-CB 3.5Å; A41-S45 PolarHBondContact O-N 2.72Å; A41-S45 PolarHBondContact O-OG 3.04Å
42W85.9Confident88Confident86 Ų8653.3 Ų53.333%0.32628%0.278SS..Hα-helixtrans-67.5-50.3-178.2-166.1-92.2000112.7T38 S39 L40 S45 L46 P288 L289 S292 L293T38-W42 WeakPolarHBondContact O-CB 3.03Å; T38-W42 PolarHBondContact O-N 3.24Å; S39-W42 PolarHBondContact O-N 3.5Å; L40-W42 VanDerWaalsContact C-N 3.27Å; L40-W42 PolarHBondContact O-N 2.94Å; W42-S45 PolarHBondContact O-N 3.46Å; W42-L46 WeakPolarHBondContact O-CB 2.96Å; W42-L46 PolarHBondContact O-N 3.38Å; W42-P288 PolarHBondContact NE1-O 2.9Å; W42-L289 HydrophobicContact CD2-CD2 3.7Å; W42-L289 HydrophobicContact CE3-CD2 4.11Å; W42-L289 HydrophobicContact CG-CD2 4.12Å; W42-L289 HydrophobicContact CH2-CD2 4.35Å; W42-L289 HydrophobicContact CZ2-CD2 3.98Å; W42-L289 HydrophobicContact CZ3-CD2 4.41Å; W42-S292 WeakPolarHBondContact CZ2-OG 3.36Å; W42-S292 PolarHBondContact NE1-OG 3.34Å; W42-L293 HydrophobicContact CH2-CD2 4.07Å; W42-L293 HydrophobicContact CZ2-CD2 4.32Å; W42-L293 HydrophobicContact CZ2-CG 4.48Å
43N89.4Confident88.3Confident0 Ų053.6 Ų53.60%028%0.279CS..Hα-helixtrans-64.1-43.7179.8-83.4-61.2000112.4S39 L40 L46 I47 S68 V72 P288S39-N43 WeakPolarHBondContact O-CB 3.05Å; S39-N43 PolarHBondContact O-N 2.92Å; S39-N43 PolarHBondContact O-ND2 3.01Å; S39-N43 VanDerWaalsContact O-ND2 3.13Å; L40-N43 PolarHBondContact O-N 2.91Å; N43-L46 PolarHBondContact O-N 3.48Å; N43-I47 WeakPolarHBondContact O-CG1 3.48Å; N43-I47 PolarHBondContact O-N 2.94Å; N43-S68 WeakPolarHBondContact OD1-CA 3.19Å; N43-S68 VanDerWaalsContact OD1-CB 3.26Å; N43-S68 WeakPolarHBondContact OD1-CB 3.45Å; N43-S68 PolarHBondContact OD1-OG 3.48Å; N43-V72 HydrophobicContact CB-CG2 3.53Å; N43-P288 WeakPolarHBondContact OD1-CB 3.35Å; N43-P288 VanDerWaalsContact OD1-CG 3.31Å; N43-P288 WeakPolarHBondContact OD1-CG 3.41Å
44L91.4Very high88.2Confident86 Ų8654.7 Ų54.745%0.4529%0.292SS..Hα-helixtrans-64.2-42175.8-67.5172.8000111.3L40 L46 I47 V48 V72L40-L44 VanDerWaalsContact O-CB 3.25Å; L40-L44 WeakPolarHBondContact O-CB 3.25Å; L40-L44 WeakPolarHBondContact O-CG 3.33Å; L40-L44 PolarHBondContact O-N 2.89Å; L44-L46 VanDerWaalsContact C-N 3.3Å; L44-L46 PolarHBondContact O-N 3.31Å; L44-I47 PolarHBondContact O-N 3.47Å; L44-V48 VanDerWaalsContact O-CG2 3.32Å; L44-V48 WeakPolarHBondContact O-CG2 3.41Å; L44-V48 PolarHBondContact O-N 3.21Å; L44-V72 HydrophobicContact CD2-CG2 4.21Å; L44-V72 HydrophobicContact CG-CG2 4.28Å
45S89.4Confident88.2Confident72 Ų7256.7 Ų56.750%0.50330%0.296SS..Hα-helixtrans-61.5-39.5175.7-63.90000111.8A41 W42 V48 L49A41-S45 WeakPolarHBondContact O-CB 3.5Å; A41-S45 PolarHBondContact O-N 2.72Å; A41-S45 PolarHBondContact O-OG 3.04Å; W42-S45 PolarHBondContact O-N 3.46Å; S45-V48 PolarHBondContact O-N 3.02Å; S45-L49 WeakPolarHBondContact O-CB 3.37Å; S45-L49 PolarHBondContact O-N 3.05Å
46L89.3Confident88.3Confident6 Ų655.6 Ų55.63%0.03129%0.29CS..Hα-helixtrans-65.8-43.5177.7-175.656.5000111.6W42 N43 L44 L49 I50 L64 S68 P288 I298W42-L46 WeakPolarHBondContact O-CB 2.96Å; W42-L46 PolarHBondContact O-N 3.38Å; N43-L46 PolarHBondContact O-N 3.48Å; L44-L46 VanDerWaalsContact C-N 3.3Å; L44-L46 PolarHBondContact O-N 3.31Å; L46-L49 PolarHBondContact O-N 3.32Å; L46-I50 HydrophobicContact CD1-CD1 3.99Å; L46-I50 HydrophobicContact CD1-CG1 4.3Å; L46-I50 HydrophobicContact CG-CD1 3.95Å; L46-I50 WeakPolarHBondContact O-CD1 3.42Å; L46-I50 VanDerWaalsContact O-CG1 3.26Å; L46-I50 WeakPolarHBondContact O-CG1 3.42Å; L46-I50 PolarHBondContact O-N 3.03Å; L46-L64 HydrophobicContact CD1-CD2 4.49Å; L46-L64 HydrophobicContact CD2-CD1 4.45Å; L46-L64 HydrophobicContact CD2-CD2 3.96Å; L46-L64 HydrophobicContact CD2-CG 4Å; L46-S68 WeakPolarHBondContact CD2-OG 3.37Å; L46-P288 HydrophobicContact CD2-CB 4Å; L46-I298 HydrophobicContact CD1-CD1 4.01Å; L46-I298 HydrophobicContact CD1-CG1 4.49Å; L46-I298 HydrophobicContact CD1-CG2 4.37Å
47I91.8Very high88.4Confident29 Ų2959 Ų5915%0.14931%0.307CS..Hα-helixtrans-58.3-51.3173.5-66.2164.8000109.9N43 L44 L49 I50 R51 F69N43-I47 WeakPolarHBondContact O-CG1 3.48Å; N43-I47 PolarHBondContact O-N 2.94Å; L44-I47 PolarHBondContact O-N 3.47Å; I47-L49 VanDerWaalsContact C-N 3.33Å; I47-L49 PolarHBondContact O-N 3.23Å; I47-I50 PolarHBondContact O-N 3.47Å; I47-R51 VanDerWaalsContact O-CG 3.26Å; I47-R51 WeakPolarHBondContact O-CG 3.04Å; I47-R51 PolarHBondContact O-N 3.2Å; I47-F69 HydrophobicContact CD1-CB 4.27Å
48V91.4Very high88.4Confident68 Ų6856.6 Ų56.641%0.41230%0.297SS..Hα-helixtrans-59.7-44.5179.4170.90000111.1L44 S45 I50 R51 M52L44-V48 VanDerWaalsContact O-CG2 3.32Å; L44-V48 WeakPolarHBondContact O-CG2 3.41Å; L44-V48 PolarHBondContact O-N 3.21Å; S45-V48 PolarHBondContact O-N 3.02Å; V48-I50 PolarHBondContact O-N 3.28Å; V48-R51 PolarHBondContact O-N 2.84Å; V48-M52 HydrophobicContact CG1-CG 4.2Å; V48-M52 HydrophobicContact CG1-SD 3.69Å; V48-M52 WeakPolarHBondContact O-CB 3.48Å; V48-M52 VanDerWaalsContact O-CG 3.3Å; V48-M52 WeakPolarHBondContact O-CG 3.47Å; V48-M52 PolarHBondContact O-N 3.43Å
49L89.9Confident88.8Confident10 Ų1054.4 Ų54.45%0.05229%0.285CS..Hα-helixtrans-60.9-45.9179.6-176.166.3000111.8S45 L46 I47 R51 M52 D53 L56 I298 A301 L305S45-L49 WeakPolarHBondContact O-CB 3.37Å; S45-L49 PolarHBondContact O-N 3.05Å; L46-L49 PolarHBondContact O-N 3.32Å; I47-L49 VanDerWaalsContact C-N 3.33Å; I47-L49 PolarHBondContact O-N 3.23Å; L49-R51 VanDerWaalsContact C-N 3.28Å; L49-R51 PolarHBondContact O-N 2.83Å; L49-M52 PolarHBondContact O-N 3.35Å; L49-D53 PolarHBondContact O-N 2.98Å; L49-L56 HydrophobicContact CD2-CD1 4.36Å; L49-L56 HydrophobicContact CG-CD1 3.98Å; L49-I298 HydrophobicContact CD2-CG2 4.01Å; L49-A301 HydrophobicContact CD1-CB 3.95Å; L49-A301 HydrophobicContact CD2-CB 4.11Å; L49-A301 HydrophobicContact CG-CB 4.11Å; L49-L305 HydrophobicContact CD1-CB 4.15Å; L49-L305 HydrophobicContact CD1-CD2 3.9Å
50I89.8Confident89.1Confident8 Ų854.7 Ų54.74%0.04129%0.286CS..Hα-helixtrans-62.6-37.2177.5-68.1164.5000110.8L46 I47 V48 L56 H57 L64L46-I50 HydrophobicContact CD1-CD1 3.99Å; L46-I50 HydrophobicContact CD1-CG1 4.3Å; L46-I50 HydrophobicContact CG-CD1 3.95Å; L46-I50 WeakPolarHBondContact O-CD1 3.42Å; L46-I50 VanDerWaalsContact O-CG1 3.26Å; L46-I50 WeakPolarHBondContact O-CG1 3.42Å; L46-I50 PolarHBondContact O-N 3.03Å; I47-I50 PolarHBondContact O-N 3.47Å; V48-I50 PolarHBondContact O-N 3.28Å; I50-L56 HydrophobicContact CG1-CD1 4.2Å; I50-H57 PolarHBondContact O-CD2 3.38Å; I50-H57 PolarHBondContact O-NE2 2.88Å; I50-H57 VanDerWaalsContact O-NE2 3.15Å; I50-L64 HydrophobicContact CD1-CB 4.48Å; I50-L64 HydrophobicContact CD1-CD2 4.48Å
51R90Very high89.2Confident182 Ų18253.5 Ų53.569%0.68728%0.279SS*.Hα-helixtrans-72.7-28.8177.6-65.7-63.7-17394.82.7113.7I47 V48 L49I47-R51 VanDerWaalsContact O-CG 3.26Å; I47-R51 WeakPolarHBondContact O-CG 3.04Å; I47-R51 PolarHBondContact O-N 3.2Å; V48-R51 PolarHBondContact O-N 2.84Å; L49-R51 VanDerWaalsContact C-N 3.28Å; L49-R51 PolarHBondContact O-N 2.83Å
52M88Confident89.4Confident97 Ų9754.7 Ų54.748%0.47828%0.275SS..Hα-helixtrans-89.7-29.5-175.9-73.2-173.172.700113.5V48 L49 L305V48-M52 HydrophobicContact CG1-CG 4.2Å; V48-M52 HydrophobicContact CG1-SD 3.69Å; V48-M52 WeakPolarHBondContact O-CB 3.48Å; V48-M52 VanDerWaalsContact O-CG 3.3Å; V48-M52 WeakPolarHBondContact O-CG 3.47Å; V48-M52 PolarHBondContact O-N 3.43Å; L49-M52 PolarHBondContact O-N 3.35Å; M52-L305 HydrophobicContact CE-CD1 3.5Å; M52-L305 HydrophobicContact SD-CD1 3.78Å
53D87.7Confident89.8Confident11 Ų1150.6 Ų50.66%0.05926%0.259CS..  trans-103107.4-178-163.8-27.7000111.4L49 H55 L56 A301 R304L49-D53 PolarHBondContact O-N 2.98Å; D53-H55 PolarHBondContact O-N 3.34Å; D53-H55 VanDerWaalsContact O-N 3.09Å; D53-H55 VanDerWaalsContact OD1-CB 3.29Å; D53-H55 WeakPolarHBondContact OD1-CB 3.37Å; D53-H55 IonicContact OD1-CG 3.42Å; D53-H55 PolarHBondContact OD1-N 3.11Å; D53-H55 IonicContact OD1-ND1 2.81Å; D53-H55 PolarHBondContact OD1-ND1 2.89Å; D53-L56 HydrophobicContact CB-CD1 4.16Å; D53-L56 HydrophobicContact CB-CG 4.17Å; D53-L56 WeakPolarHBondContact O-CB 3.4Å; D53-L56 PolarHBondContact O-N 3.36Å; D53-A301 HydrophobicContact CB-CB 4.31Å; D53-A301 WeakPolarHBondContact OD2-CA 3.49Å; D53-A301 VanDerWaalsContact OD2-CB 3.3Å; D53-A301 WeakPolarHBondContact OD2-CB 3.39Å; D53-R304 IonicContact OD1-NH2 3.83Å; D53-R304 IonicContact OD2-CZ 3.2Å; D53-R304 IonicContact OD2-NE 2.87Å; D53-R304 PolarHBondContact OD2-NE 3.33Å; D53-R304 IonicContact OD2-NH2 2.7Å; D53-R304 PolarHBondContact OD2-NH2 3.33Å
54S86.9Confident89.8Confident83 Ų8350.7 Ų50.758%0.5826%0.26SS*.G310 helixtrans-58.6-23.4177.9580000113.9L56 H57S54-L56 PolarHBondContact O-N 3.2Å; S54-H57 WeakPolarHBondContact O-CB 3.48Å; S54-H57 PolarHBondContact O-N 3.43Å
55H85.6Confident89.9Confident125 Ų12547.1 Ų47.158%0.57924%0.242SC*.G310 helixtrans-70.2-19.4176.1-57.484000112.2D53D53-H55 PolarHBondContact O-N 3.34Å; D53-H55 VanDerWaalsContact O-N 3.09Å; D53-H55 VanDerWaalsContact OD1-CB 3.29Å; D53-H55 WeakPolarHBondContact OD1-CB 3.37Å; D53-H55 IonicContact OD1-CG 3.42Å; D53-H55 PolarHBondContact OD1-N 3.11Å; D53-H55 IonicContact OD1-ND1 2.81Å; D53-H55 PolarHBondContact OD1-ND1 2.89Å
56L85.9Confident90.2Very high2 Ų245 Ų451%0.0123%0.225CC..G310 helixtrans-91.83174.6-60.3179.5000112.3L49 I50 D53 S54 T58 Y61 E297 A301L49-L56 HydrophobicContact CD2-CD1 4.36Å; L49-L56 HydrophobicContact CG-CD1 3.98Å; I50-L56 HydrophobicContact CG1-CD1 4.2Å; D53-L56 HydrophobicContact CB-CD1 4.16Å; D53-L56 HydrophobicContact CB-CG 4.17Å; D53-L56 WeakPolarHBondContact O-CB 3.4Å; D53-L56 PolarHBondContact O-N 3.36Å; S54-L56 PolarHBondContact O-N 3.2Å; L56-T58 PolarHBondContact O-N 2.99Å; L56-Y61 HydrophobicContact CB-CD2 3.96Å; L56-Y61 HydrophobicContact CB-CE2 4.49Å; L56-Y61 HydrophobicContact CB-CG 4.21Å; L56-Y61 HydrophobicContact CD2-CD1 4.44Å; L56-Y61 HydrophobicContact CD2-CD2 3.86Å; L56-Y61 HydrophobicContact CD2-CE1 4.15Å; L56-Y61 HydrophobicContact CD2-CE2 3.53Å; L56-Y61 HydrophobicContact CD2-CG 4.33Å; L56-Y61 WeakPolarHBondContact O-CB 3.44Å; L56-Y61 VanDerWaalsContact O-CD2 3.24Å; L56-Y61 WeakPolarHBondContact O-CD2 3.37Å; L56-E297 HydrophobicContact CD2-CB 4.25Å; L56-A301 HydrophobicContact CD1-CB 3.66Å; L56-A301 HydrophobicContact CD2-CB 4.45Å; L56-A301 HydrophobicContact CG-CB 4.16Å
57H87.9Confident90.3Very high121 Ų12144.8 Ų44.856%0.5622%0.224SC*.  trans-78.157.1177.3-66.9179.5000112.2I50 S54I50-H57 PolarHBondContact O-CD2 3.38Å; I50-H57 PolarHBondContact O-NE2 2.88Å; I50-H57 VanDerWaalsContact O-NE2 3.15Å; S54-H57 WeakPolarHBondContact O-CB 3.48Å; S54-H57 PolarHBondContact O-N 3.43Å
58T89.8Confident90.2Very high48 Ų4843.4 Ų43.429%0.29422%0.217SC..SBendtrans-109.7156.717473.90000110.5L56 M60 Y61 F62L56-T58 PolarHBondContact O-N 2.99Å; T58-M60 VanDerWaalsContact C-N 3.27Å; T58-M60 PolarHBondContact O-N 2.64Å; T58-Y61 HydrophobicContact CG2-CD2 4.4Å; T58-Y61 PolarHBondContact O-N 3.07Å; T58-Y61 VanDerWaalsContact O-N 3.11Å; T58-Y61 WeakPolarHBondContact OG1-CD2 3.48Å; T58-F62 PolarHBondContact O-N 3.35Å
59P92.1Very high90.3Very high24 Ų2445 Ų4516%0.15622%0.218CC..Hα-helixtrans-49-43.6178.3-33.538.9000114.4Y61 F62 F63 D122 Y133 M137P59-Y61 PolarHBondContact O-N 3.05Å; P59-F62 WeakPolarHBondContact O-CB 3.37Å; P59-F62 PolarHBondContact O-N 2.99Å; P59-F63 HydrophobicContact CB-CE2 4.32Å; P59-F63 WeakPolarHBondContact O-CD2 3.09Å; P59-F63 PolarHBondContact O-N 3.05Å; P59-D122 WeakPolarHBondContact CB-OD1 3.46Å; P59-Y133 WeakPolarHBondContact CG-OH 3.29Å; P59-M137 HydrophobicContact CB-CB 4.41Å; P59-M137 HydrophobicContact CG-CB 4.01Å
60M91.3Very high90.4Very high10 Ų1044.5 Ų44.55%0.04922%0.216CC..Hα-helixtrans-59.5-45.4178.2-178.767.8177.600113.5T58 F62 F63 L64 M119 R123 Y291T58-M60 VanDerWaalsContact C-N 3.27Å; T58-M60 PolarHBondContact O-N 2.64Å; M60-F62 VanDerWaalsContact C-N 3.33Å; M60-F63 PolarHBondContact O-N 3.18Å; M60-L64 WeakPolarHBondContact O-CB 3.35Å; M60-L64 PolarHBondContact O-N 3.46Å; M60-M119 HydrophobicContact CE-CE 3.38Å; M60-M119 HydrophobicContact SD-CB 4.18Å; M60-M119 HydrophobicContact SD-CE 3.74Å; M60-M119 HydrophobicContact SD-CG 4.26Å; M60-R123 HydrophobicContact SD-CG 4.49Å; M60-Y291 HydrophobicContact CE-CD1 4.22Å; M60-Y291 HydrophobicContact CE-CE1 3.87Å
61Y90.5Very high90.3Very high5 Ų544.1 Ų44.12%0.0221%0.214CC..Hα-helixtrans-73.8-28.1178.6-67.8-57.1000111.8L56 T58 P59 L64 S65 N295 E297 I298L56-Y61 HydrophobicContact CB-CD2 3.96Å; L56-Y61 HydrophobicContact CB-CE2 4.49Å; L56-Y61 HydrophobicContact CB-CG 4.21Å; L56-Y61 HydrophobicContact CD2-CD1 4.44Å; L56-Y61 HydrophobicContact CD2-CD2 3.86Å; L56-Y61 HydrophobicContact CD2-CE1 4.15Å; L56-Y61 HydrophobicContact CD2-CE2 3.53Å; L56-Y61 HydrophobicContact CD2-CG 4.33Å; L56-Y61 WeakPolarHBondContact O-CB 3.44Å; L56-Y61 VanDerWaalsContact O-CD2 3.24Å; L56-Y61 WeakPolarHBondContact O-CD2 3.37Å; T58-Y61 HydrophobicContact CG2-CD2 4.4Å; T58-Y61 PolarHBondContact O-N 3.07Å; T58-Y61 VanDerWaalsContact O-N 3.11Å; T58-Y61 WeakPolarHBondContact OG1-CD2 3.48Å; P59-Y61 PolarHBondContact O-N 3.05Å; Y61-L64 HydrophobicContact CD1-CD2 3.98Å; Y61-L64 HydrophobicContact CE1-CD2 4.38Å; Y61-L64 PolarHBondContact O-N 3.43Å; Y61-S65 WeakPolarHBondContact O-CB 3.48Å; Y61-S65 PolarHBondContact O-N 3.36Å; Y61-N295 PolarHBondContact OH-ND2 3.36Å; Y61-N295 PolarHBondContact OH-OD1 2.92Å; Y61-E297 VanDerWaalsContact CE2-OE2 3.28Å; Y61-E297 WeakPolarHBondContact CE2-OE2 3.49Å; Y61-E297 VanDerWaalsContact CZ-OE2 3.32Å; Y61-E297 VanDerWaalsContact OH-CB 3.31Å; Y61-E297 WeakPolarHBondContact OH-CB 3.4Å; Y61-E297 PolarHBondContact OH-OE2 2.89Å; Y61-I298 HydrophobicContact CD1-CD1 4.46Å; Y61-I298 HydrophobicContact CE1-CD1 3.81Å; Y61-I298 HydrophobicContact CE1-CG1 3.81Å
62F93.4Very high90.3Very high76 Ų7636.4 Ų36.433%0.33319%0.187SC..Hα-helixtrans-61.5-45169.2176.1-104.3000111.6T58 P59 M60 S65 N66 C142 V143 V146T58-F62 PolarHBondContact O-N 3.35Å; P59-F62 WeakPolarHBondContact O-CB 3.37Å; P59-F62 PolarHBondContact O-N 2.99Å; M60-F62 VanDerWaalsContact C-N 3.33Å; F62-S65 PolarHBondContact O-N 3.23Å; F62-N66 PolarHBondContact O-N 3.47Å; F62-N66 PolarHBondContact O-ND2 3.08Å; F62-C142 HydrophobicContact CD1-CB 3.84Å; F62-C142 HydrophobicContact CE1-CB 3.98Å; F62-V143 HydrophobicContact CE1-CG2 4.46Å; F62-V143 HydrophobicContact CZ-CG2 4.03Å; F62-V146 HydrophobicContact CD1-CG2 4.12Å; F62-V146 HydrophobicContact CE1-CB 4.23Å; F62-V146 HydrophobicContact CE1-CG2 3.45Å; F62-V146 VanDerWaalsContact CE1-CG2 3.45Å; F62-V146 HydrophobicContact CZ-CG2 4.15Å
63F93.6Very high90.4Very high0 Ų033 Ų330%017%0.172CC..Hα-helixtrans-64.8-43.1172.3-62.6-54.5000112.1P59 M60 S65 N66 L67 L115 A118 M119 D122 C142 M145 V146P59-F63 HydrophobicContact CB-CE2 4.32Å; P59-F63 WeakPolarHBondContact O-CD2 3.09Å; P59-F63 PolarHBondContact O-N 3.05Å; M60-F63 PolarHBondContact O-N 3.18Å; F63-S65 VanDerWaalsContact C-N 3.3Å; F63-S65 PolarHBondContact O-N 3.26Å; F63-N66 WeakPolarHBondContact O-CB 3.26Å; F63-N66 PolarHBondContact O-N 3.11Å; F63-L67 PolarHBondContact O-N 3.32Å; F63-L115 HydrophobicContact CD1-CD2 4.22Å; F63-A118 HydrophobicContact CD1-CB 4.31Å; F63-A118 HydrophobicContact CE1-CB 4.07Å; F63-A118 HydrophobicContact CZ-CB 4.26Å; F63-M119 HydrophobicContact CB-CG 3.39Å; F63-M119 HydrophobicContact CB-SD 4Å; F63-M119 HydrophobicContact CD2-CG 4.11Å; F63-M119 HydrophobicContact CG-CG 3.97Å; F63-D122 HydrophobicContact CD2-CB 4.5Å; F63-D122 HydrophobicContact CE2-CB 4.21Å; F63-C142 HydrophobicContact CE1-CB 4.42Å; F63-C142 HydrophobicContact CZ-CB 4.02Å; F63-M145 HydrophobicContact CE1-CB 4.06Å; F63-M145 HydrophobicContact CE1-CE 4.41Å; F63-M145 HydrophobicContact CE2-CE 4.27Å; F63-M145 HydrophobicContact CZ-CB 4.33Å; F63-M145 HydrophobicContact CZ-CE 3.51Å; F63-M145 HydrophobicContact CZ-SD 4.26Å; F63-V146 HydrophobicContact CD1-CG2 3.65Å; F63-V146 HydrophobicContact CE1-CG2 3.74Å
64L91.1Very high90.2Very high2 Ų233.4 Ų33.41%0.0117%0.173CC..Hα-helixtrans-60.8-38.3178.4-17361.8000112.2L46 I50 M60 Y61 N66 L67 S68 M119 Y291 I298L46-L64 HydrophobicContact CD1-CD2 4.49Å; L46-L64 HydrophobicContact CD2-CD1 4.45Å; L46-L64 HydrophobicContact CD2-CD2 3.96Å; L46-L64 HydrophobicContact CD2-CG 4Å; I50-L64 HydrophobicContact CD1-CB 4.48Å; I50-L64 HydrophobicContact CD1-CD2 4.48Å; M60-L64 WeakPolarHBondContact O-CB 3.35Å; M60-L64 PolarHBondContact O-N 3.46Å; Y61-L64 HydrophobicContact CD1-CD2 3.98Å; Y61-L64 HydrophobicContact CE1-CD2 4.38Å; Y61-L64 PolarHBondContact O-N 3.43Å; L64-N66 VanDerWaalsContact C-N 3.29Å; L64-N66 PolarHBondContact O-N 3.23Å; L64-L67 HydrophobicContact CD1-CD2 4.28Å; L64-L67 PolarHBondContact O-N 2.91Å; L64-S68 PolarHBondContact O-N 3.23Å; L64-S68 PolarHBondContact O-OG 3.44Å; L64-M119 HydrophobicContact CB-CE 4.35Å; L64-M119 HydrophobicContact CD1-CE 4.25Å; L64-Y291 HydrophobicContact CD1-CD1 4.21Å; L64-Y291 HydrophobicContact CD1-CD2 3.48Å; L64-Y291 VanDerWaalsContact CD1-CD2 3.48Å; L64-Y291 HydrophobicContact CD1-CE2 4.13Å; L64-Y291 HydrophobicContact CD1-CG 3.57Å; L64-Y291 HydrophobicContact CD2-CG 4.39Å; L64-I298 HydrophobicContact CD2-CD1 4.03Å
65S92.9Very high90.1Very high11 Ų1129.5 Ų29.58%0.07715%0.146CC..Hα-helixtrans-64.2-34.6175-179.30000112.2Y61 F62 F63 F69Y61-S65 WeakPolarHBondContact O-CB 3.48Å; Y61-S65 PolarHBondContact O-N 3.36Å; F62-S65 PolarHBondContact O-N 3.23Å; F63-S65 VanDerWaalsContact C-N 3.3Å; F63-S65 PolarHBondContact O-N 3.26Å; S65-F69 PolarHBondContact O-N 3.01Å
66N94.9Very high90.2Very high28 Ų2825.8 Ų25.815%0.1513%0.134CC..Hα-helixtrans-74.2-40.2175-78.6-82.8000111.2F62 F63 L64 S68 F69 I70 L115 V146 Y150F62-N66 PolarHBondContact O-N 3.47Å; F62-N66 PolarHBondContact O-ND2 3.08Å; F63-N66 WeakPolarHBondContact O-CB 3.26Å; F63-N66 PolarHBondContact O-N 3.11Å; L64-N66 VanDerWaalsContact C-N 3.29Å; L64-N66 PolarHBondContact O-N 3.23Å; N66-S68 VanDerWaalsContact C-N 3.34Å; N66-S68 PolarHBondContact O-N 2.94Å; N66-F69 WeakPolarHBondContact O-CB 3.43Å; N66-F69 PolarHBondContact O-N 3.44Å; N66-F69 VanDerWaalsContact O-N 3.09Å; N66-I70 WeakPolarHBondContact O-CG1 3.37Å; N66-I70 PolarHBondContact O-N 3.07Å; N66-L115 HydrophobicContact CB-CD1 3.82Å; N66-V146 HydrophobicContact CB-CG1 4.39Å; N66-V146 WeakPolarHBondContact OD1-CG1 3.21Å; N66-Y150 PolarHBondContact OD1-OH 2.8Å
67L91.1Very high90.2Very high0 Ų026.9 Ų26.90%014%0.142CC..Hα-helixtrans-58.3-46173.4-175.364.3000111.1F63 L64 F69 I70 D71 E112 L115 M116 M119 Y291F63-L67 PolarHBondContact O-N 3.32Å; L64-L67 HydrophobicContact CD1-CD2 4.28Å; L64-L67 PolarHBondContact O-N 2.91Å; L67-F69 VanDerWaalsContact C-N 3.27Å; L67-F69 PolarHBondContact O-N 2.71Å; L67-I70 WeakPolarHBondContact O-CB 3.46Å; L67-I70 PolarHBondContact O-N 2.88Å; L67-I70 VanDerWaalsContact O-N 3.11Å; L67-D71 PolarHBondContact O-N 3Å; L67-E112 HydrophobicContact CD1-CB 4.31Å; L67-E112 HydrophobicContact CD1-CG 3.69Å; L67-L115 HydrophobicContact CB-CD1 4.47Å; L67-M116 HydrophobicContact CD2-SD 4.04Å; L67-M119 HydrophobicContact CD2-SD 4.19Å; L67-Y291 HydrophobicContact CD2-CE2 3.89Å
68S91.4Very high89.9Confident0 Ų021.1 Ų21.10%012%0.115CC..Hα-helixtrans-62.3-31.3174.5-73.90000113.8N43 L46 L64 N66 V72N43-S68 WeakPolarHBondContact OD1-CA 3.19Å; N43-S68 VanDerWaalsContact OD1-CB 3.26Å; N43-S68 WeakPolarHBondContact OD1-CB 3.45Å; N43-S68 PolarHBondContact OD1-OG 3.48Å; L46-S68 WeakPolarHBondContact CD2-OG 3.37Å; L64-S68 PolarHBondContact O-N 3.23Å; L64-S68 PolarHBondContact O-OG 3.44Å; N66-S68 VanDerWaalsContact C-N 3.34Å; N66-S68 PolarHBondContact O-N 2.94Å; S68-V72 VanDerWaalsContact O-CG2 3.27Å; S68-V72 WeakPolarHBondContact O-CG2 3.4Å; S68-V72 PolarHBondContact O-N 3.45Å; S68-V72 VanDerWaalsContact O-N 3.09Å
69F93.2Very high89.6Confident101 Ų10118.8 Ų18.844%0.44310%0.101SC..Hα-helixtrans-69.9-40.4173.6174.4-100.1000111.6I47 S65 N66 L67 V72 C73I47-F69 HydrophobicContact CD1-CB 4.27Å; S65-F69 PolarHBondContact O-N 3.01Å; N66-F69 WeakPolarHBondContact O-CB 3.43Å; N66-F69 PolarHBondContact O-N 3.44Å; N66-F69 VanDerWaalsContact O-N 3.09Å; L67-F69 VanDerWaalsContact C-N 3.27Å; L67-F69 PolarHBondContact O-N 2.71Å; F69-V72 PolarHBondContact O-N 2.99Å; F69-C73 PolarHBondContact O-N 3.13Å; F69-C73 VanDerWaalsContact O-N 3.08Å; F69-C73 PolarHBondContact O-SG 3.29Å
70I91.4Very high89.3Confident0 Ų019.9 Ų19.90%011%0.108CC..Hα-helixtrans-59.6-47.9172.1-68.8-176.3000110.2N66 L67 V72 C73 Y74 M108 E112 L115 Y150N66-I70 WeakPolarHBondContact O-CG1 3.37Å; N66-I70 PolarHBondContact O-N 3.07Å; L67-I70 WeakPolarHBondContact O-CB 3.46Å; L67-I70 PolarHBondContact O-N 2.88Å; L67-I70 VanDerWaalsContact O-N 3.11Å; I70-V72 VanDerWaalsContact C-N 3.31Å; I70-V72 PolarHBondContact O-N 3.4Å; I70-C73 WeakPolarHBondContact O-CB 3.48Å; I70-C73 PolarHBondContact O-N 2.89Å; I70-Y74 WeakPolarHBondContact O-CB 3.39Å; I70-Y74 PolarHBondContact O-N 3.2Å; I70-M108 HydrophobicContact CB-SD 4.22Å; I70-M108 HydrophobicContact CG1-SD 4.01Å; I70-M108 HydrophobicContact CG2-CB 3.74Å; I70-M108 HydrophobicContact CG2-CG 4.34Å; I70-M108 WeakPolarHBondContact CG2-O 3.3Å; I70-M108 HydrophobicContact CG2-SD 4.02Å; I70-E112 HydrophobicContact CG2-CB 4.23Å; I70-L115 HydrophobicContact CD1-CD1 3.51Å; I70-L115 HydrophobicContact CD1-CG 4.39Å; I70-L115 HydrophobicContact CG1-CD1 4.46Å; I70-Y150 HydrophobicContact CD1-CE1 3.8Å; I70-Y150 HydrophobicContact CG1-CE1 3.75Å
71D87.8Confident89Confident0 Ų021.7 Ų21.70%012%0.115CC..Hα-helixtrans-57.7-42.4178.7-70.6-28.6000111.6L67 C73 Y74 I75L67-D71 PolarHBondContact O-N 3Å; D71-C73 PolarHBondContact O-N 3.31Å; D71-Y74 WeakPolarHBondContact O-CB 3.21Å; D71-Y74 PolarHBondContact O-N 3.28Å; D71-I75 WeakPolarHBondContact O-CG1 3.27Å; D71-I75 PolarHBondContact O-N 3.47Å
