A0A3Q0KEK7_SCHMA Loading...

Putative cell division cycle

AlphaFold DB , UniProt , Accession A0A3Q0KEK7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 802 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
1M29.8Very low55.3Low234 Ų23496.2 Ų96.2100%1.15358%0.583SS**  0104.30-56.6-156.2-155.700105.4
2D34.4Very low57.6Low141 Ų14193.3 Ų93.375%0.75457%0.57SS**  cis-139.213512.7-69.8-35.1000108.2S4D2-S4 PolarHBondContact O-N 2.9Å
3G35.3Very low59.6Low82 Ų8289.8 Ų89.885%0.84555%0.546SS*.  trans-73.980.3164.900000107.8T5G3-T5 VanDerWaalsContact C-N 3.25Å; G3-T5 PolarHBondContact O-N 3.03Å
4S40.6Very low61.1Low98 Ų9888.4 Ų88.469%0.68554%0.541SS*.  trans-66.994.6163.547.50000107D2 V6D2-S4 PolarHBondContact O-N 2.9Å; S4-V6 PolarHBondContact O-N 2.78Å
5T44.9Very low62.6Low109 Ų10987.6 Ų87.667%0.66954%0.536SS*.  trans-43.7114.4156.745.90000106.8G3 I7G3-T5 VanDerWaalsContact C-N 3.25Å; G3-T5 PolarHBondContact O-N 3.03Å; T5-I7 VanDerWaalsContact C-N 3.31Å; T5-I7 VanDerWaalsContact O-CG1 3.25Å; T5-I7 WeakPolarHBondContact O-CG1 3.35Å; T5-I7 PolarHBondContact O-N 2.85Å
6V47.2Very low64.2Low117 Ų11782.1 Ų82.171%0.70950%0.502SS*.  trans-66.799.8172.5-174.30000105.1S4 G8S4-V6 PolarHBondContact O-N 2.78Å; V6-G8 WeakPolarHBondContact CG1-O 3.44Å
7I65.2Low65.5Low110 Ų11077.6 Ų77.656%0.56448%0.475SS*.  trans-73.9-23.4-175.6-46.4-175.9000110.1T5 E283T5-I7 VanDerWaalsContact C-N 3.31Å; T5-I7 VanDerWaalsContact O-CG1 3.25Å; T5-I7 WeakPolarHBondContact O-CG1 3.35Å; T5-I7 PolarHBondContact O-N 2.85Å; I7-E283 VanDerWaalsContact CB-OE2 3.28Å; I7-E283 WeakPolarHBondContact CB-OE2 3.49Å; I7-E283 WeakPolarHBondContact CG2-OE2 3.44Å
8G71.8Confident66.6Low16 Ų1675.1 Ų75.117%0.16547%0.466CS..SBendtrans-93.7176.6175.100000115.4V6V6-G8 WeakPolarHBondContact CG1-O 3.44Å
9F80Confident67.7Low36 Ų3672.5 Ų72.516%0.15845%0.449CS..  trans-66.5149.1172.5-67.5-69.8000111.7I11 Y258 I277 K280 L281F9-I11 HydrophobicContact CB-CD1 3.67Å; F9-I11 HydrophobicContact CB-CG1 3.74Å; F9-I11 HydrophobicContact CG-CD1 4.5Å; F9-I11 PolarHBondContact O-N 3.03Å; F9-Y258 HydrophobicContact CB-CE2 4.04Å; F9-Y258 HydrophobicContact CD1-CD1 4.11Å; F9-Y258 HydrophobicContact CD1-CD2 4.43Å; F9-Y258 AromaticContact CD1-CE1 3.52Å; F9-Y258 HydrophobicContact CD1-CE1 3.52Å; F9-Y258 AromaticContact CD1-CE2 3.9Å; F9-Y258 HydrophobicContact CD1-CE2 3.9Å; F9-Y258 AromaticContact CD1-CZ 3.4Å; F9-Y258 HydrophobicContact CD2-CD1 4.35Å; F9-Y258 HydrophobicContact CD2-CD2 4.08Å; F9-Y258 HydrophobicContact CD2-CE2 4.26Å; F9-Y258 HydrophobicContact CD2-CG 4.13Å; F9-Y258 AromaticContact CE1-CD1 3.66Å; F9-Y258 HydrophobicContact CE1-CD1 3.66Å; F9-Y258 AromaticContact CE1-CE1 3.28Å; F9-Y258 HydrophobicContact CE1-CE1 3.28Å; F9-Y258 HydrophobicContact CE1-CE2 4.43Å; F9-Y258 HydrophobicContact CE1-CG 4.37Å; F9-Y258 AromaticContact CE1-CZ 3.72Å; F9-Y258 AromaticContact CE2-CD1 3.93Å; F9-Y258 HydrophobicContact CE2-CD1 3.93Å; F9-Y258 HydrophobicContact CE2-CD2 4.38Å; F9-Y258 HydrophobicContact CE2-CE1 4.32Å; F9-Y258 AromaticContact CE2-CG 3.96Å; F9-Y258 HydrophobicContact CE2-CG 3.96Å; F9-Y258 HydrophobicContact CG-CD1 4.44Å; F9-Y258 HydrophobicContact CG-CD2 4.11Å; F9-Y258 HydrophobicContact CG-CE1 4.15Å; F9-Y258 AromaticContact CG-CE2 3.81Å; F9-Y258 HydrophobicContact CG-CE2 3.81Å; F9-Y258 HydrophobicContact CG-CG 4.42Å; F9-Y258 AromaticContact CG-CZ 3.83Å; F9-Y258 AromaticContact CZ-CD1 3.56Å; F9-Y258 HydrophobicContact CZ-CD1 3.56Å; F9-Y258 AromaticContact CZ-CE1 3.72Å; F9-Y258 HydrophobicContact CZ-CE1 3.72Å; F9-Y258 HydrophobicContact CZ-CG 4.08Å; F9-I277 HydrophobicContact CE2-CG2 4.09Å; F9-I277 HydrophobicContact CZ-CG1 4.48Å; F9-I277 HydrophobicContact CZ-CG2 4.25Å; F9-K280 HydrophobicContact CD2-CB 3.77Å; F9-K280 HydrophobicContact CE1-CD 4.41Å; F9-K280 HydrophobicContact CE2-CB 3.51Å; F9-K280 HydrophobicContact CE2-CD 4.22Å; F9-K280 HydrophobicContact CZ-CB 4.17Å; F9-K280 HydrophobicContact CZ-CD 4.01Å; F9-L281 HydrophobicContact CD2-CD2 4.17Å; F9-L281 HydrophobicContact CD2-CG 4.28Å; F9-L281 HydrophobicContact CE2-CG 4.22Å
10P78.6Confident68.9Low90 Ų9068.9 Ų68.958%0.58443%0.427SS*.  trans-75.360.6-179.733.4-36.9000112.1
11I80.6Confident69.8Low25 Ų2566.4 Ų66.413%0.12841%0.41CS..  trans-98.3123.4-174.8-59.5170.5000109.7F9 L13 V16 W255 Y258 L281 F286F9-I11 HydrophobicContact CB-CD1 3.67Å; F9-I11 HydrophobicContact CB-CG1 3.74Å; F9-I11 HydrophobicContact CG-CD1 4.5Å; F9-I11 PolarHBondContact O-N 3.03Å; I11-L13 PolarHBondContact O-N 2.82Å; I11-V16 HydrophobicContact CG2-CG2 3.19Å; I11-W255 HydrophobicContact CD1-CB 4Å; I11-W255 HydrophobicContact CG1-CB 4.18Å; I11-W255 HydrophobicContact CG2-CB 4.29Å; I11-Y258 HydrophobicContact CD1-CD2 4.1Å; I11-Y258 HydrophobicContact CD1-CE2 4.15Å; I11-Y258 HydrophobicContact CG1-CE2 4.41Å; I11-L281 HydrophobicContact CD1-CD2 4.17Å; I11-F286 HydrophobicContact CD1-CE2 4.29Å
12S83.4Confident72.5Confident61 Ų6159.2 Ų59.243%0.42737%0.374SS..  trans-79.7106.4171.4172.90000110.7C14 T15 V16S12-C14 PolarHBondContact O-N 3.04Å; S12-C14 VanDerWaalsContact O-N 3.16Å; S12-T15 WeakPolarHBondContact CB-OG1 3.3Å; S12-T15 PolarHBondContact O-N 3.31Å; S12-T15 PolarHBondContact O-OG1 3.38Å; S12-V16 WeakPolarHBondContact O-CG2 3.42Å; S12-V16 PolarHBondContact O-N 2.9Å
13L83.4Confident75.1Confident48 Ų4852.8 Ų52.825%0.25134%0.34SS..Hα-helixtrans-60.2-29.2-177.3-58.7175.5000113.7I11 V16 Q17 L46 L48 S284I11-L13 PolarHBondContact O-N 2.82Å; L13-V16 PolarHBondContact O-N 3.13Å; L13-Q17 PolarHBondContact O-N 3.3Å; L13-L46 HydrophobicContact CB-CD2 4.49Å; L13-L46 HydrophobicContact CD2-CD2 3.64Å; L13-L46 HydrophobicContact CG-CD2 4.48Å; L13-L48 HydrophobicContact CB-CD1 3.7Å; L13-S284 VanDerWaalsContact CD2-O 3.24Å; L13-S284 WeakPolarHBondContact CD2-O 3.49Å
14C81Confident77.8Confident71 Ų7150.7 Ų50.748%0.4831%0.308SS..Hα-helixtrans-64.1-43.3173.7-57.20000111.7S12 Q17 G18 I51S12-C14 PolarHBondContact O-N 3.04Å; S12-C14 VanDerWaalsContact O-N 3.16Å; C14-Q17 PolarHBondContact O-N 2.92Å; C14-G18 PolarHBondContact O-N 2.77Å; C14-I51 HydrophobicContact CB-CD1 3.46Å; C14-I51 VanDerWaalsContact CB-CD1 3.46Å; C14-I51 WeakPolarHBondContact SG-CD1 3.4Å
15T83.7Confident80Confident76 Ų7647.7 Ų47.747%0.46628%0.282SS..Hα-helixtrans-69-40.6177.363.60000111.4S12 Q17 G18 N19S12-T15 WeakPolarHBondContact CB-OG1 3.3Å; S12-T15 PolarHBondContact O-N 3.31Å; S12-T15 PolarHBondContact O-OG1 3.38Å; T15-Q17 VanDerWaalsContact C-N 3.32Å; T15-Q17 PolarHBondContact O-N 2.67Å; T15-G18 PolarHBondContact O-N 3.37Å; T15-N19 WeakPolarHBondContact O-CB 3.15Å; T15-N19 PolarHBondContact O-N 2.7Å; T15-N19 PolarHBondContact O-ND2 3.21Å
16V87.3Confident82.1Confident0 Ų043.6 Ų43.60%026%0.256CS..Hα-helixtrans-57.5-44.9174.5173.20000111.1I11 S12 L13 G18 N19 I20 L46 W255 F286I11-V16 HydrophobicContact CG2-CG2 3.19Å; S12-V16 WeakPolarHBondContact O-CG2 3.42Å; S12-V16 PolarHBondContact O-N 2.9Å; L13-V16 PolarHBondContact O-N 3.13Å; V16-G18 VanDerWaalsContact C-N 3.33Å; V16-G18 PolarHBondContact O-N 2.99Å; V16-N19 PolarHBondContact O-N 2.82Å; V16-I20 HydrophobicContact CG1-CD1 3.52Å; V16-I20 HydrophobicContact CG1-CG1 4.06Å; V16-I20 WeakPolarHBondContact O-CB 3.45Å; V16-I20 VanDerWaalsContact O-CG1 3.3Å; V16-I20 WeakPolarHBondContact O-CG1 3.39Å; V16-I20 PolarHBondContact O-N 3.04Å; V16-L46 HydrophobicContact CG1-CD1 3.95Å; V16-W255 HydrophobicContact CG1-CD2 4.41Å; V16-W255 HydrophobicContact CG1-CH2 4.22Å; V16-W255 HydrophobicContact CG1-CZ2 3.95Å; V16-W255 HydrophobicContact CG2-CD2 4.16Å; V16-W255 HydrophobicContact CG2-CG 4.06Å; V16-F286 HydrophobicContact CG1-CE1 4.05Å; V16-F286 HydrophobicContact CG1-CZ 3.83Å
17Q87.1Confident84.2Confident6 Ų638.1 Ų38.13%0.02822%0.222CC..Hα-helixtrans-56.4-47.5178.3-170.3-174.443.100111.4L13 C14 T15 L21 L43 L46 L48 P49L13-Q17 PolarHBondContact O-N 3.3Å; C14-Q17 PolarHBondContact O-N 2.92Å; T15-Q17 VanDerWaalsContact C-N 3.32Å; T15-Q17 PolarHBondContact O-N 2.67Å; Q17-L21 HydrophobicContact CG-CD1 4.22Å; Q17-L21 WeakPolarHBondContact O-CB 3.2Å; Q17-L21 VanDerWaalsContact O-CG 3.29Å; Q17-L21 WeakPolarHBondContact O-CG 3.41Å; Q17-L21 PolarHBondContact O-N 2.93Å; Q17-L43 HydrophobicContact CG-CD1 3.77Å; Q17-L46 HydrophobicContact CB-CD1 4.44Å; Q17-L48 PolarHBondContact NE2-O 3.06Å; Q17-P49 PolarHBondContact NE2-O 3.05Å; Q17-P49 PolarHBondContact OE1-O 3.47Å
18G84.2Confident85.4Confident31 Ų3136.9 Ų36.932%0.3221%0.214SC..Hα-helixtrans-62-45.5176.100000113C14 T15 V16 I20 L21 Q22C14-G18 PolarHBondContact O-N 2.77Å; T15-G18 PolarHBondContact O-N 3.37Å; V16-G18 VanDerWaalsContact C-N 3.33Å; V16-G18 PolarHBondContact O-N 2.99Å; G18-I20 PolarHBondContact O-N 3.18Å; G18-L21 PolarHBondContact O-N 3.05Å; G18-Q22 PolarHBondContact O-N 3.42Å
19N88.4Confident86.1Confident26 Ų2636.3 Ų36.314%0.13921%0.207CC..Hα-helixtrans-62.5-42.6179.2-68.2-24.1000112.3T15 V16 S23 Y225 W255T15-N19 WeakPolarHBondContact O-CB 3.15Å; T15-N19 PolarHBondContact O-N 2.7Å; T15-N19 PolarHBondContact O-ND2 3.21Å; V16-N19 PolarHBondContact O-N 2.82Å; N19-S23 WeakPolarHBondContact O-CB 3.45Å; N19-S23 PolarHBondContact O-N 2.73Å; N19-S23 PolarHBondContact O-OG 3.05Å; N19-Y225 HydrophobicContact CB-CD1 3.96Å; N19-Y225 HydrophobicContact CB-CD2 4.37Å; N19-Y225 HydrophobicContact CB-CE1 3.92Å; N19-Y225 HydrophobicContact CB-CE2 4.32Å; N19-Y225 HydrophobicContact CB-CG 4.19Å; N19-Y225 WeakPolarHBondContact ND2-CE1 3.24Å; N19-Y225 VanDerWaalsContact ND2-CZ 3.32Å; N19-Y225 PolarHBondContact ND2-OH 2.85Å; N19-W255 HydrophobicContact CB-CZ2 4.41Å
20I90.5Very high86.7Confident1 Ų134.6 Ų34.61%0.00520%0.2CC..Hα-helixtrans-64.9-45.4176.5-69.2173.9000110.5V16 G18 S23 F24 L39 L42 L43 L46 W255V16-I20 HydrophobicContact CG1-CD1 3.52Å; V16-I20 HydrophobicContact CG1-CG1 4.06Å; V16-I20 WeakPolarHBondContact O-CB 3.45Å; V16-I20 VanDerWaalsContact O-CG1 3.3Å; V16-I20 WeakPolarHBondContact O-CG1 3.39Å; V16-I20 PolarHBondContact O-N 3.04Å; G18-I20 PolarHBondContact O-N 3.18Å; I20-S23 PolarHBondContact O-N 3.41Å; I20-F24 VanDerWaalsContact O-CB 3.23Å; I20-F24 WeakPolarHBondContact O-CB 3.39Å; I20-F24 PolarHBondContact O-N 3.07Å; I20-L39 HydrophobicContact CG2-CB 4.1Å; I20-L39 HydrophobicContact CG2-CD2 4.24Å; I20-L39 WeakPolarHBondContact CG2-O 3.14Å; I20-L42 HydrophobicContact CD1-CB 3.87Å; I20-L43 HydrophobicContact CG2-CB 3.92Å; I20-L43 HydrophobicContact CG2-CD1 4.34Å; I20-L46 HydrophobicContact CD1-CD1 4.14Å; I20-W255 HydrophobicContact CD1-CH2 3.94Å; I20-W255 HydrophobicContact CD1-CZ2 4.35Å; I20-W255 HydrophobicContact CG1-CH2 3.61Å; I20-W255 HydrophobicContact CG1-CZ2 3.74Å
21L88.6Confident87.2Confident17 Ų1730.6 Ų30.69%0.08918%0.175CC..Hα-helixtrans-60.4-48.5179.2-76.4168.2000111.5Q17 G18 S23 F24 F25 L43 V57Q17-L21 HydrophobicContact CG-CD1 4.22Å; Q17-L21 WeakPolarHBondContact O-CB 3.2Å; Q17-L21 VanDerWaalsContact O-CG 3.29Å; Q17-L21 WeakPolarHBondContact O-CG 3.41Å; Q17-L21 PolarHBondContact O-N 2.93Å; G18-L21 PolarHBondContact O-N 3.05Å; L21-S23 PolarHBondContact O-N 3.25Å; L21-F24 PolarHBondContact O-N 3.19Å; L21-F25 HydrophobicContact CB-CE2 4.45Å; L21-F25 HydrophobicContact CD2-CE2 4.28Å; L21-F25 WeakPolarHBondContact O-CD2 3.36Å; L21-F25 PolarHBondContact O-N 3.15Å; L21-F25 VanDerWaalsContact O-N 3.11Å; L21-L43 HydrophobicContact CD2-CD2 3.64Å; L21-L43 HydrophobicContact CG-CD1 4.35Å; L21-L43 HydrophobicContact CG-CD2 4.27Å; L21-V57 HydrophobicContact CB-CG1 4.01Å; L21-V57 HydrophobicContact CD1-CG1 4.16Å
22Q85.8Confident87.9Confident82 Ų8229.7 Ų29.738%0.38317%0.17SC..Hα-helixtrans-57.9-49.3176.2-176.5-1800.200111.3G18 F24 F25 E26 I190G18-Q22 PolarHBondContact O-N 3.42Å; Q22-F24 VanDerWaalsContact C-N 3.3Å; Q22-F24 PolarHBondContact O-N 3.09Å; Q22-F25 PolarHBondContact O-N 3.12Å; Q22-E26 VanDerWaalsContact O-CG 3.31Å; Q22-E26 WeakPolarHBondContact O-CG 3.23Å; Q22-E26 PolarHBondContact O-N 3.46Å; Q22-E26 VanDerWaalsContact O-N 3.1Å; Q22-I190 VanDerWaalsContact NE2-CD1 3.34Å
23S90Very high88.4Confident6 Ų632 Ų324%0.04217%0.17CC..Hα-helixtrans-63.2-36.8-179.7-56.50000112.5N19 I20 L21 C27 Y225N19-S23 WeakPolarHBondContact O-CB 3.45Å; N19-S23 PolarHBondContact O-N 2.73Å; N19-S23 PolarHBondContact O-OG 3.05Å; I20-S23 PolarHBondContact O-N 3.41Å; L21-S23 PolarHBondContact O-N 3.25Å; S23-C27 VanDerWaalsContact O-CB 3.29Å; S23-C27 WeakPolarHBondContact O-CB 3.15Å; S23-C27 PolarHBondContact O-N 3.49Å; S23-C27 PolarHBondContact O-SG 3.47Å; S23-Y225 WeakPolarHBondContact OG-CB 3.42Å; S23-Y225 PolarHBondContact OG-O 2.73Å
24F91.3Very high88.8Confident38 Ų3837.5 Ų37.517%0.16719%0.194CC..Hα-helixtrans-62.6-51.2177.7169.9-94.8000111.1I20 L21 Q22 E26 C27 Q28 C36 L39 T40I20-F24 VanDerWaalsContact O-CB 3.23Å; I20-F24 WeakPolarHBondContact O-CB 3.39Å; I20-F24 PolarHBondContact O-N 3.07Å; L21-F24 PolarHBondContact O-N 3.19Å; Q22-F24 VanDerWaalsContact C-N 3.3Å; Q22-F24 PolarHBondContact O-N 3.09Å; F24-E26 PolarHBondContact O-N 2.83Å; F24-C27 PolarHBondContact O-N 2.99Å; F24-Q28 VanDerWaalsContact CE1-OE1 3.25Å; F24-Q28 VanDerWaalsContact O-CB 3.25Å; F24-Q28 WeakPolarHBondContact O-CB 3.38Å; F24-Q28 PolarHBondContact O-N 2.96Å; F24-C36 HydrophobicContact CD2-CB 4.01Å; F24-C36 HydrophobicContact CE2-CB 3.83Å; F24-L39 HydrophobicContact CB-CD1 4.35Å; F24-T40 HydrophobicContact CD2-CG2 3.52Å; F24-T40 HydrophobicContact CE2-CG2 3.31Å; F24-T40 HydrophobicContact CG-CG2 4.5Å; F24-T40 HydrophobicContact CZ-CG2 4.16Å
25F87.5Confident89.5Confident36 Ų3634.7 Ų34.716%0.15818%0.175CC..Hα-helixtrans-64.7-39.9-179.5-69.5-61000112L21 Q22 Q28 L29 V57 F58 S61L21-F25 HydrophobicContact CB-CE2 4.45Å; L21-F25 HydrophobicContact CD2-CE2 4.28Å; L21-F25 WeakPolarHBondContact O-CD2 3.36Å; L21-F25 PolarHBondContact O-N 3.15Å; L21-F25 VanDerWaalsContact O-N 3.11Å; Q22-F25 PolarHBondContact O-N 3.12Å; F25-Q28 PolarHBondContact O-N 3.42Å; F25-L29 WeakPolarHBondContact O-CB 3.48Å; F25-L29 PolarHBondContact O-N 3.25Å; F25-V57 HydrophobicContact CD2-CG1 4.49Å; F25-V57 HydrophobicContact CE2-CG1 3.93Å; F25-F58 HydrophobicContact CE1-CD1 4.29Å; F25-F58 AromaticContact CE1-CE1 3.97Å; F25-F58 HydrophobicContact CE1-CE1 3.97Å; F25-F58 HydrophobicContact CE2-CD1 4.42Å; F25-F58 HydrophobicContact CE2-CE1 4.31Å; F25-F58 AromaticContact CZ-CD1 3.83Å; F25-F58 HydrophobicContact CZ-CD1 3.83Å; F25-F58 AromaticContact CZ-CE1 3.43Å; F25-F58 HydrophobicContact CZ-CE1 3.43Å; F25-F58 VanDerWaalsContact CZ-CE1 3.43Å; F25-F58 HydrophobicContact CZ-CZ 4.41Å; F25-S61 WeakPolarHBondContact CD2-OG 3.48Å
26E88Confident90Very high22 Ų2231.8 Ų31.810%0.10316%0.157CC..Hα-helixtrans-62.8-42.4175.3-69.2-70.6168.900112.2Q22 F24 R30 I190 F194Q22-E26 VanDerWaalsContact O-CG 3.31Å; Q22-E26 WeakPolarHBondContact O-CG 3.23Å; Q22-E26 PolarHBondContact O-N 3.46Å; Q22-E26 VanDerWaalsContact O-N 3.1Å; F24-E26 PolarHBondContact O-N 2.83Å; E26-R30 PolarHBondContact O-NH1 2.83Å; E26-R30 IonicContact OE2-CZ 3.97Å; E26-R30 IonicContact OE2-NH1 3.95Å; E26-R30 PolarHBondContact OE2-NH1 3.42Å; E26-R30 IonicContact OE2-NH2 2.82Å; E26-R30 PolarHBondContact OE2-NH2 3.17Å; E26-I190 HydrophobicContact CG-CG2 4.18Å; E26-F194 HydrophobicContact CB-CE2 3.8Å; E26-F194 HydrophobicContact CB-CZ 3.71Å; E26-F194 HydrophobicContact CG-CE2 4.45Å
27C92.1Very high90.4Very high2 Ų236.6 Ų36.61%0.01418%0.178CC..Hα-helixtrans-68.2-41.2175.5-72.80000112.2S23 F24 R30 G31 L32S23-C27 VanDerWaalsContact O-CB 3.29Å; S23-C27 WeakPolarHBondContact O-CB 3.15Å; S23-C27 PolarHBondContact O-N 3.49Å; S23-C27 PolarHBondContact O-SG 3.47Å; F24-C27 PolarHBondContact O-N 2.99Å; C27-R30 CarbonylContact O-C 3.59Å; C27-R30 PolarHBondContact O-N 3.42Å; C27-G31 PolarHBondContact O-N 3.27Å; C27-L32 HydrophobicContact CB-CB 4.02Å; C27-L32 PolarHBondContact O-N 3.07Å
28Q90.5Very high90.8Very high85 Ų8537.4 Ų37.440%0.39718%0.181SC..Hα-helixtrans-64.8-44.7-177.4-175.8-174.71700111.2F24 F25 R30 G31 C36 R79F24-Q28 VanDerWaalsContact CE1-OE1 3.25Å; F24-Q28 VanDerWaalsContact O-CB 3.25Å; F24-Q28 WeakPolarHBondContact O-CB 3.38Å; F24-Q28 PolarHBondContact O-N 2.96Å; F25-Q28 PolarHBondContact O-N 3.42Å; Q28-R30 PolarHBondContact O-N 3.31Å; Q28-G31 PolarHBondContact O-N 3.41Å; Q28-G31 VanDerWaalsContact O-N 3.15Å; Q28-C36 VanDerWaalsContact CA-SG 3.57Å; Q28-C36 PolarHBondContact N-SG 3.45Å; Q28-C36 VanDerWaalsContact N-SG 3.38Å; Q28-R79 PolarHBondContact O-NH2 3.03Å