72V90.3Very high88.6Confident20 Ų2021.6 Ų21.612%0.12112%0.115CC..Hα-helixtrans-60.9-43.8175.1167.30000111.4L40 N43 L44 S68 F69 I70 Y74 I75 S76L40-V72 HydrophobicContact CD2-CB 4.47Å; L40-V72 HydrophobicContact CD2-CG1 3.83Å; L40-V72 HydrophobicContact CD2-CG2 4.29Å; N43-V72 HydrophobicContact CB-CG2 3.53Å; L44-V72 HydrophobicContact CD2-CG2 4.21Å; L44-V72 HydrophobicContact CG-CG2 4.28Å; S68-V72 VanDerWaalsContact O-CG2 3.27Å; S68-V72 WeakPolarHBondContact O-CG2 3.4Å; S68-V72 PolarHBondContact O-N 3.45Å; S68-V72 VanDerWaalsContact O-N 3.09Å; F69-V72 PolarHBondContact O-N 2.99Å; I70-V72 VanDerWaalsContact C-N 3.31Å; I70-V72 PolarHBondContact O-N 3.4Å; V72-Y74 VanDerWaalsContact C-N 3.33Å; V72-I75 WeakPolarHBondContact O-CG1 3.12Å; V72-S76 WeakPolarHBondContact O-CB 3.31Å; V72-S76 PolarHBondContact O-N 3.49Å; V72-S76 PolarHBondContact O-OG 2.83Å
73C90.4Very high88.2Confident26 Ų2618.6 Ų18.618%0.17610%0.102CC..Hα-helixtrans-64.8-39.1176.4-64.90000111.7F69 I70 D71 S76 S77 M108F69-C73 PolarHBondContact O-N 3.13Å; F69-C73 VanDerWaalsContact O-N 3.08Å; F69-C73 PolarHBondContact O-SG 3.29Å; I70-C73 WeakPolarHBondContact O-CB 3.48Å; I70-C73 PolarHBondContact O-N 2.89Å; D71-C73 PolarHBondContact O-N 3.31Å; C73-S76 PolarHBondContact O-N 3.12Å; C73-S77 WeakPolarHBondContact O-CB 3.39Å; C73-S77 PolarHBondContact O-N 3.39Å; C73-S77 PolarHBondContact O-OG 3.21Å; C73-M108 HydrophobicContact CB-CE 3.69Å; C73-M108 HydrophobicContact CB-CG 3.88Å; C73-M108 HydrophobicContact CB-SD 3.67Å
74Y83.4Confident87.8Confident19 Ų1920.6 Ų20.68%0.07512%0.116CC..Hα-helixtrans-61.7-54.2-179.4-147.9-88.7000111.7I70 D71 V72 S76 S77 T78 F105 M108 T280 P284I70-Y74 WeakPolarHBondContact O-CB 3.39Å; I70-Y74 PolarHBondContact O-N 3.2Å; D71-Y74 WeakPolarHBondContact O-CB 3.21Å; D71-Y74 PolarHBondContact O-N 3.28Å; V72-Y74 VanDerWaalsContact C-N 3.33Å; Y74-S76 VanDerWaalsContact C-N 3.35Å; Y74-S76 PolarHBondContact O-N 3.23Å; Y74-S77 PolarHBondContact O-OG 2.53Å; Y74-T78 PolarHBondContact O-N 3.15Å; Y74-T78 PolarHBondContact O-OG1 3.44Å; Y74-F105 HydrophobicContact CD1-CD2 4.42Å; Y74-F105 HydrophobicContact CD1-CE2 4.36Å; Y74-F105 AromaticContact CE1-CD2 3.75Å; Y74-F105 HydrophobicContact CE1-CD2 3.75Å; Y74-F105 AromaticContact CE1-CE2 3.34Å; Y74-F105 HydrophobicContact CE1-CE2 3.34Å; Y74-F105 HydrophobicContact CE1-CZ 4.22Å; Y74-F105 AromaticContact CE2-CD2 3.95Å; Y74-F105 HydrophobicContact CE2-CD2 3.95Å; Y74-F105 HydrophobicContact CE2-CE2 4.03Å; Y74-F105 HydrophobicContact CE2-CG 4.46Å; Y74-F105 AromaticContact CZ-CD2 3.51Å; Y74-F105 AromaticContact CZ-CE2 3.15Å; Y74-F105 AromaticContact CZ-CZ 3.7Å; Y74-F105 WeakPolarHBondContact OH-CE2 3.49Å; Y74-F105 WeakPolarHBondContact OH-CZ 3.39Å; Y74-M108 HydrophobicContact CD2-CB 3.76Å; Y74-M108 HydrophobicContact CE2-CB 4.37Å; Y74-T280 WeakPolarHBondContact CD1-O 3.28Å; Y74-T280 WeakPolarHBondContact CE1-O 3.28Å; Y74-P284 HydrophobicContact CD1-CG 3.95Å; Y74-P284 HydrophobicContact CE1-CG 4.15Å
75I83.8Confident87.3Confident1 Ų120.8 Ų20.81%0.00512%0.117CC..Hα-helixtrans-69.1-33.9-179.865.9-174.1000111.7Y36 L40 D71 V72 V79 P80Y36-I75 HydrophobicContact CD2-CB 4.36Å; Y36-I75 HydrophobicContact CD2-CG1 4.36Å; Y36-I75 HydrophobicContact CE2-CG1 4.29Å; L40-I75 HydrophobicContact CB-CD1 4.39Å; L40-I75 HydrophobicContact CD2-CD1 3.82Å; L40-I75 HydrophobicContact CD2-CG1 4.27Å; L40-I75 HydrophobicContact CG-CD1 3.66Å; L40-I75 HydrophobicContact CG-CG1 4.36Å; D71-I75 WeakPolarHBondContact O-CG1 3.27Å; D71-I75 PolarHBondContact O-N 3.47Å; V72-I75 WeakPolarHBondContact O-CG1 3.12Å; I75-V79 HydrophobicContact CB-CG2 4.23Å; I75-V79 VanDerWaalsContact O-CB 3.28Å; I75-V79 WeakPolarHBondContact O-CB 3.26Å; I75-V79 WeakPolarHBondContact O-CG2 3.33Å; I75-V79 PolarHBondContact O-N 3.07Å; I75-P80 WeakPolarHBondContact O-CD 3.4Å
76S88.6Confident86.6Confident48 Ų4821.3 Ų21.334%0.33612%0.118SC..Hα-helixtrans-74.8-26.4-177.7-590000113.3V72 C73 Y74 P80V72-S76 WeakPolarHBondContact O-CB 3.31Å; V72-S76 PolarHBondContact O-N 3.49Å; V72-S76 PolarHBondContact O-OG 2.83Å; C73-S76 PolarHBondContact O-N 3.12Å; Y74-S76 VanDerWaalsContact C-N 3.35Å; Y74-S76 PolarHBondContact O-N 3.23Å; S76-P80 VanDerWaalsContact O-CD 3.31Å; S76-P80 WeakPolarHBondContact O-CD 3.16Å; S76-P80 WeakPolarHBondContact O-CG 3.46Å
77S85.9Confident85.9Confident24 Ų2426 Ų2617%0.16814%0.143CC..Hα-helixtrans-82.4-25.7176.258.50000113.2C73 Y74 Q101C73-S77 WeakPolarHBondContact O-CB 3.39Å; C73-S77 PolarHBondContact O-N 3.39Å; C73-S77 PolarHBondContact O-OG 3.21Å; Y74-S77 PolarHBondContact O-OG 2.53Å; S77-Q101 PolarHBondContact O-NE2 3.24Å
78T81.4Confident85.3Confident0 Ų030.2 Ų30.20%016%0.162CC..Hα-helixtrans-104.4-52.2-173.353.90000112.9Y74 M82 F105Y74-T78 PolarHBondContact O-N 3.15Å; Y74-T78 PolarHBondContact O-OG1 3.44Å; T78-M82 PolarHBondContact O-N 3.49Å; T78-F105 HydrophobicContact CG2-CD2 3.94Å; T78-F105 HydrophobicContact CG2-CE2 4.49Å
79V83.5Confident84.1Confident0 Ų040 Ų400%021%0.208CC..Hα-helixtrans-72-42.8-166.7-175.30000113.6Y36 I75 K81 M82 L83 V281Y36-V79 HydrophobicContact CD2-CB 3.88Å; Y36-V79 HydrophobicContact CD2-CG1 3.99Å; Y36-V79 HydrophobicContact CE2-CB 4.5Å; Y36-V79 HydrophobicContact CG-CB 4.43Å; Y36-V79 HydrophobicContact CG-CG1 4.04Å; I75-V79 HydrophobicContact CB-CG2 4.23Å; I75-V79 VanDerWaalsContact O-CB 3.28Å; I75-V79 WeakPolarHBondContact O-CB 3.26Å; I75-V79 WeakPolarHBondContact O-CG2 3.33Å; I75-V79 PolarHBondContact O-N 3.07Å; V79-K81 VanDerWaalsContact C-N 3.27Å; V79-K81 PolarHBondContact O-N 3.14Å; V79-M82 HydrophobicContact CG1-CE 3.96Å; V79-M82 PolarHBondContact O-N 3.32Å; V79-L83 HydrophobicContact CG1-CD1 3.83Å; V79-L83 HydrophobicContact CG1-CG 4.02Å; V79-L83 WeakPolarHBondContact O-CG 3.29Å; V79-L83 PolarHBondContact O-N 3.48Å; V79-V281 HydrophobicContact CG2-CG1 4.13Å; V79-V281 HydrophobicContact CG2-CG2 4.15Å
80P86.3Confident83Confident46 Ų4641.9 Ų41.930%0.29922%0.218SC..Hα-helixtrans-57.9-39.9177.6-28.837.2000113.1Y36 I75 S76 L83 S84Y36-P80 HydrophobicContact CE2-CG 3.94Å; I75-P80 WeakPolarHBondContact O-CD 3.4Å; S76-P80 VanDerWaalsContact O-CD 3.31Å; S76-P80 WeakPolarHBondContact O-CD 3.16Å; S76-P80 WeakPolarHBondContact O-CG 3.46Å; P80-L83 PolarHBondContact O-N 2.99Å; P80-S84 WeakPolarHBondContact O-CB 3.22Å; P80-S84 PolarHBondContact O-N 3.33Å
81K84.9Confident82.4Confident49 Ų4942.8 Ų42.821%0.21322%0.223CC..Hα-helixtrans-68.6-42.4178.6-174.953178.3152.60111.4V79 L83 S84 N85 T92 I93V79-K81 VanDerWaalsContact C-N 3.27Å; V79-K81 PolarHBondContact O-N 3.14Å; K81-L83 PolarHBondContact O-N 2.98Å; K81-S84 PolarHBondContact O-N 3Å; K81-N85 WeakPolarHBondContact CE-OD1 3.4Å; K81-N85 PolarHBondContact NZ-OD1 3.38Å; K81-N85 WeakPolarHBondContact O-CB 3.5Å; K81-N85 PolarHBondContact O-N 3.38Å; K81-N85 PolarHBondContact O-OD1 3.3Å; K81-T92 WeakPolarHBondContact CE-O 3.37Å; K81-T92 PolarHBondContact NZ-O 2.99Å; K81-I93 HydrophobicContact CG-CD1 4.29Å
82M81.9Confident82.2Confident2 Ų244.8 Ų44.81%0.0124%0.235CC..Hα-helixtrans-59.3-45.5173.1177.8-178.563.500111.9F32 T78 V79 N85 F86 F178F32-M82 HydrophobicContact CB-CE 3.81Å; F32-M82 HydrophobicContact CD1-CE 3.31Å; F32-M82 HydrophobicContact CD1-SD 4.35Å; F32-M82 HydrophobicContact CD2-CE 3.84Å; F32-M82 HydrophobicContact CD2-SD 4.27Å; F32-M82 HydrophobicContact CE1-CE 3.73Å; F32-M82 HydrophobicContact CE1-SD 4.25Å; F32-M82 HydrophobicContact CE2-CE 4.24Å; F32-M82 HydrophobicContact CE2-SD 4.21Å; F32-M82 HydrophobicContact CG-CE 3.37Å; F32-M82 HydrophobicContact CG-SD 4.36Å; F32-M82 HydrophobicContact CZ-CE 4.2Å; F32-M82 HydrophobicContact CZ-SD 4.21Å; T78-M82 PolarHBondContact O-N 3.49Å; V79-M82 HydrophobicContact CG1-CE 3.96Å; V79-M82 PolarHBondContact O-N 3.32Å; M82-N85 WeakPolarHBondContact O-CB 3.46Å; M82-N85 PolarHBondContact O-N 2.97Å; M82-F86 HydrophobicContact CG-CE2 3.8Å; M82-F86 HydrophobicContact CG-CZ 3.84Å; M82-F86 PolarHBondContact O-N 2.89Å; M82-F86 HydrophobicContact SD-CE2 4.36Å; M82-F86 HydrophobicContact SD-CZ 4.27Å; M82-F178 HydrophobicContact CB-CD2 4.13Å; M82-F178 HydrophobicContact CG-CB 4.07Å; M82-F178 HydrophobicContact CG-CD2 3.99Å; M82-F178 HydrophobicContact CG-CG 4.32Å; M82-F178 HydrophobicContact SD-CB 4.1Å; M82-F178 HydrophobicContact SD-CD2 3.34Å; M82-F178 WeakPolarHBondContact SD-CD2 3.48Å; M82-F178 HydrophobicContact SD-CE2 3.76Å; M82-F178 HydrophobicContact SD-CG 3.76Å
83L84.5Confident81.9Confident13 Ų1344.4 Ų44.47%0.06823%0.232CC..Hα-helixtrans-62.7-43.6178-72.6172.8000112F29 F32 L33 Y36 V79 P80 K81 N85 F86F29-L83 HydrophobicContact CD2-CB 4.48Å; F29-L83 HydrophobicContact CD2-CD2 3.77Å; F29-L83 HydrophobicContact CE2-CB 4.14Å; F29-L83 HydrophobicContact CE2-CD2 3.97Å; F29-L83 HydrophobicContact CG-CD2 4.41Å; F32-L83 HydrophobicContact CB-CD2 3.7Å; L33-L83 HydrophobicContact CB-CD1 4.41Å; L33-L83 HydrophobicContact CB-CD2 4.18Å; L33-L83 HydrophobicContact CD1-CD1 3.91Å; Y36-L83 HydrophobicContact CD1-CD1 4.49Å; V79-L83 HydrophobicContact CG1-CD1 3.83Å; V79-L83 HydrophobicContact CG1-CG 4.02Å; V79-L83 WeakPolarHBondContact O-CG 3.29Å; V79-L83 PolarHBondContact O-N 3.48Å; P80-L83 PolarHBondContact O-N 2.99Å; K81-L83 PolarHBondContact O-N 2.98Å; L83-N85 VanDerWaalsContact C-N 3.28Å; L83-N85 PolarHBondContact O-N 3.47Å; L83-F86 HydrophobicContact CD2-CD2 4.33Å; L83-F86 PolarHBondContact O-N 2.69Å; L83-F86 VanDerWaalsContact O-N 3.17Å
84S84.3Confident81.8Confident42 Ų4247.2 Ų47.229%0.29425%0.249SC..Hα-helixtrans-59.7-39.7174.4-176.30000111.7P80 K81 F86 L87 Q88P80-S84 WeakPolarHBondContact O-CB 3.22Å; P80-S84 PolarHBondContact O-N 3.33Å; K81-S84 PolarHBondContact O-N 3Å; S84-F86 PolarHBondContact O-N 3.45Å; S84-L87 PolarHBondContact O-N 2.97Å; S84-L87 VanDerWaalsContact O-N 3.08Å; S84-Q88 WeakPolarHBondContact O-CG 3.42Å; S84-Q88 PolarHBondContact O-N 3.37Å; S84-Q88 PolarHBondContact OG-NE2 3.38Å
85N81.6Confident81.8Confident6 Ų648.8 Ų48.83%0.03226%0.256CS..Hα-helixtrans-67.9-21.6179-71.5-0000112.9L15 K81 M82 L83 L87 Q91L15-N85 WeakPolarHBondContact CD1-ND2 3.38Å; K81-N85 WeakPolarHBondContact CE-OD1 3.4Å; K81-N85 PolarHBondContact NZ-OD1 3.38Å; K81-N85 WeakPolarHBondContact O-CB 3.5Å; K81-N85 PolarHBondContact O-N 3.38Å; K81-N85 PolarHBondContact O-OD1 3.3Å; M82-N85 WeakPolarHBondContact O-CB 3.46Å; M82-N85 PolarHBondContact O-N 2.97Å; L83-N85 VanDerWaalsContact C-N 3.28Å; L83-N85 PolarHBondContact O-N 3.47Å; N85-L87 VanDerWaalsContact C-N 3.29Å; N85-Q91 HydrophobicContact CB-CB 4.13Å; N85-Q91 HydrophobicContact CB-CG 4.01Å; N85-Q91 WeakPolarHBondContact O-CG 3.43Å; N85-Q91 PolarHBondContact O-NE2 3.25Å
86F78.9Confident81.9Confident22 Ų2253.1 Ų53.110%0.09628%0.282CS..Hα-helixtrans-74.3-20.7171.6-65.5-42.2000113.3F18 I25 L28 F29 F32 M82 L83 S84F18-F86 HydrophobicContact CB-CE1 4.06Å; F18-F86 AromaticContact CD2-CE1 3.97Å; F18-F86 HydrophobicContact CD2-CE1 3.97Å; F18-F86 AromaticContact CD2-CZ 3.85Å; F18-F86 HydrophobicContact CD2-CZ 3.85Å; F18-F86 HydrophobicContact CG-CE1 4.47Å; I25-F86 HydrophobicContact CD1-CD1 4.01Å; I25-F86 HydrophobicContact CG1-CB 4.25Å; I25-F86 HydrophobicContact CG1-CD1 3.71Å; I25-F86 HydrophobicContact CG1-CE1 4.42Å; I25-F86 HydrophobicContact CG1-CG 4.21Å; L28-F86 HydrophobicContact CB-CZ 4.4Å; F29-F86 HydrophobicContact CB-CB 4.3Å; F29-F86 HydrophobicContact CB-CD2 4.01Å; F29-F86 HydrophobicContact CB-CG 4.43Å; F29-F86 HydrophobicContact CD2-CB 3.91Å; F29-F86 HydrophobicContact CD2-CD2 4.02Å; F29-F86 HydrophobicContact CD2-CG 4.46Å; F32-F86 AromaticContact CD2-CE2 3.6Å; F32-F86 HydrophobicContact CD2-CE2 3.6Å; F32-F86 AromaticContact CD2-CZ 3.96Å; F32-F86 HydrophobicContact CD2-CZ 3.96Å; F32-F86 HydrophobicContact CE2-CE2 4.17Å; F32-F86 HydrophobicContact CE2-CZ 4.04Å; F32-F86 HydrophobicContact CG-CE2 4.47Å; M82-F86 HydrophobicContact CG-CE2 3.8Å; M82-F86 HydrophobicContact CG-CZ 3.84Å; M82-F86 PolarHBondContact O-N 2.89Å; M82-F86 HydrophobicContact SD-CE2 4.36Å; M82-F86 HydrophobicContact SD-CZ 4.27Å; L83-F86 HydrophobicContact CD2-CD2 4.33Å; L83-F86 PolarHBondContact O-N 2.69Å; L83-F86 VanDerWaalsContact O-N 3.17Å; S84-F86 PolarHBondContact O-N 3.45Å
87L79Confident81.9Confident128 Ų12851.9 Ų51.967%0.6728%0.277SS*.Hα-helixtrans-98.2-15.6-177.8-59.5177.2000113.1F29 S84 N85F29-L87 HydrophobicContact CD2-CD2 4.19Å; F29-L87 HydrophobicContact CD2-CG 4.27Å; F29-L87 HydrophobicContact CE2-CD1 3.77Å; F29-L87 HydrophobicContact CE2-CD2 3.87Å; F29-L87 HydrophobicContact CE2-CG 3.75Å; F29-L87 HydrophobicContact CZ-CD1 4.02Å; F29-L87 HydrophobicContact CZ-CD2 4.15Å; F29-L87 HydrophobicContact CZ-CG 4.32Å; S84-L87 PolarHBondContact O-N 2.97Å; S84-L87 VanDerWaalsContact O-N 3.08Å; N85-L87 VanDerWaalsContact C-N 3.29Å
88Q78.6Confident81.9Confident87 Ų8750.8 Ų50.841%0.40727%0.269SS..  trans-96.9142.9-177.5-71.7177-15.900111.3S84 E90S84-Q88 WeakPolarHBondContact O-CG 3.42Å; S84-Q88 PolarHBondContact O-N 3.37Å; S84-Q88 PolarHBondContact OG-NE2 3.38Å; Q88-E90 VanDerWaalsContact C-N 3.34Å
89E66.1Low82.3Confident205 Ų20551.5 Ų51.596%0.95827%0.273SS*.SBendtrans-66.4-38.1172-70.5-178.8167.500111.4
90E70.8Confident82.6Confident141 Ų14155.7 Ų55.766%0.65930%0.295SS*.SBendtrans-109.5118.4174.8-68.2-168.5176.700111.4Q88 T92Q88-E90 VanDerWaalsContact C-N 3.34Å; E90-T92 VanDerWaalsContact C-N 3.28Å; E90-T92 HydrophobicContact CB-CG2 4.21Å; E90-T92 PolarHBondContact O-N 3.37Å
91Q78.6Confident82.8Confident20 Ų2054 Ų549%0.09328%0.283CS..  trans-90.161.4-174.9-62.1177.9-39.200111.7V14 L15 S19 N85V14-Q91 CarbonylContact C-O 3.23Å; V14-Q91 WeakPolarHBondContact CA-O 3.5Å; L15-Q91 PolarHBondContact N-O 3.15Å; L15-Q91 WeakPolarHBondContact O-CB 3.45Å; L15-Q91 PolarHBondContact O-OE1 3.08Å; S19-Q91 PolarHBondContact OG-NE2 3.32Å; S19-Q91 PolarHBondContact OG-OE1 3.06Å; N85-Q91 HydrophobicContact CB-CB 4.13Å; N85-Q91 HydrophobicContact CB-CG 4.01Å; N85-Q91 WeakPolarHBondContact O-CG 3.43Å; N85-Q91 PolarHBondContact O-NE2 3.25Å
92T82.9Confident82.9Confident41 Ų4152.1 Ų52.125%0.25227%0.274SS..EExtended strand (participates in β ladder)trans-96.9145.1-171.256.80000112.6Y12 F13 V14 K81 E90Y12-T92 HydrophobicContact CD2-CG2 3.72Å; Y12-T92 HydrophobicContact CE2-CG2 4.09Å; F13-T92 CarbonylContact O-C 3.52Å; F13-T92 WeakPolarHBondContact O-CA 3.23Å; V14-T92 HydrophobicContact CG2-CG2 4.2Å; K81-T92 WeakPolarHBondContact CE-O 3.37Å; K81-T92 PolarHBondContact NZ-O 2.99Å; E90-T92 VanDerWaalsContact C-N 3.28Å; E90-T92 HydrophobicContact CB-CG2 4.21Å; E90-T92 PolarHBondContact O-N 3.37Å
93I85Confident83.3Confident13 Ų1354.8 Ų54.87%0.06729%0.286CS..EExtended strand (participates in β ladder)trans-125.7138.3166.3-169.7168.7000108.1Y12 F13 L15 K81 C98Y12-I93 CarbonylContact C-O 3.59Å; Y12-I93 VanDerWaalsContact CA-O 3.31Å; Y12-I93 WeakPolarHBondContact CA-O 3.22Å; F13-I93 HydrophobicContact CB-CG2 3.94Å; F13-I93 PolarHBondContact N-O 3.33Å; F13-I93 PolarHBondContact O-N 3.09Å; L15-I93 HydrophobicContact CD1-CB 3.82Å; L15-I93 HydrophobicContact CD1-CD1 4.35Å; L15-I93 HydrophobicContact CD1-CG2 3.65Å; L15-I93 HydrophobicContact CD2-CG2 4.43Å; L15-I93 HydrophobicContact CG-CG2 3.87Å; K81-I93 HydrophobicContact CG-CD1 4.29Å; I93-C98 HydrophobicContact CD1-CB 4.31Å; I93-C98 HydrophobicContact CG1-CB 4.42Å; I93-C98 HydrophobicContact CG2-CB 4.15Å
94T87.4Confident83.6Confident85 Ų8556.6 Ų56.652%0.52130%0.295SS..EExtended strand (participates in β ladder)trans-66.6152.8175.761.30000110V96 G97 C98T94-V96 VanDerWaalsContact C-N 3.28Å; T94-V96 PolarHBondContact O-N 3.3Å; T94-G97 PolarHBondContact O-N 2.87Å; T94-G97 VanDerWaalsContact O-N 3.12Å; T94-G97 PolarHBondContact OG1-N 3.32Å; T94-C98 WeakPolarHBondContact O-CB 3.32Å; T94-C98 PolarHBondContact O-N 3.36Å
95F83.9Confident83.6Confident51 Ų5155.9 Ų55.922%0.22429%0.287CS..Hα-helixtrans-51.1-50174.6176.1-97.4000111.3T11 F13 G97 C98 I99 L165 F169T11-F95 PolarHBondContact O-N 3.11Å; F13-F95 HydrophobicContact CE2-CB 4.41Å; F13-F95 AromaticContact CE2-CD2 3.58Å; F13-F95 HydrophobicContact CE2-CD2 3.58Å; F13-F95 HydrophobicContact CE2-CE2 4.33Å; F13-F95 HydrophobicContact CE2-CG 4.43Å; F13-F95 AromaticContact CZ-CD2 3.9Å; F13-F95 HydrophobicContact CZ-CD2 3.9Å; F13-F95 HydrophobicContact CZ-CE2 4.39Å; F95-G97 PolarHBondContact O-N 2.85Å; F95-C98 VanDerWaalsContact O-CB 3.27Å; F95-C98 WeakPolarHBondContact O-CB 3.46Å; F95-C98 PolarHBondContact O-N 3.5Å; F95-C98 VanDerWaalsContact O-N 3.14Å; F95-I99 HydrophobicContact CD1-CG1 4.3Å; F95-I99 HydrophobicContact CE1-CD1 4.47Å; F95-I99 HydrophobicContact CE1-CG1 3.88Å; F95-I99 HydrophobicContact CE2-CD1 4.23Å; F95-I99 HydrophobicContact CE2-CG1 4.3Å; F95-I99 HydrophobicContact CZ-CD1 3.96Å; F95-I99 HydrophobicContact CZ-CG1 3.88Å; F95-I99 WeakPolarHBondContact O-CG1 3.47Å; F95-I99 PolarHBondContact O-N 2.96Å; F95-L165 HydrophobicContact CE1-CD2 4.06Å; F95-L165 HydrophobicContact CZ-CD2 4.13Å; F95-F169 AromaticContact CE2-CD2 3.71Å; F95-F169 HydrophobicContact CE2-CD2 3.71Å; F95-F169 AromaticContact CE2-CE2 3.58Å; F95-F169 HydrophobicContact CE2-CE2 3.58Å; F95-F169 HydrophobicContact CE2-CZ 4.43Å; F95-F169 HydrophobicContact CZ-CD2 4.43Å; F95-F169 HydrophobicContact CZ-CE2 4.09Å
96V86.6Confident83.9Confident92 Ų9256.2 Ų56.256%0.55829%0.289SS*.Hα-helixtrans-61.5-43.1178.3179.50000111.8T94 C98 I99 I100T94-V96 VanDerWaalsContact C-N 3.28Å; T94-V96 PolarHBondContact O-N 3.3Å; V96-C98 VanDerWaalsContact C-N 3.26Å; V96-C98 PolarHBondContact O-N 3.09Å; V96-I99 PolarHBondContact O-N 3.46Å; V96-I100 HydrophobicContact CG1-CD1 3.76Å; V96-I100 HydrophobicContact CG1-CG1 4.39Å; V96-I100 VanDerWaalsContact O-CG1 3.3Å; V96-I100 WeakPolarHBondContact O-CG1 3.44Å; V96-I100 PolarHBondContact O-N 2.88Å
97G87.3Confident84.5Confident23 Ų2355.8 Ų55.824%0.23729%0.289CS..Hα-helixtrans-61.8-36.3176.800000112.5T94 F95 Q101T94-G97 PolarHBondContact O-N 2.87Å; T94-G97 VanDerWaalsContact O-N 3.12Å; T94-G97 PolarHBondContact OG1-N 3.32Å; F95-G97 PolarHBondContact O-N 2.85Å; G97-Q101 VanDerWaalsContact O-CB 3.3Å; G97-Q101 WeakPolarHBondContact O-CB 3.4Å; G97-Q101 PolarHBondContact O-N 3.03Å
98C87.1Confident85Confident0 Ų050.9 Ų50.90%026%0.263CS..Hα-helixtrans-66.6-45.9176.7-1690000112.2F13 I93 T94 F95 V96 Q101 Y102 C180F13-C98 HydrophobicContact CD2-CB 3.98Å; F13-C98 HydrophobicContact CE2-CB 4.25Å; I93-C98 HydrophobicContact CD1-CB 4.31Å; I93-C98 HydrophobicContact CG1-CB 4.42Å; I93-C98 HydrophobicContact CG2-CB 4.15Å; T94-C98 WeakPolarHBondContact O-CB 3.32Å; T94-C98 PolarHBondContact O-N 3.36Å; F95-C98 VanDerWaalsContact O-CB 3.27Å; F95-C98 WeakPolarHBondContact O-CB 3.46Å; F95-C98 PolarHBondContact O-N 3.5Å; F95-C98 VanDerWaalsContact O-N 3.14Å; V96-C98 VanDerWaalsContact C-N 3.26Å; V96-C98 PolarHBondContact O-N 3.09Å; C98-Q101 PolarHBondContact O-N 3.31Å; C98-Y102 WeakPolarHBondContact O-CB 3.38Å; C98-Y102 PolarHBondContact O-N 2.88Å; C98-C180 WeakPolarHBondContact CA-SG 3.34Å; C98-C180 HydrophobicContact CB-CB 4.03Å; C98-C180 WeakPolarHBondContact CB-SG 3.3Å; C98-C180 WeakPolarHBondContact SG-CB 3.44Å; C98-C180 CovalentContact SG-SG 2.01Å; C98-C180 PolarHBondContact SG-SG 3.38Å
99I88.9Confident85.3Confident15 Ų1547.6 Ų47.68%0.07725%0.252CS..Hα-helixtrans-62.7-43.7175.8-60.7-62.1000111.1F95 V96 Y102 F103 I161 L164 L165F95-I99 HydrophobicContact CD1-CG1 4.3Å; F95-I99 HydrophobicContact CE1-CD1 4.47Å; F95-I99 HydrophobicContact CE1-CG1 3.88Å; F95-I99 HydrophobicContact CE2-CD1 4.23Å; F95-I99 HydrophobicContact CE2-CG1 4.3Å; F95-I99 HydrophobicContact CZ-CD1 3.96Å; F95-I99 HydrophobicContact CZ-CG1 3.88Å; F95-I99 WeakPolarHBondContact O-CG1 3.47Å; F95-I99 PolarHBondContact O-N 2.96Å; V96-I99 PolarHBondContact O-N 3.46Å; I99-Y102 PolarHBondContact O-N 2.92Å; I99-F103 WeakPolarHBondContact O-CB 3.26Å; I99-F103 PolarHBondContact O-N 3.37Å; I99-I161 HydrophobicContact CG2-CD1 4.23Å; I99-I161 HydrophobicContact CG2-CG1 4.45Å; I99-I161 HydrophobicContact CG2-CG2 3.88Å; I99-L164 HydrophobicContact CD1-CD2 3.32Å; I99-L164 HydrophobicContact CD1-CG 3.95Å; I99-L165 HydrophobicContact CD1-CD2 4.43Å; I99-L165 HydrophobicContact CG1-CD2 4.34Å; I99-L165 HydrophobicContact CG2-CD2 4.45Å
100I90.4Very high86.4Confident89 Ų8938.9 Ų38.946%0.45621%0.212SC..Hα-helixtrans-64.7-43.2177.4-68.4170000111.1V96 Y102 F103 I104V96-I100 HydrophobicContact CG1-CD1 3.76Å; V96-I100 HydrophobicContact CG1-CG1 4.39Å; V96-I100 VanDerWaalsContact O-CG1 3.3Å; V96-I100 WeakPolarHBondContact O-CG1 3.44Å; V96-I100 PolarHBondContact O-N 2.88Å; I100-Y102 VanDerWaalsContact C-N 3.35Å; I100-Y102 PolarHBondContact O-N 3.35Å; I100-F103 WeakPolarHBondContact O-CB 3.33Å; I100-F103 PolarHBondContact O-N 3.12Å; I100-I104 HydrophobicContact CG2-CD1 3.89Å; I100-I104 WeakPolarHBondContact O-CG1 3.19Å; I100-I104 PolarHBondContact O-N 3.47Å; I100-I104 VanDerWaalsContact O-N 3.09Å
101Q89.6Confident87.4Confident9 Ų932.1 Ų32.14%0.04218%0.18CC..Hα-helixtrans-59.6-48176.7-179.7177.753.400110.7S77 G97 C98 F103 I104 F105S77-Q101 PolarHBondContact O-NE2 3.24Å; G97-Q101 VanDerWaalsContact O-CB 3.3Å; G97-Q101 WeakPolarHBondContact O-CB 3.4Å; G97-Q101 PolarHBondContact O-N 3.03Å; C98-Q101 PolarHBondContact O-N 3.31Å; Q101-F103 VanDerWaalsContact C-N 3.34Å; Q101-F103 PolarHBondContact O-N 2.86Å; Q101-I104 PolarHBondContact O-N 2.83Å; Q101-F105 VanDerWaalsContact O-CB 3.3Å; Q101-F105 WeakPolarHBondContact O-CB 3.37Å; Q101-F105 PolarHBondContact O-N 3.04Å
102Y87.4Confident88Confident11 Ų1131.3 Ų31.34%0.04318%0.176CC..Hα-helixtrans-61.1-42.5177174.7-98.7000112.2C98 I99 I100 I104 F105 S106 Q160 I161 L164 M182C98-Y102 WeakPolarHBondContact O-CB 3.38Å; C98-Y102 PolarHBondContact O-N 2.88Å; I99-Y102 PolarHBondContact O-N 2.92Å; I100-Y102 VanDerWaalsContact C-N 3.35Å; I100-Y102 PolarHBondContact O-N 3.35Å; Y102-I104 PolarHBondContact O-N 2.94Å; Y102-F105 PolarHBondContact O-N 3.22Å; Y102-S106 WeakPolarHBondContact O-CB 3.24Å; Y102-S106 PolarHBondContact O-N 2.87Å; Y102-Q160 HydrophobicContact CE1-CB 4.22Å; Y102-Q160 VanDerWaalsContact OH-CD 3.28Å; Y102-Q160 PolarHBondContact OH-OE1 3.25Å; Y102-I161 HydrophobicContact CD1-CD1 4.48Å; Y102-I161 HydrophobicContact CD1-CG1 4.04Å; Y102-I161 HydrophobicContact CE1-CG1 4.25Å; Y102-L164 HydrophobicContact CD1-CD2 4.47Å; Y102-M182 HydrophobicContact CD1-CE 3.92Å; Y102-M182 HydrophobicContact CD1-CG 4.42Å; Y102-M182 HydrophobicContact CD2-CG 3.77Å; Y102-M182 HydrophobicContact CE1-CE 3.23Å; Y102-M182 HydrophobicContact CE1-CG 3.85Å; Y102-M182 HydrophobicContact CE1-SD 4.35Å; Y102-M182 HydrophobicContact CE2-CB 3.85Å; Y102-M182 HydrophobicContact CE2-CE 4.29Å; Y102-M182 HydrophobicContact CE2-CG 3.09Å; Y102-M182 HydrophobicContact CE2-SD 4.48Å; Y102-M182 HydrophobicContact CG-CG 4.38Å; Y102-M182 VanDerWaalsContact CZ-CE 3.45Å; Y102-M182 VanDerWaalsContact OH-CG 3.26Å; Y102-M182 WeakPolarHBondContact OH-CG 3.38Å
103F90.6Very high88.2Confident57 Ų5729.6 Ų29.625%0.2517%0.166CC..Hα-helixtrans-55-54.5177.7-177.9-127.9000112.4I99 I100 Q101 F105 S106 T107 L154 L158 I161I99-F103 WeakPolarHBondContact O-CB 3.26Å; I99-F103 PolarHBondContact O-N 3.37Å; I100-F103 WeakPolarHBondContact O-CB 3.33Å; I100-F103 PolarHBondContact O-N 3.12Å; Q101-F103 VanDerWaalsContact C-N 3.34Å; Q101-F103 PolarHBondContact O-N 2.86Å; F103-F105 VanDerWaalsContact C-N 3.32Å; F103-F105 PolarHBondContact O-N 3.45Å; F103-S106 PolarHBondContact O-N 3.28Å; F103-T107 WeakPolarHBondContact O-CB 3.28Å; F103-T107 PolarHBondContact O-N 3.36Å; F103-T107 PolarHBondContact O-OG1 3.1Å; F103-L154 HydrophobicContact CE1-CD1 4.48Å; F103-L154 HydrophobicContact CE2-CD1 4Å; F103-L154 HydrophobicContact CZ-CD1 3.45Å; F103-L154 VanDerWaalsContact CZ-CD1 3.45Å; F103-L158 HydrophobicContact CE2-CD2 3.9Å; F103-L158 HydrophobicContact CE2-CG 4Å; F103-L158 HydrophobicContact CZ-CD2 4.15Å; F103-L158 HydrophobicContact CZ-CG 4.41Å; F103-I161 HydrophobicContact CB-CD1 3.23Å; F103-I161 HydrophobicContact CD2-CD1 3.23Å; F103-I161 HydrophobicContact CD2-CG1 4.45Å; F103-I161 HydrophobicContact CE2-CD1 4.27Å; F103-I161 HydrophobicContact CG-CD1 3.5Å
104I90.3Very high88.6Confident52 Ų5230.2 Ų30.227%0.26717%0.172SC..Hα-helixtrans-61.6-47-178.5-65168.1000108.8I100 Q101 Y102 S106 T107 M108I100-I104 HydrophobicContact CG2-CD1 3.89Å; I100-I104 WeakPolarHBondContact O-CG1 3.19Å; I100-I104 PolarHBondContact O-N 3.47Å; I100-I104 VanDerWaalsContact O-N 3.09Å; Q101-I104 PolarHBondContact O-N 2.83Å; Y102-I104 PolarHBondContact O-N 2.94Å; I104-S106 PolarHBondContact O-N 3.4Å; I104-T107 PolarHBondContact O-N 2.83Å; I104-M108 HydrophobicContact CG2-CE 4.47Å; I104-M108 HydrophobicContact CG2-CG 4.09Å; I104-M108 VanDerWaalsContact O-CB 3.28Å; I104-M108 WeakPolarHBondContact O-CB 3.39Å; I104-M108 WeakPolarHBondContact O-CG 3.32Å; I104-M108 PolarHBondContact O-N 3.03Å
105F85Confident88.8Confident27 Ų2726.2 Ų26.212%0.11815%0.147CC..Hα-helixtrans-56.9-50.2179-178-91.1000112.6Y74 T78 Q101 Y102 F103 G109 F179 T280Y74-F105 HydrophobicContact CD1-CD2 4.42Å; Y74-F105 HydrophobicContact CD1-CE2 4.36Å; Y74-F105 AromaticContact CE1-CD2 3.75Å; Y74-F105 HydrophobicContact CE1-CD2 3.75Å; Y74-F105 AromaticContact CE1-CE2 3.34Å; Y74-F105 HydrophobicContact CE1-CE2 3.34Å; Y74-F105 HydrophobicContact CE1-CZ 4.22Å; Y74-F105 AromaticContact CE2-CD2 3.95Å; Y74-F105 HydrophobicContact CE2-CD2 3.95Å; Y74-F105 HydrophobicContact CE2-CE2 4.03Å; Y74-F105 HydrophobicContact CE2-CG 4.46Å; Y74-F105 AromaticContact CZ-CD2 3.51Å; Y74-F105 AromaticContact CZ-CE2 3.15Å; Y74-F105 AromaticContact CZ-CZ 3.7Å; Y74-F105 WeakPolarHBondContact OH-CE2 3.49Å; Y74-F105 WeakPolarHBondContact OH-CZ 3.39Å; T78-F105 HydrophobicContact CG2-CD2 3.94Å; T78-F105 HydrophobicContact CG2-CE2 4.49Å; Q101-F105 VanDerWaalsContact O-CB 3.3Å; Q101-F105 WeakPolarHBondContact O-CB 3.37Å; Q101-F105 PolarHBondContact O-N 3.04Å; Y102-F105 PolarHBondContact O-N 3.22Å; F103-F105 VanDerWaalsContact C-N 3.32Å; F103-F105 PolarHBondContact O-N 3.45Å; F105-G109 PolarHBondContact O-N 3.44Å; F105-F179 HydrophobicContact CE1-CE2 4.39Å; F105-F179 HydrophobicContact CE2-CE2 4.21Å; F105-F179 HydrophobicContact CE2-CZ 4.3Å; F105-F179 HydrophobicContact CZ-CE2 4.08Å; F105-F179 HydrophobicContact CZ-CZ 4.12Å; F105-T280 HydrophobicContact CE2-CG2 3.76Å; F105-T280 HydrophobicContact CZ-CG2 3.88Å
106S87Confident89.1Confident12 Ų1223.8 Ų23.88%0.08414%0.136CC..Hα-helixtrans-63.5-45.8179.7172.80000111.7Y102 F103 I104 M108 G109 L110 S157 Q160Y102-S106 WeakPolarHBondContact O-CB 3.24Å; Y102-S106 PolarHBondContact O-N 2.87Å; F103-S106 PolarHBondContact O-N 3.28Å; I104-S106 PolarHBondContact O-N 3.4Å; S106-M108 PolarHBondContact O-N 2.9Å; S106-G109 PolarHBondContact O-N 3.48Å; S106-L110 WeakPolarHBondContact O-CB 3.34Å; S106-L110 WeakPolarHBondContact O-CG 3Å; S106-L110 PolarHBondContact O-N 3.28Å; S106-S157 WeakPolarHBondContact CB-OG 3.28Å; S106-S157 PolarHBondContact OG-OG 2.97Å; S106-Q160 PolarHBondContact OG-OE1 3.45Å
107T91.8Very high89.4Confident14 Ų1420.4 Ų20.49%0.08612%0.116CC..Hα-helixtrans-63.4-46.4-178.3-67.50000110.5F103 I104 L110 S111 L154 S157F103-T107 WeakPolarHBondContact O-CB 3.28Å; F103-T107 PolarHBondContact O-N 3.36Å; F103-T107 PolarHBondContact O-OG1 3.1Å; I104-T107 PolarHBondContact O-N 2.83Å; T107-L110 PolarHBondContact O-N 2.84Å; T107-S111 WeakPolarHBondContact O-CB 3.11Å; T107-S111 PolarHBondContact O-N 2.76Å; T107-S111 PolarHBondContact O-OG 3.41Å; T107-S111 VanDerWaalsContact O-OG 3.05Å; T107-L154 HydrophobicContact CG2-CB 4.48Å; T107-S157 WeakPolarHBondContact CA-OG 3.09Å; T107-S157 PolarHBondContact N-OG 3.21Å; T107-S157 WeakPolarHBondContact OG1-CB 3.22Å; T107-S157 PolarHBondContact OG1-OG 3.41Å
108M89.6Confident89.8Confident25 Ų2519.9 Ų19.912%0.12311%0.109CC..Hα-helixtrans-63.2-45.5179.6-67.6-56155.500111.7I70 C73 Y74 I104 S106 L110 S111 E112I70-M108 HydrophobicContact CB-SD 4.22Å; I70-M108 HydrophobicContact CG1-SD 4.01Å; I70-M108 HydrophobicContact CG2-CB 3.74Å; I70-M108 HydrophobicContact CG2-CG 4.34Å; I70-M108 WeakPolarHBondContact CG2-O 3.3Å; I70-M108 HydrophobicContact CG2-SD 4.02Å; C73-M108 HydrophobicContact CB-CE 3.69Å; C73-M108 HydrophobicContact CB-CG 3.88Å; C73-M108 HydrophobicContact CB-SD 3.67Å; Y74-M108 HydrophobicContact CD2-CB 3.76Å; Y74-M108 HydrophobicContact CE2-CB 4.37Å; I104-M108 HydrophobicContact CG2-CE 4.47Å; I104-M108 HydrophobicContact CG2-CG 4.09Å; I104-M108 VanDerWaalsContact O-CB 3.28Å; I104-M108 WeakPolarHBondContact O-CB 3.39Å; I104-M108 WeakPolarHBondContact O-CG 3.32Å; I104-M108 PolarHBondContact O-N 3.03Å; S106-M108 PolarHBondContact O-N 2.9Å; M108-L110 PolarHBondContact O-N 3.35Å; M108-S111 PolarHBondContact O-N 3.44Å; M108-E112 WeakPolarHBondContact O-CB 3.41Å; M108-E112 PolarHBondContact O-N 2.81Å
109G85.3Confident90.1Very high17 Ų1719.9 Ų19.918%0.17511%0.109CC..Hα-helixtrans-64.8-39.3179.400000113.7F105 S106 S113F105-G109 PolarHBondContact O-N 3.44Å; S106-G109 PolarHBondContact O-N 3.48Å; G109-S113 PolarHBondContact O-N 2.98Å
110L89.2Confident90.3Very high22 Ų2219.1 Ų19.112%0.11511%0.105CC..Hα-helixtrans-68.4-44.9175.3-69.7175.6000111.3S106 T107 M108 E112 S113 C114 A156 F207S106-L110 WeakPolarHBondContact O-CB 3.34Å; S106-L110 WeakPolarHBondContact O-CG 3Å; S106-L110 PolarHBondContact O-N 3.28Å; T107-L110 PolarHBondContact O-N 2.84Å; M108-L110 PolarHBondContact O-N 3.35Å; L110-E112 VanDerWaalsContact C-N 3.32Å; L110-E112 PolarHBondContact O-N 2.94Å; L110-S113 PolarHBondContact O-N 3.29Å; L110-S113 PolarHBondContact O-OG 2.99Å; L110-C114 PolarHBondContact O-N 2.84Å; L110-A156 HydrophobicContact CD1-CB 3.44Å; L110-A156 VanDerWaalsContact CD1-CB 3.44Å; L110-F207 HydrophobicContact CD2-CB 3.86Å; L110-F207 HydrophobicContact CD2-CD2 3.76Å; L110-F207 HydrophobicContact CD2-CG 3.9Å
111S92.3Very high90.5Very high0 Ų019.1 Ų19.10%010%0.1CC..Hα-helixtrans-62.6-37.3176.5-65.90000112.6T107 M108 C114 L115 A149 Y150T107-S111 WeakPolarHBondContact O-CB 3.11Å; T107-S111 PolarHBondContact O-N 2.76Å; T107-S111 PolarHBondContact O-OG 3.41Å; T107-S111 VanDerWaalsContact O-OG 3.05Å; M108-S111 PolarHBondContact O-N 3.44Å; S111-C114 PolarHBondContact O-N 2.8Å; S111-L115 WeakPolarHBondContact O-CG 3.18Å; S111-L115 PolarHBondContact O-N 2.65Å; S111-A149 PolarHBondContact OG-O 3.49Å; S111-Y150 WeakPolarHBondContact OG-CA 3.39Å
112E89.8Confident90.7Very high2 Ų218.7 Ų18.71%0.00910%0.098CC..Hα-helixtrans-57.2-49.3172.4174.8169.9-167.900111.2L67 I70 M108 L110 C114 L115 M116 F252 N287L67-E112 HydrophobicContact CD1-CB 4.31Å; L67-E112 HydrophobicContact CD1-CG 3.69Å; I70-E112 HydrophobicContact CG2-CB 4.23Å; M108-E112 WeakPolarHBondContact O-CB 3.41Å; M108-E112 PolarHBondContact O-N 2.81Å; L110-E112 VanDerWaalsContact C-N 3.32Å; L110-E112 PolarHBondContact O-N 2.94Å; E112-C114 VanDerWaalsContact C-N 3.29Å; E112-C114 PolarHBondContact O-N 2.91Å; E112-L115 PolarHBondContact O-N 3.32Å; E112-L115 VanDerWaalsContact O-N 3.14Å; E112-M116 HydrophobicContact CG-CG 4.28Å; E112-M116 WeakPolarHBondContact O-CB 3.43Å; E112-M116 VanDerWaalsContact O-CG 3.22Å; E112-M116 WeakPolarHBondContact O-CG 3.01Å; E112-M116 PolarHBondContact O-N 2.93Å; E112-F252 HydrophobicContact CB-CE2 4.41Å; E112-F252 HydrophobicContact CG-CD2 4.15Å; E112-F252 HydrophobicContact CG-CE2 3.72Å; E112-F252 HydrophobicContact CG-CZ 4.19Å; E112-F252 WeakPolarHBondContact OE1-CD2 3.5Å; E112-F252 VanDerWaalsContact OE2-CE2 3.32Å; E112-F252 WeakPolarHBondContact OE2-CE2 3.3Å; E112-N287 PolarHBondContact OE1-ND2 3.05Å
113S88.4Confident90.9Very high6 Ų619.9 Ų19.94%0.04210%0.103CC..Hα-helixtrans-59.4-39.1179.374.80000112.9G109 L110 T117G109-S113 PolarHBondContact O-N 2.98Å; L110-S113 PolarHBondContact O-N 3.29Å; L110-S113 PolarHBondContact O-OG 2.99Å; S113-T117 PolarHBondContact O-N 3.08Å; S113-T117 VanDerWaalsContact O-N 3.17Å; S113-T117 PolarHBondContact O-OG1 3.08Å
114C92.4Very high91.1Very high26 Ų2620 Ų2018%0.17610%0.102CC..Hα-helixtrans-69.5-41.5175.7-65.60000112L110 S111 E112 T117 A118 A149L110-C114 PolarHBondContact O-N 2.84Å; S111-C114 PolarHBondContact O-N 2.8Å; E112-C114 VanDerWaalsContact C-N 3.29Å; E112-C114 PolarHBondContact O-N 2.91Å; C114-T117 WeakPolarHBondContact O-CB 3.35Å; C114-T117 PolarHBondContact O-N 3.24Å; C114-A118 PolarHBondContact O-N 3.19Å; C114-A149 HydrophobicContact CB-CB 3.54Å
115L92.8Very high91.2Very high0 Ų017.6 Ų17.60%09%0.089CC..Hα-helixtrans-64.8-41176.2-74.2-175.3000112F63 N66 L67 I70 S111 E112 T117 A118 M119 V146 A149F63-L115 HydrophobicContact CD1-CD2 4.22Å; N66-L115 HydrophobicContact CB-CD1 3.82Å; L67-L115 HydrophobicContact CB-CD1 4.47Å; I70-L115 HydrophobicContact CD1-CD1 3.51Å; I70-L115 HydrophobicContact CD1-CG 4.39Å; I70-L115 HydrophobicContact CG1-CD1 4.46Å; S111-L115 WeakPolarHBondContact O-CG 3.18Å; S111-L115 PolarHBondContact O-N 2.65Å; E112-L115 PolarHBondContact O-N 3.32Å; E112-L115 VanDerWaalsContact O-N 3.14Å; L115-T117 PolarHBondContact O-N 3.34Å; L115-A118 WeakPolarHBondContact O-CB 3.29Å; L115-A118 PolarHBondContact O-N 3.46Å; L115-A118 VanDerWaalsContact O-N 3.11Å; L115-M119 WeakPolarHBondContact O-CB 3.36Å; L115-M119 VanDerWaalsContact O-CG 3.29Å; L115-M119 WeakPolarHBondContact O-CG 3.19Å; L115-M119 PolarHBondContact O-N 2.93Å; L115-V146 HydrophobicContact CD2-CG2 3.93Å; L115-A149 HydrophobicContact CD2-CB 3.92Å; L115-A149 HydrophobicContact CG-CB 4.1Å
116M90.3Very high91.5Very high0 Ų017.7 Ų17.70%010%0.095CC..Hα-helixtrans-59.9-35.3174.6-69.3-67.8-89.500111.4L67 E112 M119 A120 I215 H245 A248 V249 Y291L67-M116 HydrophobicContact CD2-SD 4.04Å; E112-M116 HydrophobicContact CG-CG 4.28Å; E112-M116 WeakPolarHBondContact O-CB 3.43Å; E112-M116 VanDerWaalsContact O-CG 3.22Å; E112-M116 WeakPolarHBondContact O-CG 3.01Å; E112-M116 PolarHBondContact O-N 2.93Å; M116-M119 HydrophobicContact SD-SD 4.44Å; M116-A120 PolarHBondContact O-N 3Å; M116-I215 HydrophobicContact CB-CD1 4.42Å; M116-H245 PolarHBondContact O-CE1 3.43Å; M116-H245 PolarHBondContact O-NE2 2.99Å; M116-A248 HydrophobicContact CE-CB 3.83Å; M116-V249 HydrophobicContact CE-CB 4.22Å; M116-V249 HydrophobicContact CE-CG2 3.57Å; M116-Y291 PolarHBondContact SD-OH 2.74Å; M116-Y291 VanDerWaalsContact SD-OH 3.39Å
117T92.7Very high91.7Very high22 Ų2218.9 Ų18.914%0.13510%0.1CC..Hα-helixtrans-69-44.1173.4-56.50000111.9S113 C114 L115 M119 A120 Y121 S211 V214S113-T117 PolarHBondContact O-N 3.08Å; S113-T117 VanDerWaalsContact O-N 3.17Å; S113-T117 PolarHBondContact O-OG1 3.08Å; C114-T117 WeakPolarHBondContact O-CB 3.35Å; C114-T117 PolarHBondContact O-N 3.24Å; L115-T117 PolarHBondContact O-N 3.34Å; T117-M119 VanDerWaalsContact C-N 3.33Å; T117-M119 PolarHBondContact O-N 3.04Å; T117-A120 WeakPolarHBondContact O-CB 3.33Å; T117-A120 PolarHBondContact O-N 2.82Å; T117-Y121 PolarHBondContact O-N 3.33Å; T117-S211 VanDerWaalsContact OG1-CB 3.24Å; T117-S211 WeakPolarHBondContact OG1-CB 3.33Å; T117-S211 PolarHBondContact OG1-OG 3.02Å; T117-V214 HydrophobicContact CG2-CB 3.79Å; T117-V214 HydrophobicContact CG2-CG1 3.44Å; T117-V214 VanDerWaalsContact CG2-CG1 3.44Å
118A94.4Very high91.6Very high11 Ų1119.6 Ų19.69%0.09111%0.105CC..Hα-helixtrans-61.5-40.4175.900000112.1F63 C114 L115 Y121 D122 M145F63-A118 HydrophobicContact CD1-CB 4.31Å; F63-A118 HydrophobicContact CE1-CB 4.07Å; F63-A118 HydrophobicContact CZ-CB 4.26Å; C114-A118 PolarHBondContact O-N 3.19Å; L115-A118 WeakPolarHBondContact O-CB 3.29Å; L115-A118 PolarHBondContact O-N 3.46Å; L115-A118 VanDerWaalsContact O-N 3.11Å; A118-Y121 PolarHBondContact O-N 3.48Å; A118-D122 PolarHBondContact O-N 3.06Å; A118-M145 HydrophobicContact CB-CB 4.4Å; A118-M145 HydrophobicContact CB-SD 4.12Å
119M93.8Very high91.6Very high0 Ų021 Ų210%011%0.114CC..Hα-helixtrans-64.9-39.7174.5-69.8173.178.500112M60 F63 L64 L67 L115 M116 T117 Y121 D122 R123 H245 Y291M60-M119 HydrophobicContact CE-CE 3.38Å; M60-M119 HydrophobicContact SD-CB 4.18Å; M60-M119 HydrophobicContact SD-CE 3.74Å; M60-M119 HydrophobicContact SD-CG 4.26Å; F63-M119 HydrophobicContact CB-CG 3.39Å; F63-M119 HydrophobicContact CB-SD 4Å; F63-M119 HydrophobicContact CD2-CG 4.11Å; F63-M119 HydrophobicContact CG-CG 3.97Å; L64-M119 HydrophobicContact CB-CE 4.35Å; L64-M119 HydrophobicContact CD1-CE 4.25Å; L67-M119 HydrophobicContact CD2-SD 4.19Å; L115-M119 WeakPolarHBondContact O-CB 3.36Å; L115-M119 VanDerWaalsContact O-CG 3.29Å; L115-M119 WeakPolarHBondContact O-CG 3.19Å; L115-M119 PolarHBondContact O-N 2.93Å; M116-M119 HydrophobicContact SD-SD 4.44Å; T117-M119 VanDerWaalsContact C-N 3.33Å; T117-M119 PolarHBondContact O-N 3.04Å; M119-Y121 VanDerWaalsContact C-N 3.32Å; M119-Y121 PolarHBondContact O-N 3.24Å; M119-D122 PolarHBondContact O-N 3.49Å; M119-R123 WeakPolarHBondContact O-CG 3.29Å; M119-R123 PolarHBondContact O-N 3.25Å; M119-H245 WeakPolarHBondContact CB-NE2 3.31Å; M119-Y291 HydrophobicContact CE-CD1 4.42Å; M119-Y291 HydrophobicContact CE-CE1 3.75Å; M119-Y291 HydrophobicContact CE-CE2 4.48Å
120A93.1Very high91.7Very high0 Ų024.4 Ų24.40%013%0.132CC..Hα-helixtrans-62.1-40.9172.300000111.9M116 T117 R123 Y124 I215 Y219M116-A120 PolarHBondContact O-N 3Å; T117-A120 WeakPolarHBondContact O-CB 3.33Å; T117-A120 PolarHBondContact O-N 2.82Å; A120-R123 PolarHBondContact O-N 2.95Å; A120-Y124 WeakPolarHBondContact O-CB 3.38Å; A120-Y124 PolarHBondContact O-N 3.31Å; A120-I215 HydrophobicContact CB-CB 4.32Å; A120-I215 HydrophobicContact CB-CG1 3.83Å; A120-I215 HydrophobicContact CB-CG2 4.26Å; A120-Y219 HydrophobicContact CB-CD2 4.39Å; A120-Y219 HydrophobicContact CB-CE2 3.84Å
121Y94.3Very high91.8Very high89 Ų8931.4 Ų31.435%0.34917%0.169SC..Hα-helixtrans-66-39.1176-176.3-115.9000112.4T117 A118 M119 Y124 A125 I136 M137 M145T117-Y121 PolarHBondContact O-N 3.33Å; A118-Y121 PolarHBondContact O-N 3.48Å; M119-Y121 VanDerWaalsContact C-N 3.32Å; M119-Y121 PolarHBondContact O-N 3.24Å; Y121-Y124 AromaticContact CD2-CD1 3.99Å; Y121-Y124 HydrophobicContact CD2-CD1 3.99Å; Y121-Y124 AromaticContact CE2-CD1 3.95Å; Y121-Y124 HydrophobicContact CE2-CD1 3.95Å; Y121-Y124 HydrophobicContact CE2-CE1 4.24Å; Y121-Y124 WeakPolarHBondContact O-CB 3.38Å; Y121-Y124 PolarHBondContact O-N 3.3Å; Y121-A125 WeakPolarHBondContact O-CB 3.39Å; Y121-A125 PolarHBondContact O-N 3.39Å; Y121-I136 HydrophobicContact CE1-CG2 4.41Å; Y121-M137 HydrophobicContact CD1-CE 3.12Å; Y121-M137 HydrophobicContact CE1-CE 3.41Å; Y121-M137 VanDerWaalsContact CE1-CE 3.41Å; Y121-M137 HydrophobicContact CG-CE 4.01Å; Y121-M145 HydrophobicContact CD1-SD 4.23Å
122D94.1Very high91.8Very high0 Ų036.2 Ų36.20%019%0.194CC..Hα-helixtrans-57-50.4170.6167.880.2000111.9P59 F63 A118 M119 Y124 A125 A126 Y133 M137P59-D122 WeakPolarHBondContact CB-OD1 3.46Å; F63-D122 HydrophobicContact CD2-CB 4.5Å; F63-D122 HydrophobicContact CE2-CB 4.21Å; A118-D122 PolarHBondContact O-N 3.06Å; M119-D122 PolarHBondContact O-N 3.49Å; D122-Y124 VanDerWaalsContact C-N 3.28Å; D122-Y124 PolarHBondContact O-N 3.25Å; D122-A125 PolarHBondContact O-N 3Å; D122-A126 WeakPolarHBondContact O-CB 3.29Å; D122-A126 PolarHBondContact O-N 2.87Å; D122-Y133 WeakPolarHBondContact OD1-CE2 3.45Å; D122-Y133 PolarHBondContact OD1-OH 2.96Å; D122-M137 VanDerWaalsContact CA-CE 3.42Å; D122-M137 HydrophobicContact CB-CE 4.02Å; D122-M137 HydrophobicContact CB-SD 4.18Å
123R92.6Very high91.9Very high36 Ų3638.5 Ų38.514%0.13620%0.203CC..Hα-helixtrans-61-39.3177.8-65-6395.2176.4-4.2111.6M60 M119 A120 I127 I222M60-R123 HydrophobicContact SD-CG 4.49Å; M119-R123 WeakPolarHBondContact O-CG 3.29Å; M119-R123 PolarHBondContact O-N 3.25Å; A120-R123 PolarHBondContact O-N 2.95Å; R123-I127 WeakPolarHBondContact O-CG1 3.45Å; R123-I127 PolarHBondContact O-N 3.36Å; R123-I127 VanDerWaalsContact O-N 3.12Å; R123-I222 HydrophobicContact CB-CD1 3.99Å
124Y93.8Very high91.9Very high60 Ų6043 Ų4324%0.23523%0.234CC..Hα-helixtrans-61.2-52174.7164.4-94.2000111.3A120 Y121 D122 A126 I127 C128 Y221A120-Y124 WeakPolarHBondContact O-CB 3.38Å; A120-Y124 PolarHBondContact O-N 3.31Å; Y121-Y124 AromaticContact CD2-CD1 3.99Å; Y121-Y124 HydrophobicContact CD2-CD1 3.99Å; Y121-Y124 AromaticContact CE2-CD1 3.95Å; Y121-Y124 HydrophobicContact CE2-CD1 3.95Å; Y121-Y124 HydrophobicContact CE2-CE1 4.24Å; Y121-Y124 WeakPolarHBondContact O-CB 3.38Å; Y121-Y124 PolarHBondContact O-N 3.3Å; D122-Y124 VanDerWaalsContact C-N 3.28Å; D122-Y124 PolarHBondContact O-N 3.25Å; Y124-A126 VanDerWaalsContact C-N 3.3Å; Y124-A126 PolarHBondContact O-N 3.01Å; Y124-I127 PolarHBondContact O-N 3.16Å; Y124-C128 HydrophobicContact CD2-CB 3.96Å; Y124-C128 VanDerWaalsContact CD2-SG 3.54Å; Y124-C128 HydrophobicContact CE2-CB 3.73Å; Y124-C128 VanDerWaalsContact O-CB 3.23Å; Y124-C128 WeakPolarHBondContact O-CB 3.46Å; Y124-C128 PolarHBondContact O-N 2.83Å; Y124-Y221 HydrophobicContact CE2-CD2 4.17Å; Y124-Y221 HydrophobicContact CE2-CG 4.05Å
125A93.4Very high91.9Very high0 Ų046.1 Ų46.10%026%0.256CS..Hα-helixtrans-60.3-41.9-179.800000111.4Y121 D122 I127 N129 Y133 I136 M137Y121-A125 WeakPolarHBondContact O-CB 3.39Å; Y121-A125 PolarHBondContact O-N 3.39Å; D122-A125 PolarHBondContact O-N 3Å; A125-I127 PolarHBondContact O-N 3.3Å; A125-N129 CarbonylContact O-C 3.45Å; A125-N129 VanDerWaalsContact O-C 3.23Å; A125-N129 WeakPolarHBondContact O-CA 3.3Å; A125-N129 PolarHBondContact O-N 3.4Å; A125-N129 VanDerWaalsContact O-N 3.1Å; A125-Y133 HydrophobicContact CB-CD2 4.01Å; A125-Y133 HydrophobicContact CB-CE2 4.46Å; A125-I136 HydrophobicContact CB-CG2 4.11Å; A125-M137 HydrophobicContact CB-CE 4.21Å; A125-M137 HydrophobicContact CB-CG 4.17Å
126A91.6Very high91.8Very high29 Ų2948.3 Ų48.324%0.2427%0.268CS..Hα-helixtrans-64.6-37.9-179.500000113.4D122 Y124 Y133D122-A126 WeakPolarHBondContact O-CB 3.29Å; D122-A126 PolarHBondContact O-N 2.87Å; Y124-A126 VanDerWaalsContact C-N 3.3Å; Y124-A126 PolarHBondContact O-N 3.01Å; A126-Y133 VanDerWaalsContact CA-CD2 3.43Å; A126-Y133 HydrophobicContact CB-CD2 3.78Å; A126-Y133 HydrophobicContact CB-CE2 3.67Å; A126-Y133 HydrophobicContact CB-CG 4.45Å
127I89.9Confident92Very high38 Ų3848.6 Ų48.620%0.19527%0.269CS..Hα-helixtrans-94-43.7-174.4-63.9172.4000111.9R123 Y124 A125 I222 I226 C242R123-I127 WeakPolarHBondContact O-CG1 3.45Å; R123-I127 PolarHBondContact O-N 3.36Å; R123-I127 VanDerWaalsContact O-N 3.12Å; Y124-I127 PolarHBondContact O-N 3.16Å; A125-I127 PolarHBondContact O-N 3.3Å; I127-I222 HydrophobicContact CD1-CG2 3.76Å; I127-I222 HydrophobicContact CG2-CG2 4.33Å; I127-I226 HydrophobicContact CG2-CG1 4.25Å; I127-C242 WeakPolarHBondContact CD1-SG 3.41Å
128C90.1Very high92.1Very high28 Ų2849.3 Ų49.319%0.18928%0.275CS..Hα-helixtrans-82.6-28.1-175.3-61.90000112.6Y124 P130 S225Y124-C128 HydrophobicContact CD2-CB 3.96Å; Y124-C128 VanDerWaalsContact CD2-SG 3.54Å; Y124-C128 HydrophobicContact CE2-CB 3.73Å; Y124-C128 VanDerWaalsContact O-CB 3.23Å; Y124-C128 WeakPolarHBondContact O-CB 3.46Å; Y124-C128 PolarHBondContact O-N 2.83Å; C128-P130 VanDerWaalsContact C-CD 3.49Å; C128-S225 PolarHBondContact SG-OG 3.34Å
129N90.2Very high92Very high56 Ų5653.9 Ų53.930%0.29930%0.304SS..  trans-133.155.5-176.6-63.8-75.8000112.4A125 L131 L132 Y133 I136A125-N129 CarbonylContact O-C 3.45Å; A125-N129 VanDerWaalsContact O-C 3.23Å; A125-N129 WeakPolarHBondContact O-CA 3.3Å; A125-N129 PolarHBondContact O-N 3.4Å; A125-N129 VanDerWaalsContact O-N 3.1Å; N129-L131 VanDerWaalsContact C-N 3.29Å; N129-L131 PolarHBondContact O-N 3Å; N129-L132 PolarHBondContact O-N 3.45Å; N129-Y133 PolarHBondContact O-N 3.35Å; N129-I136 HydrophobicContact CB-CD1 4.07Å
130P87.6Confident92.1Very high87 Ų8758.3 Ų58.357%0.56533%0.331SS*.THydrogen-bonded Turntrans-60.3-34.3-169.823.9-34.5000113.9C128 L132C128-P130 VanDerWaalsContact C-CD 3.49Å; P130-L132 VanDerWaalsContact C-N 3.32Å; P130-L132 PolarHBondContact O-N 3.06Å
131L90.3Very high92.2Very high169 Ų16961.2 Ų61.289%0.88535%0.346SS*.THydrogen-bonded Turntrans-71.1-26180-64.3176.7000113.5N129N129-L131 VanDerWaalsContact C-N 3.29Å; N129-L131 PolarHBondContact O-N 3Å
132L91.8Very high92.3Very high101 Ų10157.2 Ų57.253%0.52933%0.331SS..THydrogen-bonded Turntrans-104-2.8-178.4-64.4173.3000112.1N129 P130 S134 S135 I136N129-L132 PolarHBondContact O-N 3.45Å; P130-L132 VanDerWaalsContact C-N 3.32Å; P130-L132 PolarHBondContact O-N 3.06Å; L132-S134 VanDerWaalsContact C-N 3.34Å; L132-S134 PolarHBondContact O-N 2.86Å; L132-S135 WeakPolarHBondContact O-CB 3.28Å; L132-S135 PolarHBondContact O-N 3.19Å; L132-I136 HydrophobicContact CB-CD1 3.73Å; L132-I136 HydrophobicContact CB-CG1 4.19Å; L132-I136 WeakPolarHBondContact O-CG1 3.41Å; L132-I136 PolarHBondContact O-N 2.85Å