29L87Confident91.3Very high3 Ų336 Ų362%0.01617%0.166CC..Hα-helixtrans-58.1-33.3176.1-176.672000112.4F25 V63 Y64 F75 R79 V116F25-L29 WeakPolarHBondContact O-CB 3.48Å; F25-L29 PolarHBondContact O-N 3.25Å; L29-V63 HydrophobicContact CD2-CB 3.47Å; L29-V63 VanDerWaalsContact CD2-CB 3.47Å; L29-V63 HydrophobicContact CD2-CG1 3.2Å; L29-V63 HydrophobicContact CD2-CG2 4.21Å; L29-Y64 HydrophobicContact CD1-CD1 4.03Å; L29-Y64 HydrophobicContact CD1-CE1 3.62Å; L29-Y64 HydrophobicContact CD1-CE2 4.15Å; L29-Y64 HydrophobicContact CD1-CG 4.46Å; L29-F75 HydrophobicContact CD1-CE1 3.79Å; L29-F75 HydrophobicContact CD1-CZ 3.86Å; L29-F75 HydrophobicContact CG-CZ 4.19Å; L29-R79 WeakPolarHBondContact O-CD 3.07Å; L29-R79 PolarHBondContact O-NE 3.34Å; L29-V116 HydrophobicContact CD1-CG1 4.48Å; L29-V116 HydrophobicContact CD2-CB 4.21Å; L29-V116 HydrophobicContact CD2-CG1 3.4Å; L29-V116 HydrophobicContact CD2-CG2 3.74Å; L29-V116 HydrophobicContact CG-CG1 3.66Å
30R90.8Very high91.5Very high0 Ų037.5 Ų37.50%018%0.176CC..THydrogen-bonded Turntrans-92-4.4-178.3-76.8177.1-17074.3-12.9114.1E26 C27 Q28 L32 H115 F119 F194E26-R30 PolarHBondContact O-NH1 2.83Å; E26-R30 IonicContact OE2-CZ 3.97Å; E26-R30 IonicContact OE2-NH1 3.95Å; E26-R30 PolarHBondContact OE2-NH1 3.42Å; E26-R30 IonicContact OE2-NH2 2.82Å; E26-R30 PolarHBondContact OE2-NH2 3.17Å; C27-R30 CarbonylContact O-C 3.59Å; C27-R30 PolarHBondContact O-N 3.42Å; Q28-R30 PolarHBondContact O-N 3.31Å; R30-L32 HydrophobicContact CB-CG 4.32Å; R30-H115 PolarHBondContact NH2-ND1 2.9Å; R30-F119 HydrophobicContact CB-CD1 3.78Å; R30-F119 HydrophobicContact CB-CE1 3.4Å; R30-F119 HydrophobicContact CB-CZ 3.97Å; R30-F119 HydrophobicContact CG-CD1 3.48Å; R30-F119 VanDerWaalsContact CG-CD1 3.48Å; R30-F119 HydrophobicContact CG-CE1 3.65Å; R30-F119 HydrophobicContact CG-CG 4.08Å; R30-F119 HydrophobicContact CG-CZ 4.24Å; R30-F194 VanDerWaalsContact CD-CG 3.44Å; R30-F194 VanDerWaalsContact NE-CD2 3.31Å; R30-F194 VanDerWaalsContact NE-CG 3.26Å
31G91.1Very high91.7Very high6 Ų638.4 Ų38.46%0.06218%0.181CC..THydrogen-bonded Turntrans78.421.1178.800000115.9C27 Q28 R33 R79C27-G31 PolarHBondContact O-N 3.27Å; Q28-G31 PolarHBondContact O-N 3.41Å; Q28-G31 VanDerWaalsContact O-N 3.15Å; G31-R33 VanDerWaalsContact C-N 3.25Å; G31-R33 PolarHBondContact O-N 3Å; G31-R79 VanDerWaalsContact CA-NH2 3.29Å
32L93.9Very high91.9Very high6 Ų637.6 Ų37.63%0.03118%0.177CC..  trans-81.869.9178.6-59.3177.6000111C27 R30 H34 S35 C36 F119 Y123 F194 Y197 P228C27-L32 HydrophobicContact CB-CB 4.02Å; C27-L32 PolarHBondContact O-N 3.07Å; R30-L32 HydrophobicContact CB-CG 4.32Å; L32-H34 PolarHBondContact O-N 2.7Å; L32-S35 PolarHBondContact O-N 3.49Å; L32-C36 PolarHBondContact O-N 3.4Å; L32-C36 PolarHBondContact O-SG 2.86Å; L32-C36 VanDerWaalsContact O-SG 3.35Å; L32-F119 HydrophobicContact CD1-CZ 4.34Å; L32-F119 HydrophobicContact CD2-CZ 4.26Å; L32-F119 HydrophobicContact CG-CZ 4.46Å; L32-Y123 HydrophobicContact CD2-CE1 3.84Å; L32-Y123 HydrophobicContact CD2-CE2 4.41Å; L32-F194 HydrophobicContact CD1-CD1 4.06Å; L32-F194 HydrophobicContact CD1-CE1 3.73Å; L32-Y197 HydrophobicContact CD1-CE1 4.28Å; L32-Y197 HydrophobicContact CD2-CE1 4.06Å; L32-P228 HydrophobicContact CD1-CG 4.03Å
33R93.6Very high92.2Very high111 Ų11135.7 Ų35.742%0.41917%0.169SC..Hα-helixtrans-57.5-43.2-169.8-65.2173.7-179.9-175.2-7.6114.3G31 C36 K37 D83G31-R33 VanDerWaalsContact C-N 3.25Å; G31-R33 PolarHBondContact O-N 3Å; R33-C36 WeakPolarHBondContact O-CB 3.47Å; R33-C36 PolarHBondContact O-N 3.38Å; R33-K37 PolarHBondContact O-N 2.81Å; R33-D83 IonicContact CZ-OD1 3.84Å; R33-D83 IonicContact NE-OD1 2.83Å; R33-D83 PolarHBondContact NH2-O 3.43Å; R33-D83 IonicContact NH2-OD1 2.64Å; R33-D83 PolarHBondContact NH2-OD1 2.84Å
34H92.6Very high92.2Very high163 Ų16343.1 Ų43.176%0.75520%0.196SC*.Hα-helixtrans-67.1-41.4-178.8-67.6-68.5000111.9L32 K37 W38L32-H34 PolarHBondContact O-N 2.7Å; H34-K37 PolarHBondContact O-N 3.14Å; H34-W38 PolarHBondContact O-N 3.27Å
35S94.8Very high92.2Very high12 Ų1241.5 Ų41.58%0.08419%0.19CC..Hα-helixtrans-63.8-42.4174.5-49.70000111.3L32 K37 W38 L39 P228L32-S35 PolarHBondContact O-N 3.49Å; S35-K37 PolarHBondContact O-N 3.31Å; S35-W38 PolarHBondContact O-N 2.85Å; S35-L39 WeakPolarHBondContact O-CB 3.36Å; S35-L39 VanDerWaalsContact O-CG 3.26Å; S35-L39 WeakPolarHBondContact O-CG 3.48Å; S35-L39 PolarHBondContact O-N 3.26Å; S35-P228 WeakPolarHBondContact OG-CB 3.25Å
36C95.4Very high92.2Very high14 Ų1440.4 Ų40.410%0.09519%0.186CC..Hα-helixtrans-57.5-48.9173.5-68.50000111.7F24 Q28 L32 R33 W38 L39 T40F24-C36 HydrophobicContact CD2-CB 4.01Å; F24-C36 HydrophobicContact CE2-CB 3.83Å; Q28-C36 VanDerWaalsContact CA-SG 3.57Å; Q28-C36 PolarHBondContact N-SG 3.45Å; Q28-C36 VanDerWaalsContact N-SG 3.38Å; L32-C36 PolarHBondContact O-N 3.4Å; L32-C36 PolarHBondContact O-SG 2.86Å; L32-C36 VanDerWaalsContact O-SG 3.35Å; R33-C36 WeakPolarHBondContact O-CB 3.47Å; R33-C36 PolarHBondContact O-N 3.38Å; C36-W38 VanDerWaalsContact C-N 3.31Å; C36-W38 PolarHBondContact O-N 3.01Å; C36-L39 PolarHBondContact O-N 3.42Å; C36-T40 WeakPolarHBondContact O-CG2 3.47Å; C36-T40 PolarHBondContact O-N 3.17Å; C36-T40 PolarHBondContact O-OG1 3.04Å
37K95.5Very high91.8Very high101 Ų10145 Ų4544%0.43921%0.211SC..Hα-helixtrans-56.4-44.9177.6-179.6-175.8170.8-171.30111.7R33 H34 S35 T40 D41 D325R33-K37 PolarHBondContact O-N 2.81Å; H34-K37 PolarHBondContact O-N 3.14Å; S35-K37 PolarHBondContact O-N 3.31Å; K37-T40 WeakPolarHBondContact CA-OG1 3.36Å; K37-T40 PolarHBondContact O-OG1 2.88Å; K37-D41 PolarHBondContact O-N 3.14Å; K37-D325 WeakPolarHBondContact CE-OD2 3.4Å; K37-D325 VanDerWaalsContact NZ-CG 3.34Å; K37-D325 IonicContact NZ-OD1 3.66Å; K37-D325 PolarHBondContact NZ-OD1 3.44Å; K37-D325 IonicContact NZ-OD2 3.13Å; K37-D325 PolarHBondContact NZ-OD2 2.94Å
38W95.2Very high91.3Very high24 Ų2447.6 Ų47.69%0.09122%0.224CC..Hα-helixtrans-65.2-47.4178.8-176.983.9000112.3H34 S35 C36 T40 D41 L42 W227 M256 F259H34-W38 PolarHBondContact O-N 3.27Å; S35-W38 PolarHBondContact O-N 2.85Å; C36-W38 VanDerWaalsContact C-N 3.31Å; C36-W38 PolarHBondContact O-N 3.01Å; W38-T40 VanDerWaalsContact C-N 3.34Å; W38-T40 PolarHBondContact O-N 3.44Å; W38-D41 PolarHBondContact O-N 2.88Å; W38-L42 HydrophobicContact CD2-CD1 4.16Å; W38-L42 HydrophobicContact CE3-CD1 3.93Å; W38-L42 HydrophobicContact CH2-CD1 3.38Å; W38-L42 HydrophobicContact CZ2-CD1 3.6Å; W38-L42 HydrophobicContact CZ3-CD1 3.55Å; W38-L42 PolarHBondContact O-N 3.4Å; W38-W227 AromaticContact CD2-CD1 3.64Å; W38-W227 HydrophobicContact CD2-CD2 4.09Å; W38-W227 AromaticContact CD2-CE2 3.74Å; W38-W227 HydrophobicContact CD2-CG 4.03Å; W38-W227 HydrophobicContact CD2-CZ2 4.37Å; W38-W227 AromaticContact CD2-NE1 3.44Å; W38-W227 AromaticContact CE2-CE2 3.62Å; W38-W227 AromaticContact CE2-CZ2 3.79Å; W38-W227 AromaticContact CE2-NE1 3.79Å; W38-W227 HydrophobicContact CE3-CB 4Å; W38-W227 AromaticContact CE3-CD1 3.36Å; W38-W227 AromaticContact CE3-CD2 3.77Å; W38-W227 HydrophobicContact CE3-CD2 3.77Å; W38-W227 AromaticContact CE3-CE2 3.93Å; W38-W227 AromaticContact CE3-CG 3.41Å; W38-W227 HydrophobicContact CE3-CG 3.41Å; W38-W227 VanDerWaalsContact CE3-CG 3.41Å; W38-W227 AromaticContact CE3-NE1 3.67Å; W38-W227 AromaticContact CG-NE1 3.73Å; W38-W227 AromaticContact CH2-CD2 3.49Å; W38-W227 HydrophobicContact CH2-CD2 3.49Å; W38-W227 VanDerWaalsContact CH2-CD2 3.49Å; W38-W227 AromaticContact CH2-CE2 3.87Å; W38-W227 AromaticContact CH2-CE3 3.51Å; W38-W227 HydrophobicContact CH2-CE3 3.51Å; W38-W227 AromaticContact CH2-CG 3.96Å; W38-W227 HydrophobicContact CH2-CG 3.96Å; W38-W227 HydrophobicContact CH2-CH2 4.27Å; W38-W227 HydrophobicContact CH2-CZ2 4.25Å; W38-W227 AromaticContact CH2-CZ3 3.92Å; W38-W227 HydrophobicContact CH2-CZ3 3.92Å; W38-W227 AromaticContact CZ2-CD2 3.83Å; W38-W227 HydrophobicContact CZ2-CD2 3.83Å; W38-W227 AromaticContact CZ2-CE2 3.69Å; W38-W227 AromaticContact CZ2-CE3 3.98Å; W38-W227 HydrophobicContact CZ2-CE3 3.98Å; W38-W227 AromaticContact CZ2-CH2 3.88Å; W38-W227 HydrophobicContact CZ2-CH2 3.88Å; W38-W227 AromaticContact CZ2-CZ2 3.73Å; W38-W227 HydrophobicContact CZ2-CZ2 3.73Å; W38-W227 HydrophobicContact CZ2-CZ3 4.01Å; W38-W227 HydrophobicContact CZ3-CB 3.75Å; W38-W227 AromaticContact CZ3-CD1 3.84Å; W38-W227 AromaticContact CZ3-CD2 3.46Å; W38-W227 HydrophobicContact CZ3-CD2 3.46Å; W38-W227 VanDerWaalsContact CZ3-CD2 3.46Å; W38-W227 AromaticContact CZ3-CE2 3.99Å; W38-W227 AromaticContact CZ3-CE3 3.88Å; W38-W227 HydrophobicContact CZ3-CE3 3.88Å; W38-W227 AromaticContact CZ3-CG 3.38Å; W38-W227 HydrophobicContact CZ3-CG 3.38Å; W38-M256 HydrophobicContact CZ3-CE 4.43Å; W38-F259 HydrophobicContact CH2-CD2 4.3Å; W38-F259 HydrophobicContact CH2-CG 4.28Å; W38-F259 HydrophobicContact CZ2-CB 4.15Å; W38-F259 AromaticContact CZ2-CD1 3.92Å; W38-F259 HydrophobicContact CZ2-CD1 3.92Å; W38-F259 HydrophobicContact CZ2-CD2 4.28Å; W38-F259 HydrophobicContact CZ2-CE1 4.36Å; W38-F259 AromaticContact CZ2-CG 3.86Å; W38-F259 HydrophobicContact CZ2-CG 3.86Å
39L95.1Very high90.5Very high1 Ų148.5 Ų48.51%0.00524%0.238CC..Hα-helixtrans-60.7-41.3177.8-73.2170.6000112.1I20 F24 S35 C36 L42 L43 M256I20-L39 HydrophobicContact CG2-CB 4.1Å; I20-L39 HydrophobicContact CG2-CD2 4.24Å; I20-L39 WeakPolarHBondContact CG2-O 3.14Å; F24-L39 HydrophobicContact CB-CD1 4.35Å; S35-L39 WeakPolarHBondContact O-CB 3.36Å; S35-L39 VanDerWaalsContact O-CG 3.26Å; S35-L39 WeakPolarHBondContact O-CG 3.48Å; S35-L39 PolarHBondContact O-N 3.26Å; C36-L39 PolarHBondContact O-N 3.42Å; L39-L42 PolarHBondContact O-N 3.5Å; L39-L43 PolarHBondContact O-N 2.86Å; L39-M256 HydrophobicContact CD2-CE 3.75Å
40T93.1Very high89.5Confident57 Ų5753.8 Ų53.835%0.3527%0.265SS..Hα-helixtrans-69.6-32.7179.249.90000113.3F24 C36 K37 W38 L42 L43 W44F24-T40 HydrophobicContact CD2-CG2 3.52Å; F24-T40 HydrophobicContact CE2-CG2 3.31Å; F24-T40 HydrophobicContact CG-CG2 4.5Å; F24-T40 HydrophobicContact CZ-CG2 4.16Å; C36-T40 WeakPolarHBondContact O-CG2 3.47Å; C36-T40 PolarHBondContact O-N 3.17Å; C36-T40 PolarHBondContact O-OG1 3.04Å; K37-T40 WeakPolarHBondContact CA-OG1 3.36Å; K37-T40 PolarHBondContact O-OG1 2.88Å; W38-T40 VanDerWaalsContact C-N 3.34Å; W38-T40 PolarHBondContact O-N 3.44Å; T40-L42 VanDerWaalsContact C-N 3.34Å; T40-L43 PolarHBondContact O-N 2.79Å; T40-W44 VanDerWaalsContact O-CB 3.28Å; T40-W44 WeakPolarHBondContact O-CB 3.27Å; T40-W44 PolarHBondContact O-N 3.41Å
41D94.4Very high88.2Confident20 Ų2058.7 Ų58.711%0.10729%0.29CS..Hα-helixtrans-64.3-42.1174179.673.9000110.7K37 W38 W44 S45 S289 H290 N291K37-D41 PolarHBondContact O-N 3.14Å; W38-D41 PolarHBondContact O-N 2.88Å; D41-W44 PolarHBondContact O-N 3.45Å; D41-S45 WeakPolarHBondContact O-CB 3.46Å; D41-S45 PolarHBondContact O-N 3.04Å; D41-S289 PolarHBondContact OD2-OG 3.43Å; D41-H290 IonicContact OD1-CG 2.9Å; D41-H290 PolarHBondContact OD1-N 3.5Å; D41-H290 IonicContact OD1-ND1 3.21Å; D41-H290 PolarHBondContact OD1-ND1 2.89Å; D41-H290 VanDerWaalsContact OD1-ND1 3.12Å; D41-H290 PolarHBondContact OD2-N 3.31Å; D41-N291 WeakPolarHBondContact CB-ND2 3.28Å; D41-N291 WeakPolarHBondContact OD2-CB 3.45Å; D41-N291 PolarHBondContact OD2-N 2.94Å; D41-N291 PolarHBondContact OD2-ND2 3.36Å; D41-N291 VanDerWaalsContact OD2-ND2 3.14Å
42L93.2Very high86.4Confident0 Ų060 Ų600%030%0.299CS..Hα-helixtrans-63.6-47.4173-68.2179.4000111.6I20 W38 L39 T40 W44 S45 L46 W255 F259 F286I20-L42 HydrophobicContact CD1-CB 3.87Å; W38-L42 HydrophobicContact CD2-CD1 4.16Å; W38-L42 HydrophobicContact CE3-CD1 3.93Å; W38-L42 HydrophobicContact CH2-CD1 3.38Å; W38-L42 HydrophobicContact CZ2-CD1 3.6Å; W38-L42 HydrophobicContact CZ3-CD1 3.55Å; W38-L42 PolarHBondContact O-N 3.4Å; L39-L42 PolarHBondContact O-N 3.5Å; T40-L42 VanDerWaalsContact C-N 3.34Å; L42-W44 VanDerWaalsContact C-N 3.3Å; L42-W44 PolarHBondContact O-N 3.45Å; L42-S45 WeakPolarHBondContact O-CB 3.35Å; L42-S45 PolarHBondContact O-N 3.46Å; L42-S45 VanDerWaalsContact O-N 3.11Å; L42-S45 PolarHBondContact O-OG 3.18Å; L42-L46 WeakPolarHBondContact O-CG 3.29Å; L42-L46 PolarHBondContact O-N 3.21Å; L42-W255 HydrophobicContact CD1-CH2 4.41Å; L42-W255 HydrophobicContact CD1-CZ3 4.16Å; L42-F259 HydrophobicContact CD1-CE2 4.38Å; L42-F259 HydrophobicContact CD1-CZ 4.28Å; L42-F259 HydrophobicContact CD2-CE1 4.07Å; L42-F259 HydrophobicContact CD2-CE2 4.5Å; L42-F259 HydrophobicContact CD2-CZ 3.68Å; L42-F286 HydrophobicContact CD2-CD1 3.85Å; L42-F286 HydrophobicContact CD2-CE1 4.32Å
43L91.3Very high84.6Confident43 Ų4364.8 Ų64.823%0.22532%0.324CS..Hα-helixtrans-58.2-43.8178.5-172.862.5000112Q17 I20 L21 L39 T40 S45 L46Q17-L43 HydrophobicContact CG-CD1 3.77Å; I20-L43 HydrophobicContact CG2-CB 3.92Å; I20-L43 HydrophobicContact CG2-CD1 4.34Å; L21-L43 HydrophobicContact CD2-CD2 3.64Å; L21-L43 HydrophobicContact CG-CD1 4.35Å; L21-L43 HydrophobicContact CG-CD2 4.27Å; L39-L43 PolarHBondContact O-N 2.86Å; T40-L43 PolarHBondContact O-N 2.79Å; L43-S45 VanDerWaalsContact C-N 3.32Å; L43-S45 PolarHBondContact O-N 3.05Å; L43-L46 PolarHBondContact O-N 3.22Å
44W90.6Very high82.6Confident161 Ų16162.5 Ų62.561%0.6132%0.324SS*.Hα-helixtrans-64-38.4177.1-176.181.9000111.7T40 D41 L42 L46 N47 H290T40-W44 VanDerWaalsContact O-CB 3.28Å; T40-W44 WeakPolarHBondContact O-CB 3.27Å; T40-W44 PolarHBondContact O-N 3.41Å; D41-W44 PolarHBondContact O-N 3.45Å; L42-W44 VanDerWaalsContact C-N 3.3Å; L42-W44 PolarHBondContact O-N 3.45Å; W44-L46 VanDerWaalsContact C-N 3.28Å; W44-L46 PolarHBondContact O-N 3.06Å; W44-N47 PolarHBondContact O-N 3.18Å; W44-H290 AromaticContact CH2-CE1 3.88Å; W44-H290 AromaticContact CZ3-CE1 3.33Å; W44-H290 WeakPolarHBondContact CZ3-CE1 3.32Å
45S89.8Confident80.7Confident4 Ų460.1 Ų60.13%0.02832%0.316CS..Hα-helixtrans-62.7-32.3178.677.30000113.8D41 L42 L43 N47 S289D41-S45 WeakPolarHBondContact O-CB 3.46Å; D41-S45 PolarHBondContact O-N 3.04Å; L42-S45 WeakPolarHBondContact O-CB 3.35Å; L42-S45 PolarHBondContact O-N 3.46Å; L42-S45 VanDerWaalsContact O-N 3.11Å; L42-S45 PolarHBondContact O-OG 3.18Å; L43-S45 VanDerWaalsContact C-N 3.32Å; L43-S45 PolarHBondContact O-N 3.05Å; S45-N47 VanDerWaalsContact C-N 3.29Å; S45-N47 PolarHBondContact O-N 2.93Å; S45-S289 VanDerWaalsContact CB-N 3.26Å
46L87.7Confident78.8Confident14 Ų1462 Ų627%0.07333%0.329CS..Hα-helixtrans-66-30.5-179.2-66.8175.4000112.6L13 V16 Q17 I20 L42 L43 W44 L48 F286L13-L46 HydrophobicContact CB-CD2 4.49Å; L13-L46 HydrophobicContact CD2-CD2 3.64Å; L13-L46 HydrophobicContact CG-CD2 4.48Å; V16-L46 HydrophobicContact CG1-CD1 3.95Å; Q17-L46 HydrophobicContact CB-CD1 4.44Å; I20-L46 HydrophobicContact CD1-CD1 4.14Å; L42-L46 WeakPolarHBondContact O-CG 3.29Å; L42-L46 PolarHBondContact O-N 3.21Å; L43-L46 PolarHBondContact O-N 3.22Å; W44-L46 VanDerWaalsContact C-N 3.28Å; W44-L46 PolarHBondContact O-N 3.06Å; L46-L48 HydrophobicContact CB-CD1 4.49Å; L46-L48 HydrophobicContact CB-CG 4.33Å; L46-L48 PolarHBondContact O-N 3.41Å; L46-F286 HydrophobicContact CD2-CD1 4.03Å; L46-F286 HydrophobicContact CD2-CE1 3.78Å; L46-F286 HydrophobicContact CD2-CZ 4.43Å; L46-F286 HydrophobicContact CG-CE1 4.37Å
47N81.1Confident76.8Confident118 Ų11862.1 Ų62.163%0.63133%0.33SS*.  trans46.633.2179.6-165.645.2000114.2W44 S45 R288W44-N47 PolarHBondContact O-N 3.18Å; S45-N47 VanDerWaalsContact C-N 3.29Å; S45-N47 PolarHBondContact O-N 2.93Å; N47-R288 PolarHBondContact ND2-NH1 3.45Å
48L80Confident74.7Confident56 Ų5661.9 Ų61.929%0.29333%0.329SS..  trans-89144.2177.6-68.8177.3000110.4L13 Q17 L46 I50L13-L48 HydrophobicContact CB-CD1 3.7Å; Q17-L48 PolarHBondContact NE2-O 3.06Å; L46-L48 HydrophobicContact CB-CD1 4.49Å; L46-L48 HydrophobicContact CB-CG 4.33Å; L46-L48 PolarHBondContact O-N 3.41Å; L48-I50 PolarHBondContact O-N 2.76Å
49P74.7Confident72.6Confident104 Ų10464 Ų6468%0.67535%0.347SS*.  trans-57.2141.1165.627.1-33.1000108.8Q17 I51Q17-P49 PolarHBondContact NE2-O 3.05Å; Q17-P49 PolarHBondContact OE1-O 3.47Å; P49-I51 PolarHBondContact O-N 3.21Å
50I66.4Low70.3Confident114 Ų11468.7 Ų68.759%0.58538%0.38SS*.  trans-66.8107.5177.8-58.2170.1000107.2L48L48-I50 PolarHBondContact O-N 2.76Å
51I61.9Low68.2Low103 Ų10366.7 Ų66.753%0.52837%0.368SS..  trans-71.6-35.3-170.1-64.4165.6000111.6C14 P49C14-I51 HydrophobicContact CB-CD1 3.46Å; C14-I51 VanDerWaalsContact CB-CD1 3.46Å; C14-I51 WeakPolarHBondContact SG-CD1 3.4Å; P49-I51 PolarHBondContact O-N 3.21Å
52S54.9Low66.3Low35 Ų3568.5 Ų68.525%0.24538%0.378CS..SBendtrans-85137.4-178.830.40000109.6V57S52-V57 WeakPolarHBondContact OG-CG2 3.24Å
53N54.6Low64.7Low106 Ų10669 Ų6957%0.56738%0.382SS*.  trans-47.2122.9172.6-155.18.1000106.7D55 S56 V57N53-D55 PolarHBondContact O-N 3.08Å; N53-S56 PolarHBondContact N-OG 3.49Å; N53-S56 WeakPolarHBondContact O-CA 3.26Å; N53-S56 WeakPolarHBondContact O-CB 3.33Å; N53-S56 PolarHBondContact O-N 3.13Å; N53-S56 PolarHBondContact O-OG 3.27Å; N53-V57 PolarHBondContact O-N 3.02Å