133Y92.1Very high92.4Very high51 Ų5160.4 Ų60.420%0.235%0.351CS..Hα-helixtrans-52.8-47.2-173174.1-107.2000113P59 D122 A125 A126 N129 S135 I136 M137P59-Y133 WeakPolarHBondContact CG-OH 3.29Å; D122-Y133 WeakPolarHBondContact OD1-CE2 3.45Å; D122-Y133 PolarHBondContact OD1-OH 2.96Å; A125-Y133 HydrophobicContact CB-CD2 4.01Å; A125-Y133 HydrophobicContact CB-CE2 4.46Å; A126-Y133 VanDerWaalsContact CA-CD2 3.43Å; A126-Y133 HydrophobicContact CB-CD2 3.78Å; A126-Y133 HydrophobicContact CB-CE2 3.67Å; A126-Y133 HydrophobicContact CB-CG 4.45Å; N129-Y133 PolarHBondContact O-N 3.35Å; Y133-S135 VanDerWaalsContact C-N 3.26Å; Y133-S135 PolarHBondContact O-N 3.39Å; Y133-I136 PolarHBondContact O-N 3.02Å; Y133-M137 HydrophobicContact CD2-CB 4.18Å; Y133-M137 HydrophobicContact CD2-CG 4.02Å; Y133-M137 HydrophobicContact CE2-CB 3.79Å; Y133-M137 HydrophobicContact CE2-CG 3.59Å; Y133-M137 WeakPolarHBondContact O-CB 3.49Å; Y133-M137 PolarHBondContact O-N 3.21Å
134S89.3Confident92.6Very high99 Ų9966.9 Ų66.969%0.69238%0.375SS*.Hα-helixtrans-65.9-27.6-179.254.30000113.7L132L132-S134 VanDerWaalsContact C-N 3.34Å; L132-S134 PolarHBondContact O-N 2.86Å
135S90.9Very high92.8Very high92 Ų9265.6 Ų65.664%0.64337%0.372SS*.Hα-helixtrans-80.6-42.1176-173.40000111.3L132 Y133L132-S135 WeakPolarHBondContact O-CB 3.28Å; L132-S135 PolarHBondContact O-N 3.19Å; Y133-S135 VanDerWaalsContact C-N 3.26Å; Y133-S135 PolarHBondContact O-N 3.39Å
136I91.8Very high92.9Very high47 Ų4766 Ų6624%0.24137%0.374CS..Hα-helixtrans-67.3-56.6178.4-64.3166.7000110.2Y121 A125 N129 L132 Y133 S138 L141Y121-I136 HydrophobicContact CE1-CG2 4.41Å; A125-I136 HydrophobicContact CB-CG2 4.11Å; N129-I136 HydrophobicContact CB-CD1 4.07Å; L132-I136 HydrophobicContact CB-CD1 3.73Å; L132-I136 HydrophobicContact CB-CG1 4.19Å; L132-I136 WeakPolarHBondContact O-CG1 3.41Å; L132-I136 PolarHBondContact O-N 2.85Å; Y133-I136 PolarHBondContact O-N 3.02Å; I136-S138 VanDerWaalsContact C-N 3.26Å; I136-S138 PolarHBondContact O-N 3.5Å; I136-S138 VanDerWaalsContact O-N 3.08Å; I136-L141 WeakPolarHBondContact O-CD2 3.42Å
137M94.6Very high93.2Very high6 Ų668.6 Ų68.63%0.0338%0.383CS..THydrogen-bonded Turntrans-88.758.7-177.8-74.3-73.9164.100111.5P59 Y121 D122 A125 Y133 M145P59-M137 HydrophobicContact CB-CB 4.41Å; P59-M137 HydrophobicContact CG-CB 4.01Å; Y121-M137 HydrophobicContact CD1-CE 3.12Å; Y121-M137 HydrophobicContact CE1-CE 3.41Å; Y121-M137 VanDerWaalsContact CE1-CE 3.41Å; Y121-M137 HydrophobicContact CG-CE 4.01Å; D122-M137 VanDerWaalsContact CA-CE 3.42Å; D122-M137 HydrophobicContact CB-CE 4.02Å; D122-M137 HydrophobicContact CB-SD 4.18Å; A125-M137 HydrophobicContact CB-CE 4.21Å; A125-M137 HydrophobicContact CB-CG 4.17Å; Y133-M137 HydrophobicContact CD2-CB 4.18Å; Y133-M137 HydrophobicContact CD2-CG 4.02Å; Y133-M137 HydrophobicContact CE2-CB 3.79Å; Y133-M137 HydrophobicContact CE2-CG 3.59Å; Y133-M137 WeakPolarHBondContact O-CB 3.49Å; Y133-M137 PolarHBondContact O-N 3.21Å; M137-M145 HydrophobicContact CE-CE 3.88Å; M137-M145 HydrophobicContact SD-CE 3.6Å
138S94.3Very high93.5Very high37 Ų3769.2 Ų69.226%0.25939%0.394SS..  trans-68.4151.4173.569.60000111.3I136 T140 L141 C142I136-S138 VanDerWaalsContact C-N 3.26Å; I136-S138 PolarHBondContact O-N 3.5Å; I136-S138 VanDerWaalsContact O-N 3.08Å; S138-T140 PolarHBondContact O-N 3.31Å; S138-L141 PolarHBondContact O-N 2.94Å; S138-L141 VanDerWaalsContact O-N 3.11Å; S138-L141 WeakPolarHBondContact OG-CB 3.39Å; S138-L141 PolarHBondContact OG-N 2.89Å; S138-C142 PolarHBondContact O-N 3.26Å; S138-C142 PolarHBondContact O-SG 2.9Å
139P92.9Very high93.8Very high106 Ų10668 Ų6869%0.68839%0.387SS*.Hα-helixtrans-54.7-38.8175.2-2735.1000112.9C142 V143P139-C142 WeakPolarHBondContact O-CB 3.22Å; P139-C142 PolarHBondContact O-N 2.85Å; P139-V143 WeakPolarHBondContact O-CG2 3.48Å; P139-V143 PolarHBondContact O-N 3.42Å
140T95.2Very high94.1Very high93 Ų9367.8 Ų67.857%0.57138%0.382SS*.Hα-helixtrans-61.7-46.2177.4-52.10000111.5S138 C142 V143 W144S138-T140 PolarHBondContact O-N 3.31Å; T140-C142 VanDerWaalsContact C-N 3.33Å; T140-C142 PolarHBondContact O-N 3.43Å; T140-V143 PolarHBondContact O-N 2.84Å; T140-W144 PolarHBondContact O-N 3.14Å
141L95.3Very high94.5Very high62 Ų6268.8 Ų68.833%0.32538%0.38SS..Hα-helixtrans-63.3-41176.4-176.866.4000111.3I136 S138 V143 W144 M145I136-L141 WeakPolarHBondContact O-CD2 3.42Å; S138-L141 PolarHBondContact O-N 2.94Å; S138-L141 VanDerWaalsContact O-N 3.11Å; S138-L141 WeakPolarHBondContact OG-CB 3.39Å; S138-L141 PolarHBondContact OG-N 2.89Å; L141-V143 VanDerWaalsContact C-N 3.33Å; L141-V143 PolarHBondContact O-N 2.86Å; L141-W144 PolarHBondContact O-N 3.2Å; L141-M145 HydrophobicContact CD1-CG 4.43Å; L141-M145 HydrophobicContact CD2-CE 3.99Å; L141-M145 HydrophobicContact CG-CE 3.77Å; L141-M145 HydrophobicContact CG-CG 4.33Å; L141-M145 HydrophobicContact CG-SD 4.49Å; L141-M145 WeakPolarHBondContact O-CG 3.42Å; L141-M145 PolarHBondContact O-N 2.9Å
142C95.9Very high94.6Very high4 Ų462.9 Ų62.93%0.02735%0.351CS..Hα-helixtrans-59-45.1177.4-620000111.8F62 F63 S138 P139 T140 M145 V146F62-C142 HydrophobicContact CD1-CB 3.84Å; F62-C142 HydrophobicContact CE1-CB 3.98Å; F63-C142 HydrophobicContact CE1-CB 4.42Å; F63-C142 HydrophobicContact CZ-CB 4.02Å; S138-C142 PolarHBondContact O-N 3.26Å; S138-C142 PolarHBondContact O-SG 2.9Å; P139-C142 WeakPolarHBondContact O-CB 3.22Å; P139-C142 PolarHBondContact O-N 2.85Å; T140-C142 VanDerWaalsContact C-N 3.33Å; T140-C142 PolarHBondContact O-N 3.43Å; C142-M145 PolarHBondContact O-N 3.13Å; C142-V146 WeakPolarHBondContact O-CG2 3.48Å; C142-V146 PolarHBondContact O-N 3.38Å
143V96.7Very high94.6Very high68 Ų6858 Ų5841%0.41233%0.326SS..Hα-helixtrans-61.7-45.9175.3172.10000110.9F62 P139 T140 L141 M145 V146 L147F62-V143 HydrophobicContact CE1-CG2 4.46Å; F62-V143 HydrophobicContact CZ-CG2 4.03Å; P139-V143 WeakPolarHBondContact O-CG2 3.48Å; P139-V143 PolarHBondContact O-N 3.42Å; T140-V143 PolarHBondContact O-N 2.84Å; L141-V143 VanDerWaalsContact C-N 3.33Å; L141-V143 PolarHBondContact O-N 2.86Å; V143-M145 PolarHBondContact O-N 2.94Å; V143-V146 PolarHBondContact O-N 3.3Å; V143-L147 HydrophobicContact CG1-CD1 3.82Å; V143-L147 HydrophobicContact CG1-CG 4.26Å; V143-L147 WeakPolarHBondContact O-CB 3.31Å; V143-L147 WeakPolarHBondContact O-CG 3.5Å; V143-L147 PolarHBondContact O-N 3.11Å
144W97.5Very high94.8Very high171 Ų17158.3 Ų58.365%0.64833%0.331SS*.Hα-helixtrans-61.2-41.1176.8-82.3114.9000113T140 L141 L147 A148T140-W144 PolarHBondContact O-N 3.14Å; L141-W144 PolarHBondContact O-N 3.2Å; W144-L147 HydrophobicContact CE3-CD1 4.46Å; W144-L147 PolarHBondContact O-N 2.94Å; W144-A148 VanDerWaalsContact O-CB 3.26Å; W144-A148 WeakPolarHBondContact O-CB 3.46Å; W144-A148 PolarHBondContact O-N 3.31Å
145M96.8Very high95Very high34 Ų3457.3 Ų57.317%0.16732%0.32CS..Hα-helixtrans-62.4-42.6176.3-75-168-82.900111.7F63 A118 Y121 M137 L141 C142 V143 A149F63-M145 HydrophobicContact CE1-CB 4.06Å; F63-M145 HydrophobicContact CE1-CE 4.41Å; F63-M145 HydrophobicContact CE2-CE 4.27Å; F63-M145 HydrophobicContact CZ-CB 4.33Å; F63-M145 HydrophobicContact CZ-CE 3.51Å; F63-M145 HydrophobicContact CZ-SD 4.26Å; A118-M145 HydrophobicContact CB-CB 4.4Å; A118-M145 HydrophobicContact CB-SD 4.12Å; Y121-M145 HydrophobicContact CD1-SD 4.23Å; M137-M145 HydrophobicContact CE-CE 3.88Å; M137-M145 HydrophobicContact SD-CE 3.6Å; L141-M145 HydrophobicContact CD1-CG 4.43Å; L141-M145 HydrophobicContact CD2-CE 3.99Å; L141-M145 HydrophobicContact CG-CE 3.77Å; L141-M145 HydrophobicContact CG-CG 4.33Å; L141-M145 HydrophobicContact CG-SD 4.49Å; L141-M145 WeakPolarHBondContact O-CG 3.42Å; L141-M145 PolarHBondContact O-N 2.9Å; C142-M145 PolarHBondContact O-N 3.13Å; V143-M145 PolarHBondContact O-N 2.94Å; M145-A149 WeakPolarHBondContact O-CB 3.26Å; M145-A149 PolarHBondContact O-N 3.21Å
146V97.1Very high95Very high8 Ų853.2 Ų53.25%0.04829%0.292CS..Hα-helixtrans-65.9-46.1175.8170.70000111.4F62 F63 N66 L115 C142 V143 A148 A149 Y150F62-V146 HydrophobicContact CD1-CG2 4.12Å; F62-V146 HydrophobicContact CE1-CB 4.23Å; F62-V146 HydrophobicContact CE1-CG2 3.45Å; F62-V146 VanDerWaalsContact CE1-CG2 3.45Å; F62-V146 HydrophobicContact CZ-CG2 4.15Å; F63-V146 HydrophobicContact CD1-CG2 3.65Å; F63-V146 HydrophobicContact CE1-CG2 3.74Å; N66-V146 HydrophobicContact CB-CG1 4.39Å; N66-V146 WeakPolarHBondContact OD1-CG1 3.21Å; L115-V146 HydrophobicContact CD2-CG2 3.93Å; C142-V146 WeakPolarHBondContact O-CG2 3.48Å; C142-V146 PolarHBondContact O-N 3.38Å; V143-V146 PolarHBondContact O-N 3.3Å; V146-A148 VanDerWaalsContact C-N 3.33Å; V146-A148 PolarHBondContact O-N 3.32Å; V146-A149 WeakPolarHBondContact O-CB 3.47Å; V146-A149 PolarHBondContact O-N 3.44Å; V146-Y150 HydrophobicContact CG1-CD2 3.67Å; V146-Y150 HydrophobicContact CG1-CE2 3.39Å; V146-Y150 WeakPolarHBondContact O-CD2 3.28Å; V146-Y150 PolarHBondContact O-N 2.84Å
147L97.3Very high95Very high83 Ų8351 Ų5144%0.43528%0.281SS..Hα-helixtrans-60.3-44.6177.3-73.2173000111.2V143 W144 A149 Y150 M151V143-L147 HydrophobicContact CG1-CD1 3.82Å; V143-L147 HydrophobicContact CG1-CG 4.26Å; V143-L147 WeakPolarHBondContact O-CB 3.31Å; V143-L147 WeakPolarHBondContact O-CG 3.5Å; V143-L147 PolarHBondContact O-N 3.11Å; W144-L147 HydrophobicContact CE3-CD1 4.46Å; W144-L147 PolarHBondContact O-N 2.94Å; L147-A149 PolarHBondContact O-N 3.36Å; L147-Y150 PolarHBondContact O-N 3.32Å; L147-M151 WeakPolarHBondContact O-CB 3.33Å; L147-M151 VanDerWaalsContact O-CG 3.22Å; L147-M151 WeakPolarHBondContact O-CG 3.41Å; L147-M151 PolarHBondContact O-N 2.85Å
148A96.4Very high95Very high51 Ų5155.1 Ų55.142%0.42130%0.302SS..Hα-helixtrans-59.8-45.7175.500000111.2W144 V146 Y150 M151 T152W144-A148 VanDerWaalsContact O-CB 3.26Å; W144-A148 WeakPolarHBondContact O-CB 3.46Å; W144-A148 PolarHBondContact O-N 3.31Å; V146-A148 VanDerWaalsContact C-N 3.33Å; V146-A148 PolarHBondContact O-N 3.32Å; A148-Y150 VanDerWaalsContact C-N 3.34Å; A148-Y150 PolarHBondContact O-N 3.37Å; A148-M151 PolarHBondContact O-N 2.88Å; A148-T152 VanDerWaalsContact O-CB 3.25Å; A148-T152 WeakPolarHBondContact O-CB 3.5Å; A148-T152 PolarHBondContact O-N 3.28Å; A148-T152 PolarHBondContact O-OG1 3.17Å
149A95.7Very high94.8Very high4 Ų455.9 Ų55.93%0.03331%0.308CS..Hα-helixtrans-57.2-43.917700000112.8S111 C114 L115 M145 V146 L147 G153S111-A149 PolarHBondContact OG-O 3.49Å; C114-A149 HydrophobicContact CB-CB 3.54Å; L115-A149 HydrophobicContact CD2-CB 3.92Å; L115-A149 HydrophobicContact CG-CB 4.1Å; M145-A149 WeakPolarHBondContact O-CB 3.26Å; M145-A149 PolarHBondContact O-N 3.21Å; V146-A149 WeakPolarHBondContact O-CB 3.47Å; V146-A149 PolarHBondContact O-N 3.44Å; L147-A149 PolarHBondContact O-N 3.36Å; A149-G153 PolarHBondContact O-N 2.86Å; A149-G153 VanDerWaalsContact O-N 3.15Å
150Y96.2Very high94.7Very high50 Ų5051.1 Ų51.120%0.19628%0.276CS..Hα-helixtrans-69.4-44.5176.4-73.5-61.2000112.9N66 I70 S111 V146 L147 A148 T152 G153 L154N66-Y150 PolarHBondContact OD1-OH 2.8Å; I70-Y150 HydrophobicContact CD1-CE1 3.8Å; I70-Y150 HydrophobicContact CG1-CE1 3.75Å; S111-Y150 WeakPolarHBondContact OG-CA 3.39Å; V146-Y150 HydrophobicContact CG1-CD2 3.67Å; V146-Y150 HydrophobicContact CG1-CE2 3.39Å; V146-Y150 WeakPolarHBondContact O-CD2 3.28Å; V146-Y150 PolarHBondContact O-N 2.84Å; L147-Y150 PolarHBondContact O-N 3.32Å; A148-Y150 VanDerWaalsContact C-N 3.34Å; A148-Y150 PolarHBondContact O-N 3.37Å; Y150-T152 PolarHBondContact O-N 2.84Å; Y150-G153 PolarHBondContact O-N 3.15Å; Y150-L154 VanDerWaalsContact O-CB 3.25Å; Y150-L154 WeakPolarHBondContact O-CB 3.1Å; Y150-L154 PolarHBondContact O-N 3.48Å
151M96.3Very high94.4Very high108 Ų10847.5 Ų47.553%0.53225%0.253SS..Hα-helixtrans-65.4-40.5-179.3-70.5-58.5-63.900112.1L147 A148 L154 T155L147-M151 WeakPolarHBondContact O-CB 3.33Å; L147-M151 VanDerWaalsContact O-CG 3.22Å; L147-M151 WeakPolarHBondContact O-CG 3.41Å; L147-M151 PolarHBondContact O-N 2.85Å; A148-M151 PolarHBondContact O-N 2.88Å; M151-L154 PolarHBondContact O-N 3.42Å; M151-L154 HydrophobicContact SD-CD2 4.38Å; M151-T155 WeakPolarHBondContact O-CB 3.49Å; M151-T155 VanDerWaalsContact O-CG2 3.28Å; M151-T155 WeakPolarHBondContact O-CG2 3.48Å; M151-T155 PolarHBondContact O-N 3.45Å; M151-T155 PolarHBondContact O-OG1 3.02Å
152T92.8Very high94.1Very high45 Ų4546.2 Ų46.228%0.27626%0.255SS..Hα-helixtrans-63.8-45.1175-62.80000111.7A148 Y150 T155 A156 F207A148-T152 VanDerWaalsContact O-CB 3.25Å; A148-T152 WeakPolarHBondContact O-CB 3.5Å; A148-T152 PolarHBondContact O-N 3.28Å; A148-T152 PolarHBondContact O-OG1 3.17Å; Y150-T152 PolarHBondContact O-N 2.84Å; T152-T155 WeakPolarHBondContact CA-OG1 3.25Å; T152-T155 PolarHBondContact O-OG1 2.95Å; T152-T155 VanDerWaalsContact O-OG1 3.05Å; T152-A156 WeakPolarHBondContact O-CB 3.37Å; T152-A156 PolarHBondContact O-N 2.81Å; T152-A156 VanDerWaalsContact O-N 3.14Å; T152-F207 HydrophobicContact CG2-CD1 4.15Å; T152-F207 HydrophobicContact CG2-CE1 3.15Å; T152-F207 HydrophobicContact CG2-CZ 3.47Å; T152-F207 VanDerWaalsContact CG2-CZ 3.47Å
153G92.6Very high93.6Very high0 Ų046.4 Ų46.40%026%0.257CS..Hα-helixtrans-60.6-47.9174.100000112.1A149 Y150 T155 A156 S157A149-G153 PolarHBondContact O-N 2.86Å; A149-G153 VanDerWaalsContact O-N 3.15Å; Y150-G153 PolarHBondContact O-N 3.15Å; G153-T155 PolarHBondContact O-N 3.33Å; G153-A156 PolarHBondContact O-N 3.47Å; G153-S157 WeakPolarHBondContact O-CB 3.38Å; G153-S157 PolarHBondContact O-N 2.9Å; G153-S157 PolarHBondContact O-OG 2.85Å
154L94.8Very high93.1Very high57 Ų5743.1 Ų43.130%0.29824%0.237SC..Hα-helixtrans-58.2-51179.517864.5000112.2F103 T107 Y150 M151 A156 S157 L158F103-L154 HydrophobicContact CE1-CD1 4.48Å; F103-L154 HydrophobicContact CE2-CD1 4Å; F103-L154 HydrophobicContact CZ-CD1 3.45Å; F103-L154 VanDerWaalsContact CZ-CD1 3.45Å; T107-L154 HydrophobicContact CG2-CB 4.48Å; Y150-L154 VanDerWaalsContact O-CB 3.25Å; Y150-L154 WeakPolarHBondContact O-CB 3.1Å; Y150-L154 PolarHBondContact O-N 3.48Å; M151-L154 PolarHBondContact O-N 3.42Å; M151-L154 HydrophobicContact SD-CD2 4.38Å; L154-A156 PolarHBondContact O-N 3.37Å; L154-S157 PolarHBondContact O-N 3.03Å; L154-L158 HydrophobicContact CD1-CD1 4.07Å; L154-L158 HydrophobicContact CD1-CG 4.23Å; L154-L158 HydrophobicContact CG-CD1 3.97Å; L154-L158 HydrophobicContact CG-CG 4.5Å; L154-L158 WeakPolarHBondContact O-CB 3.35Å; L154-L158 VanDerWaalsContact O-CG 3.29Å; L154-L158 WeakPolarHBondContact O-CG 3.29Å; L154-L158 PolarHBondContact O-N 3.15Å
155T93.9Very high92.6Very high78 Ų7839.6 Ų39.648%0.47923%0.23SC..Hα-helixtrans-63.5-41.2-177.646.90000112.4M151 T152 G153 L158 S159M151-T155 WeakPolarHBondContact O-CB 3.49Å; M151-T155 VanDerWaalsContact O-CG2 3.28Å; M151-T155 WeakPolarHBondContact O-CG2 3.48Å; M151-T155 PolarHBondContact O-N 3.45Å; M151-T155 PolarHBondContact O-OG1 3.02Å; T152-T155 WeakPolarHBondContact CA-OG1 3.25Å; T152-T155 PolarHBondContact O-OG1 2.95Å; T152-T155 VanDerWaalsContact O-OG1 3.05Å; G153-T155 PolarHBondContact O-N 3.33Å; T155-L158 PolarHBondContact O-N 3.21Å; T155-S159 PolarHBondContact O-N 3.34Å; T155-S159 VanDerWaalsContact O-N 3.11Å
156A91.9Very high92.1Very high6 Ų645.2 Ų45.25%0.0526%0.256CS..Hα-helixtrans-69.3-37.3176.800000112.6L110 T152 G153 L154 S159 Q160 L203 F207L110-A156 HydrophobicContact CD1-CB 3.44Å; L110-A156 VanDerWaalsContact CD1-CB 3.44Å; T152-A156 WeakPolarHBondContact O-CB 3.37Å; T152-A156 PolarHBondContact O-N 2.81Å; T152-A156 VanDerWaalsContact O-N 3.14Å; G153-A156 PolarHBondContact O-N 3.47Å; L154-A156 PolarHBondContact O-N 3.37Å; A156-S159 PolarHBondContact O-OG 2.87Å; A156-Q160 VanDerWaalsContact O-CG 3.3Å; A156-Q160 WeakPolarHBondContact O-CG 3.39Å; A156-Q160 PolarHBondContact O-N 2.7Å; A156-Q160 VanDerWaalsContact O-N 3.14Å; A156-L203 HydrophobicContact CB-CD2 4.47Å; A156-F207 HydrophobicContact CB-CE2 3.83Å; A156-F207 HydrophobicContact CB-CZ 4.33Å
157S91.6Very high91.4Very high0 Ų045.7 Ų45.70%026%0.258CS..Hα-helixtrans-71.6-35.3175-55.40000112.6S106 T107 G153 L154 Q160 I161S106-S157 WeakPolarHBondContact CB-OG 3.28Å; S106-S157 PolarHBondContact OG-OG 2.97Å; T107-S157 WeakPolarHBondContact CA-OG 3.09Å; T107-S157 PolarHBondContact N-OG 3.21Å; T107-S157 WeakPolarHBondContact OG1-CB 3.22Å; T107-S157 PolarHBondContact OG1-OG 3.41Å; G153-S157 WeakPolarHBondContact O-CB 3.38Å; G153-S157 PolarHBondContact O-N 2.9Å; G153-S157 PolarHBondContact O-OG 2.85Å; L154-S157 PolarHBondContact O-N 3.03Å; S157-Q160 WeakPolarHBondContact O-CB 3.25Å; S157-Q160 PolarHBondContact O-N 3.08Å; S157-I161 WeakPolarHBondContact O-CG1 3.44Å; S157-I161 PolarHBondContact O-N 3.41Å
158L93.4Very high90.6Very high92 Ų9245.3 Ų45.348%0.48225%0.254SS..Hα-helixtrans-63.3-41.3174.6-78.8172.3000111.7F103 L154 T155 I161 G162F103-L158 HydrophobicContact CE2-CD2 3.9Å; F103-L158 HydrophobicContact CE2-CG 4Å; F103-L158 HydrophobicContact CZ-CD2 4.15Å; F103-L158 HydrophobicContact CZ-CG 4.41Å; L154-L158 HydrophobicContact CD1-CD1 4.07Å; L154-L158 HydrophobicContact CD1-CG 4.23Å; L154-L158 HydrophobicContact CG-CD1 3.97Å; L154-L158 HydrophobicContact CG-CG 4.5Å; L154-L158 WeakPolarHBondContact O-CB 3.35Å; L154-L158 VanDerWaalsContact O-CG 3.29Å; L154-L158 WeakPolarHBondContact O-CG 3.29Å; L154-L158 PolarHBondContact O-N 3.15Å; T155-L158 PolarHBondContact O-N 3.21Å; L158-I161 PolarHBondContact O-N 3.21Å; L158-G162 PolarHBondContact O-N 2.85Å
159S91.4Very high89.9Confident53 Ų5343.4 Ų43.437%0.37124%0.236SC..Hα-helixtrans-65.8-41.2175.564.40000111.8T155 A156 I161 G162 A163T155-S159 PolarHBondContact O-N 3.34Å; T155-S159 VanDerWaalsContact O-N 3.11Å; A156-S159 PolarHBondContact O-OG 2.87Å; S159-I161 PolarHBondContact O-N 2.98Å; S159-G162 PolarHBondContact O-N 3.5Å; S159-A163 PolarHBondContact O-N 3.41Å
160Q89.3Confident89Confident6 Ų646.7 Ų46.73%0.02826%0.258CS..Hα-helixtrans-57.4-46.7173.2-75174.9-12.200112.8Y102 S106 A156 S157 A163 L164 M182 M199 L203Y102-Q160 HydrophobicContact CE1-CB 4.22Å; Y102-Q160 VanDerWaalsContact OH-CD 3.28Å; Y102-Q160 PolarHBondContact OH-OE1 3.25Å; S106-Q160 PolarHBondContact OG-OE1 3.45Å; A156-Q160 VanDerWaalsContact O-CG 3.3Å; A156-Q160 WeakPolarHBondContact O-CG 3.39Å; A156-Q160 PolarHBondContact O-N 2.7Å; A156-Q160 VanDerWaalsContact O-N 3.14Å; S157-Q160 WeakPolarHBondContact O-CB 3.25Å; S157-Q160 PolarHBondContact O-N 3.08Å; Q160-A163 PolarHBondContact O-N 3.17Å; Q160-L164 WeakPolarHBondContact O-CB 3.5Å; Q160-L164 PolarHBondContact O-N 3.25Å; Q160-M182 HydrophobicContact CB-CE 4.09Å; Q160-M199 HydrophobicContact CB-CE 4.42Å; Q160-M199 HydrophobicContact CG-CE 4.2Å; Q160-L203 HydrophobicContact CG-CD1 3.73Å
161I89.9Confident87.7Confident18 Ų1845.8 Ų45.89%0.09226%0.264CS..Hα-helixtrans-70.3-40.9178.4-72176.4000111.9I99 Y102 F103 S157 L158 S159 A163 L164 L165I99-I161 HydrophobicContact CG2-CD1 4.23Å; I99-I161 HydrophobicContact CG2-CG1 4.45Å; I99-I161 HydrophobicContact CG2-CG2 3.88Å; Y102-I161 HydrophobicContact CD1-CD1 4.48Å; Y102-I161 HydrophobicContact CD1-CG1 4.04Å; Y102-I161 HydrophobicContact CE1-CG1 4.25Å; F103-I161 HydrophobicContact CB-CD1 3.23Å; F103-I161 HydrophobicContact CD2-CD1 3.23Å; F103-I161 HydrophobicContact CD2-CG1 4.45Å; F103-I161 HydrophobicContact CE2-CD1 4.27Å; F103-I161 HydrophobicContact CG-CD1 3.5Å; S157-I161 WeakPolarHBondContact O-CG1 3.44Å; S157-I161 PolarHBondContact O-N 3.41Å; L158-I161 PolarHBondContact O-N 3.21Å; S159-I161 PolarHBondContact O-N 2.98Å; I161-A163 PolarHBondContact O-N 3.38Å; I161-L164 WeakPolarHBondContact O-CB 3.44Å; I161-L164 PolarHBondContact O-N 2.91Å; I161-L165 HydrophobicContact CG2-CD1 3.7Å; I161-L165 HydrophobicContact CG2-CG 3.93Å; I161-L165 WeakPolarHBondContact O-CB 3.49Å; I161-L165 WeakPolarHBondContact O-CG 3.43Å; I161-L165 PolarHBondContact O-N 3.19Å
162G88.4Confident86.4Confident35 Ų3544.3 Ų44.336%0.36126%0.264SS..Hα-helixtrans-54.6-42.217600000111.4L158 S159 Q166L158-G162 PolarHBondContact O-N 2.85Å; S159-G162 PolarHBondContact O-N 3.5Å; G162-Q166 WeakPolarHBondContact O-CG 3.02Å
163A86.8Confident85.7Confident7 Ų744.2 Ų44.26%0.05826%0.262CS..Hα-helixtrans-73.1-36.8174.900000112.9S159 Q160 I161 Q166 F195 V196 M199S159-A163 PolarHBondContact O-N 3.41Å; Q160-A163 PolarHBondContact O-N 3.17Å; I161-A163 PolarHBondContact O-N 3.38Å; A163-Q166 PolarHBondContact O-N 3.27Å; A163-F195 HydrophobicContact CB-CD1 4.41Å; A163-F195 HydrophobicContact CB-CE1 4.15Å; A163-V196 HydrophobicContact CB-CG1 4.47Å; A163-V196 HydrophobicContact CB-CG2 3.94Å; A163-M199 HydrophobicContact CB-CE 3.39Å; A163-M199 HydrophobicContact CB-SD 4.22Å
164L86.1Confident84.9Confident0 Ų046.2 Ų46.20%027%0.274CS..Hα-helixtrans-63.2-40.6177.1-173.563.4000112.4I99 Y102 Q160 I161 Q166 L167 F169 M182 L185 L186I99-L164 HydrophobicContact CD1-CD2 3.32Å; I99-L164 HydrophobicContact CD1-CG 3.95Å; Y102-L164 HydrophobicContact CD1-CD2 4.47Å; Q160-L164 WeakPolarHBondContact O-CB 3.5Å; Q160-L164 PolarHBondContact O-N 3.25Å; I161-L164 WeakPolarHBondContact O-CB 3.44Å; I161-L164 PolarHBondContact O-N 2.91Å; L164-Q166 PolarHBondContact O-N 3.19Å; L164-L167 HydrophobicContact CD1-CD1 4.16Å; L164-L167 WeakPolarHBondContact O-CB 3.45Å; L164-L167 PolarHBondContact O-N 3.29Å; L164-L167 VanDerWaalsContact O-N 3.1Å; L164-F169 HydrophobicContact CD1-CZ 3.82Å; L164-F169 HydrophobicContact CG-CZ 4.36Å; L164-M182 HydrophobicContact CB-CE 3.89Å; L164-M182 HydrophobicContact CD1-CE 4.13Å; L164-M182 HydrophobicContact CD1-SD 3.78Å; L164-M182 HydrophobicContact CD2-CE 3.72Å; L164-M182 HydrophobicContact CD2-SD 4.06Å; L164-M182 HydrophobicContact CG-CE 4.13Å; L164-M182 HydrophobicContact CG-SD 4.39Å; L164-L185 HydrophobicContact CD1-CB 4.39Å; L164-L185 HydrophobicContact CD2-CD1 4.05Å; L164-L186 HydrophobicContact CD1-CD2 4.4Å