54P53.4Low63.3Low63 Ų6371.4 Ų71.441%0.40939%0.388SS..Hα-helixtrans-49-42.3-176.911.3-25.6000109.7S56 V57 F58P54-S56 VanDerWaalsContact C-N 3.28Å; P54-S56 PolarHBondContact O-N 3.1Å; P54-V57 PolarHBondContact O-N 3.5Å; P54-F58 HydrophobicContact CB-CD2 3.7Å; P54-F58 HydrophobicContact CB-CE2 3.52Å; P54-F58 VanDerWaalsContact O-CB 3.27Å; P54-F58 WeakPolarHBondContact O-CB 3.34Å; P54-F58 WeakPolarHBondContact O-CD2 3.22Å; P54-F58 VanDerWaalsContact O-CG 3.3Å; P54-F58 WeakPolarHBondContact O-CG 3.46Å; P54-F58 PolarHBondContact O-N 3.44Å
55D52.2Low61.8Low113 Ų11370.5 Ų70.560%0.60439%0.391SS*.Hα-helixtrans-59.8-28175.7-62.8-28.3000114.8N53 S59N53-D55 PolarHBondContact O-N 3.08Å; D55-S59 WeakPolarHBondContact O-CA 3.37Å; D55-S59 WeakPolarHBondContact O-CB 3.49Å; D55-S59 PolarHBondContact O-N 2.87Å; D55-S59 PolarHBondContact O-OG 3.01Å
56S55.4Low60.5Low51 Ų5171 Ų7136%0.35739%0.394SS..Hα-helixtrans-77.7-38.9175.568.50000112.7N53 P54 S59 S60N53-S56 PolarHBondContact N-OG 3.49Å; N53-S56 WeakPolarHBondContact O-CA 3.26Å; N53-S56 WeakPolarHBondContact O-CB 3.33Å; N53-S56 PolarHBondContact O-N 3.13Å; N53-S56 PolarHBondContact O-OG 3.27Å; P54-S56 VanDerWaalsContact C-N 3.28Å; P54-S56 PolarHBondContact O-N 3.1Å; S56-S59 WeakPolarHBondContact CA-OG 3.46Å; S56-S59 PolarHBondContact O-OG 3.34Å; S56-S60 WeakPolarHBondContact O-CB 3.35Å; S56-S60 PolarHBondContact O-N 3.16Å; S56-S60 PolarHBondContact O-OG 3.28Å
57V52.7Low59.7Low17 Ų1770.9 Ų70.910%0.10339%0.393CS..Hα-helixtrans-68.5-50.4172.6-174.50000108.9L21 F25 S52 N53 P54 S59 S60 S61L21-V57 HydrophobicContact CB-CG1 4.01Å; L21-V57 HydrophobicContact CD1-CG1 4.16Å; F25-V57 HydrophobicContact CD2-CG1 4.49Å; F25-V57 HydrophobicContact CE2-CG1 3.93Å; S52-V57 WeakPolarHBondContact OG-CG2 3.24Å; N53-V57 PolarHBondContact O-N 3.02Å; P54-V57 PolarHBondContact O-N 3.5Å; V57-S59 PolarHBondContact O-N 2.93Å; V57-S60 PolarHBondContact O-OG 3.06Å; V57-S61 WeakPolarHBondContact O-CB 3.49Å; V57-S61 PolarHBondContact O-N 3.13Å; V57-S61 PolarHBondContact O-OG 2.9Å
58F52.2Low59.3Low95 Ų9568 Ų6842%0.41738%0.381SS..Hα-helixtrans-65.2-35.3177.7-65.7-59.6000111.8F25 P54 S61 N62F25-F58 HydrophobicContact CE1-CD1 4.29Å; F25-F58 AromaticContact CE1-CE1 3.97Å; F25-F58 HydrophobicContact CE1-CE1 3.97Å; F25-F58 HydrophobicContact CE2-CD1 4.42Å; F25-F58 HydrophobicContact CE2-CE1 4.31Å; F25-F58 AromaticContact CZ-CD1 3.83Å; F25-F58 HydrophobicContact CZ-CD1 3.83Å; F25-F58 AromaticContact CZ-CE1 3.43Å; F25-F58 HydrophobicContact CZ-CE1 3.43Å; F25-F58 VanDerWaalsContact CZ-CE1 3.43Å; F25-F58 HydrophobicContact CZ-CZ 4.41Å; P54-F58 HydrophobicContact CB-CD2 3.7Å; P54-F58 HydrophobicContact CB-CE2 3.52Å; P54-F58 VanDerWaalsContact O-CB 3.27Å; P54-F58 WeakPolarHBondContact O-CB 3.34Å; P54-F58 WeakPolarHBondContact O-CD2 3.22Å; P54-F58 VanDerWaalsContact O-CG 3.3Å; P54-F58 WeakPolarHBondContact O-CG 3.46Å; P54-F58 PolarHBondContact O-N 3.44Å; F58-S61 CarbonylContact O-C 3.5Å; F58-N62 VanDerWaalsContact O-CA 3.25Å; F58-N62 WeakPolarHBondContact O-CA 2.92Å; F58-N62 WeakPolarHBondContact O-CB 3.26Å; F58-N62 PolarHBondContact O-N 3.44Å; F58-N62 PolarHBondContact O-ND2 3.25Å; F58-N62 PolarHBondContact O-OD1 3.46Å
59S49.6Very low59.2Low68 Ų6870.2 Ų70.248%0.47640%0.399SS..Hα-helixtrans-74.6-38.6177600000113.3D55 S56 V57D55-S59 WeakPolarHBondContact O-CA 3.37Å; D55-S59 WeakPolarHBondContact O-CB 3.49Å; D55-S59 PolarHBondContact O-N 2.87Å; D55-S59 PolarHBondContact O-OG 3.01Å; S56-S59 WeakPolarHBondContact CA-OG 3.46Å; S56-S59 PolarHBondContact O-OG 3.34Å; V57-S59 PolarHBondContact O-N 2.93Å
60S47.6Very low59.4Low100 Ų10072.4 Ų72.470%0.69941%0.405SS*.Hα-helixtrans-72.9-28.8174.857.50000112.9S56 V57S56-S60 WeakPolarHBondContact O-CB 3.35Å; S56-S60 PolarHBondContact O-N 3.16Å; S56-S60 PolarHBondContact O-OG 3.28Å; V57-S60 PolarHBondContact O-OG 3.06Å
61S49.6Very low60Low15 Ų1569.8 Ų69.811%0.10539%0.39CS..SBendtrans-102.97.6176.570.80000114.5F25 V57 F58 V63F25-S61 WeakPolarHBondContact CD2-OG 3.48Å; V57-S61 WeakPolarHBondContact O-CB 3.49Å; V57-S61 PolarHBondContact O-N 3.13Å; V57-S61 PolarHBondContact O-OG 2.9Å; F58-S61 CarbonylContact O-C 3.5Å; S61-V63 WeakPolarHBondContact O-CG2 3.38Å; S61-V63 PolarHBondContact O-N 3.44Å
62N53.9Low61.1Low58 Ų5867.5 Ų67.531%0.3138%0.378SS..  trans-73.961.9170.5-97.1-16.9000107.7F58 Y64 Q65 S66F58-N62 VanDerWaalsContact O-CA 3.25Å; F58-N62 WeakPolarHBondContact O-CA 2.92Å; F58-N62 WeakPolarHBondContact O-CB 3.26Å; F58-N62 PolarHBondContact O-N 3.44Å; F58-N62 PolarHBondContact O-ND2 3.25Å; F58-N62 PolarHBondContact O-OD1 3.46Å; N62-Y64 PolarHBondContact O-N 3.04Å; N62-Q65 HydrophobicContact CB-CB 4.24Å; N62-Q65 HydrophobicContact CB-CG 3.92Å; N62-Q65 WeakPolarHBondContact O-CA 3.35Å; N62-Q65 WeakPolarHBondContact O-CB 3.4Å; N62-Q65 PolarHBondContact O-N 2.96Å; N62-S66 PolarHBondContact O-N 3.35Å
63V58.4Low62.7Low12 Ų1271 Ų717%0.07340%0.398CS..Hα-helixtrans-59.3-19.4173.1-1660000109.6L29 S61 S66 I67 V116L29-V63 HydrophobicContact CD2-CB 3.47Å; L29-V63 VanDerWaalsContact CD2-CB 3.47Å; L29-V63 HydrophobicContact CD2-CG1 3.2Å; L29-V63 HydrophobicContact CD2-CG2 4.21Å; S61-V63 WeakPolarHBondContact O-CG2 3.38Å; S61-V63 PolarHBondContact O-N 3.44Å; V63-S66 WeakPolarHBondContact CG1-OG 3.23Å; V63-S66 WeakPolarHBondContact O-CA 3.18Å; V63-S66 WeakPolarHBondContact O-CB 3.45Å; V63-S66 PolarHBondContact O-N 3.5Å; V63-S66 PolarHBondContact O-OG 3.09Å; V63-I67 PolarHBondContact O-N 3.45Å; V63-V116 HydrophobicContact CG1-CG2 3.88Å
64Y62.6Low64.3Low92 Ų9267.7 Ų67.736%0.36138%0.382SS..Hα-helixtrans-61.3-38.4166.1-67.6-72000114L29 N62 S66 I67 F75 L76L29-Y64 HydrophobicContact CD1-CD1 4.03Å; L29-Y64 HydrophobicContact CD1-CE1 3.62Å; L29-Y64 HydrophobicContact CD1-CE2 4.15Å; L29-Y64 HydrophobicContact CD1-CG 4.46Å; N62-Y64 PolarHBondContact O-N 3.04Å; Y64-S66 PolarHBondContact O-N 3.48Å; Y64-I67 HydrophobicContact CD1-CD1 4.34Å; Y64-I67 PolarHBondContact O-N 3.35Å; Y64-F75 HydrophobicContact CE1-CE1 4.08Å; Y64-L76 HydrophobicContact CD1-CD2 4.28Å; Y64-L76 HydrophobicContact CE1-CD2 3.97Å
65Q59.6Low66Low143 Ų14364.7 Ų64.767%0.66836%0.362SS*.Hα-helixtrans-67.7-18.1172.4-70.6-179.7-8.700112.2N62N62-Q65 HydrophobicContact CB-CB 4.24Å; N62-Q65 HydrophobicContact CB-CG 3.92Å; N62-Q65 WeakPolarHBondContact O-CA 3.35Å; N62-Q65 WeakPolarHBondContact O-CB 3.4Å; N62-Q65 PolarHBondContact O-N 2.96Å
66S62.5Low67.8Low14 Ų1462.9 Ų62.910%0.09835%0.352CS..Hα-helixtrans-82.9-24.9-1801070000111.2N62 V63 Y64 Y113N62-S66 PolarHBondContact O-N 3.35Å; V63-S66 WeakPolarHBondContact CG1-OG 3.23Å; V63-S66 WeakPolarHBondContact O-CA 3.18Å; V63-S66 WeakPolarHBondContact O-CB 3.45Å; V63-S66 PolarHBondContact O-N 3.5Å; V63-S66 PolarHBondContact O-OG 3.09Å; Y64-S66 PolarHBondContact O-N 3.48Å; S66-Y113 VanDerWaalsContact CB-CG 3.5Å; S66-Y113 WeakPolarHBondContact O-CB 3.29Å; S66-Y113 WeakPolarHBondContact O-CD2 3.47Å; S66-Y113 WeakPolarHBondContact OG-CB 3.39Å; S66-Y113 WeakPolarHBondContact OG-CD1 3.35Å
67I71.3Confident69.6Low11 Ų1164.8 Ų64.86%0.05636%0.358CS..SBendtrans-69.8131.5173.1-60167.9000109V63 Y64 K71 L72 F75V63-I67 PolarHBondContact O-N 3.45Å; Y64-I67 HydrophobicContact CD1-CD1 4.34Å; Y64-I67 PolarHBondContact O-N 3.35Å; I67-K71 HydrophobicContact CG2-CB 4.3Å; I67-L72 HydrophobicContact CB-CD1 4.38Å; I67-L72 HydrophobicContact CD1-CD1 4.43Å; I67-L72 HydrophobicContact CG2-CB 4.4Å; I67-L72 HydrophobicContact CG2-CD1 4.42Å; I67-F75 HydrophobicContact CD1-CB 4.3Å; I67-F75 HydrophobicContact CD1-CD1 3.31Å; I67-F75 HydrophobicContact CD1-CD2 4.13Å; I67-F75 HydrophobicContact CD1-CE1 3.51Å; I67-F75 HydrophobicContact CD1-CE2 4.3Å; I67-F75 HydrophobicContact CD1-CG 3.64Å; I67-F75 HydrophobicContact CD1-CZ 4Å; I67-F75 HydrophobicContact CG2-CB 4.37Å
68P72.3Confident71.5Confident58 Ų5864 Ų6438%0.37735%0.353SS..  trans-53.2135.9175.6-2634.1000111D70 K71 L72P68-D70 PolarHBondContact O-N 3.46Å; P68-D70 VanDerWaalsContact O-N 3.13Å; P68-K71 HydrophobicContact CB-CB 4.37Å; P68-K71 HydrophobicContact CB-CG 4.36Å; P68-K71 HydrophobicContact CG-CD 4.36Å; P68-K71 CarbonylContact O-C 3.5Å; P68-K71 WeakPolarHBondContact O-CA 3.19Å; P68-K71 PolarHBondContact O-N 2.91Å; P68-L72 PolarHBondContact O-N 3.48Å
69P77Confident73.5Confident103 Ų10360.4 Ų60.467%0.66934%0.337SS*.Hα-helixtrans-56-36.7-175.721.7-32.9000112.1K71 L72P69-K71 PolarHBondContact O-N 3.19Å; P69-L72 WeakPolarHBondContact O-CB 3.34Å; P69-L72 PolarHBondContact O-N 2.9Å
70D79.6Confident75.6Confident150 Ų15060.4 Ų60.480%0.80234%0.337SS*.Hα-helixtrans-66.3-26178.6-54-21.9000112.9P68P68-D70 PolarHBondContact O-N 3.46Å; P68-D70 VanDerWaalsContact O-N 3.13Å
71K79.1Confident77.9Confident59 Ų5956.1 Ų56.126%0.25731%0.307SS..Hα-helixtrans-98.4-11179.5-63.1-172.3-179.7-177.40113.2I67 P68 P69 T73 T74 F75I67-K71 HydrophobicContact CG2-CB 4.3Å; P68-K71 HydrophobicContact CB-CB 4.37Å; P68-K71 HydrophobicContact CB-CG 4.36Å; P68-K71 HydrophobicContact CG-CD 4.36Å; P68-K71 CarbonylContact O-C 3.5Å; P68-K71 WeakPolarHBondContact O-CA 3.19Å; P68-K71 PolarHBondContact O-N 2.91Å; P69-K71 PolarHBondContact O-N 3.19Å; K71-T73 PolarHBondContact O-N 3.02Å; K71-T74 PolarHBondContact O-N 3.29Å; K71-F75 PolarHBondContact O-N 3.47Å
72L83.7Confident80.1Confident54 Ų5455.6 Ų55.628%0.28330%0.302SS..Hα-helixtrans-60.6-46.5-174.1-179.462000111.9I67 P68 P69 T74 F75 L76I67-L72 HydrophobicContact CB-CD1 4.38Å; I67-L72 HydrophobicContact CD1-CD1 4.43Å; I67-L72 HydrophobicContact CG2-CB 4.4Å; I67-L72 HydrophobicContact CG2-CD1 4.42Å; P68-L72 PolarHBondContact O-N 3.48Å; P69-L72 WeakPolarHBondContact O-CB 3.34Å; P69-L72 PolarHBondContact O-N 2.9Å; L72-T74 PolarHBondContact O-N 3.45Å; L72-F75 PolarHBondContact O-N 2.97Å; L72-L76 HydrophobicContact CD1-CD1 4.16Å; L72-L76 HydrophobicContact CD1-CD2 4.48Å; L72-L76 HydrophobicContact CD1-CG 4.07Å; L72-L76 HydrophobicContact CG-CD1 4.03Å; L72-L76 HydrophobicContact CG-CG 4.33Å; L72-L76 WeakPolarHBondContact O-CB 3.26Å; L72-L76 VanDerWaalsContact O-CG 3.31Å; L72-L76 WeakPolarHBondContact O-CG 3.33Å; L72-L76 PolarHBondContact O-N 3.22Å
73T88.9Confident82Confident110 Ų11055.8 Ų55.868%0.67530%0.303SS*.Hα-helixtrans-59.9-45179.4-51.90000111.7K71 L76 L77K71-T73 PolarHBondContact O-N 3.02Å; T73-L76 PolarHBondContact O-N 2.86Å; T73-L77 PolarHBondContact O-N 3.18Å
74T89.1Confident83.8Confident35 Ų3559.2 Ų59.222%0.21533%0.325CS..Hα-helixtrans-63.8-42.6177.3-48.10000111.4K71 L72 L77 A78 I93 N97K71-T74 PolarHBondContact O-N 3.29Å; L72-T74 PolarHBondContact O-N 3.45Å; T74-L77 PolarHBondContact O-N 3.17Å; T74-A78 WeakPolarHBondContact O-CB 3.22Å; T74-A78 PolarHBondContact O-N 3.28Å; T74-I93 HydrophobicContact CG2-CG2 3.41Å; T74-I93 VanDerWaalsContact CG2-CG2 3.41Å; T74-N97 VanDerWaalsContact CG2-ND2 3.31Å; T74-N97 WeakPolarHBondContact CG2-ND2 3.13Å
75F88.2Confident85.3Confident0 Ų059.3 Ų59.30%033%0.329CS..Hα-helixtrans-63.2-45.2177-180-93.6000112L29 Y64 I67 K71 L72 L77 A78 R79 V116 Y117 L120L29-F75 HydrophobicContact CD1-CE1 3.79Å; L29-F75 HydrophobicContact CD1-CZ 3.86Å; L29-F75 HydrophobicContact CG-CZ 4.19Å; Y64-F75 HydrophobicContact CE1-CE1 4.08Å; I67-F75 HydrophobicContact CD1-CB 4.3Å; I67-F75 HydrophobicContact CD1-CD1 3.31Å; I67-F75 HydrophobicContact CD1-CD2 4.13Å; I67-F75 HydrophobicContact CD1-CE1 3.51Å; I67-F75 HydrophobicContact CD1-CE2 4.3Å; I67-F75 HydrophobicContact CD1-CG 3.64Å; I67-F75 HydrophobicContact CD1-CZ 4Å; I67-F75 HydrophobicContact CG2-CB 4.37Å; K71-F75 PolarHBondContact O-N 3.47Å; L72-F75 PolarHBondContact O-N 2.97Å; F75-L77 VanDerWaalsContact C-N 3.34Å; F75-L77 PolarHBondContact O-N 3.12Å; F75-A78 PolarHBondContact O-N 2.96Å; F75-R79 HydrophobicContact CE1-CB 4.36Å; F75-R79 VanDerWaalsContact O-CB 3.26Å; F75-R79 WeakPolarHBondContact O-CB 3.19Å; F75-R79 PolarHBondContact O-N 2.83Å; F75-V116 HydrophobicContact CE2-CG1 3.77Å; F75-V116 HydrophobicContact CZ-CG1 3.78Å; F75-Y117 HydrophobicContact CB-CD2 4.41Å; F75-Y117 HydrophobicContact CB-CE2 4.37Å; F75-Y117 AromaticContact CD2-CD2 3.96Å; F75-Y117 HydrophobicContact CD2-CD2 3.96Å; F75-L120 HydrophobicContact CD2-CD2 4.24Å; F75-L120 HydrophobicContact CE2-CD2 3.66Å; F75-L120 HydrophobicContact CZ-CD2 4.14Å
76L90.7Very high87Confident75 Ų7557.1 Ų57.139%0.39332%0.318SS..Hα-helixtrans-63.3-40.2178.8-70.4177.1000111.9Y64 L72 T73 S80Y64-L76 HydrophobicContact CD1-CD2 4.28Å; Y64-L76 HydrophobicContact CE1-CD2 3.97Å; L72-L76 HydrophobicContact CD1-CD1 4.16Å; L72-L76 HydrophobicContact CD1-CD2 4.48Å; L72-L76 HydrophobicContact CD1-CG 4.07Å; L72-L76 HydrophobicContact CG-CD1 4.03Å; L72-L76 HydrophobicContact CG-CG 4.33Å; L72-L76 WeakPolarHBondContact O-CB 3.26Å; L72-L76 VanDerWaalsContact O-CG 3.31Å; L72-L76 WeakPolarHBondContact O-CG 3.33Å; L72-L76 PolarHBondContact O-N 3.22Å; T73-L76 PolarHBondContact O-N 2.86Å; L76-S80 WeakPolarHBondContact O-CB 3.47Å; L76-S80 PolarHBondContact O-N 2.93Å; L76-S80 PolarHBondContact O-OG 3.44Å
77L93.2Very high88.6Confident92 Ų9257.4 Ų57.448%0.48232%0.317SS..Hα-helixtrans-61.7-51.8173.1-178.265.2000110.9T73 T74 F75 R79 S80 C81 I93T73-L77 PolarHBondContact O-N 3.18Å; T74-L77 PolarHBondContact O-N 3.17Å; F75-L77 VanDerWaalsContact C-N 3.34Å; F75-L77 PolarHBondContact O-N 3.12Å; L77-R79 VanDerWaalsContact C-N 3.32Å; L77-R79 PolarHBondContact O-N 3.47Å; L77-S80 WeakPolarHBondContact O-CB 3.41Å; L77-S80 PolarHBondContact O-N 3.23Å; L77-S80 VanDerWaalsContact O-N 3.1Å; L77-C81 PolarHBondContact O-N 3.11Å; L77-C81 PolarHBondContact O-SG 3.47Å; L77-I93 HydrophobicContact CD2-CD1 3.96Å; L77-I93 HydrophobicContact CD2-CG1 4.5Å; L77-I93 HydrophobicContact CG-CD1 3.92Å
78A93.2Very high89.7Confident0 Ų060.9 Ų60.90%034%0.336CS..Hα-helixtrans-59.8-40.9178.800000112.5T74 F75 S80 C81 F82 C90 I93 L94T74-A78 WeakPolarHBondContact O-CB 3.22Å; T74-A78 PolarHBondContact O-N 3.28Å; F75-A78 PolarHBondContact O-N 2.96Å; A78-S80 VanDerWaalsContact C-N 3.33Å; A78-C81 PolarHBondContact O-N 3.23Å; A78-F82 WeakPolarHBondContact O-CB 3.38Å; A78-F82 PolarHBondContact O-N 2.95Å; A78-C90 PolarHBondContact O-SG 3.32Å; A78-I93 HydrophobicContact CB-CB 4.36Å; A78-I93 HydrophobicContact CB-CG2 3.98Å; A78-L94 HydrophobicContact CB-CD1 4.07Å; A78-L94 HydrophobicContact CB-CD2 3.54Å; A78-L94 HydrophobicContact CB-CG 3.62Å
79R92.5Very high90.8Very high19 Ų1961.9 Ų61.97%0.07234%0.335CS..Hα-helixtrans-63.3-40.7175.6-17474.2-168.410726.3111.2Q28 L29 G31 F75 L77 F82 D83 L120Q28-R79 PolarHBondContact O-NH2 3.03Å; L29-R79 WeakPolarHBondContact O-CD 3.07Å; L29-R79 PolarHBondContact O-NE 3.34Å; G31-R79 VanDerWaalsContact CA-NH2 3.29Å; F75-R79 HydrophobicContact CE1-CB 4.36Å; F75-R79 VanDerWaalsContact O-CB 3.26Å; F75-R79 WeakPolarHBondContact O-CB 3.19Å; F75-R79 PolarHBondContact O-N 2.83Å; L77-R79 VanDerWaalsContact C-N 3.32Å; L77-R79 PolarHBondContact O-N 3.47Å; R79-F82 WeakPolarHBondContact O-CB 3.37Å; R79-F82 PolarHBondContact O-N 2.84Å; R79-D83 IonicContact CZ-OD1 3.26Å; R79-D83 IonicContact CZ-OD2 3.5Å; R79-D83 IonicContact NE-OD2 3.39Å; R79-D83 IonicContact NH1-OD1 3.56Å; R79-D83 IonicContact NH2-OD1 2.78Å; R79-D83 PolarHBondContact NH2-OD1 3.24Å; R79-D83 IonicContact NH2-OD2 3.64Å; R79-D83 PolarHBondContact NH2-OD2 3.5Å; R79-D83 VanDerWaalsContact NH2-OD2 3.13Å; R79-D83 PolarHBondContact O-N 3.34Å; R79-L120 HydrophobicContact CB-CD2 4.43Å
80S94.4Very high91.6Very high69 Ų6957 Ų5748%0.48330%0.304SS..Hα-helixtrans-62.8-45.4175.3-56.60000111.3L76 L77 A78 F82 D83 T84L76-S80 WeakPolarHBondContact O-CB 3.47Å; L76-S80 PolarHBondContact O-N 2.93Å; L76-S80 PolarHBondContact O-OG 3.44Å; L77-S80 WeakPolarHBondContact O-CB 3.41Å; L77-S80 PolarHBondContact O-N 3.23Å; L77-S80 VanDerWaalsContact O-N 3.1Å; A78-S80 VanDerWaalsContact C-N 3.33Å; S80-F82 PolarHBondContact O-N 2.83Å; S80-D83 PolarHBondContact O-N 3.31Å; S80-D83 VanDerWaalsContact O-N 3.07Å; S80-T84 PolarHBondContact O-N 3.4Å; S80-T84 PolarHBondContact O-OG1 3.31Å
81C95.7Very high92.3Very high10 Ų1050.2 Ų50.27%0.06827%0.268CS..Hα-helixtrans-62.8-40174.3-62.60000112.3L77 A78 D83 T84 Q85 E86 H89 C90L77-C81 PolarHBondContact O-N 3.11Å; L77-C81 PolarHBondContact O-SG 3.47Å; A78-C81 PolarHBondContact O-N 3.23Å; C81-D83 PolarHBondContact O-N 2.86Å; C81-T84 WeakPolarHBondContact CA-OG1 3.48Å; C81-T84 PolarHBondContact O-N 3.46Å; C81-T84 PolarHBondContact O-OG1 2.92Å; C81-T84 VanDerWaalsContact O-OG1 3.05Å; C81-Q85 PolarHBondContact O-N 3.04Å; C81-E86 HydrophobicContact CB-CB 4.29Å; C81-E86 PolarHBondContact O-N 2.58Å; C81-H89 PolarHBondContact SG-CD2 3.39Å; C81-C90 HydrophobicContact CB-CB 4.11Å
82F95.6Very high92.9Very high3 Ų352.6 Ų52.61%0.01328%0.281CS..Hα-helixtrans-58.5-42.3172.4-173-81.2000110.3A78 R79 S80 Q85 Y87 C90 L120 Y123 M127A78-F82 WeakPolarHBondContact O-CB 3.38Å; A78-F82 PolarHBondContact O-N 2.95Å; R79-F82 WeakPolarHBondContact O-CB 3.37Å; R79-F82 PolarHBondContact O-N 2.84Å; S80-F82 PolarHBondContact O-N 2.83Å; F82-Q85 PolarHBondContact O-N 3.3Å; F82-Y87 HydrophobicContact CD1-CE1 4.33Å; F82-Y87 AromaticContact CD2-CD1 3.82Å; F82-Y87 HydrophobicContact CD2-CD1 3.82Å; F82-Y87 AromaticContact CD2-CE1 3.99Å; F82-Y87 HydrophobicContact CD2-CE1 3.99Å; F82-Y87 HydrophobicContact CE1-CE1 4.17Å; F82-Y87 AromaticContact CE2-CD1 3.84Å; F82-Y87 HydrophobicContact CE2-CD1 3.84Å; F82-Y87 AromaticContact CE2-CE1 3.8Å; F82-Y87 HydrophobicContact CE2-CE1 3.8Å; F82-Y87 HydrophobicContact CG-CD1 4.35Å; F82-Y87 HydrophobicContact CG-CE1 4.24Å; F82-Y87 HydrophobicContact CZ-CD1 4.39Å; F82-Y87 AromaticContact CZ-CE1 3.87Å; F82-Y87 HydrophobicContact CZ-CE1 3.87Å; F82-C90 HydrophobicContact CB-CB 4.42Å; F82-L120 HydrophobicContact CB-CD1 4.37Å; F82-L120 HydrophobicContact CD2-CD1 3.66Å; F82-L120 HydrophobicContact CE2-CD1 4.12Å; F82-L120 HydrophobicContact CG-CD1 3.97Å; F82-Y123 HydrophobicContact CE1-CE1 4.4Å; F82-Y123 AromaticContact CE2-CD1 3.68Å; F82-Y123 HydrophobicContact CE2-CD1 3.68Å; F82-Y123 AromaticContact CE2-CE1 3.98Å; F82-Y123 HydrophobicContact CE2-CE1 3.98Å; F82-Y123 AromaticContact CZ-CD1 3.61Å; F82-Y123 HydrophobicContact CZ-CD1 3.61Å; F82-Y123 AromaticContact CZ-CE1 3.42Å; F82-Y123 HydrophobicContact CZ-CE1 3.42Å; F82-Y123 VanDerWaalsContact CZ-CE1 3.42Å; F82-M127 HydrophobicContact CE2-CG 4.19Å; F82-M127 HydrophobicContact CZ-CG 4.19Å
83D93.9Very high93.2Very high62 Ų6251 Ų5133%0.33227%0.272SS..Hα-helixtrans-71.6-30-176.8-78.4-32.5000113.6R33 R79 S80 C81 Q85R33-D83 IonicContact CZ-OD1 3.84Å; R33-D83 IonicContact NE-OD1 2.83Å; R33-D83 PolarHBondContact NH2-O 3.43Å; R33-D83 IonicContact NH2-OD1 2.64Å; R33-D83 PolarHBondContact NH2-OD1 2.84Å; R79-D83 IonicContact CZ-OD1 3.26Å; R79-D83 IonicContact CZ-OD2 3.5Å; R79-D83 IonicContact NE-OD2 3.39Å; R79-D83 IonicContact NH1-OD1 3.56Å; R79-D83 IonicContact NH2-OD1 2.78Å; R79-D83 PolarHBondContact NH2-OD1 3.24Å; R79-D83 IonicContact NH2-OD2 3.64Å; R79-D83 PolarHBondContact NH2-OD2 3.5Å; R79-D83 VanDerWaalsContact NH2-OD2 3.13Å; R79-D83 PolarHBondContact O-N 3.34Å; S80-D83 PolarHBondContact O-N 3.31Å; S80-D83 VanDerWaalsContact O-N 3.07Å; C81-D83 PolarHBondContact O-N 2.86Å; D83-Q85 PolarHBondContact O-N 2.95Å
84T95.8Very high93.2Very high84 Ų8445.7 Ų45.752%0.51524%0.24SC..THydrogen-bonded Turntrans-78.94.2169.4620000113.7S80 C81 E86S80-T84 PolarHBondContact O-N 3.4Å; S80-T84 PolarHBondContact O-OG1 3.31Å; C81-T84 WeakPolarHBondContact CA-OG1 3.48Å; C81-T84 PolarHBondContact O-N 3.46Å; C81-T84 PolarHBondContact O-OG1 2.92Å; C81-T84 VanDerWaalsContact O-OG1 3.05Å; T84-E86 VanDerWaalsContact C-N 3.26Å; T84-E86 PolarHBondContact O-N 2.76Å; T84-E86 PolarHBondContact OG1-OE1 3.45Å; T84-E86 VanDerWaalsContact OG1-OE1 3.05Å
85Q94.9Very high93Very high95 Ų9546 Ų4644%0.44424%0.243SC..THydrogen-bonded Turntrans6525-178.2-46.1178.818.300114C81 F82 D83 Y87 K131C81-Q85 PolarHBondContact O-N 3.04Å; F82-Q85 PolarHBondContact O-N 3.3Å; D83-Q85 PolarHBondContact O-N 2.95Å; Q85-Y87 VanDerWaalsContact C-N 3.31Å; Q85-Y87 HydrophobicContact CB-CE2 4.03Å; Q85-Y87 PolarHBondContact O-N 2.86Å; Q85-K131 PolarHBondContact O-NZ 3.32Å
86E95.8Very high92.5Very high96 Ų9652.6 Ų52.645%0.44927%0.274SS..  trans-90.366.2171.4-67.6169.9-137.300109.7C81 T84 H89 C90C81-E86 HydrophobicContact CB-CB 4.29Å; C81-E86 PolarHBondContact O-N 2.58Å; T84-E86 VanDerWaalsContact C-N 3.26Å; T84-E86 PolarHBondContact O-N 2.76Å; T84-E86 PolarHBondContact OG1-OE1 3.45Å; T84-E86 VanDerWaalsContact OG1-OE1 3.05Å; E86-H89 HydrophobicContact CB-CB 4.24Å; E86-H89 PolarHBondContact O-N 2.79Å; E86-H89 IonicContact OE2-CD2 2.78Å; E86-C90 WeakPolarHBondContact O-CB 3.5Å; E86-C90 PolarHBondContact O-N 2.94Å
87Y96.5Very high91.4Very high20 Ų2051.2 Ų51.28%0.07827%0.267CS..Hα-helixtrans-66.5-39.9-169.2-59.3-54.4000114.2F82 Q85 C90 A91 S124 M127 K131F82-Y87 HydrophobicContact CD1-CE1 4.33Å; F82-Y87 AromaticContact CD2-CD1 3.82Å; F82-Y87 HydrophobicContact CD2-CD1 3.82Å; F82-Y87 AromaticContact CD2-CE1 3.99Å; F82-Y87 HydrophobicContact CD2-CE1 3.99Å; F82-Y87 HydrophobicContact CE1-CE1 4.17Å; F82-Y87 AromaticContact CE2-CD1 3.84Å; F82-Y87 HydrophobicContact CE2-CD1 3.84Å; F82-Y87 AromaticContact CE2-CE1 3.8Å; F82-Y87 HydrophobicContact CE2-CE1 3.8Å; F82-Y87 HydrophobicContact CG-CD1 4.35Å; F82-Y87 HydrophobicContact CG-CE1 4.24Å; F82-Y87 HydrophobicContact CZ-CD1 4.39Å; F82-Y87 AromaticContact CZ-CE1 3.87Å; F82-Y87 HydrophobicContact CZ-CE1 3.87Å; Q85-Y87 VanDerWaalsContact C-N 3.31Å; Q85-Y87 HydrophobicContact CB-CE2 4.03Å; Q85-Y87 PolarHBondContact O-N 2.86Å; Y87-C90 WeakPolarHBondContact O-CB 3.39Å; Y87-C90 PolarHBondContact O-N 3.39Å; Y87-A91 PolarHBondContact O-N 3.01Å; Y87-S124 WeakPolarHBondContact CB-O 3.37Å; Y87-M127 HydrophobicContact CD1-CB 3.77Å; Y87-M127 HydrophobicContact CD2-CB 3.88Å; Y87-M127 HydrophobicContact CE1-CB 3.93Å; Y87-M127 HydrophobicContact CE1-CE 4.35Å; Y87-M127 HydrophobicContact CE1-CG 4.45Å; Y87-M127 HydrophobicContact CE2-CB 4.03Å; Y87-M127 HydrophobicContact CE2-CE 4.21Å; Y87-M127 HydrophobicContact CG-CB 3.76Å; Y87-M127 WeakPolarHBondContact OH-CE 3.5Å; Y87-K131 HydrophobicContact CD2-CB 4.13Å; Y87-K131 HydrophobicContact CD2-CD 3.92Å; Y87-K131 HydrophobicContact CE2-CB 4.28Å; Y87-K131 HydrophobicContact CE2-CD 4.1Å
88D94.6Very high90.1Very high85 Ų8548 Ų4846%0.45525%0.249SC..Hα-helixtrans-64.5-43.4176.9-67.3-58.4000111.3C90 A91 E92 A128 R132D88-C90 VanDerWaalsContact C-N 3.35Å; D88-C90 PolarHBondContact O-N 2.83Å; D88-A91 WeakPolarHBondContact O-CB 3.32Å; D88-A91 PolarHBondContact O-N 2.88Å; D88-E92 WeakPolarHBondContact O-CB 3.46Å; D88-E92 PolarHBondContact O-N 3.4Å; D88-A128 WeakPolarHBondContact OD1-CB 3.45Å; D88-R132 IonicContact OD1-CZ 2.75Å; D88-R132 IonicContact OD1-NH1 3.76Å; D88-R132 PolarHBondContact OD1-NH1 3.47Å; D88-R132 IonicContact OD1-NH2 3.18Å; D88-R132 IonicContact OD2-NH1 2.81Å; D88-R132 PolarHBondContact OD2-NH1 3.12Å
89H94.6Very high88.1Confident78 Ų7856.7 Ų56.736%0.36129%0.289SS..Hα-helixtrans-64-41.4177.3-17242.8000111.6C81 E86 A91 E92 I93C81-H89 PolarHBondContact SG-CD2 3.39Å; E86-H89 HydrophobicContact CB-CB 4.24Å; E86-H89 PolarHBondContact O-N 2.79Å; E86-H89 IonicContact OE2-CD2 2.78Å; H89-A91 VanDerWaalsContact C-N 3.35Å; H89-A91 PolarHBondContact O-N 3.31Å; H89-E92 IonicContact ND1-OE2 2.88Å; H89-E92 PolarHBondContact O-N 3.49Å; H89-I93 WeakPolarHBondContact O-CD1 3.49Å; H89-I93 VanDerWaalsContact O-CG1 3.24Å; H89-I93 WeakPolarHBondContact O-CG1 3.4Å; H89-I93 PolarHBondContact O-N 3.5Å
90C94.7Very high86.1Confident0 Ų061.9 Ų61.90%031%0.313CS..Hα-helixtrans-55.9-48.2171.2176.70000111.7A78 C81 F82 E86 Y87 D88 L94A78-C90 PolarHBondContact O-SG 3.32Å; C81-C90 HydrophobicContact CB-CB 4.11Å; F82-C90 HydrophobicContact CB-CB 4.42Å; E86-C90 WeakPolarHBondContact O-CB 3.5Å; E86-C90 PolarHBondContact O-N 2.94Å; Y87-C90 WeakPolarHBondContact O-CB 3.39Å; Y87-C90 PolarHBondContact O-N 3.39Å; D88-C90 VanDerWaalsContact C-N 3.35Å; D88-C90 PolarHBondContact O-N 2.83Å; C90-L94 VanDerWaalsContact O-CG 3.24Å; C90-L94 WeakPolarHBondContact O-CG 3.25Å; C90-L94 PolarHBondContact O-N 2.95Å; C90-L94 VanDerWaalsContact O-N 3.14Å
91A93Very high84Confident8 Ų862.5 Ų62.57%0.06632%0.315CS..Hα-helixtrans-62.4-42.8178.100000112.5Y87 D88 H89 L94 S95 Y121 S124 R125Y87-A91 PolarHBondContact O-N 3.01Å; D88-A91 WeakPolarHBondContact O-CB 3.32Å; D88-A91 PolarHBondContact O-N 2.88Å; H89-A91 VanDerWaalsContact C-N 3.35Å; H89-A91 PolarHBondContact O-N 3.31Å; A91-L94 PolarHBondContact O-N 3.03Å; A91-S95 WeakPolarHBondContact O-CB 3.35Å; A91-S95 PolarHBondContact O-N 3.14Å; A91-Y121 HydrophobicContact CB-CD2 4.39Å; A91-Y121 HydrophobicContact CB-CE2 4.4Å; A91-Y121 WeakPolarHBondContact O-CD2 3.32Å; A91-Y121 WeakPolarHBondContact O-CE2 3.26Å; A91-S124 WeakPolarHBondContact CA-OG 3.32Å; A91-S124 WeakPolarHBondContact CB-OG 3.09Å; A91-S124 PolarHBondContact N-OG 3.3Å; A91-R125 HydrophobicContact CB-CG 3.53Å
92E92Very high81.9Confident109 Ų10962.7 Ų62.751%0.50932%0.315SS..Hα-helixtrans-62.3-49.6178.8-174.8-180-163.500111.5D88 H89 L94 S95 H96D88-E92 WeakPolarHBondContact O-CB 3.46Å; D88-E92 PolarHBondContact O-N 3.4Å; H89-E92 IonicContact ND1-OE2 2.88Å; H89-E92 PolarHBondContact O-N 3.49Å; E92-L94 PolarHBondContact O-N 3.01Å; E92-S95 WeakPolarHBondContact O-CB 3.37Å; E92-S95 PolarHBondContact O-N 2.97Å; E92-S95 PolarHBondContact O-OG 3.43Å; E92-H96 PolarHBondContact O-CD2 3.48Å; E92-H96 PolarHBondContact O-N 3.33Å
93I90.6Very high79.7Confident20 Ų2067.9 Ų67.910%0.10334%0.339CS..Hα-helixtrans-54.7-43175.8-69.2161.5000110.8T74 L77 A78 H89T74-I93 HydrophobicContact CG2-CG2 3.41Å; T74-I93 VanDerWaalsContact CG2-CG2 3.41Å; L77-I93 HydrophobicContact CD2-CD1 3.96Å; L77-I93 HydrophobicContact CD2-CG1 4.5Å; L77-I93 HydrophobicContact CG-CD1 3.92Å; A78-I93 HydrophobicContact CB-CB 4.36Å; A78-I93 HydrophobicContact CB-CG2 3.98Å; H89-I93 WeakPolarHBondContact O-CD1 3.49Å; H89-I93 VanDerWaalsContact O-CG1 3.24Å; H89-I93 WeakPolarHBondContact O-CG1 3.4Å; H89-I93 PolarHBondContact O-N 3.5Å
94L88.5Confident77.5Confident0 Ų069.7 Ų69.70%035%0.349CS..Hα-helixtrans-72.8-30.9-179.6-64.3170.7000112.3A78 C90 A91 E92 H96 N97 F98 Y117 L120 Y121A78-L94 HydrophobicContact CB-CD1 4.07Å; A78-L94 HydrophobicContact CB-CD2 3.54Å; A78-L94 HydrophobicContact CB-CG 3.62Å; C90-L94 VanDerWaalsContact O-CG 3.24Å; C90-L94 WeakPolarHBondContact O-CG 3.25Å; C90-L94 PolarHBondContact O-N 2.95Å; C90-L94 VanDerWaalsContact O-N 3.14Å; A91-L94 PolarHBondContact O-N 3.03Å; E92-L94 PolarHBondContact O-N 3.01Å; L94-H96 PolarHBondContact O-N 3.18Å; L94-N97 PolarHBondContact O-N 2.88Å; L94-F98 VanDerWaalsContact O-CE2 3.23Å; L94-F98 WeakPolarHBondContact O-CE2 3.3Å; L94-Y117 WeakPolarHBondContact CA-OH 3.34Å; L94-Y117 HydrophobicContact CB-CE1 4Å; L94-Y117 HydrophobicContact CD2-CD1 4.22Å; L94-Y117 HydrophobicContact CD2-CD2 3.86Å; L94-Y117 HydrophobicContact CD2-CE1 3.72Å; L94-Y117 HydrophobicContact CD2-CE2 3.29Å; L94-Y117 HydrophobicContact CD2-CG 4.28Å; L94-Y117 WeakPolarHBondContact CD2-OH 3.32Å; L94-Y117 HydrophobicContact CG-CE1 4.45Å; L94-Y117 WeakPolarHBondContact O-CE1 3.48Å; L94-Y117 PolarHBondContact O-OH 3.38Å; L94-L120 HydrophobicContact CD1-CB 4.03Å; L94-L120 HydrophobicContact CD1-CD2 4.12Å; L94-L120 HydrophobicContact CD1-CG 3.85Å; L94-Y121 HydrophobicContact CB-CD2 3.9Å; L94-Y121 HydrophobicContact CB-CG 4.34Å
95S85.4Confident75.2Confident41 Ų4169.9 Ų69.929%0.28735%0.347SS..Hα-helixtrans-64.6-34.7-177.976.90000114A91 E92 N97 F98A91-S95 WeakPolarHBondContact O-CB 3.35Å; A91-S95 PolarHBondContact O-N 3.14Å; E92-S95 WeakPolarHBondContact O-CB 3.37Å; E92-S95 PolarHBondContact O-N 2.97Å; E92-S95 PolarHBondContact O-OG 3.43Å; S95-N97 PolarHBondContact O-N 2.88Å; S95-F98 VanDerWaalsContact O-CD2 3.29Å; S95-F98 WeakPolarHBondContact O-CD2 3.38Å; S95-F98 PolarHBondContact O-N 3.26Å
96H76.3Confident73.1Confident139 Ų13966.7 Ų66.764%0.64433%0.334SS*.THydrogen-bonded Turntrans-67.9-17.1-176.7-73.3-65.2000114.4E92 L94E92-H96 PolarHBondContact O-CD2 3.48Å; E92-H96 PolarHBondContact O-N 3.33Å; L94-H96 PolarHBondContact O-N 3.18Å
97N68.5Low71Confident46 Ų4668.5 Ų68.525%0.24634%0.341CS..THydrogen-bonded Turntrans-93.2-0.5-176.8-79.8-8.8000114.1T74 L94 S95 E99 F109 Y117T74-N97 VanDerWaalsContact CG2-ND2 3.31Å; T74-N97 WeakPolarHBondContact CG2-ND2 3.13Å; L94-N97 PolarHBondContact O-N 2.88Å; S95-N97 PolarHBondContact O-N 2.88Å; N97-E99 PolarHBondContact O-N 3.11Å; N97-F109 WeakPolarHBondContact O-CE2 3.43Å; N97-Y117 HydrophobicContact CB-CE1 4.06Å; N97-Y117 VanDerWaalsContact CB-OH 3.25Å; N97-Y117 WeakPolarHBondContact CB-OH 3.48Å; N97-Y117 PolarHBondContact ND2-OH 2.77Å
98F66.2Low68.6Low24 Ų2473 Ų7311%0.10537%0.366CS..  trans-82.2106.6170.9-56.9-71.7000108.4L94 S95 K100 I102 F109 Y117 Y118 Y121L94-F98 VanDerWaalsContact O-CE2 3.23Å; L94-F98 WeakPolarHBondContact O-CE2 3.3Å; S95-F98 VanDerWaalsContact O-CD2 3.29Å; S95-F98 WeakPolarHBondContact O-CD2 3.38Å; S95-F98 PolarHBondContact O-N 3.26Å; F98-K100 PolarHBondContact O-N 3.26Å; F98-I102 HydrophobicContact CB-CD1 4.42Å; F98-I102 HydrophobicContact CB-CG1 3.95Å; F98-I102 HydrophobicContact CD1-CD1 3.43Å; F98-I102 VanDerWaalsContact CD1-CD1 3.43Å; F98-I102 HydrophobicContact CD1-CG1 3.5Å; F98-I102 HydrophobicContact CD2-CD1 3.68Å; F98-I102 HydrophobicContact CD2-CG1 4.16Å; F98-I102 HydrophobicContact CE1-CD1 3.42Å; F98-I102 VanDerWaalsContact CE1-CD1 3.42Å; F98-I102 HydrophobicContact CE1-CG1 4.01Å; F98-I102 HydrophobicContact CE2-CD1 3.7Å; F98-I102 HydrophobicContact CG-CD1 3.58Å; F98-I102 HydrophobicContact CG-CG1 3.61Å; F98-I102 HydrophobicContact CZ-CD1 3.58Å; F98-F109 AromaticContact CD1-CD1 3.9Å; F98-F109 HydrophobicContact CD1-CD1 3.9Å; F98-F109 HydrophobicContact CD1-CD2 4.32Å; F98-F109 AromaticContact CD1-CE1 3.35Å; F98-F109 HydrophobicContact CD1-CE1 3.35Å; F98-F109 AromaticContact CD1-CE2 3.81Å; F98-F109 HydrophobicContact CD1-CE2 3.81Å; F98-F109 HydrophobicContact CD1-CG 4.36Å; F98-F109 AromaticContact CD1-CZ 3.27Å; F98-F109 HydrophobicContact CD1-CZ 3.27Å; F98-F109 AromaticContact CE1-CD1 3.99Å; F98-F109 HydrophobicContact CE1-CD1 3.99Å; F98-F109 AromaticContact CE1-CE1 3.29Å; F98-F109 HydrophobicContact CE1-CE1 3.29Å; F98-F109 AromaticContact CE1-CZ 3.61Å; F98-F109 HydrophobicContact CE1-CZ 3.61Å; F98-F109 HydrophobicContact CG-CZ 4.26Å; F98-Y117 HydrophobicContact CE1-CD1 4.28Å; F98-Y117 HydrophobicContact CE1-CE1 4.49Å; F98-Y117 HydrophobicContact CZ-CD1 4.13Å; F98-Y117 HydrophobicContact CZ-CE1 4.16Å; F98-Y118 HydrophobicContact CE1-CD2 4.07Å; F98-Y118 HydrophobicContact CZ-CD2 4.08Å; F98-Y121 AromaticContact CE2-CD1 3.83Å; F98-Y121 HydrophobicContact CE2-CD1 3.83Å; F98-Y121 HydrophobicContact CE2-CD2 4Å; F98-Y121 HydrophobicContact CE2-CE1 4.06Å; F98-Y121 HydrophobicContact CE2-CE2 4.22Å; F98-Y121 AromaticContact CE2-CG 3.79Å; F98-Y121 HydrophobicContact CE2-CG 3.79Å; F98-Y121 AromaticContact CZ-CD1 3.84Å; F98-Y121 HydrophobicContact CZ-CD1 3.84Å; F98-Y121 HydrophobicContact CZ-CE1 4.43Å; F98-Y121 AromaticContact CZ-CG 3.89Å; F98-Y121 HydrophobicContact CZ-CG 3.89Å
99E50.8Low66.6Low182 Ų18270.7 Ų70.785%0.8535%0.352SS*.SBendtrans-57.2-19.7-177.7-69.7179.6175.700113.9N97N97-E99 PolarHBondContact O-N 3.11Å
100K51.1Low64.7Low129 Ų12967.9 Ų67.956%0.56134%0.34SS*.SBendtrans-143.6158173.5-67.7-173.8-179.8-177.60108.5F98 I102 D104F98-K100 PolarHBondContact O-N 3.26Å; K100-I102 PolarHBondContact O-N 3.15Å; K100-D104 HydrophobicContact CB-CB 4.49Å; K100-D104 HydrophobicContact CD-CB 4.3Å
101P49.5Very low62.5Low82 Ų8273.7 Ų73.753%0.53237%0.37SS..  trans-49.2121.7160.222.3-31.3000107.4H103 D104P101-H103 PolarHBondContact O-N 3.47Å; P101-D104 PolarHBondContact O-N 3.32Å
102I52.3Low60.6Low13 Ų1379.2 Ų79.27%0.06739%0.393CS..G310 helixtrans-42.9-27.8-176.4-70.3179000112.1F98 K100 D104 Y118 Y121 Y174F98-I102 HydrophobicContact CB-CD1 4.42Å; F98-I102 HydrophobicContact CB-CG1 3.95Å; F98-I102 HydrophobicContact CD1-CD1 3.43Å; F98-I102 VanDerWaalsContact CD1-CD1 3.43Å; F98-I102 HydrophobicContact CD1-CG1 3.5Å; F98-I102 HydrophobicContact CD2-CD1 3.68Å; F98-I102 HydrophobicContact CD2-CG1 4.16Å; F98-I102 HydrophobicContact CE1-CD1 3.42Å; F98-I102 VanDerWaalsContact CE1-CD1 3.42Å; F98-I102 HydrophobicContact CE1-CG1 4.01Å; F98-I102 HydrophobicContact CE2-CD1 3.7Å; F98-I102 HydrophobicContact CG-CD1 3.58Å; F98-I102 HydrophobicContact CG-CG1 3.61Å; F98-I102 HydrophobicContact CZ-CD1 3.58Å; K100-I102 PolarHBondContact O-N 3.15Å; I102-D104 VanDerWaalsContact C-N 3.34Å; I102-D104 PolarHBondContact O-N 2.97Å; I102-Y118 HydrophobicContact CD1-CD2 3.89Å; I102-Y118 HydrophobicContact CD1-CE2 3.53Å; I102-Y118 HydrophobicContact CG2-CE2 3.89Å; I102-Y121 HydrophobicContact CD1-CE1 4.26Å; I102-Y174 HydrophobicContact CG2-CE2 3.3Å; I102-Y174 WeakPolarHBondContact CG2-OH 3.35Å; I102-Y174 PolarHBondContact O-OH 3.34Å
103H48.2Very low59Low112 Ų11278.7 Ų78.752%0.51939%0.387SS..G310 helixtrans-55-32174-56.6-64.2000116.3P101P101-H103 PolarHBondContact O-N 3.47Å