165L86.3Confident84.1Confident97 Ų9743.6 Ų43.651%0.50826%0.26SS..THydrogen-bonded Turntrans-69.4-15.4179.2-70.3175.4000113.2F95 I99 I161 L167F95-L165 HydrophobicContact CE1-CD2 4.06Å; F95-L165 HydrophobicContact CZ-CD2 4.13Å; I99-L165 HydrophobicContact CD1-CD2 4.43Å; I99-L165 HydrophobicContact CG1-CD2 4.34Å; I99-L165 HydrophobicContact CG2-CD2 4.45Å; I161-L165 HydrophobicContact CG2-CD1 3.7Å; I161-L165 HydrophobicContact CG2-CG 3.93Å; I161-L165 WeakPolarHBondContact O-CB 3.49Å; I161-L165 WeakPolarHBondContact O-CG 3.43Å; I161-L165 PolarHBondContact O-N 3.19Å; L165-L167 VanDerWaalsContact C-N 3.31Å
166Q85.6Confident82.9Confident151 Ų15146.1 Ų46.171%0.70626%0.261SS*.THydrogen-bonded Turntrans-81.8-12.4173-68.2177.9-0.800112.7G162 A163 L164G162-Q166 WeakPolarHBondContact O-CG 3.02Å; A163-Q166 PolarHBondContact O-N 3.27Å; L164-Q166 PolarHBondContact O-N 3.19Å
167L83.6Confident82Confident18 Ų1846.2 Ų46.29%0.09426%0.261CS..SBendtrans-80.2142.2178.3-62.6-179000111.2L164 L165 F169 L186 T191 T193 V196L164-L167 HydrophobicContact CD1-CD1 4.16Å; L164-L167 WeakPolarHBondContact O-CB 3.45Å; L164-L167 PolarHBondContact O-N 3.29Å; L164-L167 VanDerWaalsContact O-N 3.1Å; L165-L167 VanDerWaalsContact C-N 3.31Å; L167-F169 HydrophobicContact CB-CE2 4.19Å; L167-F169 HydrophobicContact CB-CZ 4.14Å; L167-L186 HydrophobicContact CD1-CD2 3.43Å; L167-L186 VanDerWaalsContact CD1-CD2 3.43Å; L167-T191 HydrophobicContact CD2-CG2 4.39Å; L167-T193 HydrophobicContact CD1-CG2 3.97Å; L167-T193 HydrophobicContact CD2-CG2 4.28Å; L167-V196 HydrophobicContact CD1-CG2 4Å; L167-V196 HydrophobicContact CD2-CG2 4.18Å; L167-V196 HydrophobicContact CG-CG2 4.19Å
168H80.6Confident81Confident75 Ų7546.3 Ų46.335%0.34726%0.261SS..PPolyproline II helixtrans-98.8121.2170.7-168.268.2000110.4I7 C190 T191I7-H168 WeakPolarHBondContact CG2-NE2 3.48Å; H168-C190 PolarHBondContact O-N 2.96Å; H168-T191 WeakPolarHBondContact CB-OG1 3.28Å; H168-T191 PolarHBondContact N-OG1 3.07Å; H168-T191 VanDerWaalsContact N-OG1 3.16Å
169F80.9Confident80Confident12 Ų1242 Ų425%0.05324%0.238CC..BIsolated β-bridgetrans-94.1118179.9-58.6-88.5000109.9I10 F13 F95 L164 L167 L185 L188I10-F169 HydrophobicContact CD1-CB 3.95Å; I10-F169 WeakPolarHBondContact CD1-O 3.38Å; F13-F169 HydrophobicContact CZ-CD1 4.39Å; F13-F169 HydrophobicContact CZ-CG 4.43Å; F95-F169 AromaticContact CE2-CD2 3.71Å; F95-F169 HydrophobicContact CE2-CD2 3.71Å; F95-F169 AromaticContact CE2-CE2 3.58Å; F95-F169 HydrophobicContact CE2-CE2 3.58Å; F95-F169 HydrophobicContact CE2-CZ 4.43Å; F95-F169 HydrophobicContact CZ-CD2 4.43Å; F95-F169 HydrophobicContact CZ-CE2 4.09Å; L164-F169 HydrophobicContact CD1-CZ 3.82Å; L164-F169 HydrophobicContact CG-CZ 4.36Å; L167-F169 HydrophobicContact CB-CE2 4.19Å; L167-F169 HydrophobicContact CB-CZ 4.14Å; F169-L185 HydrophobicContact CE1-CB 4.31Å; F169-L185 WeakPolarHBondContact CE1-O 3.34Å; F169-L188 HydrophobicContact CD1-CB 4.19Å
170C76.2Confident79.3Confident73 Ų7339.5 Ų39.549%0.49322%0.221SC..  trans-136.14.6176.292.30000113.7L188 C190C170-L188 PolarHBondContact N-O 3.41Å; C170-C190 WeakPolarHBondContact CA-SG 3.39Å; C170-C190 HydrophobicContact CB-CB 3.86Å; C170-C190 WeakPolarHBondContact CB-SG 3.46Å; C170-C190 PolarHBondContact N-SG 3.08Å; C170-C190 WeakPolarHBondContact SG-CB 3.49Å; C170-C190 CovalentContact SG-SG 1.99Å; C170-C190 PolarHBondContact SG-SG 3.48Å
171G69.3Low78.7Confident31 Ų3140.5 Ų40.532%0.3223%0.226SC..SBendtrans-71.6-173.5173.500000113.3I10 N173 L188I10-G171 WeakPolarHBondContact CD1-O 3.35Å; G171-N173 PolarHBondContact O-N 3Å; G171-L188 PolarHBondContact N-O 2.98Å; G171-L188 VanDerWaalsContact N-O 3.1Å
172S68.4Low78Confident76 Ų7639.8 Ų39.853%0.53122%0.223SC..  trans-55.613217058.30000109V174 L188S172-V174 PolarHBondContact O-N 3.4Å; S172-L188 WeakPolarHBondContact O-CD2 3.49Å
173N78.1Confident77.3Confident44 Ų4441 Ų4124%0.23522%0.224CC..SBendtrans-70.533.9175.762.6-26.3000112.8I10 Y12 F13 V14 G171I10-N173 HydrophobicContact CG2-CB 4.08Å; Y12-N173 WeakPolarHBondContact CE2-ND2 3.47Å; Y12-N173 VanDerWaalsContact CZ-ND2 3.3Å; Y12-N173 WeakPolarHBondContact O-CB 3.37Å; Y12-N173 PolarHBondContact OH-ND2 3.03Å; F13-N173 CarbonylContact C-O 3.45Å; F13-N173 VanDerWaalsContact CA-O 3.31Å; F13-N173 WeakPolarHBondContact CA-O 3.46Å; V14-N173 PolarHBondContact N-O 2.91Å; G171-N173 PolarHBondContact O-N 3Å
174V76.7Confident76.7Confident42 Ų4242.8 Ų42.826%0.25523%0.231SC..EExtended strand (participates in β ladder)trans-119.1117.7-169.7179.70000109.9V14 L16 S172V14-V174 HydrophobicContact CB-CG2 4.39Å; L16-V174 HydrophobicContact CD1-CG1 3.51Å; S172-V174 PolarHBondContact O-N 3.4Å
175I76.9Confident76.2Confident1 Ų142.8 Ų42.81%0.00523%0.231CC..EExtended strand (participates in β ladder)trans-102.9118.5174.2-65.8174.2000107.6F13 V14 L15 L16 H177 Q184 L185 L188F13-I175 HydrophobicContact CB-CD1 3.68Å; F13-I175 HydrophobicContact CB-CG1 4.18Å; F13-I175 HydrophobicContact CD1-CD1 3.93Å; F13-I175 HydrophobicContact CD1-CG1 4.16Å; F13-I175 HydrophobicContact CD2-CD1 4.18Å; F13-I175 HydrophobicContact CG-CD1 3.69Å; F13-I175 HydrophobicContact CG-CG1 4.31Å; V14-I175 PolarHBondContact O-N 3.5Å; L15-I175 HydrophobicContact CD2-CB 4.04Å; L15-I175 HydrophobicContact CD2-CD1 4.35Å; L15-I175 HydrophobicContact CD2-CG2 3.85Å; L16-I175 PolarHBondContact N-O 3.01Å; I175-H177 HydrophobicContact CG2-CB 3.8Å; I175-H177 PolarHBondContact O-N 3.4Å; I175-Q184 HydrophobicContact CG2-CB 3.96Å; I175-Q184 HydrophobicContact CG2-CG 4.45Å; I175-L185 HydrophobicContact CD1-CD2 3.82Å; I175-L188 HydrophobicContact CG1-CD1 3.69Å
176R70.4Confident75.8Confident131 Ų13138.7 Ų38.749%0.49421%0.21SC..SBendtrans-81.943.9-178.9-65.3-176.6176.7-157.3-2.4112.5S268 R273R176-S268 VanDerWaalsContact CD-OG 3.23Å; R176-S268 WeakPolarHBondContact CD-OG 3.5Å; R176-S268 PolarHBondContact NH1-OG 3.2Å; R176-R273 PolarHBondContact O-NE 3.45Å; R176-R273 VanDerWaalsContact O-NE 3.15Å
177H71.4Confident75.4Confident9 Ų937.5 Ų37.54%0.04221%0.207CC..SBendtrans-146.1163.2-176-141.9-93.1000109.8L15 G17 I175 F179 Q184 S276L15-H177 CarbonylContact C-O 3.6Å; G17-H177 PolarHBondContact N-O 3.33Å; I175-H177 HydrophobicContact CG2-CB 3.8Å; I175-H177 PolarHBondContact O-N 3.4Å; H177-F179 AromaticContact CE1-CD1 3.62Å; H177-F179 AromaticContact CE1-CE1 3.1Å; H177-F179 WeakPolarHBondContact CE1-CE1 3.46Å; H177-F179 AromaticContact CE1-CZ 3.61Å; H177-F179 AromaticContact ND1-CD1 3.31Å; H177-F179 VanDerWaalsContact ND1-CD1 3.31Å; H177-F179 WeakPolarHBondContact ND1-CD1 3.19Å; H177-F179 AromaticContact ND1-CE1 3.28Å; H177-F179 VanDerWaalsContact ND1-CE1 3.28Å; H177-F179 WeakPolarHBondContact ND1-CE1 3.41Å; H177-F179 AromaticContact ND1-CG 3.95Å; H177-F179 AromaticContact ND1-CZ 3.8Å; H177-Q184 HydrophobicContact CB-CG 4.24Å; H177-S276 WeakPolarHBondContact CE1-CB 3.37Å; H177-S276 PolarHBondContact CE1-OG 3.28Å; H177-S276 WeakPolarHBondContact NE2-CB 3.29Å; H177-S276 PolarHBondContact NE2-OG 3.07Å
178F71.1Confident75Confident2 Ų237 Ų371%0.00921%0.205CC..SBendtrans-89.6-6.4179.665.1-93.7000113.9F18 M82 S276 V277 T280 V281F18-F178 HydrophobicContact CE2-CD1 4.09Å; M82-F178 HydrophobicContact CB-CD2 4.13Å; M82-F178 HydrophobicContact CG-CB 4.07Å; M82-F178 HydrophobicContact CG-CD2 3.99Å; M82-F178 HydrophobicContact CG-CG 4.32Å; M82-F178 HydrophobicContact SD-CB 4.1Å; M82-F178 HydrophobicContact SD-CD2 3.34Å; M82-F178 WeakPolarHBondContact SD-CD2 3.48Å; M82-F178 HydrophobicContact SD-CE2 3.76Å; M82-F178 HydrophobicContact SD-CG 3.76Å; F178-S276 VanDerWaalsContact CE1-OG 3.26Å; F178-S276 WeakPolarHBondContact CE1-OG 3.41Å; F178-V277 HydrophobicContact CD1-CG2 4.41Å; F178-V277 HydrophobicContact CE1-CG2 3.74Å; F178-V277 HydrophobicContact CZ-CG2 4.07Å; F178-T280 VanDerWaalsContact CZ-OG1 3.29Å; F178-T280 WeakPolarHBondContact CZ-OG1 3.33Å; F178-V281 HydrophobicContact CE2-CG2 4.49Å
179F73.1Confident75.1Confident1 Ų134.4 Ų34.40%0.00420%0.195CC..SBendtrans-141.7168.5173.769.5-92.6000110.2F105 H177 D181 T280F105-F179 HydrophobicContact CE1-CE2 4.39Å; F105-F179 HydrophobicContact CE2-CE2 4.21Å; F105-F179 HydrophobicContact CE2-CZ 4.3Å; F105-F179 HydrophobicContact CZ-CE2 4.08Å; F105-F179 HydrophobicContact CZ-CZ 4.12Å; H177-F179 AromaticContact CE1-CD1 3.62Å; H177-F179 AromaticContact CE1-CE1 3.1Å; H177-F179 WeakPolarHBondContact CE1-CE1 3.46Å; H177-F179 AromaticContact CE1-CZ 3.61Å; H177-F179 AromaticContact ND1-CD1 3.31Å; H177-F179 VanDerWaalsContact ND1-CD1 3.31Å; H177-F179 WeakPolarHBondContact ND1-CD1 3.19Å; H177-F179 AromaticContact ND1-CE1 3.28Å; H177-F179 VanDerWaalsContact ND1-CE1 3.28Å; H177-F179 WeakPolarHBondContact ND1-CE1 3.41Å; H177-F179 AromaticContact ND1-CG 3.95Å; H177-F179 AromaticContact ND1-CZ 3.8Å; F179-D181 HydrophobicContact CD2-CB 4.17Å; F179-D181 HydrophobicContact CE2-CB 3.59Å; F179-D181 HydrophobicContact CZ-CB 4.13Å; F179-D181 PolarHBondContact O-N 3.27Å; F179-D181 VanDerWaalsContact O-N 3.14Å; F179-T280 HydrophobicContact CE1-CG2 3.52Å; F179-T280 HydrophobicContact CZ-CG2 3.67Å
180C77.1Confident75.1Confident0 Ų037 Ų370%021%0.214CC..  trans-75.297.5175.9-72.70000112.4C98C98-C180 WeakPolarHBondContact CA-SG 3.34Å; C98-C180 HydrophobicContact CB-CB 4.03Å; C98-C180 WeakPolarHBondContact CB-SG 3.3Å; C98-C180 WeakPolarHBondContact SG-CB 3.44Å; C98-C180 CovalentContact SG-SG 2.01Å; C98-C180 PolarHBondContact SG-SG 3.38Å
181D75.1Confident75.4Confident27 Ų2736.7 Ų36.714%0.14421%0.209CC..  trans-101141.8176.2-169.326.5000111.5F179 P183 Q184 L185F179-D181 HydrophobicContact CD2-CB 4.17Å; F179-D181 HydrophobicContact CE2-CB 3.59Å; F179-D181 HydrophobicContact CZ-CB 4.13Å; F179-D181 PolarHBondContact O-N 3.27Å; F179-D181 VanDerWaalsContact O-N 3.14Å; D181-P183 WeakPolarHBondContact OD1-CD 2.95Å; D181-P183 WeakPolarHBondContact OD2-CD 2.93Å; D181-Q184 HydrophobicContact CB-CG 4.18Å; D181-Q184 PolarHBondContact O-N 2.93Å; D181-L185 PolarHBondContact O-N 2.68Å
182M76.6Confident76Confident4 Ų441 Ų412%0.0223%0.226CC..Hα-helixtrans-60-51.9-174.1-100.9-73-163.200113.7Y102 Q160 L164 Q184 L185 L186Y102-M182 HydrophobicContact CD1-CE 3.92Å; Y102-M182 HydrophobicContact CD1-CG 4.42Å; Y102-M182 HydrophobicContact CD2-CG 3.77Å; Y102-M182 HydrophobicContact CE1-CE 3.23Å; Y102-M182 HydrophobicContact CE1-CG 3.85Å; Y102-M182 HydrophobicContact CE1-SD 4.35Å; Y102-M182 HydrophobicContact CE2-CB 3.85Å; Y102-M182 HydrophobicContact CE2-CE 4.29Å; Y102-M182 HydrophobicContact CE2-CG 3.09Å; Y102-M182 HydrophobicContact CE2-SD 4.48Å; Y102-M182 HydrophobicContact CG-CG 4.38Å; Y102-M182 VanDerWaalsContact CZ-CE 3.45Å; Y102-M182 VanDerWaalsContact OH-CG 3.26Å; Y102-M182 WeakPolarHBondContact OH-CG 3.38Å; Q160-M182 HydrophobicContact CB-CE 4.09Å; L164-M182 HydrophobicContact CB-CE 3.89Å; L164-M182 HydrophobicContact CD1-CE 4.13Å; L164-M182 HydrophobicContact CD1-SD 3.78Å; L164-M182 HydrophobicContact CD2-CE 3.72Å; L164-M182 HydrophobicContact CD2-SD 4.06Å; L164-M182 HydrophobicContact CG-CE 4.13Å; L164-M182 HydrophobicContact CG-SD 4.39Å; M182-Q184 PolarHBondContact O-N 2.8Å; M182-Q184 VanDerWaalsContact O-N 3.15Å; M182-L185 WeakPolarHBondContact O-CB 3.32Å; M182-L185 PolarHBondContact O-N 3.39Å; M182-L186 WeakPolarHBondContact O-CG 3.2Å; M182-L186 PolarHBondContact O-N 3.31Å
183P73.1Confident76.8Confident61 Ų6138.4 Ų38.440%0.39621%0.206SC..Hα-helixtrans-53.4-37.1177.4-2735000113D181 L186 I187D181-P183 WeakPolarHBondContact OD1-CD 2.95Å; D181-P183 WeakPolarHBondContact OD2-CD 2.93Å; P183-L186 PolarHBondContact O-N 3.26Å; P183-I187 WeakPolarHBondContact O-CG1 3.3Å; P183-I187 PolarHBondContact O-N 3.23Å
184Q74.2Confident77.1Confident43 Ų4342.6 Ų42.620%0.20122%0.223CC..Hα-helixtrans-71.2-37.4178.6-58.4-64.7-32.900112.1I175 H177 D181 M182 L188I175-Q184 HydrophobicContact CG2-CB 3.96Å; I175-Q184 HydrophobicContact CG2-CG 4.45Å; H177-Q184 HydrophobicContact CB-CG 4.24Å; D181-Q184 HydrophobicContact CB-CG 4.18Å; D181-Q184 PolarHBondContact O-N 2.93Å; M182-Q184 PolarHBondContact O-N 2.8Å; M182-Q184 VanDerWaalsContact O-N 3.15Å; Q184-L188 WeakPolarHBondContact O-CG 3.49Å
185L76.6Confident77.6Confident0 Ų046.9 Ų46.90%024%0.238CC..Hα-helixtrans-65.9-41.7174.4-71.9169.2000111.7F13 L164 F169 I175 D181 M182 I187 L188F13-L185 HydrophobicContact CE1-CD2 4.31Å; F13-L185 HydrophobicContact CE2-CD2 4.02Å; F13-L185 HydrophobicContact CZ-CD2 3.88Å; L164-L185 HydrophobicContact CD1-CB 4.39Å; L164-L185 HydrophobicContact CD2-CD1 4.05Å; F169-L185 HydrophobicContact CE1-CB 4.31Å; F169-L185 WeakPolarHBondContact CE1-O 3.34Å; I175-L185 HydrophobicContact CD1-CD2 3.82Å; D181-L185 PolarHBondContact O-N 2.68Å; M182-L185 WeakPolarHBondContact O-CB 3.32Å; M182-L185 PolarHBondContact O-N 3.39Å; L185-I187 VanDerWaalsContact C-N 3.28Å; L185-I187 PolarHBondContact O-N 2.95Å; L185-L188 WeakPolarHBondContact O-CB 3.32Å; L185-L188 PolarHBondContact O-N 3.28Å
186L76.8Confident78Confident11 Ų1147 Ų476%0.05824%0.239CC..Hα-helixtrans-64.2-31.9-178.6-63.3178.2000112.7L164 L167 M182 P183 L188 S189 T193 V196 Q197L164-L186 HydrophobicContact CD1-CD2 4.4Å; L167-L186 HydrophobicContact CD1-CD2 3.43Å; L167-L186 VanDerWaalsContact CD1-CD2 3.43Å; M182-L186 WeakPolarHBondContact O-CG 3.2Å; M182-L186 PolarHBondContact O-N 3.31Å; P183-L186 PolarHBondContact O-N 3.26Å; L186-L188 PolarHBondContact O-N 3.45Å; L186-S189 WeakPolarHBondContact O-CB 3.36Å; L186-S189 PolarHBondContact O-N 2.84Å; L186-T193 HydrophobicContact CB-CG2 4.15Å; L186-T193 HydrophobicContact CD2-CG2 4.03Å; L186-T193 WeakPolarHBondContact O-CG2 3.45Å; L186-V196 HydrophobicContact CD1-CG1 4.34Å; L186-V196 HydrophobicContact CD2-CB 3.89Å; L186-V196 HydrophobicContact CD2-CG1 3.73Å; L186-Q197 HydrophobicContact CD1-CG 3.6Å
187I76.6Confident78.6Confident126 Ų12645.4 Ų45.465%0.64624%0.237SC*.Hα-helixtrans-65.5-24.6175.2-66.2164.3000112P183 L185P183-I187 WeakPolarHBondContact O-CG1 3.3Å; P183-I187 PolarHBondContact O-N 3.23Å; L185-I187 VanDerWaalsContact C-N 3.28Å; L185-I187 PolarHBondContact O-N 2.95Å
188L76.3Confident79.2Confident9 Ų948 Ų485%0.04725%0.253CS..THydrogen-bonded Turntrans-89.5-8.7-177.8-59.2178.7000113.6F13 F169 C170 G171 S172 I175 Q184 L185 L186F13-L188 HydrophobicContact CD1-CD1 3.96Å; F13-L188 HydrophobicContact CE1-CD1 3.87Å; F169-L188 HydrophobicContact CD1-CB 4.19Å; C170-L188 PolarHBondContact N-O 3.41Å; G171-L188 PolarHBondContact N-O 2.98Å; G171-L188 VanDerWaalsContact N-O 3.1Å; S172-L188 WeakPolarHBondContact O-CD2 3.49Å; I175-L188 HydrophobicContact CG1-CD1 3.69Å; Q184-L188 WeakPolarHBondContact O-CG 3.49Å; L185-L188 WeakPolarHBondContact O-CB 3.32Å; L185-L188 PolarHBondContact O-N 3.28Å; L186-L188 PolarHBondContact O-N 3.45Å
189S81.8Confident79.9Confident20 Ų2049.6 Ų49.614%0.1426%0.261CS..BIsolated β-bridgetrans-73.4141.5177.9177.40000111.4L186 T191 T193L186-S189 WeakPolarHBondContact O-CB 3.36Å; L186-S189 PolarHBondContact O-N 2.84Å; S189-T191 PolarHBondContact OG-N 2.97Å; S189-T191 VanDerWaalsContact OG-N 3.17Å; S189-T191 PolarHBondContact OG-O 2.85Å; S189-T193 VanDerWaalsContact CB-CG2 3.4Å
190C81.7Confident80.4Confident67 Ų6750.7 Ų50.745%0.45327%0.268SS..SBendtrans-101-9.8171.7-64.80000113H168 C170H168-C190 PolarHBondContact O-N 2.96Å; C170-C190 WeakPolarHBondContact CA-SG 3.39Å; C170-C190 HydrophobicContact CB-CB 3.86Å; C170-C190 WeakPolarHBondContact CB-SG 3.46Å; C170-C190 PolarHBondContact N-SG 3.08Å; C170-C190 WeakPolarHBondContact SG-CB 3.49Å; C170-C190 CovalentContact SG-SG 1.99Å; C170-C190 PolarHBondContact SG-SG 3.48Å
191T82.9Confident80.6Confident65 Ų6553.6 Ų53.640%0.39929%0.292SS..SBendtrans-88.1150.6167.4-47.30000109.4L167 H168 S189 T193L167-T191 HydrophobicContact CD2-CG2 4.39Å; H168-T191 WeakPolarHBondContact CB-OG1 3.28Å; H168-T191 PolarHBondContact N-OG1 3.07Å; H168-T191 VanDerWaalsContact N-OG1 3.16Å; S189-T191 PolarHBondContact OG-N 2.97Å; S189-T191 VanDerWaalsContact OG-N 3.17Å; S189-T191 PolarHBondContact OG-O 2.85Å; T191-T193 WeakPolarHBondContact O-CG2 3.35Å; T191-T193 PolarHBondContact O-N 3.25Å
192D81.5Confident81.1Confident123 Ų12356.4 Ų56.466%0.65831%0.31SS*.  trans-52.9126.5173.9179.327.7000111F194D192-F194 WeakPolarHBondContact OD1-CB 3.3Å; D192-F194 PolarHBondContact OD1-N 3.24Å; D192-F194 VanDerWaalsContact OD1-N 3.09Å
193T85.7Confident81.5Confident20 Ų2057.8 Ų57.812%0.12332%0.317CS..  trans-101.2-2-176.457.40000113.1L167 L186 S189 T191 F195 V196 Q197L167-T193 HydrophobicContact CD1-CG2 3.97Å; L167-T193 HydrophobicContact CD2-CG2 4.28Å; L186-T193 HydrophobicContact CB-CG2 4.15Å; L186-T193 HydrophobicContact CD2-CG2 4.03Å; L186-T193 WeakPolarHBondContact O-CG2 3.45Å; S189-T193 VanDerWaalsContact CB-CG2 3.4Å; T191-T193 WeakPolarHBondContact O-CG2 3.35Å; T191-T193 PolarHBondContact O-N 3.25Å; T193-F195 VanDerWaalsContact C-N 3.28Å; T193-F195 PolarHBondContact O-N 3.43Å; T193-V196 PolarHBondContact O-N 2.87Å; T193-Q197 WeakPolarHBondContact O-CG 3.36Å; T193-Q197 PolarHBondContact O-N 3.19Å; T193-Q197 PolarHBondContact OG1-NE2 2.99Å
194F84.6Confident81.8Confident133 Ų13358.9 Ų58.958%0.58332%0.323SS*.Hα-helixtrans-52.2-45.5-175.3-179.1-102.5000112.6D192 V196 Q197 V198D192-F194 WeakPolarHBondContact OD1-CB 3.3Å; D192-F194 PolarHBondContact OD1-N 3.24Å; D192-F194 VanDerWaalsContact OD1-N 3.09Å; F194-V196 PolarHBondContact O-N 2.83Å; F194-Q197 PolarHBondContact O-N 3.45Å; F194-V198 HydrophobicContact CD1-CG2 4.23Å; F194-V198 HydrophobicContact CD2-CG2 4.19Å; F194-V198 HydrophobicContact CE1-CG2 3.86Å; F194-V198 HydrophobicContact CE2-CG2 3.81Å; F194-V198 HydrophobicContact CG-CG2 4.4Å; F194-V198 HydrophobicContact CZ-CG2 3.63Å; F194-V198 WeakPolarHBondContact O-CB 3.39Å; F194-V198 VanDerWaalsContact O-CG2 3.29Å; F194-V198 WeakPolarHBondContact O-CG2 3.43Å; F194-V198 PolarHBondContact O-N 3.07Å
195F85.7Confident82.1Confident132 Ų13262.7 Ų62.758%0.57934%0.342SS*.Hα-helixtrans-59.4-47.1177.9178.9-99000112.5A163 T193 V198 M199A163-F195 HydrophobicContact CB-CD1 4.41Å; A163-F195 HydrophobicContact CB-CE1 4.15Å; T193-F195 VanDerWaalsContact C-N 3.28Å; T193-F195 PolarHBondContact O-N 3.43Å; F195-V198 PolarHBondContact O-N 2.89Å; F195-M199 HydrophobicContact CE1-SD 4.3Å; F195-M199 VanDerWaalsContact O-CB 3.27Å; F195-M199 WeakPolarHBondContact O-CB 3.5Å; F195-M199 PolarHBondContact O-N 3.42Å
196V85.4Confident82.4Confident4 Ų469 Ų692%0.02437%0.37CS..Hα-helixtrans-68.7-37.8-178.9-170.60000111A163 L167 L186 T193 F194 M199 T200A163-V196 HydrophobicContact CB-CG1 4.47Å; A163-V196 HydrophobicContact CB-CG2 3.94Å; L167-V196 HydrophobicContact CD1-CG2 4Å; L167-V196 HydrophobicContact CD2-CG2 4.18Å; L167-V196 HydrophobicContact CG-CG2 4.19Å; L186-V196 HydrophobicContact CD1-CG1 4.34Å; L186-V196 HydrophobicContact CD2-CB 3.89Å; L186-V196 HydrophobicContact CD2-CG1 3.73Å; T193-V196 PolarHBondContact O-N 2.87Å; F194-V196 PolarHBondContact O-N 2.83Å; V196-M199 HydrophobicContact CG1-CE 4.46Å; V196-T200 VanDerWaalsContact O-CB 3.25Å; V196-T200 WeakPolarHBondContact O-CB 3.24Å; V196-T200 PolarHBondContact O-N 3.03Å; V196-T200 PolarHBondContact O-OG1 2.95Å
197Q83Confident82.7Confident96 Ų9669.9 Ų69.945%0.44937%0.373SS..Hα-helixtrans-62-50.4174.4-70.9-179.3-700111.5L186 T193 F194 T200 A201L186-Q197 HydrophobicContact CD1-CG 3.6Å; T193-Q197 WeakPolarHBondContact O-CG 3.36Å; T193-Q197 PolarHBondContact O-N 3.19Å; T193-Q197 PolarHBondContact OG1-NE2 2.99Å; F194-Q197 PolarHBondContact O-N 3.45Å; Q197-T200 PolarHBondContact O-N 3.37Å; Q197-A201 WeakPolarHBondContact O-CB 3.14Å; Q197-A201 PolarHBondContact O-N 3.41Å
198V84.3Confident82.9Confident64 Ų6465 Ų6539%0.38835%0.354SS..Hα-helixtrans-63.4-46.4179.4171.70000110.8F194 F195 T200 A201 V202F194-V198 HydrophobicContact CD1-CG2 4.23Å; F194-V198 HydrophobicContact CD2-CG2 4.19Å; F194-V198 HydrophobicContact CE1-CG2 3.86Å; F194-V198 HydrophobicContact CE2-CG2 3.81Å; F194-V198 HydrophobicContact CG-CG2 4.4Å; F194-V198 HydrophobicContact CZ-CG2 3.63Å; F194-V198 WeakPolarHBondContact O-CB 3.39Å; F194-V198 VanDerWaalsContact O-CG2 3.29Å; F194-V198 WeakPolarHBondContact O-CG2 3.43Å; F194-V198 PolarHBondContact O-N 3.07Å; F195-V198 PolarHBondContact O-N 2.89Å; V198-T200 VanDerWaalsContact C-N 3.33Å; V198-T200 PolarHBondContact O-N 3.32Å; V198-A201 PolarHBondContact O-N 3.36Å; V198-V202 HydrophobicContact CG1-CG2 4.24Å; V198-V202 WeakPolarHBondContact O-CB 3.06Å; V198-V202 VanDerWaalsContact O-CG2 3.27Å; V198-V202 WeakPolarHBondContact O-CG2 3.28Å; V198-V202 PolarHBondContact O-N 3.49Å
199M87Confident83.2Confident35 Ų3568.3 Ų68.317%0.17237%0.371CS..Hα-helixtrans-59.2-45.5177.3-177.6-174.464.900111.4Q160 A163 F195 V196 V202 L203Q160-M199 HydrophobicContact CB-CE 4.42Å; Q160-M199 HydrophobicContact CG-CE 4.2Å; A163-M199 HydrophobicContact CB-CE 3.39Å; A163-M199 HydrophobicContact CB-SD 4.22Å; F195-M199 HydrophobicContact CE1-SD 4.3Å; F195-M199 VanDerWaalsContact O-CB 3.27Å; F195-M199 WeakPolarHBondContact O-CB 3.5Å; F195-M199 PolarHBondContact O-N 3.42Å; V196-M199 HydrophobicContact CG1-CE 4.46Å; M199-V202 PolarHBondContact O-N 3.12Å; M199-L203 HydrophobicContact CG-CD1 3.96Å; M199-L203 HydrophobicContact CG-CG 4.49Å; M199-L203 WeakPolarHBondContact O-CB 3.22Å; M199-L203 VanDerWaalsContact O-CG 3.28Å; M199-L203 WeakPolarHBondContact O-CG 3.41Å; M199-L203 PolarHBondContact O-N 3.09Å
200T82.7Confident83.5Confident25 Ų2569.2 Ų69.215%0.15338%0.38CS..Hα-helixtrans-64.2-43178.6-580000111.4V196 Q197 V198 T204V196-T200 VanDerWaalsContact O-CB 3.25Å; V196-T200 WeakPolarHBondContact O-CB 3.24Å; V196-T200 PolarHBondContact O-N 3.03Å; V196-T200 PolarHBondContact O-OG1 2.95Å; Q197-T200 PolarHBondContact O-N 3.37Å; V198-T200 VanDerWaalsContact C-N 3.33Å; V198-T200 PolarHBondContact O-N 3.32Å; T200-T204 VanDerWaalsContact O-CB 3.28Å; T200-T204 WeakPolarHBondContact O-CB 3.49Å; T200-T204 PolarHBondContact O-N 3.3Å; T200-T204 PolarHBondContact O-OG1 3.02Å
201A81.1Confident83.8Confident60 Ų6066.5 Ų66.550%0.49636%0.361SS..Hα-helixtrans-62.7-45.8176.700000111.8Q197 V198 T204 M205Q197-A201 WeakPolarHBondContact O-CB 3.14Å; Q197-A201 PolarHBondContact O-N 3.41Å; V198-A201 PolarHBondContact O-N 3.36Å; A201-T204 PolarHBondContact O-N 3.46Å; A201-M205 WeakPolarHBondContact O-CB 3.1Å; A201-M205 PolarHBondContact O-N 3.33Å