104D47.7Very low58.1Low100 Ų10078.3 Ų78.354%0.53539%0.388SS..G310 helixtrans-78.6-28.6-169.3-79.1-9.5000114.1K100 P101 I102K100-D104 HydrophobicContact CB-CB 4.49Å; K100-D104 HydrophobicContact CD-CB 4.3Å; P101-D104 PolarHBondContact O-N 3.32Å; I102-D104 VanDerWaalsContact C-N 3.34Å; I102-D104 PolarHBondContact O-N 2.97Å
105N48.4Very low57.6Low89 Ų8979 Ų7948%0.47639%0.392SS..  trans-159.281.3177.9-94.9-40.1000111.9K107 N108N105-K107 PolarHBondContact O-N 2.98Å; N105-K107 VanDerWaalsContact O-N 3.07Å; N105-N108 HydrophobicContact CB-CB 4.47Å; N105-N108 PolarHBondContact O-N 3.21Å
106P51.4Low57.5Low27 Ų2777.1 Ų77.118%0.17538%0.378CS..Hα-helixtrans-54.9-33178.5-2.1-4.5000113.8Y174P106-Y174 VanDerWaalsContact CA-CE1 3.49Å; P106-Y174 VanDerWaalsContact CA-OH 3.24Å; P106-Y174 WeakPolarHBondContact CA-OH 3.42Å; P106-Y174 HydrophobicContact CB-CD1 3.74Å; P106-Y174 HydrophobicContact CB-CD2 4.45Å; P106-Y174 HydrophobicContact CB-CE1 3.25Å; P106-Y174 HydrophobicContact CB-CE2 3.98Å; P106-Y174 HydrophobicContact CB-CG 4.33Å; P106-Y174 WeakPolarHBondContact O-CE1 3.34Å
107K50.2Low57.8Low134 Ų13470.9 Ų70.958%0.58335%0.349SS*.Hα-helixtrans-72.5-29.3-172.5-66-179.2179.3176.80114.4N105N105-K107 PolarHBondContact O-N 2.98Å; N105-K107 VanDerWaalsContact O-N 3.07Å
108N46.9Very low58.6Low115 Ų11568.8 Ų68.862%0.61534%0.337SS*.Hα-helixtrans-93.4-20.8-172.3-73.14.5000113.5N105N105-N108 HydrophobicContact CB-CB 4.47Å; N105-N108 PolarHBondContact O-N 3.21Å
109F51.5Low59.8Low37 Ų3767.6 Ų67.616%0.16233%0.332CS..Hα-helixtrans-85.3-34.3-179.1-170.2-92.7000112.8N97 F98 D111N97-F109 WeakPolarHBondContact O-CE2 3.43Å; F98-F109 AromaticContact CD1-CD1 3.9Å; F98-F109 HydrophobicContact CD1-CD1 3.9Å; F98-F109 HydrophobicContact CD1-CD2 4.32Å; F98-F109 AromaticContact CD1-CE1 3.35Å; F98-F109 HydrophobicContact CD1-CE1 3.35Å; F98-F109 AromaticContact CD1-CE2 3.81Å; F98-F109 HydrophobicContact CD1-CE2 3.81Å; F98-F109 HydrophobicContact CD1-CG 4.36Å; F98-F109 AromaticContact CD1-CZ 3.27Å; F98-F109 HydrophobicContact CD1-CZ 3.27Å; F98-F109 AromaticContact CE1-CD1 3.99Å; F98-F109 HydrophobicContact CE1-CD1 3.99Å; F98-F109 AromaticContact CE1-CE1 3.29Å; F98-F109 HydrophobicContact CE1-CE1 3.29Å; F98-F109 AromaticContact CE1-CZ 3.61Å; F98-F109 HydrophobicContact CE1-CZ 3.61Å; F98-F109 HydrophobicContact CG-CZ 4.26Å; F109-D111 PolarHBondContact O-N 3.16Å
110I54.8Low61.8Low19 Ų1959 Ų5910%0.09729%0.292CS..  trans-84.263173.5-46.6179000108.5H115 Y174 L195I110-H115 HydrophobicContact CG2-CB 4.19Å; I110-Y174 HydrophobicContact CD1-CD1 3.46Å; I110-Y174 VanDerWaalsContact CD1-CD1 3.46Å; I110-Y174 HydrophobicContact CD1-CE1 3.41Å; I110-Y174 VanDerWaalsContact CD1-CE1 3.41Å; I110-Y174 HydrophobicContact CG1-CE1 4.05Å; I110-L195 HydrophobicContact CD1-CD1 4.45Å
111D48.5Very low63.7Low121 Ų12154 Ų5465%0.64727%0.27SS*.SBendtrans-56.1167.9149.8-82.9-23.2000109.1F109 Y113 G114F109-D111 PolarHBondContact O-N 3.16Å; D111-Y113 PolarHBondContact O-N 2.95Å; D111-G114 PolarHBondContact O-N 3.06Å
112K53.1Low65.8Low125 Ų12550 Ų5054%0.54324%0.244SC..THydrogen-bonded Turntrans-32.8-28.9-168.2-74-176.6177.8179.30117.2H115 V187K112-H115 PolarHBondContact O-CD2 2.91Å; K112-H115 PolarHBondContact O-NE2 3.42Å; K112-V187 HydrophobicContact CG-CG1 4.41Å
113Y59Low67.8Low97 Ų9750.6 Ų50.638%0.3825%0.246SC..THydrogen-bonded Turntrans-132.15.1-171.5-46.5-64.5000115.5S66 D111 H115 V116S66-Y113 VanDerWaalsContact CB-CG 3.5Å; S66-Y113 WeakPolarHBondContact O-CB 3.29Å; S66-Y113 WeakPolarHBondContact O-CD2 3.47Å; S66-Y113 WeakPolarHBondContact OG-CB 3.39Å; S66-Y113 WeakPolarHBondContact OG-CD1 3.35Å; D111-Y113 PolarHBondContact O-N 2.95Å; Y113-H115 PolarHBondContact O-N 3.4Å; Y113-H115 VanDerWaalsContact O-N 3.12Å; Y113-V116 PolarHBondContact O-N 3.12Å
114G72.6Confident70.1Confident12 Ų1245.3 Ų45.312%0.12422%0.221CC..Hα-helixtrans-62.6-17175.300000113.6D111 Y117 Y118D111-G114 PolarHBondContact O-N 3.06Å; G114-Y117 PolarHBondContact O-N 2.83Å; G114-Y118 VanDerWaalsContact O-CB 3.3Å; G114-Y118 WeakPolarHBondContact O-CB 3.26Å; G114-Y118 PolarHBondContact O-N 2.96Å
115H77.8Confident72.4Confident16 Ų1642.9 Ų42.97%0.07421%0.205CC..Hα-helixtrans-67.2-36.1-179.864.477.5000113.2R30 I110 K112 Y113 F119 G191 L195R30-H115 PolarHBondContact NH2-ND1 2.9Å; I110-H115 HydrophobicContact CG2-CB 4.19Å; K112-H115 PolarHBondContact O-CD2 2.91Å; K112-H115 PolarHBondContact O-NE2 3.42Å; Y113-H115 PolarHBondContact O-N 3.4Å; Y113-H115 VanDerWaalsContact O-N 3.12Å; H115-F119 WeakPolarHBondContact O-CB 3.32Å; H115-F119 PolarHBondContact O-N 3.3Å; H115-G191 VanDerWaalsContact CG-CA 3.5Å; H115-G191 VanDerWaalsContact ND1-CA 3.31Å; H115-G191 WeakPolarHBondContact ND1-CA 3.5Å; H115-L195 HydrophobicContact CB-CD1 4.43Å
116V83.1Confident74.6Confident0 Ų039.7 Ų39.70%019%0.186CC..Hα-helixtrans-67.4-45177.8-177.70000109.5L29 V63 F75 Y113 F119 L120L29-V116 HydrophobicContact CD1-CG1 4.48Å; L29-V116 HydrophobicContact CD2-CB 4.21Å; L29-V116 HydrophobicContact CD2-CG1 3.4Å; L29-V116 HydrophobicContact CD2-CG2 3.74Å; L29-V116 HydrophobicContact CG-CG1 3.66Å; V63-V116 HydrophobicContact CG1-CG2 3.88Å; F75-V116 HydrophobicContact CE2-CG1 3.77Å; F75-V116 HydrophobicContact CZ-CG1 3.78Å; Y113-V116 PolarHBondContact O-N 3.12Å; V116-F119 PolarHBondContact O-N 3.48Å; V116-L120 WeakPolarHBondContact O-CB 3.29Å; V116-L120 PolarHBondContact O-N 3.26Å
117Y83.2Confident76.7Confident9 Ų940.4 Ų40.44%0.03519%0.188CC..Hα-helixtrans-61.2-49.9179.3-162.7-87.9000111.1F75 L94 N97 F98 G114 L120 Y121F75-Y117 HydrophobicContact CB-CD2 4.41Å; F75-Y117 HydrophobicContact CB-CE2 4.37Å; F75-Y117 AromaticContact CD2-CD2 3.96Å; F75-Y117 HydrophobicContact CD2-CD2 3.96Å; L94-Y117 WeakPolarHBondContact CA-OH 3.34Å; L94-Y117 HydrophobicContact CB-CE1 4Å; L94-Y117 HydrophobicContact CD2-CD1 4.22Å; L94-Y117 HydrophobicContact CD2-CD2 3.86Å; L94-Y117 HydrophobicContact CD2-CE1 3.72Å; L94-Y117 HydrophobicContact CD2-CE2 3.29Å; L94-Y117 HydrophobicContact CD2-CG 4.28Å; L94-Y117 WeakPolarHBondContact CD2-OH 3.32Å; L94-Y117 HydrophobicContact CG-CE1 4.45Å; L94-Y117 WeakPolarHBondContact O-CE1 3.48Å; L94-Y117 PolarHBondContact O-OH 3.38Å; N97-Y117 HydrophobicContact CB-CE1 4.06Å; N97-Y117 VanDerWaalsContact CB-OH 3.25Å; N97-Y117 WeakPolarHBondContact CB-OH 3.48Å; N97-Y117 PolarHBondContact ND2-OH 2.77Å; F98-Y117 HydrophobicContact CE1-CD1 4.28Å; F98-Y117 HydrophobicContact CE1-CE1 4.49Å; F98-Y117 HydrophobicContact CZ-CD1 4.13Å; F98-Y117 HydrophobicContact CZ-CE1 4.16Å; G114-Y117 PolarHBondContact O-N 2.83Å; Y117-L120 PolarHBondContact O-N 3.16Å; Y117-Y121 WeakPolarHBondContact O-CB 3.39Å; Y117-Y121 PolarHBondContact O-N 2.98Å
118Y85.2Confident78.8Confident1 Ų134.1 Ų34.10%0.00416%0.16CC..Hα-helixtrans-66.7-40.4178.5-174.1-120.1000112.4F98 I102 G114 L120 Y121 I122 E170 I171 Y174 L195F98-Y118 HydrophobicContact CE1-CD2 4.07Å; F98-Y118 HydrophobicContact CZ-CD2 4.08Å; I102-Y118 HydrophobicContact CD1-CD2 3.89Å; I102-Y118 HydrophobicContact CD1-CE2 3.53Å; I102-Y118 HydrophobicContact CG2-CE2 3.89Å; G114-Y118 VanDerWaalsContact O-CB 3.3Å; G114-Y118 WeakPolarHBondContact O-CB 3.26Å; G114-Y118 PolarHBondContact O-N 2.96Å; Y118-L120 PolarHBondContact O-N 3.12Å; Y118-Y121 HydrophobicContact CD2-CD1 4.19Å; Y118-Y121 HydrophobicContact CE2-CD1 4.21Å; Y118-Y121 WeakPolarHBondContact O-CB 3.26Å; Y118-Y121 PolarHBondContact O-N 3.44Å; Y118-I122 HydrophobicContact CD1-CG1 4.48Å; Y118-I122 HydrophobicContact CD2-CG1 4.19Å; Y118-I122 HydrophobicContact CE1-CG1 4.08Å; Y118-I122 HydrophobicContact CE2-CD1 3.79Å; Y118-I122 HydrophobicContact CE2-CG1 3.75Å; Y118-I122 WeakPolarHBondContact O-CG1 3.46Å; Y118-I122 PolarHBondContact O-N 3.03Å; Y118-E170 PolarHBondContact OH-O 3.41Å; Y118-I171 HydrophobicContact CE1-CG1 4.3Å; Y118-I171 WeakPolarHBondContact OH-CA 3.47Å; Y118-Y174 HydrophobicContact CE1-CD2 4.14Å; Y118-Y174 HydrophobicContact CE1-CE2 4.39Å; Y118-Y174 HydrophobicContact CE1-CG 4.25Å; Y118-L195 HydrophobicContact CD1-CD1 4.07Å; Y118-L195 HydrophobicContact CD1-CD2 3.62Å; Y118-L195 HydrophobicContact CE1-CD2 4.24Å
119F90.7Very high81Confident0 Ų028.7 Ų28.70%013%0.131CC..Hα-helixtrans-55.4-52.4172172.7-80.9000110.8R30 L32 H115 V116 Y121 I122 Y123 F194 L195 Y197 V198R30-F119 HydrophobicContact CB-CD1 3.78Å; R30-F119 HydrophobicContact CB-CE1 3.4Å; R30-F119 HydrophobicContact CB-CZ 3.97Å; R30-F119 HydrophobicContact CG-CD1 3.48Å; R30-F119 VanDerWaalsContact CG-CD1 3.48Å; R30-F119 HydrophobicContact CG-CE1 3.65Å; R30-F119 HydrophobicContact CG-CG 4.08Å; R30-F119 HydrophobicContact CG-CZ 4.24Å; L32-F119 HydrophobicContact CD1-CZ 4.34Å; L32-F119 HydrophobicContact CD2-CZ 4.26Å; L32-F119 HydrophobicContact CG-CZ 4.46Å; H115-F119 WeakPolarHBondContact O-CB 3.32Å; H115-F119 PolarHBondContact O-N 3.3Å; V116-F119 PolarHBondContact O-N 3.48Å; F119-Y121 PolarHBondContact O-N 3.14Å; F119-I122 PolarHBondContact O-N 3.42Å; F119-Y123 AromaticContact CE1-CD1 3.79Å; F119-Y123 HydrophobicContact CE1-CD1 3.79Å; F119-Y123 AromaticContact CE1-CG 3.88Å; F119-Y123 HydrophobicContact CE1-CG 3.88Å; F119-Y123 HydrophobicContact CZ-CD1 4.21Å; F119-Y123 HydrophobicContact CZ-CG 4.08Å; F119-Y123 WeakPolarHBondContact O-CB 3.45Å; F119-Y123 PolarHBondContact O-N 2.92Å; F119-F194 HydrophobicContact CD2-CB 3.58Å; F119-F194 WeakPolarHBondContact CD2-O 3.37Å; F119-F194 HydrophobicContact CE2-CB 3.71Å; F119-F194 HydrophobicContact CE2-CD1 4.04Å; F119-F194 HydrophobicContact CE2-CG 4.33Å; F119-F194 VanDerWaalsContact CE2-O 3.31Å; F119-F194 WeakPolarHBondContact CE2-O 3.25Å; F119-F194 HydrophobicContact CG-CB 4.49Å; F119-L195 HydrophobicContact CB-CD2 3.92Å; F119-Y197 HydrophobicContact CE2-CD1 4.3Å; F119-V198 HydrophobicContact CD2-CG2 3.6Å; F119-V198 HydrophobicContact CE1-CG2 4.43Å; F119-V198 HydrophobicContact CE2-CB 4.35Å; F119-V198 HydrophobicContact CE2-CG2 3.09Å; F119-V198 HydrophobicContact CZ-CG2 3.55Å
120L91.8Very high82.8Confident0 Ų028.6 Ų28.60%013%0.131CC..Hα-helixtrans-64.3-35-174.9-173.962.5000110.9F75 R79 F82 L94 V116 Y117 Y118 S124F75-L120 HydrophobicContact CD2-CD2 4.24Å; F75-L120 HydrophobicContact CE2-CD2 3.66Å; F75-L120 HydrophobicContact CZ-CD2 4.14Å; R79-L120 HydrophobicContact CB-CD2 4.43Å; F82-L120 HydrophobicContact CB-CD1 4.37Å; F82-L120 HydrophobicContact CD2-CD1 3.66Å; F82-L120 HydrophobicContact CE2-CD1 4.12Å; F82-L120 HydrophobicContact CG-CD1 3.97Å; L94-L120 HydrophobicContact CD1-CB 4.03Å; L94-L120 HydrophobicContact CD1-CD2 4.12Å; L94-L120 HydrophobicContact CD1-CG 3.85Å; V116-L120 WeakPolarHBondContact O-CB 3.29Å; V116-L120 PolarHBondContact O-N 3.26Å; Y117-L120 PolarHBondContact O-N 3.16Å; Y118-L120 PolarHBondContact O-N 3.12Å; L120-S124 WeakPolarHBondContact O-CB 3.49Å; L120-S124 PolarHBondContact O-N 3.44Å; L120-S124 PolarHBondContact O-OG 2.92Å
121Y92Very high84.5Confident24 Ų2431.6 Ų31.69%0.09414%0.144CC..Hα-helixtrans-63.7-51.1174.2169.7-107.7000112.8A91 L94 F98 I102 Y117 Y118 F119 S124 R125 E170A91-Y121 HydrophobicContact CB-CD2 4.39Å; A91-Y121 HydrophobicContact CB-CE2 4.4Å; A91-Y121 WeakPolarHBondContact O-CD2 3.32Å; A91-Y121 WeakPolarHBondContact O-CE2 3.26Å; L94-Y121 HydrophobicContact CB-CD2 3.9Å; L94-Y121 HydrophobicContact CB-CG 4.34Å; F98-Y121 AromaticContact CE2-CD1 3.83Å; F98-Y121 HydrophobicContact CE2-CD1 3.83Å; F98-Y121 HydrophobicContact CE2-CD2 4Å; F98-Y121 HydrophobicContact CE2-CE1 4.06Å; F98-Y121 HydrophobicContact CE2-CE2 4.22Å; F98-Y121 AromaticContact CE2-CG 3.79Å; F98-Y121 HydrophobicContact CE2-CG 3.79Å; F98-Y121 AromaticContact CZ-CD1 3.84Å; F98-Y121 HydrophobicContact CZ-CD1 3.84Å; F98-Y121 HydrophobicContact CZ-CE1 4.43Å; F98-Y121 AromaticContact CZ-CG 3.89Å; F98-Y121 HydrophobicContact CZ-CG 3.89Å; I102-Y121 HydrophobicContact CD1-CE1 4.26Å; Y117-Y121 WeakPolarHBondContact O-CB 3.39Å; Y117-Y121 PolarHBondContact O-N 2.98Å; Y118-Y121 HydrophobicContact CD2-CD1 4.19Å; Y118-Y121 HydrophobicContact CE2-CD1 4.21Å; Y118-Y121 WeakPolarHBondContact O-CB 3.26Å; Y118-Y121 PolarHBondContact O-N 3.44Å; F119-Y121 PolarHBondContact O-N 3.14Å; Y121-S124 PolarHBondContact O-OG 3.33Å; Y121-R125 HydrophobicContact CE2-CG 4.37Å; Y121-R125 VanDerWaalsContact CZ-CD 3.48Å; Y121-R125 WeakPolarHBondContact O-CG 3.16Å; Y121-R125 PolarHBondContact O-N 3.35Å; Y121-R125 WeakPolarHBondContact OH-CD 3.25Å; Y121-R125 PolarHBondContact OH-NH1 3.2Å; Y121-E170 WeakPolarHBondContact CE1-OE1 3.42Å
122I93Very high86.4Confident0 Ų028.9 Ų28.90%012%0.124CC..Hα-helixtrans-66.9-42.6179.1-62.7-63.8000110.3Y118 F119 R125 Y126 I167 I171 V198 I202Y118-I122 HydrophobicContact CD1-CG1 4.48Å; Y118-I122 HydrophobicContact CD2-CG1 4.19Å; Y118-I122 HydrophobicContact CE1-CG1 4.08Å; Y118-I122 HydrophobicContact CE2-CD1 3.79Å; Y118-I122 HydrophobicContact CE2-CG1 3.75Å; Y118-I122 WeakPolarHBondContact O-CG1 3.46Å; Y118-I122 PolarHBondContact O-N 3.03Å; F119-I122 PolarHBondContact O-N 3.42Å; I122-R125 PolarHBondContact O-N 3.37Å; I122-Y126 PolarHBondContact O-N 2.94Å; I122-I167 HydrophobicContact CD1-CG2 4.2Å; I122-I167 HydrophobicContact CG2-CG2 3.63Å; I122-I171 HydrophobicContact CG1-CD1 4.41Å; I122-I171 HydrophobicContact CG2-CD1 4.01Å; I122-V198 HydrophobicContact CB-CG1 4.34Å; I122-V198 HydrophobicContact CG2-CG1 3.55Å; I122-I202 HydrophobicContact CG2-CD1 3.9Å
123Y95.8Very high87.8Confident25 Ų2527.4 Ų27.410%0.09812%0.115CC..Hα-helixtrans-67.3-37.2-179-171.5-125.5000112.2L32 F82 F119 Y126 M127 V198 L201L32-Y123 HydrophobicContact CD2-CE1 3.84Å; L32-Y123 HydrophobicContact CD2-CE2 4.41Å; F82-Y123 HydrophobicContact CE1-CE1 4.4Å; F82-Y123 AromaticContact CE2-CD1 3.68Å; F82-Y123 HydrophobicContact CE2-CD1 3.68Å; F82-Y123 AromaticContact CE2-CE1 3.98Å; F82-Y123 HydrophobicContact CE2-CE1 3.98Å; F82-Y123 AromaticContact CZ-CD1 3.61Å; F82-Y123 HydrophobicContact CZ-CD1 3.61Å; F82-Y123 AromaticContact CZ-CE1 3.42Å; F82-Y123 HydrophobicContact CZ-CE1 3.42Å; F82-Y123 VanDerWaalsContact CZ-CE1 3.42Å; F119-Y123 AromaticContact CE1-CD1 3.79Å; F119-Y123 HydrophobicContact CE1-CD1 3.79Å; F119-Y123 AromaticContact CE1-CG 3.88Å; F119-Y123 HydrophobicContact CE1-CG 3.88Å; F119-Y123 HydrophobicContact CZ-CD1 4.21Å; F119-Y123 HydrophobicContact CZ-CG 4.08Å; F119-Y123 WeakPolarHBondContact O-CB 3.45Å; F119-Y123 PolarHBondContact O-N 2.92Å; Y123-Y126 HydrophobicContact CD2-CD1 4.03Å; Y123-Y126 AromaticContact CE2-CD1 3.99Å; Y123-Y126 HydrophobicContact CE2-CD1 3.99Å; Y123-Y126 HydrophobicContact CE2-CE1 4.36Å; Y123-Y126 PolarHBondContact O-N 2.96Å; Y123-M127 HydrophobicContact CD1-CG 4.31Å; Y123-M127 HydrophobicContact CD2-CG 4.27Å; Y123-M127 HydrophobicContact CE1-CG 4.04Å; Y123-M127 HydrophobicContact CE2-CG 3.97Å; Y123-M127 HydrophobicContact CE2-SD 4.05Å; Y123-M127 HydrophobicContact CG-CG 4.42Å; Y123-M127 WeakPolarHBondContact O-CB 3.47Å; Y123-M127 VanDerWaalsContact O-CG 3.23Å; Y123-M127 WeakPolarHBondContact O-CG 3.17Å; Y123-M127 PolarHBondContact O-N 3.18Å; Y123-V198 HydrophobicContact CD2-CG1 4.43Å; Y123-V198 HydrophobicContact CD2-CG2 3.89Å; Y123-V198 HydrophobicContact CG-CG2 4.28Å; Y123-L201 HydrophobicContact CE2-CD1 4.09Å
124S96Very high88.8Confident0 Ų025.2 Ų25.20%012%0.117CC..Hα-helixtrans-66.1-40.6174.264.70000111.7Y87 A91 L120 Y121 Y126 M127 A128Y87-S124 WeakPolarHBondContact CB-O 3.37Å; A91-S124 WeakPolarHBondContact CA-OG 3.32Å; A91-S124 WeakPolarHBondContact CB-OG 3.09Å; A91-S124 PolarHBondContact N-OG 3.3Å; L120-S124 WeakPolarHBondContact O-CB 3.49Å; L120-S124 PolarHBondContact O-N 3.44Å; L120-S124 PolarHBondContact O-OG 2.92Å; Y121-S124 PolarHBondContact O-OG 3.33Å; S124-Y126 PolarHBondContact O-N 3.47Å; S124-M127 PolarHBondContact O-N 3Å; S124-A128 WeakPolarHBondContact O-CB 3.47Å; S124-A128 PolarHBondContact O-N 3.26Å
125R94.8Very high89.4Confident50 Ų5029 Ų2919%0.18914%0.135CC..Hα-helixtrans-61.3-42.6172.8-69.5179.664.1-165.1-4.2112.4A91 Y121 I122 A128 C129 I167 E170A91-R125 HydrophobicContact CB-CG 3.53Å; Y121-R125 HydrophobicContact CE2-CG 4.37Å; Y121-R125 VanDerWaalsContact CZ-CD 3.48Å; Y121-R125 WeakPolarHBondContact O-CG 3.16Å; Y121-R125 PolarHBondContact O-N 3.35Å; Y121-R125 WeakPolarHBondContact OH-CD 3.25Å; Y121-R125 PolarHBondContact OH-NH1 3.2Å; I122-R125 PolarHBondContact O-N 3.37Å; R125-A128 PolarHBondContact O-N 3.14Å; R125-C129 PolarHBondContact O-N 2.73Å; R125-C129 PolarHBondContact O-SG 3.25Å; R125-I167 HydrophobicContact CB-CD1 3.71Å; R125-I167 HydrophobicContact CB-CG1 4.25Å; R125-E170 IonicContact CZ-OE2 3.67Å; R125-E170 IonicContact NH1-OE1 3.48Å; R125-E170 IonicContact NH1-OE2 3.86Å; R125-E170 PolarHBondContact NH1-OE2 3.42Å
126Y95.7Very high89.5Confident22 Ų2230.5 Ų30.59%0.08614%0.143CC..Hα-helixtrans-61.3-48.7173.5169.8-100.3000111.8I122 Y123 S124 A128 C129 E130 L164 L201 I202 R205I122-Y126 PolarHBondContact O-N 2.94Å; Y123-Y126 HydrophobicContact CD2-CD1 4.03Å; Y123-Y126 AromaticContact CE2-CD1 3.99Å; Y123-Y126 HydrophobicContact CE2-CD1 3.99Å; Y123-Y126 HydrophobicContact CE2-CE1 4.36Å; Y123-Y126 PolarHBondContact O-N 2.96Å; S124-Y126 PolarHBondContact O-N 3.47Å; Y126-A128 VanDerWaalsContact C-N 3.3Å; Y126-A128 PolarHBondContact O-N 3.49Å; Y126-C129 WeakPolarHBondContact O-CB 3.46Å; Y126-C129 PolarHBondContact O-N 3.37Å; Y126-C129 VanDerWaalsContact O-N 3.13Å; Y126-E130 HydrophobicContact CE1-CG 3.96Å; Y126-E130 HydrophobicContact CE2-CG 4.05Å; Y126-E130 PolarHBondContact O-N 3.4Å; Y126-L164 HydrophobicContact CD2-CD2 3.92Å; Y126-L164 HydrophobicContact CE2-CD2 4.47Å; Y126-L201 HydrophobicContact CE1-CB 4.36Å; Y126-L201 HydrophobicContact CE1-CD1 4.13Å; Y126-L201 HydrophobicContact CE2-CB 4.34Å; Y126-I202 HydrophobicContact CD2-CG1 3.99Å; Y126-R205 HydrophobicContact CE2-CB 4.3Å; Y126-R205 HydrophobicContact CE2-CG 4.41Å
127M95.4Very high89.1Confident42 Ų4232.1 Ų32.121%0.20716%0.155CC..Hα-helixtrans-64.5-33.1179.4-72.4-64-66.200112.7F82 Y87 Y123 S124 E130 K131F82-M127 HydrophobicContact CE2-CG 4.19Å; F82-M127 HydrophobicContact CZ-CG 4.19Å; Y87-M127 HydrophobicContact CD1-CB 3.77Å; Y87-M127 HydrophobicContact CD2-CB 3.88Å; Y87-M127 HydrophobicContact CE1-CB 3.93Å; Y87-M127 HydrophobicContact CE1-CE 4.35Å; Y87-M127 HydrophobicContact CE1-CG 4.45Å; Y87-M127 HydrophobicContact CE2-CB 4.03Å; Y87-M127 HydrophobicContact CE2-CE 4.21Å; Y87-M127 HydrophobicContact CG-CB 3.76Å; Y87-M127 WeakPolarHBondContact OH-CE 3.5Å; Y123-M127 HydrophobicContact CD1-CG 4.31Å; Y123-M127 HydrophobicContact CD2-CG 4.27Å; Y123-M127 HydrophobicContact CE1-CG 4.04Å; Y123-M127 HydrophobicContact CE2-CG 3.97Å; Y123-M127 HydrophobicContact CE2-SD 4.05Å; Y123-M127 HydrophobicContact CG-CG 4.42Å; Y123-M127 WeakPolarHBondContact O-CB 3.47Å; Y123-M127 VanDerWaalsContact O-CG 3.23Å; Y123-M127 WeakPolarHBondContact O-CG 3.17Å; Y123-M127 PolarHBondContact O-N 3.18Å; S124-M127 PolarHBondContact O-N 3Å; M127-E130 PolarHBondContact O-N 3.42Å; M127-K131 WeakPolarHBondContact O-CB 3.1Å; M127-K131 PolarHBondContact O-N 3.34Å
128A94.3Very high88.6Confident1 Ų134.7 Ų34.71%0.00817%0.171CC..Hα-helixtrans-63.4-42.1172.800000111.8D88 S124 R125 Y126 K131 R132D88-A128 WeakPolarHBondContact OD1-CB 3.45Å; S124-A128 WeakPolarHBondContact O-CB 3.47Å; S124-A128 PolarHBondContact O-N 3.26Å; R125-A128 PolarHBondContact O-N 3.14Å; Y126-A128 VanDerWaalsContact C-N 3.3Å; Y126-A128 PolarHBondContact O-N 3.49Å; A128-K131 PolarHBondContact O-N 2.9Å; A128-R132 PolarHBondContact O-N 3.32Å
129C91.9Very high87.9Confident1 Ų140.3 Ų40.31%0.00720%0.197CC..Hα-helixtrans-61.9-45.4174.1-65.80000111.6R125 Y126 R133 L164R125-C129 PolarHBondContact O-N 2.73Å; R125-C129 PolarHBondContact O-SG 3.25Å; Y126-C129 WeakPolarHBondContact O-CB 3.46Å; Y126-C129 PolarHBondContact O-N 3.37Å; Y126-C129 VanDerWaalsContact O-N 3.13Å; C129-R133 WeakPolarHBondContact O-CB 3.19Å; C129-R133 PolarHBondContact O-N 3Å; C129-L164 HydrophobicContact CB-CD2 4.19Å; C129-L164 HydrophobicContact CB-CG 4.48Å
130E89.9Confident86.7Confident35 Ų3541.3 Ų41.316%0.16420%0.204CC..Hα-helixtrans-65-38.9177.6-73.8-60.5116.400112.5Y126 M127 R133 A134 R205Y126-E130 HydrophobicContact CE1-CG 3.96Å; Y126-E130 HydrophobicContact CE2-CG 4.05Å; Y126-E130 PolarHBondContact O-N 3.4Å; M127-E130 PolarHBondContact O-N 3.42Å; E130-R133 PolarHBondContact O-N 3.05Å; E130-A134 WeakPolarHBondContact O-CB 3.3Å; E130-A134 PolarHBondContact O-N 2.66Å; E130-R205 VanDerWaalsContact CD-NE 3.26Å; E130-R205 WeakPolarHBondContact OE1-CD 3.34Å; E130-R205 VanDerWaalsContact OE1-CG 3.27Å; E130-R205 WeakPolarHBondContact OE1-CG 3.24Å; E130-R205 IonicContact OE1-CZ 2.71Å; E130-R205 IonicContact OE1-NE 3.54Å; E130-R205 PolarHBondContact OE1-NE 2.75Å; E130-R205 IonicContact OE1-NH2 2.76Å; E130-R205 IonicContact OE2-CZ 3.46Å; E130-R205 VanDerWaalsContact OE2-CZ 3.3Å; E130-R205 IonicContact OE2-NE 3.82Å; E130-R205 PolarHBondContact OE2-NE 2.95Å; E130-R205 IonicContact OE2-NH2 3.92Å; E130-R205 PolarHBondContact OE2-NH2 3.37Å
131K90.6Very high85.4Confident82 Ų8246.3 Ų46.336%0.35722%0.224SC..Hα-helixtrans-62.3-51.5175.9-174.8-178.5-178.5-1770111.4Q85 Y87 M127 A128 R133 A134 D135Q85-K131 PolarHBondContact O-NZ 3.32Å; Y87-K131 HydrophobicContact CD2-CB 4.13Å; Y87-K131 HydrophobicContact CD2-CD 3.92Å; Y87-K131 HydrophobicContact CE2-CB 4.28Å; Y87-K131 HydrophobicContact CE2-CD 4.1Å; M127-K131 WeakPolarHBondContact O-CB 3.1Å; M127-K131 PolarHBondContact O-N 3.34Å; A128-K131 PolarHBondContact O-N 2.9Å; K131-R133 VanDerWaalsContact C-N 3.31Å; K131-R133 PolarHBondContact O-N 3.23Å; K131-A134 WeakPolarHBondContact O-CB 3.33Å; K131-A134 PolarHBondContact O-N 2.88Å; K131-A134 VanDerWaalsContact O-N 3.08Å; K131-D135 VanDerWaalsContact O-CG 3.32Å; K131-D135 PolarHBondContact O-N 3.05Å
132R88.3Confident83.9Confident64 Ų6451.6 Ų51.624%0.24225%0.253CS..Hα-helixtrans-56.8-45176.5-75.4-171.6-72.5-85.55111.8D88 A128 A134 D135 D136 E163D88-R132 IonicContact OD1-CZ 2.75Å; D88-R132 IonicContact OD1-NH1 3.76Å; D88-R132 PolarHBondContact OD1-NH1 3.47Å; D88-R132 IonicContact OD1-NH2 3.18Å; D88-R132 IonicContact OD2-NH1 2.81Å; D88-R132 PolarHBondContact OD2-NH1 3.12Å; A128-R132 PolarHBondContact O-N 3.32Å; R132-A134 VanDerWaalsContact C-N 3.3Å; R132-A134 PolarHBondContact O-N 3.31Å; R132-D135 PolarHBondContact O-N 3.41Å; R132-D135 VanDerWaalsContact O-N 3.16Å; R132-D136 WeakPolarHBondContact O-CB 3.34Å; R132-D136 PolarHBondContact O-N 3Å; R132-E163 IonicContact CZ-OE2 2.69Å; R132-E163 IonicContact NE-OE2 2.77Å; R132-E163 IonicContact NH2-OE2 3.5Å; R132-E163 PolarHBondContact NH2-OE2 3.03Å
133R82.5Confident82.1Confident94 Ų9456.3 Ų56.336%0.35528%0.281SS..Hα-helixtrans-60.3-40.4176.8179.9179.5170.3149.41.4112.3C129 E130 K131 S137C129-R133 WeakPolarHBondContact O-CB 3.19Å; C129-R133 PolarHBondContact O-N 3Å; E130-R133 PolarHBondContact O-N 3.05Å; K131-R133 VanDerWaalsContact C-N 3.31Å; K131-R133 PolarHBondContact O-N 3.23Å; R133-S137 WeakPolarHBondContact O-CB 3.27Å; R133-S137 PolarHBondContact O-N 2.9Å
134A81.4Confident79.7Confident51 Ų5157 Ų5742%0.42129%0.286SS..Hα-helixtrans-63.2-45.7175.500000110.9E130 K131 R132 S137 V138E130-A134 WeakPolarHBondContact O-CB 3.3Å; E130-A134 PolarHBondContact O-N 2.66Å; K131-A134 WeakPolarHBondContact O-CB 3.33Å; K131-A134 PolarHBondContact O-N 2.88Å; K131-A134 VanDerWaalsContact O-N 3.08Å; R132-A134 VanDerWaalsContact C-N 3.3Å; R132-A134 PolarHBondContact O-N 3.31Å; A134-S137 WeakPolarHBondContact O-CB 3.44Å; A134-S137 PolarHBondContact O-N 3.41Å; A134-S137 PolarHBondContact O-OG 3.49Å; A134-V138 WeakPolarHBondContact O-CG2 3.39Å; A134-V138 PolarHBondContact O-N 3.14Å
135D83.2Confident77.3Confident91 Ų9166 Ų6649%0.48733%0.326SS..Hα-helixtrans-62.9-48.1178.5-64.2-23.1000111.7K131 R132 S137 V138 E139K131-D135 VanDerWaalsContact O-CG 3.32Å; K131-D135 PolarHBondContact O-N 3.05Å; R132-D135 PolarHBondContact O-N 3.41Å; R132-D135 VanDerWaalsContact O-N 3.16Å; D135-S137 VanDerWaalsContact C-N 3.26Å; D135-S137 PolarHBondContact O-N 3.41Å; D135-V138 WeakPolarHBondContact O-CA 3.46Å; D135-V138 WeakPolarHBondContact O-CB 3.34Å; D135-V138 PolarHBondContact O-N 3.2Å; D135-E139 PolarHBondContact O-N 3.24Å
136D80.8Confident75.3Confident48 Ų4871.5 Ų71.526%0.25735%0.353SS..Hα-helixtrans-61.3-35.4177.5-66.9-30.8000111.8R132 V138 E139 S140 S156R132-D136 WeakPolarHBondContact O-CB 3.34Å; R132-D136 PolarHBondContact O-N 3Å; D136-V138 VanDerWaalsContact C-N 3.27Å; D136-V138 PolarHBondContact O-N 3.47Å; D136-E139 PolarHBondContact O-N 2.95Å; D136-S140 VanDerWaalsContact O-CB 3.31Å; D136-S140 WeakPolarHBondContact O-CB 3.39Å; D136-S140 PolarHBondContact O-N 3.39Å; D136-S140 PolarHBondContact O-OG 3.34Å; D136-S156 VanDerWaalsContact CG-OG 3.23Å; D136-S156 WeakPolarHBondContact OD2-CB 3.49Å; D136-S156 PolarHBondContact OD2-OG 3.42Å
137S73.6Confident73.1Confident34 Ų3477.5 Ų77.524%0.23839%0.387CS..Hα-helixtrans-63.9-35.6174.288.50000111.5R133 A134 D135 R141R133-S137 WeakPolarHBondContact O-CB 3.27Å; R133-S137 PolarHBondContact O-N 2.9Å; A134-S137 WeakPolarHBondContact O-CB 3.44Å; A134-S137 PolarHBondContact O-N 3.41Å; A134-S137 PolarHBondContact O-OG 3.49Å; D135-S137 VanDerWaalsContact C-N 3.26Å; D135-S137 PolarHBondContact O-N 3.41Å; S137-R141 VanDerWaalsContact C-CZ 3.49Å; S137-R141 WeakPolarHBondContact O-CG 3.43Å; S137-R141 PolarHBondContact O-NE 3.27Å; S137-R141 PolarHBondContact O-NH1 3.15Å; S137-R141 PolarHBondContact O-NH2 2.93Å; S137-R141 PolarHBondContact OG-NH1 2.9Å; S137-R141 PolarHBondContact OG-NH2 3.44Å
138V72.7Confident71Confident64 Ų6481.9 Ų81.939%0.38841%0.407SS..Hα-helixtrans-73.9-45.8178175.40000110.1A134 D135 D136 R141 L142A134-V138 WeakPolarHBondContact O-CG2 3.39Å; A134-V138 PolarHBondContact O-N 3.14Å; D135-V138 WeakPolarHBondContact O-CA 3.46Å; D135-V138 WeakPolarHBondContact O-CB 3.34Å; D135-V138 PolarHBondContact O-N 3.2Å; D136-V138 VanDerWaalsContact C-N 3.27Å; D136-V138 PolarHBondContact O-N 3.47Å; V138-R141 VanDerWaalsContact CG2-NH2 3.32Å; V138-R141 WeakPolarHBondContact O-CB 3.28Å; V138-R141 PolarHBondContact O-N 3.36Å; V138-L142 HydrophobicContact CG1-CD1 4.15Å; V138-L142 PolarHBondContact O-N 2.65Å
139E71.5Confident68.9Low118 Ų11885.8 Ų85.855%0.55143%0.425SS*.Hα-helixtrans-63.3-44.6-179.8-173.6171.5-170.400112.3D135 D136 R141 L142 V143D135-E139 PolarHBondContact O-N 3.24Å; D136-E139 PolarHBondContact O-N 2.95Å; E139-R141 PolarHBondContact O-N 3.03Å; E139-L142 PolarHBondContact O-N 2.68Å; E139-V143 HydrophobicContact CG-CG2 3.96Å; E139-V143 PolarHBondContact O-N 3.34Å; E139-V143 VanDerWaalsContact O-N 3.13Å
140S66.1Low67Low21 Ų2189.8 Ų89.815%0.14745%0.45CS..Hα-helixtrans-54.8-30.2175.8-61.10000112.3D136D136-S140 VanDerWaalsContact O-CB 3.31Å; D136-S140 WeakPolarHBondContact O-CB 3.39Å; D136-S140 PolarHBondContact O-N 3.39Å; D136-S140 PolarHBondContact O-OG 3.34Å
141R63.3Low65.4Low106 Ų10695.8 Ų95.840%0.448%0.475SS..Hα-helixtrans-83.7-18.6177.5-68.8-175.2-67.4-95.53.4114.4S137 V138 E139S137-R141 VanDerWaalsContact C-CZ 3.49Å; S137-R141 WeakPolarHBondContact O-CG 3.43Å; S137-R141 PolarHBondContact O-NE 3.27Å; S137-R141 PolarHBondContact O-NH1 3.15Å; S137-R141 PolarHBondContact O-NH2 2.93Å; S137-R141 PolarHBondContact OG-NH1 2.9Å; S137-R141 PolarHBondContact OG-NH2 3.44Å; V138-R141 VanDerWaalsContact CG2-NH2 3.32Å; V138-R141 WeakPolarHBondContact O-CB 3.28Å; V138-R141 PolarHBondContact O-N 3.36Å; E139-R141 PolarHBondContact O-N 3.03Å
142L60.6Low63.7Low135 Ų13595.2 Ų95.271%0.70748%0.481SS*.Hα-helixtrans-92.3-34.6-178.1-70.9174.6000112.5V138 E139V138-L142 HydrophobicContact CG1-CD1 4.15Å; V138-L142 PolarHBondContact O-N 2.65Å; E139-L142 PolarHBondContact O-N 2.68Å
143V56Low62.5Low98 Ų9893.6 Ų93.659%0.59448%0.48SS*.Hα-helixtrans-95.9-27.4-165.1-178.30000113.4E139E139-V143 HydrophobicContact CG-CG2 3.96Å; E139-V143 PolarHBondContact O-N 3.34Å; E139-V143 VanDerWaalsContact O-N 3.13Å
144L44.2Very low61.8Low40 Ų4092.5 Ų92.521%0.20949%0.486CS..  trans-118135.2-161.1-61.7174.5000114.7E148 E149L144-E148 HydrophobicContact CB-CB 4.44Å; L144-E148 HydrophobicContact CD1-CB 3.98Å; L144-E148 WeakPolarHBondContact CD1-O 3.39Å; L144-E148 HydrophobicContact CD2-CB 3.7Å; L144-E148 HydrophobicContact CG-CB 4.23Å; L144-E149 HydrophobicContact CB-CG 3.92Å
145K46.9Very low61.4Low190 Ų19096 Ų9683%0.82650%0.496SS*.  trans-72.7144.9157.2-68177179176.50107.4D147 E148K145-D147 PolarHBondContact O-N 3.18Å; K145-E148 PolarHBondContact O-N 3.11Å
146Q52.8Low60.9Low165 Ų16592.8 Ų92.877%0.77148%0.481SS*.THydrogen-bonded Turntrans-35.6-24.2-165.7-69.3171.9-18.900118.7
147D49.8Very low60.7Low147 Ų14794.4 Ų94.479%0.78649%0.488SS*.THydrogen-bonded Turntrans-87.4-28.5-173.3-62.1-37.5000115.1K145K145-D147 PolarHBondContact O-N 3.18Å
148E50.8Low61Low135 Ų13595.6 Ų95.663%0.63150%0.5SS*.THydrogen-bonded Turntrans-92.4-11.9-179.4-72.4-150.7160.300113.8L144 K145 T150 K151L144-E148 HydrophobicContact CB-CB 4.44Å; L144-E148 HydrophobicContact CD1-CB 3.98Å; L144-E148 WeakPolarHBondContact CD1-O 3.39Å; L144-E148 HydrophobicContact CD2-CB 3.7Å; L144-E148 HydrophobicContact CG-CB 4.23Å; K145-E148 PolarHBondContact O-N 3.11Å; E148-T150 PolarHBondContact O-N 3.46Å; E148-K151 PolarHBondContact O-N 2.96Å
149E50Low61.6Low82 Ų8298.9 Ų98.938%0.38351%0.509SS..Hα-helixtrans-51.3-34.7-179.6-69.8-178.6-175.100112.5L144 S153L144-E149 HydrophobicContact CB-CG 3.92Å; E149-S153 WeakPolarHBondContact O-CB 3.45Å; E149-S153 PolarHBondContact O-OG 3.08Å
150T52.3Low62.2Low86 Ų8693.7 Ų93.753%0.52849%0.486SS..Hα-helixtrans-74-37.2-172.9590000113.4E148 S153 C154E148-T150 PolarHBondContact O-N 3.46Å; T150-S153 PolarHBondContact O-OG 3.28Å; T150-C154 WeakPolarHBondContact O-CB 3.21Å; T150-C154 PolarHBondContact O-N 3Å; T150-C154 PolarHBondContact O-SG 3.33Å
151K55.5Low63.3Low161 Ų16195.8 Ų95.870%0.750%0.495SS*.Hα-helixtrans-76.7-47.9-173.1-71.4-179-176.4171.30112.7E148 C154 I155E148-K151 PolarHBondContact O-N 2.96Å; K151-C154 PolarHBondContact O-N 2.95Å; K151-I155 WeakPolarHBondContact O-CG1 3.37Å; K151-I155 PolarHBondContact O-N 2.92Å
152S55.8Low64.6Low69 Ų6998.5 Ų98.548%0.48351%0.51SS..Hα-helixtrans-65.3-46.3-178.8-175.90000111.6C154 I155 S156S152-C154 VanDerWaalsContact C-N 3.34Å; S152-C154 PolarHBondContact O-N 3.12Å; S152-I155 PolarHBondContact O-N 3.5Å; S152-S156 PolarHBondContact O-N 3.35Å; S152-S156 VanDerWaalsContact O-N 3.11Å
153S62.3Low66Low31 Ų3194.7 Ų94.722%0.21749%0.488CS..Hα-helixtrans-62-38.9177.363.30000112.5E149 T150 I155 M157E149-S153 WeakPolarHBondContact O-CB 3.45Å; E149-S153 PolarHBondContact O-OG 3.08Å; T150-S153 PolarHBondContact O-OG 3.28Å; S153-I155 PolarHBondContact O-N 3.22Å; S153-M157 WeakPolarHBondContact O-CB 3.33Å; S153-M157 WeakPolarHBondContact O-CE 3.3Å; S153-M157 VanDerWaalsContact O-CG 3.25Å; S153-M157 WeakPolarHBondContact O-CG 3.5Å; S153-M157 PolarHBondContact O-N 3.42Å
154C67.8Low67.7Low71 Ų7190 Ų9048%0.4846%0.46SS..Hα-helixtrans-64-39.9176.3-75.90000112.9T150 K151 S152 A158T150-C154 WeakPolarHBondContact O-CB 3.21Å; T150-C154 PolarHBondContact O-N 3Å; T150-C154 PolarHBondContact O-SG 3.33Å; K151-C154 PolarHBondContact O-N 2.95Å; S152-C154 VanDerWaalsContact C-N 3.34Å; S152-C154 PolarHBondContact O-N 3.12Å; C154-A158 VanDerWaalsContact O-CB 3.28Å; C154-A158 WeakPolarHBondContact O-CB 3.49Å; C154-A158 PolarHBondContact O-N 2.89Å
155I74.3Confident70Confident125 Ų12592.2 Ų92.264%0.64147%0.472SS*.Hα-helixtrans-66.7-46.2179.3-65.9163.4000110.5K151 S152 S153 A158 K159K151-I155 WeakPolarHBondContact O-CG1 3.37Å; K151-I155 PolarHBondContact O-N 2.92Å; S152-I155 PolarHBondContact O-N 3.5Å; S153-I155 PolarHBondContact O-N 3.22Å; I155-A158 PolarHBondContact O-N 3.14Å; I155-K159 PolarHBondContact O-N 3.15Å
156S71.9Confident72.2Confident23 Ų2386 Ų8616%0.16145%0.452CS..Hα-helixtrans-58.8-49.3175.1148.80000111.3D136 S152 A158 K159 C160D136-S156 VanDerWaalsContact CG-OG 3.23Å; D136-S156 WeakPolarHBondContact OD2-CB 3.49Å; D136-S156 PolarHBondContact OD2-OG 3.42Å; S152-S156 PolarHBondContact O-N 3.35Å; S152-S156 VanDerWaalsContact O-N 3.11Å; S156-A158 VanDerWaalsContact C-N 3.31Å; S156-A158 PolarHBondContact O-N 2.92Å; S156-K159 PolarHBondContact O-N 3.2Å; S156-C160 PolarHBondContact O-N 3.4Å
157M75.9Confident74.1Confident81 Ų8178.1 Ų78.140%0.39942%0.415SS..Hα-helixtrans-60.6-40.5178.6-74.4-172-65.200112S153 C160 N161S153-M157 WeakPolarHBondContact O-CB 3.33Å; S153-M157 WeakPolarHBondContact O-CE 3.3Å; S153-M157 VanDerWaalsContact O-CG 3.25Å; S153-M157 WeakPolarHBondContact O-CG 3.5Å; S153-M157 PolarHBondContact O-N 3.42Å; M157-C160 PolarHBondContact O-N 3.05Å; M157-N161 WeakPolarHBondContact O-CB 3.48Å; M157-N161 PolarHBondContact O-N 3.24Å; M157-N161 PolarHBondContact O-ND2 3.4Å
158A81.6Confident76.2Confident60 Ų6072.9 Ų72.950%0.49639%0.385SS..Hα-helixtrans-64-40.9176.900000112.3C154 I155 S156 N161 K162C154-A158 VanDerWaalsContact O-CB 3.28Å; C154-A158 WeakPolarHBondContact O-CB 3.49Å; C154-A158 PolarHBondContact O-N 2.89Å; I155-A158 PolarHBondContact O-N 3.14Å; S156-A158 VanDerWaalsContact C-N 3.31Å; S156-A158 PolarHBondContact O-N 2.92Å; A158-N161 PolarHBondContact O-N 3.05Å; A158-K162 WeakPolarHBondContact O-CB 3.4Å; A158-K162 PolarHBondContact O-N 2.91Å