202V85.7Confident84Confident87 Ų8764.7 Ų64.753%0.52735%0.353SS..Hα-helixtrans-62.5-47.4178.2169.30000111.1V198 M199 M205 F206V198-V202 HydrophobicContact CG1-CG2 4.24Å; V198-V202 WeakPolarHBondContact O-CB 3.06Å; V198-V202 VanDerWaalsContact O-CG2 3.27Å; V198-V202 WeakPolarHBondContact O-CG2 3.28Å; V198-V202 PolarHBondContact O-N 3.49Å; M199-V202 PolarHBondContact O-N 3.12Å; V202-M205 PolarHBondContact O-N 3.47Å; V202-F206 WeakPolarHBondContact O-CB 3.28Å; V202-F206 PolarHBondContact O-N 2.94Å
203L85.6Confident84.4Confident32 Ų3263.6 Ų63.617%0.16835%0.347CS..Hα-helixtrans-62.7-47.5178.6-69.9170.4000110.9A156 Q160 M199 M205 F206 F207A156-L203 HydrophobicContact CB-CD2 4.47Å; Q160-L203 HydrophobicContact CG-CD1 3.73Å; M199-L203 HydrophobicContact CG-CD1 3.96Å; M199-L203 HydrophobicContact CG-CG 4.49Å; M199-L203 WeakPolarHBondContact O-CB 3.22Å; M199-L203 VanDerWaalsContact O-CG 3.28Å; M199-L203 WeakPolarHBondContact O-CG 3.41Å; M199-L203 PolarHBondContact O-N 3.09Å; L203-M205 PolarHBondContact O-N 3.48Å; L203-F206 PolarHBondContact O-N 3.39Å; L203-F207 HydrophobicContact CB-CD2 4.41Å; L203-F207 HydrophobicContact CD2-CE2 3.92Å; L203-F207 WeakPolarHBondContact O-CB 3.4Å; L203-F207 WeakPolarHBondContact O-CD2 3.38Å; L203-F207 PolarHBondContact O-N 3.47Å
204T78.4Confident84.6Confident84 Ų8465.7 Ų65.752%0.51536%0.359SS..Hα-helixtrans-61.9-44.4179.8-54.90000111.4T200 A201 G208T200-T204 VanDerWaalsContact O-CB 3.28Å; T200-T204 WeakPolarHBondContact O-CB 3.49Å; T200-T204 PolarHBondContact O-N 3.3Å; T200-T204 PolarHBondContact O-OG1 3.02Å; A201-T204 PolarHBondContact O-N 3.46Å; T204-G208 WeakPolarHBondContact O-CA 3.43Å; T204-G208 PolarHBondContact O-N 3.4Å
205M80.5Confident85Confident123 Ų12359.5 Ų59.561%0.60633%0.332SS*.Hα-helixtrans-66.4-45.2178.3-171.8176.4-175.900111.1A201 V202 L203 I209A201-M205 WeakPolarHBondContact O-CB 3.1Å; A201-M205 PolarHBondContact O-N 3.33Å; V202-M205 PolarHBondContact O-N 3.47Å; L203-M205 PolarHBondContact O-N 3.48Å; M205-I209 HydrophobicContact CE-CD1 3.44Å; M205-I209 VanDerWaalsContact CE-CD1 3.44Å; M205-I209 HydrophobicContact CG-CD1 3.37Å; M205-I209 HydrophobicContact CG-CG1 4.01Å; M205-I209 WeakPolarHBondContact O-CA 3.37Å; M205-I209 WeakPolarHBondContact O-CB 3.29Å; M205-I209 VanDerWaalsContact O-CG1 3.28Å; M205-I209 WeakPolarHBondContact O-CG1 3.37Å; M205-I209 PolarHBondContact O-N 3.15Å; M205-I209 HydrophobicContact SD-CD1 4.24Å
206F84.3Confident85.2Confident133 Ų13359.6 Ų59.658%0.58334%0.336SS*.Hα-helixtrans-62.3-54.2179.6-177.7-99.3000111.1V202 L203 A210V202-F206 WeakPolarHBondContact O-CB 3.28Å; V202-F206 PolarHBondContact O-N 2.94Å; L203-F206 PolarHBondContact O-N 3.39Å; F206-A210 WeakPolarHBondContact O-CB 3.49Å; F206-A210 PolarHBondContact O-N 3.46Å
207F82.8Confident85.6Confident29 Ų2964 Ų6413%0.12736%0.359CS..Hα-helixtrans-67.5-43.2-179.4-73.6-65000112.4L110 T152 A156 L203 S211L110-F207 HydrophobicContact CD2-CB 3.86Å; L110-F207 HydrophobicContact CD2-CD2 3.76Å; L110-F207 HydrophobicContact CD2-CG 3.9Å; T152-F207 HydrophobicContact CG2-CD1 4.15Å; T152-F207 HydrophobicContact CG2-CE1 3.15Å; T152-F207 HydrophobicContact CG2-CZ 3.47Å; T152-F207 VanDerWaalsContact CG2-CZ 3.47Å; A156-F207 HydrophobicContact CB-CE2 3.83Å; A156-F207 HydrophobicContact CB-CZ 4.33Å; L203-F207 HydrophobicContact CB-CD2 4.41Å; L203-F207 HydrophobicContact CD2-CE2 3.92Å; L203-F207 WeakPolarHBondContact O-CB 3.4Å; L203-F207 WeakPolarHBondContact O-CD2 3.38Å; L203-F207 PolarHBondContact O-N 3.47Å; F207-S211 WeakPolarHBondContact O-CB 3.5Å; F207-S211 PolarHBondContact O-N 2.87Å; F207-S211 VanDerWaalsContact O-N 3.12Å; F207-S211 PolarHBondContact O-OG 3.45Å
208G80.2Confident86.1Confident24 Ų2459.9 Ų59.925%0.24734%0.341CS..Hα-helixtrans-65.8-53.8179.600000112.4T204 A212 Y253T204-G208 WeakPolarHBondContact O-CA 3.43Å; T204-G208 PolarHBondContact O-N 3.4Å; G208-A212 VanDerWaalsContact O-CB 3.23Å; G208-A212 WeakPolarHBondContact O-CB 3.34Å; G208-A212 PolarHBondContact O-N 2.85Å; G208-Y253 WeakPolarHBondContact O-CE1 3.47Å
209I82.7Confident86.4Confident79 Ų7958 Ų5841%0.40533%0.326SS..Hα-helixtrans-70.7-44-177.5-61.3-174.9000111M205 S211 A212 L213M205-I209 HydrophobicContact CE-CD1 3.44Å; M205-I209 VanDerWaalsContact CE-CD1 3.44Å; M205-I209 HydrophobicContact CG-CD1 3.37Å; M205-I209 HydrophobicContact CG-CG1 4.01Å; M205-I209 WeakPolarHBondContact O-CA 3.37Å; M205-I209 WeakPolarHBondContact O-CB 3.29Å; M205-I209 VanDerWaalsContact O-CG1 3.28Å; M205-I209 WeakPolarHBondContact O-CG1 3.37Å; M205-I209 PolarHBondContact O-N 3.15Å; M205-I209 HydrophobicContact SD-CD1 4.24Å; I209-S211 VanDerWaalsContact C-N 3.34Å; I209-S211 PolarHBondContact O-N 2.95Å; I209-A212 PolarHBondContact O-N 3.37Å; I209-L213 HydrophobicContact CG2-CD1 3.74Å; I209-L213 HydrophobicContact CG2-CG 3.99Å; I209-L213 WeakPolarHBondContact O-CB 3.47Å; I209-L213 VanDerWaalsContact O-CG 3.25Å; I209-L213 WeakPolarHBondContact O-CG 3.25Å; I209-L213 PolarHBondContact O-N 2.99Å
210A87.3Confident86.6Confident38 Ų3858 Ų5831%0.31434%0.336SS..Hα-helixtrans-61.2-45.5179.900000111.1F206 L213 V214F206-A210 WeakPolarHBondContact O-CB 3.49Å; F206-A210 PolarHBondContact O-N 3.46Å; A210-L213 PolarHBondContact O-N 2.96Å; A210-V214 VanDerWaalsContact O-CG2 3.32Å; A210-V214 WeakPolarHBondContact O-CG2 3.33Å; A210-V214 PolarHBondContact O-N 3.05Å
211S89.2Confident87Confident10 Ų1063 Ų637%0.0735%0.353CS..Hα-helixtrans-62.9-46176.9-60.80000111.4T117 F207 I209 L213 V214 I215 Y253T117-S211 VanDerWaalsContact OG1-CB 3.24Å; T117-S211 WeakPolarHBondContact OG1-CB 3.33Å; T117-S211 PolarHBondContact OG1-OG 3.02Å; F207-S211 WeakPolarHBondContact O-CB 3.5Å; F207-S211 PolarHBondContact O-N 2.87Å; F207-S211 VanDerWaalsContact O-N 3.12Å; F207-S211 PolarHBondContact O-OG 3.45Å; I209-S211 VanDerWaalsContact C-N 3.34Å; I209-S211 PolarHBondContact O-N 2.95Å; S211-L213 PolarHBondContact O-N 3.48Å; S211-V214 PolarHBondContact O-N 3.38Å; S211-I215 WeakPolarHBondContact O-CB 3.49Å; S211-I215 WeakPolarHBondContact O-CD1 3.08Å; S211-I215 WeakPolarHBondContact O-CG1 3.48Å; S211-I215 PolarHBondContact O-N 2.9Å; S211-Y253 WeakPolarHBondContact CB-OH 2.95Å
212A86.9Confident87.5Confident28 Ų2860.3 Ų60.323%0.23133%0.33CS..Hα-helixtrans-59.6-43.3176.200000112.4G208 I209 I215 M216 Y253G208-A212 VanDerWaalsContact O-CB 3.23Å; G208-A212 WeakPolarHBondContact O-CB 3.34Å; G208-A212 PolarHBondContact O-N 2.85Å; I209-A212 PolarHBondContact O-N 3.37Å; A212-I215 PolarHBondContact O-N 3.19Å; A212-M216 WeakPolarHBondContact O-CB 3.21Å; A212-M216 VanDerWaalsContact O-CG 3.25Å; A212-M216 WeakPolarHBondContact O-CG 3.42Å; A212-M216 PolarHBondContact O-N 2.7Å; A212-Y253 HydrophobicContact CB-CD1 4.16Å; A212-Y253 HydrophobicContact CB-CE1 3.81Å; A212-Y253 PolarHBondContact N-OH 3.19Å
213L89.2Confident87.7Confident99 Ų9957.7 Ų57.752%0.51832%0.321SS..Hα-helixtrans-62.7-46.8177.8-74.9174.5000111.6I209 A210 S211 I215 M216 I217I209-L213 HydrophobicContact CG2-CD1 3.74Å; I209-L213 HydrophobicContact CG2-CG 3.99Å; I209-L213 WeakPolarHBondContact O-CB 3.47Å; I209-L213 VanDerWaalsContact O-CG 3.25Å; I209-L213 WeakPolarHBondContact O-CG 3.25Å; I209-L213 PolarHBondContact O-N 2.99Å; A210-L213 PolarHBondContact O-N 2.96Å; S211-L213 PolarHBondContact O-N 3.48Å; L213-I215 VanDerWaalsContact C-N 3.3Å; L213-I215 PolarHBondContact O-N 3.48Å; L213-M216 PolarHBondContact O-N 3.33Å; L213-I217 WeakPolarHBondContact O-CB 3.39Å; L213-I217 VanDerWaalsContact O-CG1 3.23Å; L213-I217 WeakPolarHBondContact O-CG1 3.29Å; L213-I217 PolarHBondContact O-N 2.68Å
214V91.2Very high87.9Confident64 Ų6460.6 Ų60.639%0.38834%0.336SS..Hα-helixtrans-61.4-42178.1174.90000110.7T117 A210 S211 S218T117-V214 HydrophobicContact CG2-CB 3.79Å; T117-V214 HydrophobicContact CG2-CG1 3.44Å; T117-V214 VanDerWaalsContact CG2-CG1 3.44Å; A210-V214 VanDerWaalsContact O-CG2 3.32Å; A210-V214 WeakPolarHBondContact O-CG2 3.33Å; A210-V214 PolarHBondContact O-N 3.05Å; S211-V214 PolarHBondContact O-N 3.38Å; V214-S218 VanDerWaalsContact O-CB 3.28Å; V214-S218 WeakPolarHBondContact O-CB 3.26Å; V214-S218 PolarHBondContact O-N 3.22Å; V214-S218 PolarHBondContact O-OG 3.41Å
215I91.2Very high88.4Confident3 Ų358.1 Ų58.12%0.01532%0.322CS..Hα-helixtrans-62.3-49.4175.8-66.6165.5000110.2M116 A120 S211 A212 L213 I217 S218 Y219 V249 Y253M116-I215 HydrophobicContact CB-CD1 4.42Å; A120-I215 HydrophobicContact CB-CB 4.32Å; A120-I215 HydrophobicContact CB-CG1 3.83Å; A120-I215 HydrophobicContact CB-CG2 4.26Å; S211-I215 WeakPolarHBondContact O-CB 3.49Å; S211-I215 WeakPolarHBondContact O-CD1 3.08Å; S211-I215 WeakPolarHBondContact O-CG1 3.48Å; S211-I215 PolarHBondContact O-N 2.9Å; A212-I215 PolarHBondContact O-N 3.19Å; L213-I215 VanDerWaalsContact C-N 3.3Å; L213-I215 PolarHBondContact O-N 3.48Å; I215-I217 PolarHBondContact O-N 3.21Å; I215-S218 WeakPolarHBondContact O-CB 3.43Å; I215-S218 PolarHBondContact O-N 2.93Å; I215-Y219 HydrophobicContact CG2-CD2 3.7Å; I215-Y219 HydrophobicContact CG2-CE2 4.01Å; I215-Y219 WeakPolarHBondContact O-CB 3.15Å; I215-Y219 VanDerWaalsContact O-CD2 3.32Å; I215-Y219 WeakPolarHBondContact O-CD2 3.28Å; I215-Y219 PolarHBondContact O-N 3.49Å; I215-V249 HydrophobicContact CD1-CG1 4.3Å; I215-V249 HydrophobicContact CD1-CG2 4.24Å; I215-V249 HydrophobicContact CG2-CG1 3.9Å; I215-V249 HydrophobicContact CG2-CG2 4.24Å; I215-Y253 HydrophobicContact CD1-CE2 3.73Å
216M90.9Very high88.8Confident134 Ų13452.8 Ų52.866%0.6630%0.296SS*.Hα-helixtrans-61.5-43.1-179.5-73.7-58.7-64.200112.5A212 L213 Y219 G220A212-M216 WeakPolarHBondContact O-CB 3.21Å; A212-M216 VanDerWaalsContact O-CG 3.25Å; A212-M216 WeakPolarHBondContact O-CG 3.42Å; A212-M216 PolarHBondContact O-N 2.7Å; L213-M216 PolarHBondContact O-N 3.33Å; M216-Y219 PolarHBondContact O-N 2.93Å; M216-G220 PolarHBondContact O-N 2.91Å
217I92.8Very high88.9Confident98 Ų9852.3 Ų52.350%0.50330%0.297SS..Hα-helixtrans-62-48.2175.5-69166.2000110.1L213 I215 Y219 G220 Y221L213-I217 WeakPolarHBondContact O-CB 3.39Å; L213-I217 VanDerWaalsContact O-CG1 3.23Å; L213-I217 WeakPolarHBondContact O-CG1 3.29Å; L213-I217 PolarHBondContact O-N 2.68Å; I215-I217 PolarHBondContact O-N 3.21Å; I217-Y219 VanDerWaalsContact C-N 3.34Å; I217-Y219 PolarHBondContact O-N 2.97Å; I217-G220 PolarHBondContact O-N 3.46Å; I217-Y221 HydrophobicContact CG2-CD2 3.87Å; I217-Y221 HydrophobicContact CG2-CE2 3.57Å; I217-Y221 VanDerWaalsContact O-CD2 3.22Å; I217-Y221 WeakPolarHBondContact O-CD2 3.1Å; I217-Y221 PolarHBondContact O-N 2.95Å
218S93.7Very high89.2Confident9 Ų958.7 Ų58.76%0.06332%0.324CS..Hα-helixtrans-57.4-47.9178.6-60.90000111.2V214 I215 G220 Y221 I222V214-S218 VanDerWaalsContact O-CB 3.28Å; V214-S218 WeakPolarHBondContact O-CB 3.26Å; V214-S218 PolarHBondContact O-N 3.22Å; V214-S218 PolarHBondContact O-OG 3.41Å; I215-S218 WeakPolarHBondContact O-CB 3.43Å; I215-S218 PolarHBondContact O-N 2.93Å; S218-G220 PolarHBondContact O-N 3.41Å; S218-Y221 PolarHBondContact O-N 2.97Å; S218-I222 VanDerWaalsContact O-CG1 3.26Å; S218-I222 WeakPolarHBondContact O-CG1 3.34Å; S218-I222 PolarHBondContact O-N 2.72Å
219Y90.5Very high89.5Confident23 Ų2360.5 Ų60.59%0.0933%0.328CS..Hα-helixtrans-72-26.7179.2-84.7-80.1000113.9A120 I215 M216 I217 I222 G223 C242 H245 L246A120-Y219 HydrophobicContact CB-CD2 4.39Å; A120-Y219 HydrophobicContact CB-CE2 3.84Å; I215-Y219 HydrophobicContact CG2-CD2 3.7Å; I215-Y219 HydrophobicContact CG2-CE2 4.01Å; I215-Y219 WeakPolarHBondContact O-CB 3.15Å; I215-Y219 VanDerWaalsContact O-CD2 3.32Å; I215-Y219 WeakPolarHBondContact O-CD2 3.28Å; I215-Y219 PolarHBondContact O-N 3.49Å; M216-Y219 PolarHBondContact O-N 2.93Å; I217-Y219 VanDerWaalsContact C-N 3.34Å; I217-Y219 PolarHBondContact O-N 2.97Å; Y219-I222 HydrophobicContact CD1-CD1 3.9Å; Y219-I222 HydrophobicContact CE1-CD1 3.94Å; Y219-I222 HydrophobicContact CG-CD1 4.24Å; Y219-G223 PolarHBondContact O-N 3.47Å; Y219-C242 HydrophobicContact CE1-CB 3.82Å; Y219-H245 AromaticContact CE2-CE1 3.94Å; Y219-H245 AromaticContact CE2-ND1 3.48Å; Y219-H245 WeakPolarHBondContact CE2-ND1 3.26Å; Y219-H245 AromaticContact CZ-ND1 3.5Å; Y219-H245 VanDerWaalsContact OH-CB 3.29Å; Y219-H245 WeakPolarHBondContact OH-CB 3.46Å; Y219-H245 PolarHBondContact OH-ND1 2.95Å; Y219-L246 HydrophobicContact CD1-CD1 3.76Å; Y219-L246 HydrophobicContact CD1-CD2 3.61Å; Y219-L246 HydrophobicContact CD1-CG 3.72Å; Y219-L246 HydrophobicContact CD2-CD2 3.92Å; Y219-L246 HydrophobicContact CE1-CD1 3.81Å; Y219-L246 HydrophobicContact CE1-CD2 3.82Å; Y219-L246 HydrophobicContact CE1-CG 3.51Å; Y219-L246 HydrophobicContact CE2-CD2 4.12Å; Y219-L246 HydrophobicContact CE2-CG 4.47Å; Y219-L246 HydrophobicContact CG-CD2 3.67Å; Y219-L246 HydrophobicContact CG-CG 4.3Å
220G90.9Very high89.7Confident37 Ų3763.8 Ų63.838%0.38135%0.352SS..Hα-helixtrans-60.6-50.1168.100000111.4M216 I217 S218 G223 I224M216-G220 PolarHBondContact O-N 2.91Å; I217-G220 PolarHBondContact O-N 3.46Å; S218-G220 PolarHBondContact O-N 3.41Å; G220-G223 PolarHBondContact O-N 2.92Å; G220-I224 WeakPolarHBondContact O-CG1 3.31Å; G220-I224 PolarHBondContact O-N 3.28Å
221Y92.8Very high89.8Confident129 Ų12965 Ų6551%0.50636%0.358SS..Hα-helixtrans-65.4-38.9176.1-74.6-65.7000113.4Y124 I217 S218 G223 I224 S225Y124-Y221 HydrophobicContact CE2-CD2 4.17Å; Y124-Y221 HydrophobicContact CE2-CG 4.05Å; I217-Y221 HydrophobicContact CG2-CD2 3.87Å; I217-Y221 HydrophobicContact CG2-CE2 3.57Å; I217-Y221 VanDerWaalsContact O-CD2 3.22Å; I217-Y221 WeakPolarHBondContact O-CD2 3.1Å; I217-Y221 PolarHBondContact O-N 2.95Å; S218-Y221 PolarHBondContact O-N 2.97Å; Y221-G223 VanDerWaalsContact C-N 3.33Å; Y221-I224 PolarHBondContact O-N 3.42Å; Y221-S225 WeakPolarHBondContact O-CB 2.96Å; Y221-S225 PolarHBondContact O-N 3.47Å; Y221-S225 PolarHBondContact O-OG 3.42Å
222I91.8Very high89.6Confident3 Ų368.5 Ų68.52%0.01539%0.387CS..Hα-helixtrans-59.1-48172.9-69.9166.1000109.5R123 I127 S218 Y219 I224 S225 I226R123-I222 HydrophobicContact CB-CD1 3.99Å; I127-I222 HydrophobicContact CD1-CG2 3.76Å; I127-I222 HydrophobicContact CG2-CG2 4.33Å; S218-I222 VanDerWaalsContact O-CG1 3.26Å; S218-I222 WeakPolarHBondContact O-CG1 3.34Å; S218-I222 PolarHBondContact O-N 2.72Å; Y219-I222 HydrophobicContact CD1-CD1 3.9Å; Y219-I222 HydrophobicContact CE1-CD1 3.94Å; Y219-I222 HydrophobicContact CG-CD1 4.24Å; I222-I224 PolarHBondContact O-N 3.05Å; I222-S225 PolarHBondContact O-N 3.14Å; I222-S225 VanDerWaalsContact O-N 3.13Å; I222-I226 HydrophobicContact CG2-CD1 3.6Å; I222-I226 HydrophobicContact CG2-CG1 4.18Å; I222-I226 WeakPolarHBondContact O-CB 3.31Å; I222-I226 VanDerWaalsContact O-CG1 3.28Å; I222-I226 WeakPolarHBondContact O-CG1 2.93Å; I222-I226 PolarHBondContact O-N 3.15Å
223G89.4Confident89.4Confident33 Ų3375.7 Ų75.734%0.3441%0.413SS..Hα-helixtrans-56.7-48.4177.500000112.1Y219 G220 Y221 S225 I226 M227Y219-G223 PolarHBondContact O-N 3.47Å; G220-G223 PolarHBondContact O-N 2.92Å; Y221-G223 VanDerWaalsContact C-N 3.33Å; G223-S225 VanDerWaalsContact C-N 3.31Å; G223-S225 PolarHBondContact O-N 2.88Å; G223-I226 PolarHBondContact O-N 2.95Å; G223-M227 VanDerWaalsContact O-CG 3.29Å; G223-M227 WeakPolarHBondContact O-CG 3.31Å; G223-M227 PolarHBondContact O-N 2.77Å
224I89.6Confident89Confident93 Ų9372.2 Ų72.248%0.47740%0.402SS..Hα-helixtrans-58.4-44175.5-66.7165.2000111.1G220 Y221 I222 M227 K228G220-I224 WeakPolarHBondContact O-CG1 3.31Å; G220-I224 PolarHBondContact O-N 3.28Å; Y221-I224 PolarHBondContact O-N 3.42Å; I222-I224 PolarHBondContact O-N 3.05Å; I224-M227 PolarHBondContact O-N 2.79Å; I224-K228 WeakPolarHBondContact O-CG 3.31Å; I224-K228 PolarHBondContact O-N 3.34Å
225S88.5Confident88.7Confident31 Ų3174.7 Ų74.722%0.21740%0.404CS..Hα-helixtrans-67.4-40.1-179.3-59.30000112.1C128 Y221 I222 G223 M227 K228C128-S225 PolarHBondContact SG-OG 3.34Å; Y221-S225 WeakPolarHBondContact O-CB 2.96Å; Y221-S225 PolarHBondContact O-N 3.47Å; Y221-S225 PolarHBondContact O-OG 3.42Å; I222-S225 PolarHBondContact O-N 3.14Å; I222-S225 VanDerWaalsContact O-N 3.13Å; G223-S225 VanDerWaalsContact C-N 3.31Å; G223-S225 PolarHBondContact O-N 2.88Å; S225-M227 VanDerWaalsContact C-N 3.32Å; S225-M227 PolarHBondContact O-N 3.44Å; S225-K228 WeakPolarHBondContact O-CB 2.96Å; S225-K228 PolarHBondContact O-N 3.07Å; S225-K228 VanDerWaalsContact O-N 3.16Å
226I88.9Confident88.2Confident12 Ų1277.6 Ų77.66%0.06243%0.425CS..Hα-helixtrans-62.9-38.9175.5-71.8176.1000111.1I127 I222 G223 K228 I229 R235 A238I127-I226 HydrophobicContact CG2-CG1 4.25Å; I222-I226 HydrophobicContact CG2-CD1 3.6Å; I222-I226 HydrophobicContact CG2-CG1 4.18Å; I222-I226 WeakPolarHBondContact O-CB 3.31Å; I222-I226 VanDerWaalsContact O-CG1 3.28Å; I222-I226 WeakPolarHBondContact O-CG1 2.93Å; I222-I226 PolarHBondContact O-N 3.15Å; G223-I226 PolarHBondContact O-N 2.95Å; I226-K228 PolarHBondContact O-N 3.41Å; I226-I229 WeakPolarHBondContact O-CB 3.33Å; I226-I229 PolarHBondContact O-N 3.48Å; I226-I229 VanDerWaalsContact O-N 3.15Å; I226-R235 HydrophobicContact CG2-CG 3.66Å; I226-A238 HydrophobicContact CD1-CB 3.97Å; I226-A238 HydrophobicContact CG1-CB 3.84Å
227M86.9Confident87.8Confident122 Ų12278.8 Ų78.860%0.60143%0.426SS*.Hα-helixtrans-65.8-25.4176.7-69.4-63.5-67.900113.1G223 I224 S225 I229 R235G223-M227 VanDerWaalsContact O-CG 3.29Å; G223-M227 WeakPolarHBondContact O-CG 3.31Å; G223-M227 PolarHBondContact O-N 2.77Å; I224-M227 PolarHBondContact O-N 2.79Å; S225-M227 VanDerWaalsContact C-N 3.32Å; S225-M227 PolarHBondContact O-N 3.44Å; M227-I229 VanDerWaalsContact C-N 3.31Å; M227-R235 PolarHBondContact SD-NH1 3.26Å; M227-R235 PolarHBondContact SD-NH2 3.18Å
228K88.3Confident87.3Confident163 Ų16374.8 Ų74.871%0.70941%0.408SS*.THydrogen-bonded Turntrans-78-13.1174.9-68.1176.6179.2-178.20113.5I224 S225 I226 T230I224-K228 WeakPolarHBondContact O-CG 3.31Å; I224-K228 PolarHBondContact O-N 3.34Å; S225-K228 WeakPolarHBondContact O-CB 2.96Å; S225-K228 PolarHBondContact O-N 3.07Å; S225-K228 VanDerWaalsContact O-N 3.16Å; I226-K228 PolarHBondContact O-N 3.41Å; K228-T230 PolarHBondContact O-N 2.63Å
229I88.1Confident86.7Confident63 Ų6380.2 Ų80.232%0.32343%0.431SS..  trans-72.2118.8177.1-59.1174.2000109I226 M227 A238I226-I229 WeakPolarHBondContact O-CB 3.33Å; I226-I229 PolarHBondContact O-N 3.48Å; I226-I229 VanDerWaalsContact O-N 3.15Å; M227-I229 VanDerWaalsContact C-N 3.31Å; I229-A238 HydrophobicContact CD1-CB 4.14Å
230T86.3Confident86.1Confident148 Ų14884 Ų8491%0.90845%0.452SS*.  trans-73.3-27.9-177.552.90000113.5K228K228-T230 PolarHBondContact O-N 2.63Å
231S89.9Confident85.5Confident63 Ų6385 Ų8544%0.44145%0.451SS..  trans-86122.1179.8-179.30000112.2K233 G234 R235S231-K233 PolarHBondContact O-N 3.05Å; S231-K233 PolarHBondContact OG-N 3.17Å; S231-G234 WeakPolarHBondContact O-CA 3.23Å; S231-G234 PolarHBondContact O-N 3.05Å; S231-G234 PolarHBondContact OG-N 2.78Å; S231-R235 PolarHBondContact O-N 2.81Å
232A83.4Confident85Confident83 Ų8379 Ų7969%0.68643%0.428SS*.Hα-helixtrans-56-37.3174.500000112.8R235 S236A232-R235 PolarHBondContact O-N 2.97Å; A232-S236 WeakPolarHBondContact O-CB 3.4Å; A232-S236 PolarHBondContact O-N 3.38Å
233K83.4Confident84.5Confident179 Ų17979.9 Ų79.978%0.77844%0.436SS*.Hα-helixtrans-67.4-41175.8-170.6174.7-177.5177.10111.7S231 K237S231-K233 PolarHBondContact O-N 3.05Å; S231-K233 PolarHBondContact OG-N 3.17Å; K233-K237 WeakPolarHBondContact O-CB 3.27Å; K233-K237 PolarHBondContact O-N 2.64Å
234G80.7Confident84Confident27 Ų2778.7 Ų78.728%0.27842%0.422SS..Hα-helixtrans-63.3-44.4174.500000112.3S231 K237 A238S231-G234 WeakPolarHBondContact O-CA 3.23Å; S231-G234 PolarHBondContact O-N 3.05Å; S231-G234 PolarHBondContact OG-N 2.78Å; G234-K237 PolarHBondContact O-N 3Å; G234-A238 PolarHBondContact O-N 3.45Å
235R84.1Confident83.8Confident116 Ų11674.3 Ų74.344%0.43840%0.4SS..Hα-helixtrans-60.3-50.4176.3178.9174.2169167.2-2.7112.3I226 M227 S231 A232 K237 A238 F239I226-R235 HydrophobicContact CG2-CG 3.66Å; M227-R235 PolarHBondContact SD-NH1 3.26Å; M227-R235 PolarHBondContact SD-NH2 3.18Å; S231-R235 PolarHBondContact O-N 2.81Å; A232-R235 PolarHBondContact O-N 2.97Å; R235-K237 VanDerWaalsContact C-N 3.33Å; R235-K237 PolarHBondContact O-N 2.94Å; R235-A238 PolarHBondContact O-N 2.79Å; R235-F239 WeakPolarHBondContact O-CB 3.25Å; R235-F239 PolarHBondContact O-N 2.79Å
236S82.4Confident83.6Confident64 Ų6475.4 Ų75.445%0.44840%0.403SS..Hα-helixtrans-61.9-40.7178.4178.40000111.9A232 F239 N240A232-S236 WeakPolarHBondContact O-CB 3.4Å; A232-S236 PolarHBondContact O-N 3.38Å; S236-F239 PolarHBondContact O-N 2.01Å; S236-N240 WeakPolarHBondContact O-CB 3.41Å; S236-N240 VanDerWaalsContact O-CG 3.32Å; S236-N240 PolarHBondContact O-N 2.99Å; S236-N240 PolarHBondContact O-ND2 3.32Å
237K81.8Confident83.2Confident158 Ų15876.9 Ų76.969%0.68741%0.413SS*.Hα-helixtrans-60.2-49.9175.5-173.3-179.9179.2-174.50111.4K233 G234 R235 F239 N240 T241K233-K237 WeakPolarHBondContact O-CB 3.27Å; K233-K237 PolarHBondContact O-N 2.64Å; G234-K237 PolarHBondContact O-N 3Å; R235-K237 VanDerWaalsContact C-N 3.33Å; R235-K237 PolarHBondContact O-N 2.94Å; K237-F239 PolarHBondContact O-N 3.4Å; K237-N240 PolarHBondContact O-N 3.14Å; K237-T241 PolarHBondContact O-N 3.02Å; K237-T241 VanDerWaalsContact O-N 3.14Å; K237-T241 PolarHBondContact O-OG1 2.98Å
238A82.4Confident82.9Confident14 Ų1471.1 Ų71.112%0.11638%0.384CS..Hα-helixtrans-62.7-42.6-179.700000112.4I226 I229 G234 R235 T241 C242I226-A238 HydrophobicContact CD1-CB 3.97Å; I226-A238 HydrophobicContact CG1-CB 3.84Å; I229-A238 HydrophobicContact CD1-CB 4.14Å; G234-A238 PolarHBondContact O-N 3.45Å; R235-A238 PolarHBondContact O-N 2.79Å; A238-T241 WeakPolarHBondContact O-CB 3.38Å; A238-T241 PolarHBondContact O-N 3.4Å; A238-C242 PolarHBondContact O-N 2.68Å
239F80.1Confident82.6Confident124 Ų12464 Ų6454%0.54435%0.354SS..Hα-helixtrans-62.4-45.2177-173.8-96.3000112.2R235 S236 K237 T241 C242 A243R235-F239 WeakPolarHBondContact O-CB 3.25Å; R235-F239 PolarHBondContact O-N 2.79Å; S236-F239 PolarHBondContact O-N 2.01Å; K237-F239 PolarHBondContact O-N 3.4Å; F239-T241 VanDerWaalsContact C-N 3.26Å; F239-T241 PolarHBondContact O-N 2.95Å; F239-C242 PolarHBondContact O-N 3.36Å; F239-C242 VanDerWaalsContact O-N 3.08Å; F239-A243 PolarHBondContact O-N 2.79Å
240N78.9Confident82.3Confident102 Ų10264.4 Ų64.455%0.54536%0.363SS..Hα-helixtrans-62.8-32.5178.6-77.1-25.5000112.7S236 K237 C242S236-N240 WeakPolarHBondContact O-CB 3.41Å; S236-N240 VanDerWaalsContact O-CG 3.32Å; S236-N240 PolarHBondContact O-N 2.99Å; S236-N240 PolarHBondContact O-ND2 3.32Å; K237-N240 PolarHBondContact O-N 3.14Å; N240-C242 VanDerWaalsContact C-N 3.28Å; N240-C242 PolarHBondContact O-N 2.89Å
241T77.8Confident81.8Confident58 Ų5859.8 Ų59.836%0.35633%0.332SS..Hα-helixtrans-65-31.6174.8-55.70000112.8K237 A238 F239K237-T241 PolarHBondContact O-N 3.02Å; K237-T241 VanDerWaalsContact O-N 3.14Å; K237-T241 PolarHBondContact O-OG1 2.98Å; A238-T241 WeakPolarHBondContact O-CB 3.38Å; A238-T241 PolarHBondContact O-N 3.4Å; F239-T241 VanDerWaalsContact C-N 3.26Å; F239-T241 PolarHBondContact O-N 2.95Å
242C81.9Confident81.1Confident3 Ų358.8 Ų58.82%0.0232%0.32CS..Hα-helixtrans-88.6-24.4-179.4-77.50000113.6I127 Y219 A238 F239 N240 S244 H245 L246I127-C242 WeakPolarHBondContact CD1-SG 3.41Å; Y219-C242 HydrophobicContact CE1-CB 3.82Å; A238-C242 PolarHBondContact O-N 2.68Å; F239-C242 PolarHBondContact O-N 3.36Å; F239-C242 VanDerWaalsContact O-N 3.08Å; N240-C242 VanDerWaalsContact C-N 3.28Å; N240-C242 PolarHBondContact O-N 2.89Å; C242-S244 VanDerWaalsContact C-N 3.33Å; C242-S244 PolarHBondContact O-N 2.84Å; C242-H245 PolarHBondContact O-N 3.12Å; C242-L246 PolarHBondContact O-N 3.35Å
243A81.2Confident80.8Confident22 Ų2256.6 Ų56.618%0.18229%0.294CS..Hα-helixtrans-60.6-38.6-171.700000113.2F239 T247F239-A243 PolarHBondContact O-N 2.79Å; A243-T247 WeakPolarHBondContact O-CB 3.25Å; A243-T247 PolarHBondContact O-N 2.67Å; A243-T247 PolarHBondContact O-OG1 3.47Å
244S80Confident80.4Confident8 Ų851.2 Ų51.26%0.05628%0.279CS..Hα-helixtrans-63.9-47.7177.851.90000111.6C242 T247 A248 I290C242-S244 VanDerWaalsContact C-N 3.33Å; C242-S244 PolarHBondContact O-N 2.84Å; S244-T247 PolarHBondContact O-N 2.92Å; S244-A248 PolarHBondContact O-N 3.42Å; S244-I290 VanDerWaalsContact O-CG2 3.29Å; S244-I290 WeakPolarHBondContact O-CG2 3.47Å
245H84.6Confident79.8Confident0 Ų050.7 Ų50.70%027%0.271CS..Hα-helixtrans-64.1-45.5178-174-82.6000112.2M116 M119 Y219 C242 T247 A248 V249 Y291M116-H245 PolarHBondContact O-CE1 3.43Å; M116-H245 PolarHBondContact O-NE2 2.99Å; M119-H245 WeakPolarHBondContact CB-NE2 3.31Å; Y219-H245 AromaticContact CE2-CE1 3.94Å; Y219-H245 AromaticContact CE2-ND1 3.48Å; Y219-H245 WeakPolarHBondContact CE2-ND1 3.26Å; Y219-H245 AromaticContact CZ-ND1 3.5Å; Y219-H245 VanDerWaalsContact OH-CB 3.29Å; Y219-H245 WeakPolarHBondContact OH-CB 3.46Å; Y219-H245 PolarHBondContact OH-ND1 2.95Å; C242-H245 PolarHBondContact O-N 3.12Å; H245-T247 VanDerWaalsContact C-N 3.29Å; H245-T247 PolarHBondContact O-N 2.82Å; H245-A248 PolarHBondContact O-N 3.36Å; H245-V249 WeakPolarHBondContact CE1-CG2 3.32Å; H245-V249 WeakPolarHBondContact ND1-CG2 3.37Å; H245-V249 WeakPolarHBondContact O-CB 3.37Å; H245-V249 VanDerWaalsContact O-CG2 3.3Å; H245-V249 WeakPolarHBondContact O-CG2 3.35Å; H245-V249 PolarHBondContact O-N 3.31Å; H245-Y291 HydrophobicContact CB-CE1 4.03Å; H245-Y291 PolarHBondContact CD2-OH 3.02Å; H245-Y291 VanDerWaalsContact CD2-OH 3.3Å
246L83.8Confident79.1Confident55 Ų5547.1 Ų47.129%0.28827%0.27SS..Hα-helixtrans-59.9-40.2175-79.1170.4000111.9Y219 C242 V249 S250Y219-L246 HydrophobicContact CD1-CD1 3.76Å; Y219-L246 HydrophobicContact CD1-CD2 3.61Å; Y219-L246 HydrophobicContact CD1-CG 3.72Å; Y219-L246 HydrophobicContact CD2-CD2 3.92Å; Y219-L246 HydrophobicContact CE1-CD1 3.81Å; Y219-L246 HydrophobicContact CE1-CD2 3.82Å; Y219-L246 HydrophobicContact CE1-CG 3.51Å; Y219-L246 HydrophobicContact CE2-CD2 4.12Å; Y219-L246 HydrophobicContact CE2-CG 4.47Å; Y219-L246 HydrophobicContact CG-CD2 3.67Å; Y219-L246 HydrophobicContact CG-CG 4.3Å; C242-L246 PolarHBondContact O-N 3.35Å; L246-V249 PolarHBondContact O-N 2.85Å; L246-S250 VanDerWaalsContact O-CB 3.29Å; L246-S250 WeakPolarHBondContact O-CB 3.23Å; L246-S250 PolarHBondContact O-N 2.84Å; L246-S250 PolarHBondContact O-OG 3.36Å
247T81.3Confident78.5Confident43 Ų4348.8 Ų48.826%0.26427%0.273SS..Hα-helixtrans-61.9-46.3176.6-53.70000110.8A243 S244 H245 S250 L251 I290 R294A243-T247 WeakPolarHBondContact O-CB 3.25Å; A243-T247 PolarHBondContact O-N 2.67Å; A243-T247 PolarHBondContact O-OG1 3.47Å; S244-T247 PolarHBondContact O-N 2.92Å; H245-T247 VanDerWaalsContact C-N 3.29Å; H245-T247 PolarHBondContact O-N 2.82Å; T247-S250 PolarHBondContact O-N 2.86Å; T247-L251 HydrophobicContact CG2-CD1 4.38Å; T247-L251 WeakPolarHBondContact O-CG 3.41Å; T247-L251 PolarHBondContact O-N 2.93Å; T247-I290 HydrophobicContact CG2-CD1 4.04Å; T247-I290 HydrophobicContact CG2-CG1 4.41Å; T247-I290 HydrophobicContact CG2-CG2 4.02Å; T247-R294 PolarHBondContact OG1-NH1 3.41Å
248A80.6Confident77.7Confident0 Ų045.6 Ų45.60%026%0.259CS..Hα-helixtrans-64.1-46.1178.400000112.2M116 S244 H245 S250 L251 F252 I290 Y291M116-A248 HydrophobicContact CE-CB 3.83Å; S244-A248 PolarHBondContact O-N 3.42Å; H245-A248 PolarHBondContact O-N 3.36Å; A248-S250 PolarHBondContact O-N 3.34Å; A248-L251 PolarHBondContact O-N 3.14Å; A248-F252 WeakPolarHBondContact O-CB 3.5Å; A248-F252 PolarHBondContact O-N 3.49Å; A248-I290 HydrophobicContact CB-CG2 4.49Å; A248-Y291 HydrophobicContact CB-CD2 4.47Å; A248-Y291 HydrophobicContact CB-CE1 4.49Å; A248-Y291 HydrophobicContact CB-CE2 3.51Å; A248-Y291 VanDerWaalsContact CB-OH 3.29Å; A248-Y291 WeakPolarHBondContact CB-OH 3.45Å
249V82.6Confident76.8Confident13 Ų1346.4 Ų46.48%0.07926%0.263CS..Hα-helixtrans-57-49.4173.7167.20000110.8M116 I215 H245 L246 L251 F252 Y253M116-V249 HydrophobicContact CE-CB 4.22Å; M116-V249 HydrophobicContact CE-CG2 3.57Å; I215-V249 HydrophobicContact CD1-CG1 4.3Å; I215-V249 HydrophobicContact CD1-CG2 4.24Å; I215-V249 HydrophobicContact CG2-CG1 3.9Å; I215-V249 HydrophobicContact CG2-CG2 4.24Å; H245-V249 WeakPolarHBondContact CE1-CG2 3.32Å; H245-V249 WeakPolarHBondContact ND1-CG2 3.37Å; H245-V249 WeakPolarHBondContact O-CB 3.37Å; H245-V249 VanDerWaalsContact O-CG2 3.3Å; H245-V249 WeakPolarHBondContact O-CG2 3.35Å; H245-V249 PolarHBondContact O-N 3.31Å; L246-V249 PolarHBondContact O-N 2.85Å; V249-L251 VanDerWaalsContact C-N 3.32Å; V249-L251 PolarHBondContact O-N 3.11Å; V249-F252 PolarHBondContact O-N 3.1Å; V249-Y253 HydrophobicContact CG1-CD2 3.69Å; V249-Y253 HydrophobicContact CG1-CE2 3.98Å; V249-Y253 WeakPolarHBondContact O-CD2 3.36Å; V249-Y253 PolarHBondContact O-N 2.9Å
250S80.4Confident75.9Confident72 Ų7248.5 Ų48.550%0.50327%0.269SS..Hα-helixtrans-60.3-43.1-178.8-68.50000111.3L246 T247 A248 S254L246-S250 VanDerWaalsContact O-CB 3.29Å; L246-S250 WeakPolarHBondContact O-CB 3.23Å; L246-S250 PolarHBondContact O-N 2.84Å; L246-S250 PolarHBondContact O-OG 3.36Å; T247-S250 PolarHBondContact O-N 2.86Å; A248-S250 PolarHBondContact O-N 3.34Å; S250-S254 WeakPolarHBondContact O-CB 3.34Å; S250-S254 PolarHBondContact O-N 3.03Å; S250-S254 PolarHBondContact O-OG 3.35Å
251L75.8Confident75.1Confident52 Ų5248.5 Ų48.527%0.27227%0.268SS..Hα-helixtrans-62.4-50.3175.7-71.1173.1000111.4T247 A248 V249 Y253 S254 S255 I283 L286 I290T247-L251 HydrophobicContact CG2-CD1 4.38Å; T247-L251 WeakPolarHBondContact O-CG 3.41Å; T247-L251 PolarHBondContact O-N 2.93Å; A248-L251 PolarHBondContact O-N 3.14Å; V249-L251 VanDerWaalsContact C-N 3.32Å; V249-L251 PolarHBondContact O-N 3.11Å; L251-Y253 PolarHBondContact O-N 3.17Å; L251-S254 PolarHBondContact O-OG 3.32Å; L251-S255 WeakPolarHBondContact O-CB 3.34Å; L251-S255 PolarHBondContact O-N 2.49Å; L251-S255 PolarHBondContact O-OG 3.02Å; L251-I283 HydrophobicContact CB-CG2 4.48Å; L251-L286 HydrophobicContact CD1-CB 4.48Å; L251-L286 HydrophobicContact CD1-CD1 4.45Å; L251-I290 HydrophobicContact CD1-CD1 3.2Å
252F75.9Confident74Confident41 Ų4146.6 Ų46.618%0.1826%0.257CS..Hα-helixtrans-57.4-49.1-179.1-178.9-96.8000113.3E112 A248 V249 S255 G256E112-F252 HydrophobicContact CB-CE2 4.41Å; E112-F252 HydrophobicContact CG-CD2 4.15Å; E112-F252 HydrophobicContact CG-CE2 3.72Å; E112-F252 HydrophobicContact CG-CZ 4.19Å; E112-F252 WeakPolarHBondContact OE1-CD2 3.5Å; E112-F252 VanDerWaalsContact OE2-CE2 3.32Å; E112-F252 WeakPolarHBondContact OE2-CE2 3.3Å; A248-F252 WeakPolarHBondContact O-CB 3.5Å; A248-F252 PolarHBondContact O-N 3.49Å; V249-F252 PolarHBondContact O-N 3.1Å; F252-S255 PolarHBondContact O-OG 3.28Å; F252-G256 PolarHBondContact O-N 3.23Å
253Y76.2Confident72.6Confident38 Ų3849.8 Ų49.815%0.14928%0.279CS..Hα-helixtrans-77.6-38.8-178.4-76.3-78.2000113.1G208 S211 A212 I215 V249 L251 S255 G256 I257G208-Y253 WeakPolarHBondContact O-CE1 3.47Å; S211-Y253 WeakPolarHBondContact CB-OH 2.95Å; A212-Y253 HydrophobicContact CB-CD1 4.16Å; A212-Y253 HydrophobicContact CB-CE1 3.81Å; A212-Y253 PolarHBondContact N-OH 3.19Å; I215-Y253 HydrophobicContact CD1-CE2 3.73Å; V249-Y253 HydrophobicContact CG1-CD2 3.69Å; V249-Y253 HydrophobicContact CG1-CE2 3.98Å; V249-Y253 WeakPolarHBondContact O-CD2 3.36Å; V249-Y253 PolarHBondContact O-N 2.9Å; L251-Y253 PolarHBondContact O-N 3.17Å; Y253-S255 PolarHBondContact O-N 2.93Å; Y253-G256 PolarHBondContact O-N 2.93Å; Y253-I257 VanDerWaalsContact O-CG1 3.31Å; Y253-I257 WeakPolarHBondContact O-CG1 3.15Å; Y253-I257 PolarHBondContact O-N 2.98Å
254S74.9Confident71.2Confident66 Ų6652.7 Ų52.746%0.46230%0.298SS..Hα-helixtrans-63-35.5177.363.50000111.5S250 L251 F258S250-S254 WeakPolarHBondContact O-CB 3.34Å; S250-S254 PolarHBondContact O-N 3.03Å; S250-S254 PolarHBondContact O-OG 3.35Å; L251-S254 PolarHBondContact O-OG 3.32Å; S254-F258 WeakPolarHBondContact O-CB 3.45Å; S254-F258 PolarHBondContact O-N 2.99Å
255S70.1Confident69.8Low16 Ų1656.4 Ų56.411%0.11232%0.324CS..Hα-helixtrans-68.9-44.2174.262.10000112.8L251 F252 Y253 I257 F258 V259 I283L251-S255 WeakPolarHBondContact O-CB 3.34Å; L251-S255 PolarHBondContact O-N 2.49Å; L251-S255 PolarHBondContact O-OG 3.02Å; F252-S255 PolarHBondContact O-OG 3.28Å; Y253-S255 PolarHBondContact O-N 2.93Å; S255-I257 VanDerWaalsContact C-N 3.28Å; S255-I257 PolarHBondContact O-N 2.87Å; S255-F258 WeakPolarHBondContact O-CB 3.34Å; S255-F258 PolarHBondContact O-N 3.08Å; S255-F258 VanDerWaalsContact O-N 3.08Å; S255-V259 WeakPolarHBondContact O-CG2 3.27Å; S255-V259 PolarHBondContact O-N 3.25Å; S255-I283 WeakPolarHBondContact OG-CD1 3.48Å
256G67.7Low67.9Low40 Ų4060 Ų6041%0.41236%0.362SS..Hα-helixtrans-56.1-44.1175.500000112.3F252 Y253 V259 Y260F252-G256 PolarHBondContact O-N 3.23Å; Y253-G256 PolarHBondContact O-N 2.93Å; G256-V259 PolarHBondContact O-N 3.24Å; G256-Y260 PolarHBondContact O-N 2.84Å; G256-Y260 VanDerWaalsContact O-N 3.14Å
257I70.1Confident66.2Low100 Ų10059.3 Ų59.351%0.51337%0.368SS..Hα-helixtrans-63.1-43.8175-67.2165.8000110.9Y253 S255 V259 Y260 L261Y253-I257 VanDerWaalsContact O-CG1 3.31Å; Y253-I257 WeakPolarHBondContact O-CG1 3.15Å; Y253-I257 PolarHBondContact O-N 2.98Å; S255-I257 VanDerWaalsContact C-N 3.28Å; S255-I257 PolarHBondContact O-N 2.87Å; I257-V259 VanDerWaalsContact C-N 3.35Å; I257-V259 PolarHBondContact O-N 3.49Å; I257-Y260 PolarHBondContact O-N 3.03Å; I257-L261 HydrophobicContact CG2-CD1 3.78Å; I257-L261 HydrophobicContact CG2-CG 4.3Å; I257-L261 WeakPolarHBondContact O-CG 3.11Å; I257-L261 PolarHBondContact O-N 2.79Å
258F65.2Low64.9Low90 Ų9059.7 Ų59.740%0.39537%0.372SS..Hα-helixtrans-59.9-44.6177.9-171.6-99.1000111.7S254 S255 Y260 L261 S262 F271 A275S254-F258 WeakPolarHBondContact O-CB 3.45Å; S254-F258 PolarHBondContact O-N 2.99Å; S255-F258 WeakPolarHBondContact O-CB 3.34Å; S255-F258 PolarHBondContact O-N 3.08Å; S255-F258 VanDerWaalsContact O-N 3.08Å; F258-Y260 VanDerWaalsContact C-N 3.34Å; F258-Y260 PolarHBondContact O-N 2.8Å; F258-L261 PolarHBondContact O-N 2.92Å; F258-S262 WeakPolarHBondContact O-CB 3.49Å; F258-S262 PolarHBondContact O-N 2.9Å; F258-S262 PolarHBondContact O-OG 3.08Å; F258-S262 VanDerWaalsContact O-OG 3.13Å; F258-F271 HydrophobicContact CE1-CE1 4.4Å; F258-F271 AromaticContact CZ-CE1 3.8Å; F258-F271 HydrophobicContact CZ-CE1 3.8Å; F258-F271 AromaticContact CZ-CZ 3.83Å; F258-F271 HydrophobicContact CZ-CZ 3.83Å; F258-A275 HydrophobicContact CD1-CB 4.28Å; F258-A275 HydrophobicContact CE1-CB 3.59Å
259V62.8Low63.9Low32 Ų3262 Ų6219%0.19439%0.388CS..Hα-helixtrans-56.7-49.3175.9-171.50000111.1S255 G256 I257 L261 S262 S263 Y279S255-V259 WeakPolarHBondContact O-CG2 3.27Å; S255-V259 PolarHBondContact O-N 3.25Å; G256-V259 PolarHBondContact O-N 3.24Å; I257-V259 VanDerWaalsContact C-N 3.35Å; I257-V259 PolarHBondContact O-N 3.49Å; V259-L261 PolarHBondContact O-N 3.39Å; V259-S262 PolarHBondContact O-N 3.46Å; V259-S263 WeakPolarHBondContact O-CB 3.07Å; V259-S263 PolarHBondContact O-N 3.36Å; V259-S263 PolarHBondContact O-OG 3.35Å; V259-Y279 HydrophobicContact CB-CD1 4.31Å; V259-Y279 HydrophobicContact CB-CE1 3.88Å; V259-Y279 HydrophobicContact CG1-CE1 3.68Å; V259-Y279 HydrophobicContact CG1-CE2 4.13Å; V259-Y279 WeakPolarHBondContact CG1-OH 3.46Å; V259-Y279 HydrophobicContact CG2-CD1 3.17Å; V259-Y279 HydrophobicContact CG2-CD2 3.64Å; V259-Y279 HydrophobicContact CG2-CE1 3.15Å; V259-Y279 HydrophobicContact CG2-CE2 3.7Å; V259-Y279 HydrophobicContact CG2-CG 3.41Å; V259-Y279 VanDerWaalsContact CG2-CG 3.41Å
260Y62Low62.8Low168 Ų16864.4 Ų64.466%0.65941%0.405SS*.Hα-helixtrans-61.5-45.2-177.4178.6-99.9000111.5G256 I257 F258 S263 S264G256-Y260 PolarHBondContact O-N 2.84Å; G256-Y260 VanDerWaalsContact O-N 3.14Å; I257-Y260 PolarHBondContact O-N 3.03Å; F258-Y260 VanDerWaalsContact C-N 3.34Å; F258-Y260 PolarHBondContact O-N 2.8Å; Y260-S263 PolarHBondContact O-OG 3.48Å; Y260-S264 WeakPolarHBondContact O-CB 3.42Å; Y260-S264 PolarHBondContact O-N 2.86Å
261L62.7Low61.9Low102 Ų10266.8 Ų66.853%0.53441%0.407SS..Hα-helixtrans-65.7-43.6178.1-67.6173.2000111.6I257 F258 V259 S264I257-L261 HydrophobicContact CG2-CD1 3.78Å; I257-L261 HydrophobicContact CG2-CG 4.3Å; I257-L261 WeakPolarHBondContact O-CG 3.11Å; I257-L261 PolarHBondContact O-N 2.79Å; F258-L261 PolarHBondContact O-N 2.92Å; V259-L261 PolarHBondContact O-N 3.39Å; L261-S264 PolarHBondContact O-N 3.42Å; L261-S264 PolarHBondContact O-OG 2.7Å
262S54.9Low61.2Low17 Ų1765.5 Ų65.512%0.11940%0.4CS..Hα-helixtrans-61.7-45.3177.3-710000112.3F258 V259 S265 D272F258-S262 WeakPolarHBondContact O-CB 3.49Å; F258-S262 PolarHBondContact O-N 2.9Å; F258-S262 PolarHBondContact O-OG 3.08Å; F258-S262 VanDerWaalsContact O-OG 3.13Å; V259-S262 PolarHBondContact O-N 3.46Å; S262-S265 PolarHBondContact O-N 3.14Å; S262-S265 PolarHBondContact O-OG 3.14Å; S262-D272 WeakPolarHBondContact CB-OD1 3.38Å
263S50.9Low60.8Low71 Ų7164.1 Ų64.150%0.49739%0.394SS..Hα-helixtrans-71.6-28-179.848.90000114.2V259 Y260 S265V259-S263 WeakPolarHBondContact O-CB 3.07Å; V259-S263 PolarHBondContact O-N 3.36Å; V259-S263 PolarHBondContact O-OG 3.35Å; Y260-S263 PolarHBondContact O-OG 3.48Å; S263-S265 PolarHBondContact O-N 2.96Å
264S51.7Low60.2Low83 Ų8365.7 Ų65.758%0.5840%0.402SS*.Hα-helixtrans-69.7-15.9174.473.40000114.7Y260 L261 G266Y260-S264 WeakPolarHBondContact O-CB 3.42Å; Y260-S264 PolarHBondContact O-N 2.86Å; L261-S264 PolarHBondContact O-N 3.42Å; L261-S264 PolarHBondContact O-OG 2.7Å; S264-G266 PolarHBondContact O-N 3.22Å
265S50.8Low59.5Low85 Ų8563 Ų6359%0.59438%0.383SS*.THydrogen-bonded Turntrans-76.7-2.8-176.4740000114.2S262 S263 G267S262-S265 PolarHBondContact O-N 3.14Å; S262-S265 PolarHBondContact O-OG 3.14Å; S263-S265 PolarHBondContact O-N 2.96Å; S265-G267 VanDerWaalsContact C-N 3.25Å; S265-G267 PolarHBondContact O-N 3.07Å
266G44.4Very low59.2Low77 Ų7762.2 Ų62.279%0.79438%0.378SS*.SBendtrans75.4-0.7166.700000116.2S264S264-G266 PolarHBondContact O-N 3.22Å
267G49.3Very low59Low40 Ų4061 Ų6141%0.41236%0.362SS..  trans-110.4128.4173.200000111.1S265 S269S265-G267 VanDerWaalsContact C-N 3.25Å; S265-G267 PolarHBondContact O-N 3.07Å; G267-S269 PolarHBondContact O-N 2.71Å
268S54Low58.6Low50 Ų5062.4 Ų62.435%0.3537%0.365SS..  trans-76.571.6165.481.60000109R176R176-S268 VanDerWaalsContact CD-OG 3.23Å; R176-S268 WeakPolarHBondContact CD-OG 3.5Å; R176-S268 PolarHBondContact NH1-OG 3.2Å
269S60.1Low58.3Low48 Ų4859.7 Ų59.734%0.33635%0.352SS..  trans-76.2157.6-17872.90000110.6G267 F271 D272G267-S269 PolarHBondContact O-N 2.71Å; S269-F271 PolarHBondContact O-N 2.84Å; S269-F271 WeakPolarHBondContact OG-CB 3.27Å; S269-F271 PolarHBondContact OG-N 3.1Å; S269-D272 WeakPolarHBondContact CB-OD2 3.38Å; S269-D272 PolarHBondContact N-OD2 2.96Å; S269-D272 PolarHBondContact O-N 2.82Å; S269-D272 VanDerWaalsContact O-N 3.11Å; S269-D272 VanDerWaalsContact OG-CG 3.27Å; S269-D272 PolarHBondContact OG-N 3.29Å; S269-D272 PolarHBondContact OG-OD2 3.46Å
270S59.8Low58.2Low64 Ų6458.1 Ų58.145%0.44834%0.343SS..Hα-helixtrans-56.8-28.4170.848.20000111.8R273 F274S270-R273 PolarHBondContact O-N 3.45Å; S270-F274 VanDerWaalsContact O-CD2 3.27Å; S270-F274 WeakPolarHBondContact O-CD2 3.31Å; S270-F274 PolarHBondContact O-N 3.46Å
271F61.3Low58Low122 Ų12250.1 Ų50.154%0.53531%0.312SS..Hα-helixtrans-63.4-39.8175.3-178-98.9000112.6F258 S269 R273 F274 A275F258-F271 HydrophobicContact CE1-CE1 4.4Å; F258-F271 AromaticContact CZ-CE1 3.8Å; F258-F271 HydrophobicContact CZ-CE1 3.8Å; F258-F271 AromaticContact CZ-CZ 3.83Å; F258-F271 HydrophobicContact CZ-CZ 3.83Å; S269-F271 PolarHBondContact O-N 2.84Å; S269-F271 WeakPolarHBondContact OG-CB 3.27Å; S269-F271 PolarHBondContact OG-N 3.1Å; F271-R273 VanDerWaalsContact C-N 3.27Å; F271-R273 PolarHBondContact O-N 2.72Å; F271-F274 PolarHBondContact O-N 2.94Å; F271-A275 VanDerWaalsContact O-CB 3.27Å; F271-A275 WeakPolarHBondContact O-CB 3.07Å; F271-A275 PolarHBondContact O-N 2.82Å
272D61.2Low58Low25 Ų2546.8 Ų46.813%0.13430%0.296CS..Hα-helixtrans-66.7-30.4179.4-54.3-51.4000112.3S262 S269 A275 S276S262-D272 WeakPolarHBondContact CB-OD1 3.38Å; S269-D272 WeakPolarHBondContact CB-OD2 3.38Å; S269-D272 PolarHBondContact N-OD2 2.96Å; S269-D272 PolarHBondContact O-N 2.82Å; S269-D272 VanDerWaalsContact O-N 3.11Å; S269-D272 VanDerWaalsContact OG-CG 3.27Å; S269-D272 PolarHBondContact OG-N 3.29Å; S269-D272 PolarHBondContact OG-OD2 3.46Å; D272-A275 WeakPolarHBondContact O-CB 3.47Å; D272-S276 WeakPolarHBondContact O-CB 3.43Å; D272-S276 PolarHBondContact O-N 3.27Å; D272-S276 PolarHBondContact O-OG 2.72Å
273R66.9Low58.4Low13 Ų1346.8 Ų46.85%0.04929%0.294CS..Hα-helixtrans-74.1-37.6175.1-53.8-170.9-166157.29.7112.5G17 F18 D20 R176 S270 F271 S276 V277G17-R273 WeakPolarHBondContact O-CD 3.5Å; G17-R273 PolarHBondContact O-NH1 3.45Å; F18-R273 HydrophobicContact CE1-CB 4.26Å; F18-R273 HydrophobicContact CZ-CB 4.43Å; F18-R273 WeakPolarHBondContact CZ-O 3.48Å; D20-R273 IonicContact OD2-CZ 3.56Å; D20-R273 IonicContact OD2-NH1 2.72Å; D20-R273 PolarHBondContact OD2-NH1 2.94Å; D20-R273 IonicContact OD2-NH2 3.5Å; R176-R273 PolarHBondContact O-NE 3.45Å; R176-R273 VanDerWaalsContact O-NE 3.15Å; S270-R273 PolarHBondContact O-N 3.45Å; F271-R273 VanDerWaalsContact C-N 3.27Å; F271-R273 PolarHBondContact O-N 2.72Å; R273-S276 WeakPolarHBondContact CA-OG 3.2Å; R273-S276 PolarHBondContact O-N 2.93Å; R273-S276 PolarHBondContact O-OG 3.19Å; R273-V277 PolarHBondContact O-N 3.45Å
274F64.1Low58.7Low70 Ų7043.6 Ų43.631%0.30727%0.271SS..Hα-helixtrans-71-39.7172.9-83.3-74.6000111.4F18 F21 I24 L28 S270 F271 S276 V277 F278F18-F274 HydrophobicContact CD1-CE1 4.23Å; F18-F274 HydrophobicContact CD1-CE2 4.21Å; F18-F274 AromaticContact CD1-CZ 3.94Å; F18-F274 HydrophobicContact CD1-CZ 3.94Å; F18-F274 AromaticContact CE1-CD1 3.88Å; F18-F274 HydrophobicContact CE1-CD1 3.88Å; F18-F274 HydrophobicContact CE1-CD2 4.12Å; F18-F274 AromaticContact CE1-CE1 3.79Å; F18-F274 HydrophobicContact CE1-CE1 3.79Å; F18-F274 HydrophobicContact CE1-CE2 4.02Å; F18-F274 HydrophobicContact CE1-CG 4.05Å; F18-F274 AromaticContact CE1-CZ 3.85Å; F18-F274 HydrophobicContact CE1-CZ 3.85Å; F21-F274 HydrophobicContact CE2-CE2 4.08Å; F21-F274 HydrophobicContact CZ-CE2 4.36Å; I24-F274 HydrophobicContact CD1-CZ 4.33Å; L28-F274 HydrophobicContact CD2-CE1 4.31Å; S270-F274 VanDerWaalsContact O-CD2 3.27Å; S270-F274 WeakPolarHBondContact O-CD2 3.31Å; S270-F274 PolarHBondContact O-N 3.46Å; F271-F274 PolarHBondContact O-N 2.94Å; F274-S276 PolarHBondContact O-N 3.41Å; F274-V277 WeakPolarHBondContact O-CB 3.22Å; F274-V277 PolarHBondContact O-N 3.36Å; F274-F278 VanDerWaalsContact O-CD2 3.25Å; F274-F278 WeakPolarHBondContact O-CD2 3.49Å
275A60Low59.2Low9 Ų941.2 Ų41.27%0.07425%0.252CS..Hα-helixtrans-55.4-41.4171.900000111.8F258 F271 D272 V277 F278 Y279F258-A275 HydrophobicContact CD1-CB 4.28Å; F258-A275 HydrophobicContact CE1-CB 3.59Å; F271-A275 VanDerWaalsContact O-CB 3.27Å; F271-A275 WeakPolarHBondContact O-CB 3.07Å; F271-A275 PolarHBondContact O-N 2.82Å; D272-A275 WeakPolarHBondContact O-CB 3.47Å; A275-V277 VanDerWaalsContact C-N 3.33Å; A275-V277 PolarHBondContact O-N 3.21Å; A275-F278 WeakPolarHBondContact O-CB 3.31Å; A275-F278 PolarHBondContact O-N 3.38Å; A275-F278 VanDerWaalsContact O-N 3.07Å; A275-Y279 WeakPolarHBondContact O-CD1 3.04Å; A275-Y279 PolarHBondContact O-N 3.15Å
276S63.7Low59.7Low0 Ų040.1 Ų40.10%024%0.239CC..Hα-helixtrans-69.4-25.9-178.365.90000116.9H177 F178 D272 R273 F274 Y279 T280H177-S276 WeakPolarHBondContact CE1-CB 3.37Å; H177-S276 PolarHBondContact CE1-OG 3.28Å; H177-S276 WeakPolarHBondContact NE2-CB 3.29Å; H177-S276 PolarHBondContact NE2-OG 3.07Å; F178-S276 VanDerWaalsContact CE1-OG 3.26Å; F178-S276 WeakPolarHBondContact CE1-OG 3.41Å; D272-S276 WeakPolarHBondContact O-CB 3.43Å; D272-S276 PolarHBondContact O-N 3.27Å; D272-S276 PolarHBondContact O-OG 2.72Å; R273-S276 WeakPolarHBondContact CA-OG 3.2Å; R273-S276 PolarHBondContact O-N 2.93Å; R273-S276 PolarHBondContact O-OG 3.19Å; F274-S276 PolarHBondContact O-N 3.41Å; S276-Y279 VanDerWaalsContact CA-CD1 3.47Å; S276-Y279 VanDerWaalsContact CA-CZ 3.43Å; S276-Y279 VanDerWaalsContact CB-CE1 3.45Å; S276-Y279 WeakPolarHBondContact CB-OH 3.49Å; S276-T280 WeakPolarHBondContact O-CB 3Å; S276-T280 WeakPolarHBondContact O-CG2 3.44Å; S276-T280 PolarHBondContact O-N 2.83Å; S276-T280 PolarHBondContact O-OG1 3.05Å