159K84.5Confident78.1Confident133 Ų13370.2 Ų70.258%0.57838%0.381SS*.Hα-helixtrans-62.9-48.1175.4-176.4-179.2176.3-1760111.2I155 S156 N161 K162 E163I155-K159 PolarHBondContact O-N 3.15Å; S156-K159 PolarHBondContact O-N 3.2Å; K159-N161 PolarHBondContact O-N 2.69Å; K159-K162 WeakPolarHBondContact O-CB 3.28Å; K159-K162 PolarHBondContact O-N 2.64Å; K159-E163 PolarHBondContact O-N 3.49Å
160C84.9Confident79.9Confident9 Ų967.1 Ų67.16%0.06137%0.366CS..Hα-helixtrans-61.1-44.7177.6-175.40000111.7S156 M157 K162 E163 L164S156-C160 PolarHBondContact O-N 3.4Å; M157-C160 PolarHBondContact O-N 3.05Å; C160-K162 VanDerWaalsContact C-N 3.32Å; C160-K162 PolarHBondContact O-N 3.21Å; C160-E163 PolarHBondContact O-N 2.72Å; C160-L164 WeakPolarHBondContact O-CG 3.49Å; C160-L164 PolarHBondContact O-N 3.32Å
161N87.8Confident81.6Confident64 Ų6463 Ų6334%0.34234%0.341SS..Hα-helixtrans-62.1-37.8176.2-74.8-17.4000112.5M157 A158 K159 L164 L165M157-N161 WeakPolarHBondContact O-CB 3.48Å; M157-N161 PolarHBondContact O-N 3.24Å; M157-N161 PolarHBondContact O-ND2 3.4Å; A158-N161 PolarHBondContact O-N 3.05Å; K159-N161 PolarHBondContact O-N 2.69Å; N161-L164 PolarHBondContact O-N 3.29Å; N161-L165 WeakPolarHBondContact O-CB 3.46Å; N161-L165 VanDerWaalsContact O-CG 3.27Å; N161-L165 WeakPolarHBondContact O-CG 3.29Å; N161-L165 PolarHBondContact O-N 2.96Å
162K90.1Very high83.2Confident163 Ų16358.8 Ų58.871%0.70932%0.324SS*.Hα-helixtrans-63.8-41.8174.9-173.1-178179.2-177.10111.8A158 K159 C160 S166A158-K162 WeakPolarHBondContact O-CB 3.4Å; A158-K162 PolarHBondContact O-N 2.91Å; K159-K162 WeakPolarHBondContact O-CB 3.28Å; K159-K162 PolarHBondContact O-N 2.64Å; C160-K162 VanDerWaalsContact C-N 3.32Å; C160-K162 PolarHBondContact O-N 3.21Å; K162-S166 PolarHBondContact O-N 3.34Å
163E90.2Very high84.5Confident56 Ų5658 Ų5826%0.26232%0.317SS..Hα-helixtrans-65.1-46175-74.3173.9-173.500111.5R132 K159 C160 L165 S166 I167R132-E163 IonicContact CZ-OE2 2.69Å; R132-E163 IonicContact NE-OE2 2.77Å; R132-E163 IonicContact NH2-OE2 3.5Å; R132-E163 PolarHBondContact NH2-OE2 3.03Å; K159-E163 PolarHBondContact O-N 3.49Å; C160-E163 PolarHBondContact O-N 2.72Å; E163-L165 VanDerWaalsContact C-N 3.33Å; E163-L165 PolarHBondContact O-N 2.71Å; E163-S166 WeakPolarHBondContact O-CB 3.23Å; E163-S166 PolarHBondContact O-N 3Å; E163-S166 VanDerWaalsContact O-N 3.11Å; E163-I167 VanDerWaalsContact O-CG1 3.29Å; E163-I167 WeakPolarHBondContact O-CG1 3.26Å; E163-I167 PolarHBondContact O-N 3.46Å
164L92.5Very high85.3Confident0 Ų057.1 Ų57.10%031%0.309CS..Hα-helixtrans-60.5-40.3176.2-71.3173000112.4Y126 C129 C160 N161 S166 I167 K168 I202 R205 L206Y126-L164 HydrophobicContact CD2-CD2 3.92Å; Y126-L164 HydrophobicContact CE2-CD2 4.47Å; C129-L164 HydrophobicContact CB-CD2 4.19Å; C129-L164 HydrophobicContact CB-CG 4.48Å; C160-L164 WeakPolarHBondContact O-CG 3.49Å; C160-L164 PolarHBondContact O-N 3.32Å; N161-L164 PolarHBondContact O-N 3.29Å; L164-S166 VanDerWaalsContact C-N 3.35Å; L164-I167 PolarHBondContact O-N 3.24Å; L164-K168 WeakPolarHBondContact O-CB 3.34Å; L164-K168 PolarHBondContact O-N 3.16Å; L164-I202 HydrophobicContact CD2-CG2 4.47Å; L164-R205 HydrophobicContact CD1-CB 4.22Å; L164-R205 HydrophobicContact CD1-CG 4.25Å; L164-L206 HydrophobicContact CB-CD2 3.81Å; L164-L206 HydrophobicContact CB-CG 4.23Å
165L93.5Very high86.1Confident86 Ų8653.8 Ų53.845%0.4529%0.287SS..Hα-helixtrans-63.7-39.6173.6-76.2169.3000112N161 E163 K168 C169 L206N161-L165 WeakPolarHBondContact O-CB 3.46Å; N161-L165 VanDerWaalsContact O-CG 3.27Å; N161-L165 WeakPolarHBondContact O-CG 3.29Å; N161-L165 PolarHBondContact O-N 2.96Å; E163-L165 VanDerWaalsContact C-N 3.33Å; E163-L165 PolarHBondContact O-N 2.71Å; L165-K168 PolarHBondContact O-N 3.35Å; L165-C169 PolarHBondContact O-N 2.92Å; L165-C169 PolarHBondContact O-SG 3.19Å; L165-L206 HydrophobicContact CD2-CD1 3.97Å; L165-L206 HydrophobicContact CD2-CD2 4.11Å; L165-L206 HydrophobicContact CG-CD1 4.49Å; L165-L206 HydrophobicContact CG-CD2 3.96Å
166S92.7Very high86.4Confident58 Ų5851.4 Ų51.441%0.40628%0.275SS..Hα-helixtrans-62.3-45.5174.1169.30000111.5K162 E163 L164 K168 C169 E170K162-S166 PolarHBondContact O-N 3.34Å; E163-S166 WeakPolarHBondContact O-CB 3.23Å; E163-S166 PolarHBondContact O-N 3Å; E163-S166 VanDerWaalsContact O-N 3.11Å; L164-S166 VanDerWaalsContact C-N 3.35Å; S166-K168 VanDerWaalsContact C-N 3.34Å; S166-K168 PolarHBondContact O-N 3.45Å; S166-C169 PolarHBondContact O-N 2.98Å; S166-E170 PolarHBondContact O-N 3.39Å; S166-E170 VanDerWaalsContact O-N 3.16Å
167I92.2Very high86.6Confident1 Ų153.1 Ų53.11%0.00528%0.282CS..Hα-helixtrans-63.2-42.7177.4-59.8162.9000110.3I122 R125 E163 L164 E170 I171 I202I122-I167 HydrophobicContact CD1-CG2 4.2Å; I122-I167 HydrophobicContact CG2-CG2 3.63Å; R125-I167 HydrophobicContact CB-CD1 3.71Å; R125-I167 HydrophobicContact CB-CG1 4.25Å; E163-I167 VanDerWaalsContact O-CG1 3.29Å; E163-I167 WeakPolarHBondContact O-CG1 3.26Å; E163-I167 PolarHBondContact O-N 3.46Å; L164-I167 PolarHBondContact O-N 3.24Å; I167-E170 WeakPolarHBondContact O-CB 3.46Å; I167-E170 PolarHBondContact O-N 3.31Å; I167-I171 VanDerWaalsContact O-CG2 3.31Å; I167-I171 WeakPolarHBondContact O-CG2 3.08Å; I167-I171 PolarHBondContact O-N 2.88Å; I167-I202 HydrophobicContact CB-CD1 4.4Å; I167-I202 HydrophobicContact CG2-CD1 3.51Å; I167-I202 HydrophobicContact CG2-CG1 4.46Å
168K93.1Very high86.6Confident37 Ų3750.1 Ų50.116%0.16127%0.268CS..Hα-helixtrans-57.6-50.2175.6-176.6-173.3170.1-173.40111.5L164 L165 S166 E170 I171 E172 I202 L206 I208L164-K168 WeakPolarHBondContact O-CB 3.34Å; L164-K168 PolarHBondContact O-N 3.16Å; L165-K168 PolarHBondContact O-N 3.35Å; S166-K168 VanDerWaalsContact C-N 3.34Å; S166-K168 PolarHBondContact O-N 3.45Å; K168-E170 PolarHBondContact O-N 2.91Å; K168-I171 PolarHBondContact O-N 3.3Å; K168-E172 WeakPolarHBondContact O-CB 3.38Å; K168-E172 PolarHBondContact O-N 3.49Å; K168-I202 HydrophobicContact CB-CG2 3.99Å; K168-L206 HydrophobicContact CB-CD1 4.19Å; K168-L206 HydrophobicContact CD-CD1 3.78Å; K168-I208 VanDerWaalsContact NZ-CD1 3.31Å
169C90.8Very high85.7Confident79 Ų7950.1 Ų50.153%0.53426%0.259SS..Hα-helixtrans-61.1-28.1179.8-66.20000112.5L165 S166 P173L165-C169 PolarHBondContact O-N 2.92Å; L165-C169 PolarHBondContact O-SG 3.19Å; S166-C169 PolarHBondContact O-N 2.98Å; C169-P173 VanDerWaalsContact O-CD 3.27Å; C169-P173 WeakPolarHBondContact O-CD 3.47Å
170E87.9Confident84.5Confident17 Ų1750.6 Ų50.68%0.07927%0.268CS..Hα-helixtrans-78.3-41.4179.3-170.8-180152.500113.4Y118 Y121 R125 S166 I167 K168Y118-E170 PolarHBondContact OH-O 3.41Å; Y121-E170 WeakPolarHBondContact CE1-OE1 3.42Å; R125-E170 IonicContact CZ-OE2 3.67Å; R125-E170 IonicContact NH1-OE1 3.48Å; R125-E170 IonicContact NH1-OE2 3.86Å; R125-E170 PolarHBondContact NH1-OE2 3.42Å; S166-E170 PolarHBondContact O-N 3.39Å; S166-E170 VanDerWaalsContact O-N 3.16Å; I167-E170 WeakPolarHBondContact O-CB 3.46Å; I167-E170 PolarHBondContact O-N 3.31Å; K168-E170 PolarHBondContact O-N 2.91Å
171I88.8Confident83.2Confident0 Ų052.3 Ų52.30%028%0.279CS..Hα-helixtrans-82.7-25-179.7-170.3164.2000113.2Y118 I122 I167 K168 Y174 T175 H199 I202Y118-I171 HydrophobicContact CE1-CG1 4.3Å; Y118-I171 WeakPolarHBondContact OH-CA 3.47Å; I122-I171 HydrophobicContact CG1-CD1 4.41Å; I122-I171 HydrophobicContact CG2-CD1 4.01Å; I167-I171 VanDerWaalsContact O-CG2 3.31Å; I167-I171 WeakPolarHBondContact O-CG2 3.08Å; I167-I171 PolarHBondContact O-N 2.88Å; K168-I171 PolarHBondContact O-N 3.3Å; I171-Y174 WeakPolarHBondContact O-CB 3.34Å; I171-Y174 PolarHBondContact O-N 3.2Å; I171-T175 HydrophobicContact CG1-CG2 4.1Å; I171-T175 PolarHBondContact O-N 3.03Å; I171-T175 PolarHBondContact O-OG1 2.97Å; I171-H199 HydrophobicContact CD1-CB 4.1Å; I171-H199 HydrophobicContact CG1-CB 4.43Å; I171-H199 HydrophobicContact CG2-CB 4.31Å; I171-H199 WeakPolarHBondContact CG2-ND1 3.23Å; I171-I202 HydrophobicContact CG2-CD1 4.35Å
172E88.6Confident81.4Confident71 Ų7156.1 Ų56.133%0.33230%0.3SS..Hα-helixtrans-57.2-43.1-175.3179.7169.2-173.800115.2K168 Y174 T175 N176K168-E172 WeakPolarHBondContact O-CB 3.38Å; K168-E172 PolarHBondContact O-N 3.49Å; E172-Y174 PolarHBondContact O-N 3.48Å; E172-T175 WeakPolarHBondContact CA-OG1 3.47Å; E172-T175 PolarHBondContact O-N 3.18Å; E172-T175 PolarHBondContact O-OG1 3.04Å; E172-T175 VanDerWaalsContact O-OG1 3.05Å; E172-N176 WeakPolarHBondContact CG-ND2 3.31Å; E172-N176 WeakPolarHBondContact O-CB 3.41Å; E172-N176 VanDerWaalsContact O-CG 3.23Å; E172-N176 PolarHBondContact O-N 3.44Å; E172-N176 PolarHBondContact O-ND2 2.83Å
173P83.1Confident79.4Confident53 Ų5357.3 Ų57.334%0.34431%0.308SS..Hα-helixtrans-58.6-32.6174.4-25.234.6000113.3C169 N177C169-P173 VanDerWaalsContact O-CD 3.27Å; C169-P173 WeakPolarHBondContact O-CD 3.47Å; P173-N177 WeakPolarHBondContact O-CB 3.18Å; P173-N177 VanDerWaalsContact O-CG 3.23Å; P173-N177 PolarHBondContact O-N 3.13Å; P173-N177 PolarHBondContact O-ND2 3.31Å
174Y79.4Confident77.2Confident13 Ų1362.9 Ų62.95%0.05134%0.336CS..Hα-helixtrans-72.6-49.8177.9-71.3-93.8000111.5I102 P106 I110 Y118 I171 E172 N176 N177 I178I102-Y174 HydrophobicContact CG2-CE2 3.3Å; I102-Y174 WeakPolarHBondContact CG2-OH 3.35Å; I102-Y174 PolarHBondContact O-OH 3.34Å; P106-Y174 VanDerWaalsContact CA-CE1 3.49Å; P106-Y174 VanDerWaalsContact CA-OH 3.24Å; P106-Y174 WeakPolarHBondContact CA-OH 3.42Å; P106-Y174 HydrophobicContact CB-CD1 3.74Å; P106-Y174 HydrophobicContact CB-CD2 4.45Å; P106-Y174 HydrophobicContact CB-CE1 3.25Å; P106-Y174 HydrophobicContact CB-CE2 3.98Å; P106-Y174 HydrophobicContact CB-CG 4.33Å; P106-Y174 WeakPolarHBondContact O-CE1 3.34Å; I110-Y174 HydrophobicContact CD1-CD1 3.46Å; I110-Y174 VanDerWaalsContact CD1-CD1 3.46Å; I110-Y174 HydrophobicContact CD1-CE1 3.41Å; I110-Y174 VanDerWaalsContact CD1-CE1 3.41Å; I110-Y174 HydrophobicContact CG1-CE1 4.05Å; Y118-Y174 HydrophobicContact CE1-CD2 4.14Å; Y118-Y174 HydrophobicContact CE1-CE2 4.39Å; Y118-Y174 HydrophobicContact CE1-CG 4.25Å; I171-Y174 WeakPolarHBondContact O-CB 3.34Å; I171-Y174 PolarHBondContact O-N 3.2Å; E172-Y174 PolarHBondContact O-N 3.48Å; Y174-N176 VanDerWaalsContact C-N 3.29Å; Y174-N176 PolarHBondContact O-N 3.39Å; Y174-N177 WeakPolarHBondContact O-CB 3.21Å; Y174-N177 PolarHBondContact O-N 3.19Å; Y174-N177 VanDerWaalsContact O-N 3.12Å; Y174-I178 WeakPolarHBondContact O-CG1 3.3Å; Y174-I178 PolarHBondContact O-N 2.82Å; Y174-I178 VanDerWaalsContact O-N 3.07Å
175T84Confident75.2Confident1 Ų168.1 Ų68.11%0.00636%0.356CS..Hα-helixtrans-63.9-37.1-179.552.70000111.7I171 E172 N177 I178 N179 L196 H199I171-T175 HydrophobicContact CG1-CG2 4.1Å; I171-T175 PolarHBondContact O-N 3.03Å; I171-T175 PolarHBondContact O-OG1 2.97Å; E172-T175 WeakPolarHBondContact CA-OG1 3.47Å; E172-T175 PolarHBondContact O-N 3.18Å; E172-T175 PolarHBondContact O-OG1 3.04Å; E172-T175 VanDerWaalsContact O-OG1 3.05Å; T175-N177 VanDerWaalsContact C-N 3.32Å; T175-N177 PolarHBondContact O-N 3.22Å; T175-I178 PolarHBondContact O-N 2.87Å; T175-N179 PolarHBondContact O-N 3.25Å; T175-N179 PolarHBondContact O-ND2 2.95Å; T175-L196 HydrophobicContact CG2-CD2 3.77Å; T175-H199 HydrophobicContact CG2-CB 3.92Å; T175-H199 WeakPolarHBondContact CG2-ND1 3.33Å; T175-H199 PolarHBondContact OG1-CE1 3.14Å; T175-H199 PolarHBondContact OG1-ND1 3.4Å; T175-H199 VanDerWaalsContact OG1-ND1 3.1Å
176N81.8Confident73Confident75 Ų7569.4 Ų69.440%0.40137%0.368SS..Hα-helixtrans-66.8-33.6174.7-70.7-14.3000112.6E172 Y174 N179 L180E172-N176 WeakPolarHBondContact CG-ND2 3.31Å; E172-N176 WeakPolarHBondContact O-CB 3.41Å; E172-N176 VanDerWaalsContact O-CG 3.23Å; E172-N176 PolarHBondContact O-N 3.44Å; E172-N176 PolarHBondContact O-ND2 2.83Å; Y174-N176 VanDerWaalsContact C-N 3.29Å; Y174-N176 PolarHBondContact O-N 3.39Å; N176-N179 WeakPolarHBondContact O-CB 3.5Å; N176-N179 PolarHBondContact O-N 2.91Å; N176-L180 PolarHBondContact O-N 3.44Å
177N75.2Confident71.1Confident58 Ų5871.7 Ų71.731%0.3138%0.379SS..Hα-helixtrans-69.7-36.1174.9-80.7-45.6000112.6P173 Y174 T175 N179 L180 S181P173-N177 WeakPolarHBondContact O-CB 3.18Å; P173-N177 VanDerWaalsContact O-CG 3.23Å; P173-N177 PolarHBondContact O-N 3.13Å; P173-N177 PolarHBondContact O-ND2 3.31Å; Y174-N177 WeakPolarHBondContact O-CB 3.21Å; Y174-N177 PolarHBondContact O-N 3.19Å; Y174-N177 VanDerWaalsContact O-N 3.12Å; T175-N177 VanDerWaalsContact C-N 3.32Å; T175-N177 PolarHBondContact O-N 3.22Å; N177-N179 PolarHBondContact O-N 3.36Å; N177-L180 PolarHBondContact O-N 3.3Å; N177-L180 VanDerWaalsContact O-N 3.15Å; N177-S181 PolarHBondContact O-N 3.2Å; N177-S181 PolarHBondContact O-OG 3.29Å
178I75.3Confident70Confident19 Ų1972.5 Ų72.510%0.09738%0.383CS..Hα-helixtrans-57.9-40.3174.3-67.2162.2000109.8Y174 T175 L180 S181 D192 L196 L222Y174-I178 WeakPolarHBondContact O-CG1 3.3Å; Y174-I178 PolarHBondContact O-N 2.82Å; Y174-I178 VanDerWaalsContact O-N 3.07Å; T175-I178 PolarHBondContact O-N 2.87Å; I178-L180 VanDerWaalsContact C-N 3.29Å; I178-L180 PolarHBondContact O-N 2.77Å; I178-S181 PolarHBondContact O-N 3.01Å; I178-D192 HydrophobicContact CD1-CB 3.69Å; I178-D192 HydrophobicContact CG1-CB 4.14Å; I178-D192 HydrophobicContact CG2-CB 4.3Å; I178-L196 HydrophobicContact CG2-CD1 4.39Å; I178-L222 HydrophobicContact CG2-CD1 4.06Å
179N64.1Low69.3Low60 Ų6075.7 Ų75.732%0.32140%0.397SS..Hα-helixtrans-65-27.6178.5-63.2-20.4000114.1T175 N176 N177 Q218T175-N179 PolarHBondContact O-N 3.25Å; T175-N179 PolarHBondContact O-ND2 2.95Å; N176-N179 WeakPolarHBondContact O-CB 3.5Å; N176-N179 PolarHBondContact O-N 2.91Å; N177-N179 PolarHBondContact O-N 3.36Å; N179-Q218 PolarHBondContact OD1-OE1 3.39Å; N179-Q218 VanDerWaalsContact OD1-OE1 3.07Å
180L58.3Low68.7Low143 Ų14374.5 Ų74.575%0.74939%0.385SS*.Hα-helixtrans-87.3-26.3-177.9-71165.2000112.8N176 N177 I178 N182N176-L180 PolarHBondContact O-N 3.44Å; N177-L180 PolarHBondContact O-N 3.3Å; N177-L180 VanDerWaalsContact O-N 3.15Å; I178-L180 VanDerWaalsContact C-N 3.29Å; I178-L180 PolarHBondContact O-N 2.77Å; L180-N182 PolarHBondContact O-N 2.85Å
181S57.1Low68.2Low44 Ų4473.8 Ų73.831%0.30838%0.382SS..  trans-9458.2-173.863.40000113.3N177 I178 E183N177-S181 PolarHBondContact O-N 3.2Å; N177-S181 PolarHBondContact O-OG 3.29Å; I178-S181 PolarHBondContact O-N 3.01Å; S181-E183 VanDerWaalsContact C-N 3.27Å; S181-E183 PolarHBondContact O-N 3.09Å
182N51.2Low68Low144 Ų14474.3 Ų74.377%0.7739%0.385SS*.THydrogen-bonded Turntrans-70.4-12.6-178.8-85.2-14.9000115.1L180L180-N182 PolarHBondContact O-N 2.85Å
183E47.9Very low68Low188 Ų18870.9 Ų70.988%0.87937%0.369SS*.THydrogen-bonded Turntrans-115.1-13.1-166.8-67.8-175.1170.900117.4S181S181-E183 VanDerWaalsContact C-N 3.27Å; S181-E183 PolarHBondContact O-N 3.09Å
184M43.4Very low68.5Low173 Ų17368.5 Ų68.585%0.85235%0.353SS*.THydrogen-bonded Turntrans-135.5-3.6-167.2-137.881.615700117.8
185R50.1Low69Low110 Ų11067.9 Ų67.942%0.41535%0.351SS..  trans-108.776.7-178.3-72.2-175173.4-161-4.9112.1V187R185-V187 VanDerWaalsContact C-N 3.32Å
186T48.5Very low69.5Low114 Ų11467.9 Ų67.970%0.69935%0.351SS*.  trans-72-24.8172.9500000113.2
187V53.3Low70.1Confident105 Ų10565 Ų6564%0.63633%0.334SS*.SBendtrans-77.1-30.9-165.7-1740000114.2K112 R185K112-V187 HydrophobicContact CG-CG1 4.41Å; R185-V187 VanDerWaalsContact C-N 3.32Å
188N68.6Low71.1Confident18 Ų1862.2 Ų62.210%0.09632%0.319CS..SBendtrans-113.110.3-168-69.94.2000115.5I190 G191 D192N188-I190 VanDerWaalsContact C-N 3.26Å; N188-I190 PolarHBondContact O-N 3.43Å; N188-I190 VanDerWaalsContact O-N 3.1Å; N188-G191 WeakPolarHBondContact O-CA 3.35Å; N188-G191 PolarHBondContact O-N 3.49Å; N188-D192 PolarHBondContact O-N 2.93Å
189K77.2Confident72Confident105 Ų10561.7 Ų61.746%0.45732%0.316SS..Hα-helixtrans-50.8-41.7-173.7-67.5-172.4176.3-173.20114.1D192 S193 L222K189-D192 PolarHBondContact O-N 3.24Å; K189-S193 PolarHBondContact O-N 2.82Å; K189-L222 HydrophobicContact CG-CD2 4.45Å
190I78.9Confident73.5Confident53 Ų5358.9 Ų58.927%0.27230%0.301SS..Hα-helixtrans-64.9-49.1178.7-61.8168.9000110.1Q22 E26 N188 D192 S193 F194Q22-I190 VanDerWaalsContact NE2-CD1 3.34Å; E26-I190 HydrophobicContact CG-CG2 4.18Å; N188-I190 VanDerWaalsContact C-N 3.26Å; N188-I190 PolarHBondContact O-N 3.43Å; N188-I190 VanDerWaalsContact O-N 3.1Å; I190-D192 VanDerWaalsContact C-N 3.32Å; I190-D192 PolarHBondContact O-N 3.11Å; I190-S193 PolarHBondContact O-N 2.73Å; I190-S193 PolarHBondContact O-OG 3.37Å; I190-F194 HydrophobicContact CG2-CD2 4.24Å; I190-F194 HydrophobicContact CG2-CE2 3.88Å; I190-F194 VanDerWaalsContact O-CD2 3.25Å; I190-F194 WeakPolarHBondContact O-CD2 3.34Å; I190-F194 PolarHBondContact O-N 3.27Å