277V62.7Low60.7Low14 Ų1436.5 Ų36.59%0.08520%0.201CC..Hα-helixtrans-63.2-43.5166.8162.50000111.8F18 F32 F178 R273 F274 A275 Y279 V281 V282F18-V277 HydrophobicContact CE2-CG2 3.81Å; F18-V277 HydrophobicContact CZ-CG2 3.46Å; F18-V277 VanDerWaalsContact CZ-CG2 3.46Å; F32-V277 HydrophobicContact CE1-CB 4.2Å; F32-V277 HydrophobicContact CE1-CG1 3.41Å; F32-V277 VanDerWaalsContact CE1-CG1 3.41Å; F32-V277 HydrophobicContact CE1-CG2 3.84Å; F32-V277 HydrophobicContact CZ-CB 4.12Å; F32-V277 HydrophobicContact CZ-CG1 3.59Å; F32-V277 HydrophobicContact CZ-CG2 3.44Å; F32-V277 VanDerWaalsContact CZ-CG2 3.44Å; F178-V277 HydrophobicContact CD1-CG2 4.41Å; F178-V277 HydrophobicContact CE1-CG2 3.74Å; F178-V277 HydrophobicContact CZ-CG2 4.07Å; R273-V277 PolarHBondContact O-N 3.45Å; F274-V277 WeakPolarHBondContact O-CB 3.22Å; F274-V277 PolarHBondContact O-N 3.36Å; A275-V277 VanDerWaalsContact C-N 3.33Å; A275-V277 PolarHBondContact O-N 3.21Å; V277-Y279 PolarHBondContact O-N 3.11Å; V277-V281 WeakPolarHBondContact O-CB 3.12Å; V277-V281 PolarHBondContact O-N 2.63Å; V277-V281 VanDerWaalsContact O-N 3.07Å; V277-V282 HydrophobicContact CG1-CG2 4.36Å; V277-V282 PolarHBondContact O-N 2.85Å
278F61.4Low61.1Low131 Ų13134.6 Ų34.658%0.57518%0.182SC*.Iπ-helixtrans-63.4-42.3-177.8-78.7-81.3000111.6F274 A275 V282 I283F274-F278 VanDerWaalsContact O-CD2 3.25Å; F274-F278 WeakPolarHBondContact O-CD2 3.49Å; A275-F278 WeakPolarHBondContact O-CB 3.31Å; A275-F278 PolarHBondContact O-N 3.38Å; A275-F278 VanDerWaalsContact O-N 3.07Å; F278-V282 HydrophobicContact CD1-CB 4.23Å; F278-V282 HydrophobicContact CD1-CG1 4.29Å; F278-V282 HydrophobicContact CD1-CG2 4.06Å; F278-V282 CarbonylContact O-C 3.55Å; F278-V282 WeakPolarHBondContact O-CA 3.47Å; F278-V282 VanDerWaalsContact O-CB 3.28Å; F278-V282 WeakPolarHBondContact O-CB 3.16Å; F278-V282 PolarHBondContact O-N 3.35Å; F278-I283 WeakPolarHBondContact O-CG1 3.38Å; F278-I283 PolarHBondContact O-N 3.13Å; F278-I283 VanDerWaalsContact O-N 3.08Å
279Y59.4Low61.4Low32 Ų3234.5 Ų34.513%0.12518%0.177CC..Iπ-helixtrans-86.4-29.7-176.367.6-108.6000115.2V259 A275 S276 V277V259-Y279 HydrophobicContact CB-CD1 4.31Å; V259-Y279 HydrophobicContact CB-CE1 3.88Å; V259-Y279 HydrophobicContact CG1-CE1 3.68Å; V259-Y279 HydrophobicContact CG1-CE2 4.13Å; V259-Y279 WeakPolarHBondContact CG1-OH 3.46Å; V259-Y279 HydrophobicContact CG2-CD1 3.17Å; V259-Y279 HydrophobicContact CG2-CD2 3.64Å; V259-Y279 HydrophobicContact CG2-CE1 3.15Å; V259-Y279 HydrophobicContact CG2-CE2 3.7Å; V259-Y279 HydrophobicContact CG2-CG 3.41Å; V259-Y279 VanDerWaalsContact CG2-CG 3.41Å; A275-Y279 WeakPolarHBondContact O-CD1 3.04Å; A275-Y279 PolarHBondContact O-N 3.15Å; S276-Y279 VanDerWaalsContact CA-CD1 3.47Å; S276-Y279 VanDerWaalsContact CA-CZ 3.43Å; S276-Y279 VanDerWaalsContact CB-CE1 3.45Å; S276-Y279 WeakPolarHBondContact CB-OH 3.49Å; V277-Y279 PolarHBondContact O-N 3.11Å
280T59.7Low61.8Low0 Ų033.1 Ų33.10%017%0.166CC..Iπ-helixtrans-90.3-22.2179.958.70000114.3Y74 F105 F178 F179 S276Y74-T280 WeakPolarHBondContact CD1-O 3.28Å; Y74-T280 WeakPolarHBondContact CE1-O 3.28Å; F105-T280 HydrophobicContact CE2-CG2 3.76Å; F105-T280 HydrophobicContact CZ-CG2 3.88Å; F178-T280 VanDerWaalsContact CZ-OG1 3.29Å; F178-T280 WeakPolarHBondContact CZ-OG1 3.33Å; F179-T280 HydrophobicContact CE1-CG2 3.52Å; F179-T280 HydrophobicContact CZ-CG2 3.67Å; S276-T280 WeakPolarHBondContact O-CB 3Å; S276-T280 WeakPolarHBondContact O-CG2 3.44Å; S276-T280 PolarHBondContact O-N 2.83Å; S276-T280 PolarHBondContact O-OG1 3.05Å
281V59.7Low62.1Low0 Ų030.3 Ų30.30%015%0.145CC..Iπ-helixtrans-120-49.6-175.1-170.10000110.9I35 V79 F178 V277 M285I35-V281 HydrophobicContact CG2-CG1 3.37Å; V79-V281 HydrophobicContact CG2-CG1 4.13Å; V79-V281 HydrophobicContact CG2-CG2 4.15Å; F178-V281 HydrophobicContact CE2-CG2 4.49Å; V277-V281 WeakPolarHBondContact O-CB 3.12Å; V277-V281 PolarHBondContact O-N 2.63Å; V277-V281 VanDerWaalsContact O-N 3.07Å; V281-M285 WeakPolarHBondContact O-CB 3.39Å; V281-M285 WeakPolarHBondContact O-CG 3.16Å; V281-M285 PolarHBondContact O-N 2.9Å
282V61.9Low62.2Low32 Ų3224.6 Ų24.619%0.19412%0.121CC..Iπ-helixtrans-74.2-29.2-173.5-176.50000112.2V277 F278 M285 L286V277-V282 HydrophobicContact CG1-CG2 4.36Å; V277-V282 PolarHBondContact O-N 2.85Å; F278-V282 HydrophobicContact CD1-CB 4.23Å; F278-V282 HydrophobicContact CD1-CG1 4.29Å; F278-V282 HydrophobicContact CD1-CG2 4.06Å; F278-V282 CarbonylContact O-C 3.55Å; F278-V282 WeakPolarHBondContact O-CA 3.47Å; F278-V282 VanDerWaalsContact O-CB 3.28Å; F278-V282 WeakPolarHBondContact O-CB 3.16Å; F278-V282 PolarHBondContact O-N 3.35Å; V282-M285 WeakPolarHBondContact O-CB 3.25Å; V282-L286 HydrophobicContact CG1-CD1 3.86Å; V282-L286 HydrophobicContact CG1-CG 4.29Å; V282-L286 WeakPolarHBondContact O-CB 3.43Å; V282-L286 WeakPolarHBondContact O-CD1 3.41Å; V282-L286 WeakPolarHBondContact O-CG 3.43Å; V282-L286 PolarHBondContact O-N 3.48Å; V282-L286 VanDerWaalsContact O-N 3.08Å
283I62.9Low62.1Low17 Ų1727.9 Ų27.99%0.08714%0.138CC..Hα-helixtrans-79.1-47.3179.8-71.3176.1000113.1L251 S255 F278 M285 L286 N287L251-I283 HydrophobicContact CB-CG2 4.48Å; S255-I283 WeakPolarHBondContact OG-CD1 3.48Å; F278-I283 WeakPolarHBondContact O-CG1 3.38Å; F278-I283 PolarHBondContact O-N 3.13Å; F278-I283 VanDerWaalsContact O-N 3.08Å; I283-M285 PolarHBondContact O-N 3.36Å; I283-L286 PolarHBondContact O-N 3.34Å; I283-N287 PolarHBondContact O-N 2.99Å
284P57.7Low62.1Low3 Ų335.1 Ų35.12%0.01917%0.165CC..Hα-helixtrans-57.7-31.6169.6-26.936.4000112.9Y74 P288Y74-P284 HydrophobicContact CD1-CG 3.95Å; Y74-P284 HydrophobicContact CE1-CG 4.15Å; P284-P288 WeakPolarHBondContact O-CD 3.46Å
285M61Low62.3Low34 Ų3433.6 Ų33.617%0.16716%0.16CC..Hα-helixtrans-60.9-45.5168.2-81.3-105.8-55.400112.7I35 S39 V281 V282 I283 P288I35-M285 HydrophobicContact CB-CE 4.23Å; I35-M285 HydrophobicContact CB-SD 3.89Å; I35-M285 HydrophobicContact CG1-CE 3.95Å; I35-M285 HydrophobicContact CG1-SD 4.28Å; I35-M285 HydrophobicContact CG2-CE 4.03Å; I35-M285 HydrophobicContact CG2-CG 3.65Å; I35-M285 HydrophobicContact CG2-SD 3.34Å; I35-M285 WeakPolarHBondContact CG2-SD 3.48Å; S39-M285 WeakPolarHBondContact OG-CG 3.46Å; S39-M285 PolarHBondContact OG-SD 2.91Å; V281-M285 WeakPolarHBondContact O-CB 3.39Å; V281-M285 WeakPolarHBondContact O-CG 3.16Å; V281-M285 PolarHBondContact O-N 2.9Å; V282-M285 WeakPolarHBondContact O-CB 3.25Å; I283-M285 PolarHBondContact O-N 3.36Å; M285-P288 WeakPolarHBondContact O-CD 3.28Å
286L61.7Low63Low62 Ų6240.3 Ų40.333%0.32519%0.187SC..Hα-helixtrans-77.9-32.2-171.5-75.4171.3000112.6L251 V282 I283 L289 I290L251-L286 HydrophobicContact CD1-CB 4.48Å; L251-L286 HydrophobicContact CD1-CD1 4.45Å; V282-L286 HydrophobicContact CG1-CD1 3.86Å; V282-L286 HydrophobicContact CG1-CG 4.29Å; V282-L286 WeakPolarHBondContact O-CB 3.43Å; V282-L286 WeakPolarHBondContact O-CD1 3.41Å; V282-L286 WeakPolarHBondContact O-CG 3.43Å; V282-L286 PolarHBondContact O-N 3.48Å; V282-L286 VanDerWaalsContact O-N 3.08Å; I283-L286 PolarHBondContact O-N 3.34Å; L286-L289 PolarHBondContact O-N 3.18Å; L286-L289 VanDerWaalsContact O-N 3.15Å; L286-I290 HydrophobicContact CB-CD1 3.99Å; L286-I290 WeakPolarHBondContact O-CB 3.33Å; L286-I290 WeakPolarHBondContact O-CD1 3.35Å; L286-I290 WeakPolarHBondContact O-CG1 2.97Å; L286-I290 PolarHBondContact O-N 3.28Å
287N65.2Low63.5Low0 Ų045.2 Ų45.20%021%0.21CC..Hα-helixtrans-46.4-60.9179.5-81-11.2000112.6E112 I283 L289 I290 Y291E112-N287 PolarHBondContact OE1-ND2 3.05Å; I283-N287 PolarHBondContact O-N 2.99Å; N287-L289 VanDerWaalsContact C-N 3.34Å; N287-L289 PolarHBondContact O-N 3.41Å; N287-I290 PolarHBondContact O-N 2.67Å; N287-Y291 WeakPolarHBondContact O-CD2 3.42Å; N287-Y291 PolarHBondContact O-N 3.29Å; N287-Y291 VanDerWaalsContact O-N 3.12Å
288P58.7Low64.1Low1 Ų145 Ų451%0.00621%0.209CC..Hα-helixtrans-72.4-25.8-177.332.9-40.4000112.6W42 N43 L46 P284 M285 S292W42-P288 PolarHBondContact NE1-O 2.9Å; N43-P288 WeakPolarHBondContact OD1-CB 3.35Å; N43-P288 VanDerWaalsContact OD1-CG 3.31Å; N43-P288 WeakPolarHBondContact OD1-CG 3.41Å; L46-P288 HydrophobicContact CD2-CB 4Å; P284-P288 WeakPolarHBondContact O-CD 3.46Å; M285-P288 WeakPolarHBondContact O-CD 3.28Å; P288-S292 WeakPolarHBondContact O-CB 3.47Å; P288-S292 PolarHBondContact O-N 3.15Å; P288-S292 VanDerWaalsContact O-N 3.07Å; P288-S292 PolarHBondContact O-OG 2.95Å
289L60.5Low65Low47 Ų4743.6 Ų43.625%0.24620%0.202CC..Hα-helixtrans-67.2-38.7172.2-71171000111.5W42 L286 N287 S292 L293W42-L289 HydrophobicContact CD2-CD2 3.7Å; W42-L289 HydrophobicContact CE3-CD2 4.11Å; W42-L289 HydrophobicContact CG-CD2 4.12Å; W42-L289 HydrophobicContact CH2-CD2 4.35Å; W42-L289 HydrophobicContact CZ2-CD2 3.98Å; W42-L289 HydrophobicContact CZ3-CD2 4.41Å; L286-L289 PolarHBondContact O-N 3.18Å; L286-L289 VanDerWaalsContact O-N 3.15Å; N287-L289 VanDerWaalsContact C-N 3.34Å; N287-L289 PolarHBondContact O-N 3.41Å; L289-S292 WeakPolarHBondContact CA-OG 3.37Å; L289-S292 PolarHBondContact O-N 3.35Å; L289-S292 PolarHBondContact O-OG 3.03Å; L289-L293 HydrophobicContact CB-CD1 4.17Å; L289-L293 HydrophobicContact CD2-CD1 3.95Å; L289-L293 HydrophobicContact CD2-CG 4.39Å; L289-L293 WeakPolarHBondContact O-CB 3.35Å; L289-L293 WeakPolarHBondContact O-CG 3.32Å; L289-L293 PolarHBondContact O-N 3.32Å
290I68Low66Low20 Ų2044.4 Ų44.410%0.10321%0.209CC..Hα-helixtrans-67-44177.3-70.5161.3000110.7S244 T247 A248 L251 L286 N287 S292S244-I290 VanDerWaalsContact O-CG2 3.29Å; S244-I290 WeakPolarHBondContact O-CG2 3.47Å; T247-I290 HydrophobicContact CG2-CD1 4.04Å; T247-I290 HydrophobicContact CG2-CG1 4.41Å; T247-I290 HydrophobicContact CG2-CG2 4.02Å; A248-I290 HydrophobicContact CB-CG2 4.49Å; L251-I290 HydrophobicContact CD1-CD1 3.2Å; L286-I290 HydrophobicContact CB-CD1 3.99Å; L286-I290 WeakPolarHBondContact O-CB 3.33Å; L286-I290 WeakPolarHBondContact O-CD1 3.35Å; L286-I290 WeakPolarHBondContact O-CG1 2.97Å; L286-I290 PolarHBondContact O-N 3.28Å; N287-I290 PolarHBondContact O-N 2.67Å; I290-S292 VanDerWaalsContact C-N 3.33Å; I290-S292 PolarHBondContact O-N 3.49Å
291Y65.8Low67Low4 Ų444.4 Ų44.42%0.01621%0.209CC..Hα-helixtrans-68.3-31.9178.6-73.7-70.8000112.9M60 L64 L67 M116 M119 H245 A248 N287 N295 I298M60-Y291 HydrophobicContact CE-CD1 4.22Å; M60-Y291 HydrophobicContact CE-CE1 3.87Å; L64-Y291 HydrophobicContact CD1-CD1 4.21Å; L64-Y291 HydrophobicContact CD1-CD2 3.48Å; L64-Y291 VanDerWaalsContact CD1-CD2 3.48Å; L64-Y291 HydrophobicContact CD1-CE2 4.13Å; L64-Y291 HydrophobicContact CD1-CG 3.57Å; L64-Y291 HydrophobicContact CD2-CG 4.39Å; L67-Y291 HydrophobicContact CD2-CE2 3.89Å; M116-Y291 PolarHBondContact SD-OH 2.74Å; M116-Y291 VanDerWaalsContact SD-OH 3.39Å; M119-Y291 HydrophobicContact CE-CD1 4.42Å; M119-Y291 HydrophobicContact CE-CE1 3.75Å; M119-Y291 HydrophobicContact CE-CE2 4.48Å; H245-Y291 HydrophobicContact CB-CE1 4.03Å; H245-Y291 PolarHBondContact CD2-OH 3.02Å; H245-Y291 VanDerWaalsContact CD2-OH 3.3Å; A248-Y291 HydrophobicContact CB-CD2 4.47Å; A248-Y291 HydrophobicContact CB-CE1 4.49Å; A248-Y291 HydrophobicContact CB-CE2 3.51Å; A248-Y291 VanDerWaalsContact CB-OH 3.29Å; A248-Y291 WeakPolarHBondContact CB-OH 3.45Å; N287-Y291 WeakPolarHBondContact O-CD2 3.42Å; N287-Y291 PolarHBondContact O-N 3.29Å; N287-Y291 VanDerWaalsContact O-N 3.12Å; Y291-N295 WeakPolarHBondContact O-CB 3.27Å; Y291-I298 WeakPolarHBondContact O-CD1 3.42Å
292S64.1Low68Low3 Ų348.1 Ų48.12%0.02123%0.228CC..Hα-helixtrans-94.2-47.8-173.756.20000114.3W42 P288 L289 I290 R294 N295W42-S292 WeakPolarHBondContact CZ2-OG 3.36Å; W42-S292 PolarHBondContact NE1-OG 3.34Å; P288-S292 WeakPolarHBondContact O-CB 3.47Å; P288-S292 PolarHBondContact O-N 3.15Å; P288-S292 VanDerWaalsContact O-N 3.07Å; P288-S292 PolarHBondContact O-OG 2.95Å; L289-S292 WeakPolarHBondContact CA-OG 3.37Å; L289-S292 PolarHBondContact O-N 3.35Å; L289-S292 PolarHBondContact O-OG 3.03Å; I290-S292 VanDerWaalsContact C-N 3.33Å; I290-S292 PolarHBondContact O-N 3.49Å; S292-R294 VanDerWaalsContact C-N 3.26Å; S292-R294 PolarHBondContact O-N 3.35Å; S292-N295 PolarHBondContact O-N 3.16Å
293L60Low69Low94 Ų9452.3 Ų52.349%0.49224%0.244SC..Hα-helixtrans-72.6-19.8-174.3-65.4176.2000112.9W42 L289 K299W42-L293 HydrophobicContact CH2-CD2 4.07Å; W42-L293 HydrophobicContact CZ2-CD2 4.32Å; W42-L293 HydrophobicContact CZ2-CG 4.48Å; L289-L293 HydrophobicContact CB-CD1 4.17Å; L289-L293 HydrophobicContact CD2-CD1 3.95Å; L289-L293 HydrophobicContact CD2-CG 4.39Å; L289-L293 WeakPolarHBondContact O-CB 3.35Å; L289-L293 WeakPolarHBondContact O-CG 3.32Å; L289-L293 PolarHBondContact O-N 3.32Å; L293-K299 WeakPolarHBondContact O-CE 3.23Å; L293-K299 PolarHBondContact O-NZ 2.85Å
294R65.3Low69.9Low165 Ų16554.9 Ų54.962%0.62325%0.253SS*.SBendtrans-96.7-16.7173.3-70.8-174.9169.2-171.5-2.3113.1T247 S292T247-R294 PolarHBondContact OG1-NH1 3.41Å; S292-R294 VanDerWaalsContact C-N 3.26Å; S292-R294 PolarHBondContact O-N 3.35Å
295N69.8Low71.1Confident37 Ų3756 Ų5620%0.19826%0.258CS..  trans-94.2117.5-174.7-167.6-25.2000111.8Y61 Y291 S292 E297 I298 K299Y61-N295 PolarHBondContact OH-ND2 3.36Å; Y61-N295 PolarHBondContact OH-OD1 2.92Å; Y291-N295 WeakPolarHBondContact O-CB 3.27Å; S292-N295 PolarHBondContact O-N 3.16Å; N295-E297 VanDerWaalsContact C-N 3.27Å; N295-E297 PolarHBondContact O-N 3.42Å; N295-E297 WeakPolarHBondContact OD1-CB 3.27Å; N295-E297 PolarHBondContact OD1-N 2.89Å; N295-I298 HydrophobicContact CB-CB 4.46Å; N295-I298 HydrophobicContact CB-CD1 4.25Å; N295-I298 HydrophobicContact CB-CG1 4.43Å; N295-I298 PolarHBondContact O-N 3.45Å; N295-K299 PolarHBondContact O-N 2.9Å
296K73.8Confident72Confident150 Ų15059.8 Ų59.865%0.65228%0.275SS*.Hα-helixtrans-60.6-36.9179.1-173.3-179.6174.5-175.80112.1I298 K299 D300K296-I298 PolarHBondContact O-N 2.88Å; K296-K299 PolarHBondContact O-N 3.45Å; K296-D300 WeakPolarHBondContact CE-OD2 3.43Å; K296-D300 WeakPolarHBondContact O-CB 3.33Å; K296-D300 VanDerWaalsContact O-CG 3.23Å; K296-D300 PolarHBondContact O-N 3.29Å
297E75Confident72.9Confident104 Ų10462.9 Ų62.949%0.48629%0.288SS..Hα-helixtrans-66.5-38.9-177.1-63.3175.7174.700111.7L56 Y61 N295 D300 A301L56-E297 HydrophobicContact CD2-CB 4.25Å; Y61-E297 VanDerWaalsContact CE2-OE2 3.28Å; Y61-E297 WeakPolarHBondContact CE2-OE2 3.49Å; Y61-E297 VanDerWaalsContact CZ-OE2 3.32Å; Y61-E297 VanDerWaalsContact OH-CB 3.31Å; Y61-E297 WeakPolarHBondContact OH-CB 3.4Å; Y61-E297 PolarHBondContact OH-OE2 2.89Å; N295-E297 VanDerWaalsContact C-N 3.27Å; N295-E297 PolarHBondContact O-N 3.42Å; N295-E297 WeakPolarHBondContact OD1-CB 3.27Å; N295-E297 PolarHBondContact OD1-N 2.89Å; E297-D300 PolarHBondContact O-N 3.32Å; E297-A301 WeakPolarHBondContact O-CB 3.39Å; E297-A301 PolarHBondContact O-N 2.96Å
298I75.4Confident73.4Confident10 Ų1070.4 Ų70.45%0.05132%0.317CS..Hα-helixtrans-67.8-41.5174.4-69.1171.9000110.8L46 L49 Y61 L64 Y291 N295 K296 D300 A301 L302L46-I298 HydrophobicContact CD1-CD1 4.01Å; L46-I298 HydrophobicContact CD1-CG1 4.49Å; L46-I298 HydrophobicContact CD1-CG2 4.37Å; L49-I298 HydrophobicContact CD2-CG2 4.01Å; Y61-I298 HydrophobicContact CD1-CD1 4.46Å; Y61-I298 HydrophobicContact CE1-CD1 3.81Å; Y61-I298 HydrophobicContact CE1-CG1 3.81Å; L64-I298 HydrophobicContact CD2-CD1 4.03Å; Y291-I298 WeakPolarHBondContact O-CD1 3.42Å; N295-I298 HydrophobicContact CB-CB 4.46Å; N295-I298 HydrophobicContact CB-CD1 4.25Å; N295-I298 HydrophobicContact CB-CG1 4.43Å; N295-I298 PolarHBondContact O-N 3.45Å; K296-I298 PolarHBondContact O-N 2.88Å; I298-D300 PolarHBondContact O-N 3.35Å; I298-A301 PolarHBondContact O-N 2.73Å; I298-L302 PolarHBondContact O-N 3.17Å
299K79.5Confident73.8Confident101 Ų10179.3 Ų79.344%0.43935%0.35SS..Hα-helixtrans-62-43.4175.5-70.2-179.4-178.1177.60112.2L293 N295 K296 A301 L302 K303L293-K299 WeakPolarHBondContact O-CE 3.23Å; L293-K299 PolarHBondContact O-NZ 2.85Å; N295-K299 PolarHBondContact O-N 2.9Å; K296-K299 PolarHBondContact O-N 3.45Å; K299-A301 VanDerWaalsContact C-N 3.34Å; K299-L302 PolarHBondContact O-N 3.03Å; K299-K303 WeakPolarHBondContact O-CG 3Å; K299-K303 PolarHBondContact O-N 3.34Å; K299-K303 VanDerWaalsContact O-N 3.08Å
300D81.3Confident73.8Confident49 Ų4982.6 Ų82.626%0.26238%0.376SS..Hα-helixtrans-68.5-36.7179.6-68.6-16.7000110.6K296 E297 I298 K303 R304K296-D300 WeakPolarHBondContact CE-OD2 3.43Å; K296-D300 WeakPolarHBondContact O-CB 3.33Å; K296-D300 VanDerWaalsContact O-CG 3.23Å; K296-D300 PolarHBondContact O-N 3.29Å; E297-D300 PolarHBondContact O-N 3.32Å; I298-D300 PolarHBondContact O-N 3.35Å; D300-K303 PolarHBondContact O-N 3.34Å; D300-R304 WeakPolarHBondContact O-CG 3.08Å; D300-R304 PolarHBondContact O-N 3.1Å
301A79.7Confident72.7Confident0 Ų089.5 Ų89.50%042%0.424CS..Hα-helixtrans-63.6-42172.300000112.4L49 D53 L56 E297 I298 K299 K303 R304 L305L49-A301 HydrophobicContact CD1-CB 3.95Å; L49-A301 HydrophobicContact CD2-CB 4.11Å; L49-A301 HydrophobicContact CG-CB 4.11Å; D53-A301 HydrophobicContact CB-CB 4.31Å; D53-A301 WeakPolarHBondContact OD2-CA 3.49Å; D53-A301 VanDerWaalsContact OD2-CB 3.3Å; D53-A301 WeakPolarHBondContact OD2-CB 3.39Å; L56-A301 HydrophobicContact CD1-CB 3.66Å; L56-A301 HydrophobicContact CD2-CB 4.45Å; L56-A301 HydrophobicContact CG-CB 4.16Å; E297-A301 WeakPolarHBondContact O-CB 3.39Å; E297-A301 PolarHBondContact O-N 2.96Å; I298-A301 PolarHBondContact O-N 2.73Å; K299-A301 VanDerWaalsContact C-N 3.34Å; A301-K303 VanDerWaalsContact C-N 3.34Å; A301-K303 PolarHBondContact O-N 2.81Å; A301-R304 PolarHBondContact O-N 3.42Å; A301-L305 WeakPolarHBondContact O-CB 2.95Å; A301-L305 PolarHBondContact O-N 3.3Å
302L80.6Confident73.1Confident78 Ų7893.8 Ų93.841%0.40844%0.444SS..Hα-helixtrans-61.8-41.9176.9-172.266.5000111.7I298 K299 L305 Q306I298-L302 PolarHBondContact O-N 3.17Å; K299-L302 PolarHBondContact O-N 3.03Å; L302-L305 PolarHBondContact O-N 3.26Å; L302-Q306 WeakPolarHBondContact O-CG 3.29Å; L302-Q306 PolarHBondContact O-N 3.26Å
303K82.8Confident73.5Confident120 Ų12098.6 Ų98.652%0.52247%0.467SS..Hα-helixtrans-60.9-48.1174.4-71.9176.7-179.3179.70112K299 D300 A301 L305 Q306 E307K299-K303 WeakPolarHBondContact O-CG 3Å; K299-K303 PolarHBondContact O-N 3.34Å; K299-K303 VanDerWaalsContact O-N 3.08Å; D300-K303 PolarHBondContact O-N 3.34Å; A301-K303 VanDerWaalsContact C-N 3.34Å; A301-K303 PolarHBondContact O-N 2.81Å; K303-L305 VanDerWaalsContact C-N 3.27Å; K303-L305 PolarHBondContact O-N 3.45Å; K303-Q306 WeakPolarHBondContact O-CB 3.46Å; K303-Q306 PolarHBondContact O-N 3.04Å; K303-Q306 VanDerWaalsContact O-N 3.14Å; K303-E307 WeakPolarHBondContact O-CG 3.45Å; K303-E307 PolarHBondContact O-N 2.96Å
304R82.4Confident74.3Confident71 Ų7198.8 Ų98.827%0.26847%0.465SS..Hα-helixtrans-58.8-39.3176.5-73.4-172.7-66.3-89.55.2112.3D53 D300 A301 E307 R308D53-R304 IonicContact OD1-NH2 3.83Å; D53-R304 IonicContact OD2-CZ 3.2Å; D53-R304 IonicContact OD2-NE 2.87Å; D53-R304 PolarHBondContact OD2-NE 3.33Å; D53-R304 IonicContact OD2-NH2 2.7Å; D53-R304 PolarHBondContact OD2-NH2 3.33Å; D300-R304 WeakPolarHBondContact O-CG 3.08Å; D300-R304 PolarHBondContact O-N 3.1Å; A301-R304 PolarHBondContact O-N 3.42Å; R304-E307 PolarHBondContact O-N 1.99Å; R304-R308 WeakPolarHBondContact O-CG 3.39Å; R304-R308 PolarHBondContact O-N 3.27Å
305L81.8Confident74.8Confident25 Ų2594.9 Ų94.913%0.13146%0.456CS..Hα-helixtrans-66.9-39.3177.6-17367.9000111.8L49 M52 A301 L302 K303 R308 R309L49-L305 HydrophobicContact CD1-CB 4.15Å; L49-L305 HydrophobicContact CD1-CD2 3.9Å; M52-L305 HydrophobicContact CE-CD1 3.5Å; M52-L305 HydrophobicContact SD-CD1 3.78Å; A301-L305 WeakPolarHBondContact O-CB 2.95Å; A301-L305 PolarHBondContact O-N 3.3Å; L302-L305 PolarHBondContact O-N 3.26Å; K303-L305 VanDerWaalsContact C-N 3.27Å; K303-L305 PolarHBondContact O-N 3.45Å; L305-R308 PolarHBondContact O-N 3.17Å; L305-R309 PolarHBondContact O-N 3.2Å
306Q81.1Confident75.1Confident114 Ų11498.6 Ų98.653%0.53347%0.472SS..Hα-helixtrans-65-45.7174.7-73173-26.700111.4L302 K303 R308 R309 C310L302-Q306 WeakPolarHBondContact O-CG 3.29Å; L302-Q306 PolarHBondContact O-N 3.26Å; K303-Q306 WeakPolarHBondContact O-CB 3.46Å; K303-Q306 PolarHBondContact O-N 3.04Å; K303-Q306 VanDerWaalsContact O-N 3.14Å; Q306-R308 VanDerWaalsContact C-N 3.31Å; Q306-R308 PolarHBondContact O-N 3.09Å; Q306-R309 PolarHBondContact O-N 2.93Å; Q306-R309 VanDerWaalsContact O-N 3.13Å; Q306-C310 PolarHBondContact O-N 3.02Å; Q306-C310 VanDerWaalsContact O-N 3.09Å; Q306-C310 PolarHBondContact O-SG 3.4Å; Q306-C310 VanDerWaalsContact O-SG 3.38Å
307E80.7Confident75.2Confident127 Ų12795.1 Ų95.159%0.59346%0.46SS*.Hα-helixtrans-58.2-41.7176-71.6166.9-176.100111.9K303 R304 R309 C310K303-E307 WeakPolarHBondContact O-CG 3.45Å; K303-E307 PolarHBondContact O-N 2.96Å; R304-E307 PolarHBondContact O-N 1.99Å; E307-R309 VanDerWaalsContact C-N 3.34Å; E307-R309 PolarHBondContact O-N 2.82Å; E307-C310 PolarHBondContact O-N 2.83Å
308R76.3Confident75.2Confident159 Ų15994.5 Ų94.560%0.646%0.458SS*.Hα-helixtrans-69.7-24.4177-74.1179.4-177.8-171.71.5114.6R304 L305 Q306R304-R308 WeakPolarHBondContact O-CG 3.39Å; R304-R308 PolarHBondContact O-N 3.27Å; L305-R308 PolarHBondContact O-N 3.17Å; Q306-R308 VanDerWaalsContact C-N 3.31Å; Q306-R308 PolarHBondContact O-N 3.09Å
309R66.3Low75.2Confident188 Ų188101 Ų10171%0.70949%0.49SS*.Hα-helixtrans-87.2-19.3176.5-81.2-173.6-178.6179.91.7113.2L305 Q306 E307L305-R309 PolarHBondContact O-N 3.2Å; Q306-R309 PolarHBondContact O-N 2.93Å; Q306-R309 VanDerWaalsContact O-N 3.13Å; E307-R309 VanDerWaalsContact C-N 3.34Å; E307-R309 PolarHBondContact O-N 2.82Å
310C59.8Low74.9Confident116 Ų116101 Ų10178%0.78449%0.494SS*.  trans-85.3-9.1176.3-70.70000113.4Q306 E307Q306-C310 PolarHBondContact O-N 3.02Å; Q306-C310 VanDerWaalsContact O-N 3.09Å; Q306-C310 PolarHBondContact O-SG 3.4Å; Q306-C310 VanDerWaalsContact O-SG 3.38Å; E307-C310 PolarHBondContact O-N 2.83Å
311C45.6Very low74.3Confident165 Ų165105.7 Ų105.7100%1.11552%0.515SS*.  trans-97.80169.8-67.20000110.4

Retrieved 311 of 311 residues in 128.6 ms (Link to these results)

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