191G77.7Confident75.3Confident2 Ų252.4 Ų52.42%0.02127%0.267CS..Hα-helixtrans-56.6-46.2176.900000112.7H115 N188 S193 F194 L195H115-G191 VanDerWaalsContact CG-CA 3.5Å; H115-G191 VanDerWaalsContact ND1-CA 3.31Å; H115-G191 WeakPolarHBondContact ND1-CA 3.5Å; N188-G191 WeakPolarHBondContact O-CA 3.35Å; N188-G191 PolarHBondContact O-N 3.49Å; G191-S193 VanDerWaalsContact C-N 3.34Å; G191-S193 PolarHBondContact O-N 2.97Å; G191-F194 PolarHBondContact O-N 3.26Å; G191-L195 PolarHBondContact O-N 3.25Å
192D83.4Confident77.1Confident11 Ų1150.3 Ų50.36%0.05925%0.253CS..Hα-helixtrans-62.3-38.3179.1-67.2-21.4000112I178 N188 K189 I190 F194 L195 L196 L222I178-D192 HydrophobicContact CD1-CB 3.69Å; I178-D192 HydrophobicContact CG1-CB 4.14Å; I178-D192 HydrophobicContact CG2-CB 4.3Å; N188-D192 PolarHBondContact O-N 2.93Å; K189-D192 PolarHBondContact O-N 3.24Å; I190-D192 VanDerWaalsContact C-N 3.32Å; I190-D192 PolarHBondContact O-N 3.11Å; D192-F194 VanDerWaalsContact C-N 3.31Å; D192-F194 PolarHBondContact O-N 3.01Å; D192-L195 PolarHBondContact O-N 2.94Å; D192-L196 WeakPolarHBondContact O-CG 3.49Å; D192-L196 PolarHBondContact O-N 2.92Å; D192-L222 HydrophobicContact CB-CD1 4.11Å
193S90.2Very high79.2Confident0 Ų043.4 Ų43.40%022%0.216CC..Hα-helixtrans-59.4-38.4176.374.30000113.4K189 I190 G191 L196 Y197 A219 N223K189-S193 PolarHBondContact O-N 2.82Å; I190-S193 PolarHBondContact O-N 2.73Å; I190-S193 PolarHBondContact O-OG 3.37Å; G191-S193 VanDerWaalsContact C-N 3.34Å; G191-S193 PolarHBondContact O-N 2.97Å; S193-L196 PolarHBondContact O-N 3.24Å; S193-Y197 PolarHBondContact O-N 3.34Å; S193-A219 WeakPolarHBondContact CB-O 3.34Å; S193-A219 WeakPolarHBondContact O-CB 3.34Å; S193-N223 WeakPolarHBondContact OG-CB 3.39Å
194F91.9Very high81.4Confident2 Ų236.4 Ų36.41%0.00918%0.184CC..Hα-helixtrans-73.7-33.4179.6-78.8-77.9000112.1E26 R30 L32 F119 I190 G191 D192 Y197 V198 L226E26-F194 HydrophobicContact CB-CE2 3.8Å; E26-F194 HydrophobicContact CB-CZ 3.71Å; E26-F194 HydrophobicContact CG-CE2 4.45Å; R30-F194 VanDerWaalsContact CD-CG 3.44Å; R30-F194 VanDerWaalsContact NE-CD2 3.31Å; R30-F194 VanDerWaalsContact NE-CG 3.26Å; L32-F194 HydrophobicContact CD1-CD1 4.06Å; L32-F194 HydrophobicContact CD1-CE1 3.73Å; F119-F194 HydrophobicContact CD2-CB 3.58Å; F119-F194 WeakPolarHBondContact CD2-O 3.37Å; F119-F194 HydrophobicContact CE2-CB 3.71Å; F119-F194 HydrophobicContact CE2-CD1 4.04Å; F119-F194 HydrophobicContact CE2-CG 4.33Å; F119-F194 VanDerWaalsContact CE2-O 3.31Å; F119-F194 WeakPolarHBondContact CE2-O 3.25Å; F119-F194 HydrophobicContact CG-CB 4.49Å; I190-F194 HydrophobicContact CG2-CD2 4.24Å; I190-F194 HydrophobicContact CG2-CE2 3.88Å; I190-F194 VanDerWaalsContact O-CD2 3.25Å; I190-F194 WeakPolarHBondContact O-CD2 3.34Å; I190-F194 PolarHBondContact O-N 3.27Å; G191-F194 PolarHBondContact O-N 3.26Å; D192-F194 VanDerWaalsContact C-N 3.31Å; D192-F194 PolarHBondContact O-N 3.01Å; F194-Y197 WeakPolarHBondContact O-CB 3.49Å; F194-Y197 PolarHBondContact O-N 3.41Å; F194-V198 PolarHBondContact O-N 3.02Å; F194-L226 HydrophobicContact CD1-CD1 3.64Å; F194-L226 HydrophobicContact CE1-CD1 3.19Å; F194-L226 HydrophobicContact CE2-CD1 4.33Å; F194-L226 HydrophobicContact CG-CD1 4.37Å; F194-L226 HydrophobicContact CZ-CD1 3.58Å
195L91.1Very high83.7Confident1 Ų133 Ų331%0.00516%0.162CC..Hα-helixtrans-67.4-42.7174.3-65.1178.3000111.2I110 H115 Y118 F119 G191 D192 Y197 V198 H199I110-L195 HydrophobicContact CD1-CD1 4.45Å; H115-L195 HydrophobicContact CB-CD1 4.43Å; Y118-L195 HydrophobicContact CD1-CD1 4.07Å; Y118-L195 HydrophobicContact CD1-CD2 3.62Å; Y118-L195 HydrophobicContact CE1-CD2 4.24Å; F119-L195 HydrophobicContact CB-CD2 3.92Å; G191-L195 PolarHBondContact O-N 3.25Å; D192-L195 PolarHBondContact O-N 2.94Å; L195-Y197 VanDerWaalsContact C-N 3.3Å; L195-Y197 PolarHBondContact O-N 2.96Å; L195-V198 PolarHBondContact O-N 3.36Å; L195-H199 WeakPolarHBondContact O-CB 3.42Å; L195-H199 PolarHBondContact O-N 2.97Å
196L93.5Very high85.6Confident1 Ų129.5 Ų29.51%0.00515%0.151CC..Hα-helixtrans-60.4-40.9172.4-69.6171.9000111.7T175 I178 D192 S193 H199 S200 L215 Q218 A219 L222T175-L196 HydrophobicContact CG2-CD2 3.77Å; I178-L196 HydrophobicContact CG2-CD1 4.39Å; D192-L196 WeakPolarHBondContact O-CG 3.49Å; D192-L196 PolarHBondContact O-N 2.92Å; S193-L196 PolarHBondContact O-N 3.24Å; L196-H199 PolarHBondContact O-N 3.06Å; L196-S200 WeakPolarHBondContact O-CB 3.47Å; L196-S200 PolarHBondContact O-N 2.97Å; L196-L215 HydrophobicContact CD2-CD2 3.75Å; L196-Q218 HydrophobicContact CD1-CB 3.96Å; L196-A219 HydrophobicContact CB-CB 3.82Å; L196-A219 HydrophobicContact CD1-CB 4.46Å; L196-L222 HydrophobicContact CD1-CD1 3.67Å
197Y95.9Very high87.6Confident13 Ų1326.5 Ų26.55%0.05114%0.143CC..Hα-helixtrans-59.2-49.9174.9167-106.6000112.4L32 F119 S193 F194 L195 H199 S200 L201 L216 P228 A229 E232L32-Y197 HydrophobicContact CD1-CE1 4.28Å; L32-Y197 HydrophobicContact CD2-CE1 4.06Å; F119-Y197 HydrophobicContact CE2-CD1 4.3Å; S193-Y197 PolarHBondContact O-N 3.34Å; F194-Y197 WeakPolarHBondContact O-CB 3.49Å; F194-Y197 PolarHBondContact O-N 3.41Å; L195-Y197 VanDerWaalsContact C-N 3.3Å; L195-Y197 PolarHBondContact O-N 2.96Å; Y197-H199 PolarHBondContact O-N 3.37Å; Y197-S200 WeakPolarHBondContact O-CB 3.32Å; Y197-S200 PolarHBondContact O-N 3.49Å; Y197-S200 VanDerWaalsContact O-N 3.12Å; Y197-S200 PolarHBondContact O-OG 2.97Å; Y197-L201 HydrophobicContact CD1-CD1 4.39Å; Y197-L201 HydrophobicContact CE1-CD1 3.69Å; Y197-L201 HydrophobicContact CE1-CG 4.38Å; Y197-L201 HydrophobicContact CE2-CD1 4.22Å; Y197-L201 HydrophobicContact CE2-CD2 4.17Å; Y197-L201 HydrophobicContact CE2-CG 4.11Å; Y197-L201 PolarHBondContact O-N 3.31Å; Y197-L216 HydrophobicContact CD2-CD2 4.12Å; Y197-P228 HydrophobicContact CD2-CB 4.48Å; Y197-P228 HydrophobicContact CE1-CB 4.31Å; Y197-P228 HydrophobicContact CE2-CB 3.72Å; Y197-A229 HydrophobicContact CD2-CB 4.1Å; Y197-E232 HydrophobicContact CE2-CG 3.94Å
198V95.4Very high89.4Confident0 Ų024.1 Ų24.10%013%0.126CC..Hα-helixtrans-67.4-37.5179.1174.90000111.9F119 I122 Y123 F194 L195 S200 L201 I202F119-V198 HydrophobicContact CD2-CG2 3.6Å; F119-V198 HydrophobicContact CE1-CG2 4.43Å; F119-V198 HydrophobicContact CE2-CB 4.35Å; F119-V198 HydrophobicContact CE2-CG2 3.09Å; F119-V198 HydrophobicContact CZ-CG2 3.55Å; I122-V198 HydrophobicContact CB-CG1 4.34Å; I122-V198 HydrophobicContact CG2-CG1 3.55Å; Y123-V198 HydrophobicContact CD2-CG1 4.43Å; Y123-V198 HydrophobicContact CD2-CG2 3.89Å; Y123-V198 HydrophobicContact CG-CG2 4.28Å; F194-V198 PolarHBondContact O-N 3.02Å; L195-V198 PolarHBondContact O-N 3.36Å; V198-S200 VanDerWaalsContact C-N 3.26Å; V198-S200 PolarHBondContact O-N 2.94Å; V198-L201 PolarHBondContact O-N 3.42Å; V198-I202 HydrophobicContact CG1-CD1 4.09Å; V198-I202 WeakPolarHBondContact O-CD1 3.33Å; V198-I202 WeakPolarHBondContact O-CG1 3.49Å; V198-I202 PolarHBondContact O-N 3.01Å; V198-I202 VanDerWaalsContact O-N 3.1Å
199H94.9Very high90.5Very high9 Ų928 Ų284%0.04214%0.142CC..Hα-helixtrans-56.8-44.9171.4-169.7129.6000110.4I171 T175 L195 L196 Y197 L201 I202 C203 L215I171-H199 HydrophobicContact CD1-CB 4.1Å; I171-H199 HydrophobicContact CG1-CB 4.43Å; I171-H199 HydrophobicContact CG2-CB 4.31Å; I171-H199 WeakPolarHBondContact CG2-ND1 3.23Å; T175-H199 HydrophobicContact CG2-CB 3.92Å; T175-H199 WeakPolarHBondContact CG2-ND1 3.33Å; T175-H199 PolarHBondContact OG1-CE1 3.14Å; T175-H199 PolarHBondContact OG1-ND1 3.4Å; T175-H199 VanDerWaalsContact OG1-ND1 3.1Å; L195-H199 WeakPolarHBondContact O-CB 3.42Å; L195-H199 PolarHBondContact O-N 2.97Å; L196-H199 PolarHBondContact O-N 3.06Å; Y197-H199 PolarHBondContact O-N 3.37Å; H199-L201 PolarHBondContact O-N 3.38Å; H199-I202 PolarHBondContact O-N 3.39Å; H199-C203 PolarHBondContact CD2-SG 3.07Å; H199-C203 PolarHBondContact O-N 3.05Å; H199-L215 HydrophobicContact CB-CD1 4.34Å; H199-L215 WeakPolarHBondContact CD2-CD1 3.3Å
200S95.6Very high91.2Very high0 Ų029.5 Ų29.50%015%0.151CC..Hα-helixtrans-62.6-39.5179.178.90000112.9L196 Y197 V198 I202 C203 L204 L216L196-S200 WeakPolarHBondContact O-CB 3.47Å; L196-S200 PolarHBondContact O-N 2.97Å; Y197-S200 WeakPolarHBondContact O-CB 3.32Å; Y197-S200 PolarHBondContact O-N 3.49Å; Y197-S200 VanDerWaalsContact O-N 3.12Å; Y197-S200 PolarHBondContact O-OG 2.97Å; V198-S200 VanDerWaalsContact C-N 3.26Å; V198-S200 PolarHBondContact O-N 2.94Å; S200-I202 VanDerWaalsContact C-N 3.34Å; S200-I202 PolarHBondContact O-N 3.14Å; S200-C203 PolarHBondContact O-N 3Å; S200-L204 WeakPolarHBondContact O-CB 3.32Å; S200-L204 WeakPolarHBondContact O-CG 3.38Å; S200-L204 PolarHBondContact O-N 3.41Å; S200-L216 WeakPolarHBondContact OG-CD2 3.09Å; S200-L216 WeakPolarHBondContact OG-CG 3.39Å
201L96Very high91.8Very high7 Ų729.6 Ų29.64%0.03715%0.154CC..Hα-helixtrans-60.2-42.9174.1-70.3178.3000111.8Y123 Y126 Y197 V198 H199 L204 R205 E232Y123-L201 HydrophobicContact CE2-CD1 4.09Å; Y126-L201 HydrophobicContact CE1-CB 4.36Å; Y126-L201 HydrophobicContact CE1-CD1 4.13Å; Y126-L201 HydrophobicContact CE2-CB 4.34Å; Y197-L201 HydrophobicContact CD1-CD1 4.39Å; Y197-L201 HydrophobicContact CE1-CD1 3.69Å; Y197-L201 HydrophobicContact CE1-CG 4.38Å; Y197-L201 HydrophobicContact CE2-CD1 4.22Å; Y197-L201 HydrophobicContact CE2-CD2 4.17Å; Y197-L201 HydrophobicContact CE2-CG 4.11Å; Y197-L201 PolarHBondContact O-N 3.31Å; V198-L201 PolarHBondContact O-N 3.42Å; H199-L201 PolarHBondContact O-N 3.38Å; L201-L204 HydrophobicContact CD2-CD1 4.4Å; L201-L204 WeakPolarHBondContact O-CB 3.34Å; L201-L204 PolarHBondContact O-N 3.28Å; L201-R205 WeakPolarHBondContact O-CB 3.5Å; L201-R205 PolarHBondContact O-N 3.26Å; L201-E232 HydrophobicContact CD2-CG 3.83Å
202I95.3Very high92.6Very high0 Ų029.5 Ų29.50%015%0.153CC..Hα-helixtrans-62.9-45.5176.5-63.2157.8000110I122 Y126 L164 I167 K168 I171 V198 H199 S200 R205 L206I122-I202 HydrophobicContact CG2-CD1 3.9Å; Y126-I202 HydrophobicContact CD2-CG1 3.99Å; L164-I202 HydrophobicContact CD2-CG2 4.47Å; I167-I202 HydrophobicContact CB-CD1 4.4Å; I167-I202 HydrophobicContact CG2-CD1 3.51Å; I167-I202 HydrophobicContact CG2-CG1 4.46Å; K168-I202 HydrophobicContact CB-CG2 3.99Å; I171-I202 HydrophobicContact CG2-CD1 4.35Å; V198-I202 HydrophobicContact CG1-CD1 4.09Å; V198-I202 WeakPolarHBondContact O-CD1 3.33Å; V198-I202 WeakPolarHBondContact O-CG1 3.49Å; V198-I202 PolarHBondContact O-N 3.01Å; V198-I202 VanDerWaalsContact O-N 3.1Å; H199-I202 PolarHBondContact O-N 3.39Å; S200-I202 VanDerWaalsContact C-N 3.34Å; S200-I202 PolarHBondContact O-N 3.14Å; I202-R205 PolarHBondContact O-N 2.95Å; I202-L206 HydrophobicContact CG2-CD1 3.99Å; I202-L206 WeakPolarHBondContact O-CG 3.43Å; I202-L206 PolarHBondContact O-N 3.09Å
203C95Very high93.1Very high0 Ų029.4 Ų29.40%015%0.154CC..Hα-helixtrans-63.2-41.4176.6-77.30000112.9H199 S200 R205 L206 G207 I208 A212H199-C203 PolarHBondContact CD2-SG 3.07Å; H199-C203 PolarHBondContact O-N 3.05Å; S200-C203 PolarHBondContact O-N 3Å; C203-R205 VanDerWaalsContact C-N 3.26Å; C203-R205 PolarHBondContact O-N 3.13Å; C203-L206 PolarHBondContact O-N 3.37Å; C203-G207 PolarHBondContact O-N 2.95Å; C203-G207 VanDerWaalsContact O-N 3.14Å; C203-I208 PolarHBondContact O-N 3.42Å; C203-A212 HydrophobicContact CB-CB 3.97Å
204L93.3Very high93.2Very high41 Ų4132 Ų3222%0.21517%0.172CC..Hα-helixtrans-55.7-45.2173.1-80.2175.1000110.8S200 L201 G207 A212 E232 L236S200-L204 WeakPolarHBondContact O-CB 3.32Å; S200-L204 WeakPolarHBondContact O-CG 3.38Å; S200-L204 PolarHBondContact O-N 3.41Å; L201-L204 HydrophobicContact CD2-CD1 4.4Å; L201-L204 WeakPolarHBondContact O-CB 3.34Å; L201-L204 PolarHBondContact O-N 3.28Å; L204-G207 PolarHBondContact O-N 3.13Å; L204-G207 VanDerWaalsContact O-N 3.07Å; L204-A212 HydrophobicContact CD2-CB 3.75Å; L204-A212 HydrophobicContact CG-CB 3.69Å; L204-E232 HydrophobicContact CD1-CB 4.29Å; L204-L236 HydrophobicContact CD2-CD1 3.78Å; L204-L236 HydrophobicContact CD2-CD2 3.37Å; L204-L236 HydrophobicContact CD2-CG 3.74Å
205R90.9Very high93.3Very high100 Ų10032.5 Ų32.538%0.37718%0.175SC..Hα-helixtrans-71.6-32.1-178.1-138.465.3176.9151.5-12.7114.1Y126 E130 L164 L201 I202 C203 G207Y126-R205 HydrophobicContact CE2-CB 4.3Å; Y126-R205 HydrophobicContact CE2-CG 4.41Å; E130-R205 VanDerWaalsContact CD-NE 3.26Å; E130-R205 WeakPolarHBondContact OE1-CD 3.34Å; E130-R205 VanDerWaalsContact OE1-CG 3.27Å; E130-R205 WeakPolarHBondContact OE1-CG 3.24Å; E130-R205 IonicContact OE1-CZ 2.71Å; E130-R205 IonicContact OE1-NE 3.54Å; E130-R205 PolarHBondContact OE1-NE 2.75Å; E130-R205 IonicContact OE1-NH2 2.76Å; E130-R205 IonicContact OE2-CZ 3.46Å; E130-R205 VanDerWaalsContact OE2-CZ 3.3Å; E130-R205 IonicContact OE2-NE 3.82Å; E130-R205 PolarHBondContact OE2-NE 2.95Å; E130-R205 IonicContact OE2-NH2 3.92Å; E130-R205 PolarHBondContact OE2-NH2 3.37Å; L164-R205 HydrophobicContact CD1-CB 4.22Å; L164-R205 HydrophobicContact CD1-CG 4.25Å; L201-R205 WeakPolarHBondContact O-CB 3.5Å; L201-R205 PolarHBondContact O-N 3.26Å; I202-R205 PolarHBondContact O-N 2.95Å; C203-R205 VanDerWaalsContact C-N 3.26Å; C203-R205 PolarHBondContact O-N 3.13Å; R205-G207 PolarHBondContact O-N 2.87Å
206L91.6Very high93.5Very high37 Ų3732.4 Ų32.419%0.19417%0.174CC..THydrogen-bonded Turntrans-74.4-4.9170.1-68.7171.8000113.2L164 L165 K168 I202 C203 I208L164-L206 HydrophobicContact CB-CD2 3.81Å; L164-L206 HydrophobicContact CB-CG 4.23Å; L165-L206 HydrophobicContact CD2-CD1 3.97Å; L165-L206 HydrophobicContact CD2-CD2 4.11Å; L165-L206 HydrophobicContact CG-CD1 4.49Å; L165-L206 HydrophobicContact CG-CD2 3.96Å; K168-L206 HydrophobicContact CB-CD1 4.19Å; K168-L206 HydrophobicContact CD-CD1 3.78Å; I202-L206 HydrophobicContact CG2-CD1 3.99Å; I202-L206 WeakPolarHBondContact O-CG 3.43Å; I202-L206 PolarHBondContact O-N 3.09Å; C203-L206 PolarHBondContact O-N 3.37Å; L206-I208 HydrophobicContact CB-CD1 4.28Å; L206-I208 HydrophobicContact CB-CG1 4.2Å
207G89Confident93.5Very high52 Ų5233 Ų3354%0.53618%0.178SC..THydrogen-bonded Turntrans83.69179.100000115C203 L204 R205 K209C203-G207 PolarHBondContact O-N 2.95Å; C203-G207 VanDerWaalsContact O-N 3.14Å; L204-G207 PolarHBondContact O-N 3.13Å; L204-G207 VanDerWaalsContact O-N 3.07Å; R205-G207 PolarHBondContact O-N 2.87Å; G207-K209 PolarHBondContact O-N 2.84Å
208I92.2Very high93.2Very high54 Ų5435.3 Ų35.328%0.27719%0.189SC..  trans-91.676.5-178-40.8171.8000109.5K168 C203 L206 T211 A212K168-I208 VanDerWaalsContact NZ-CD1 3.31Å; C203-I208 PolarHBondContact O-N 3.42Å; L206-I208 HydrophobicContact CB-CD1 4.28Å; L206-I208 HydrophobicContact CB-CG1 4.2Å; I208-T211 WeakPolarHBondContact CB-OG1 3.46Å; I208-T211 HydrophobicContact CG2-CG2 3.78Å; I208-T211 WeakPolarHBondContact CG2-OG1 2.89Å; I208-T211 PolarHBondContact O-OG1 3.1Å; I208-T211 VanDerWaalsContact O-OG1 3.06Å; I208-A212 WeakPolarHBondContact O-CB 3.37Å; I208-A212 PolarHBondContact O-N 3.43Å; I208-A212 VanDerWaalsContact O-N 3.16Å
209K91.8Very high93.1Very high99 Ų9935.3 Ų35.343%0.4319%0.189SC..Hα-helixtrans-67-39.5-169.7-68-176.3-179.31800113.7G207 A212 A213 L236G207-K209 PolarHBondContact O-N 2.84Å; K209-A212 PolarHBondContact O-N 3.42Å; K209-A213 PolarHBondContact O-N 2.67Å; K209-L236 HydrophobicContact CB-CD2 3.83Å; K209-L236 HydrophobicContact CD-CD2 4.28Å; K209-L236 HydrophobicContact CG-CD2 3.91Å
210E91.5Very high93Very high138 Ų13834.9 Ų34.965%0.64519%0.187SC*.Hα-helixtrans-66.2-45.8-177.1-63.971.2-152.300111A212 A213 S214E210-A212 VanDerWaalsContact C-N 3.33Å; E210-A212 PolarHBondContact O-N 3.44Å; E210-A213 PolarHBondContact O-N 3.45Å; E210-S214 PolarHBondContact O-N 3Å
211T92.1Very high92.8Very high55 Ų5538.2 Ų38.234%0.33721%0.205SC..Hα-helixtrans-65.3-40.8176.858.80000110.9I208 A213 S214 L215I208-T211 WeakPolarHBondContact CB-OG1 3.46Å; I208-T211 HydrophobicContact CG2-CG2 3.78Å; I208-T211 WeakPolarHBondContact CG2-OG1 2.89Å; I208-T211 PolarHBondContact O-OG1 3.1Å; I208-T211 VanDerWaalsContact O-OG1 3.06Å; T211-A213 PolarHBondContact O-N 3.48Å; T211-S214 PolarHBondContact O-N 3.36Å; T211-S214 PolarHBondContact O-OG 2.78Å; T211-L215 VanDerWaalsContact O-CG 3.29Å; T211-L215 WeakPolarHBondContact O-CG 3.32Å; T211-L215 PolarHBondContact O-N 3.08Å
212A94.6Very high92.4Very high0 Ų040.6 Ų40.60%022%0.217CC..Hα-helixtrans-59.8-45.217600000112C203 L204 I208 K209 E210 S214 L215 L216 L236C203-A212 HydrophobicContact CB-CB 3.97Å; L204-A212 HydrophobicContact CD2-CB 3.75Å; L204-A212 HydrophobicContact CG-CB 3.69Å; I208-A212 WeakPolarHBondContact O-CB 3.37Å; I208-A212 PolarHBondContact O-N 3.43Å; I208-A212 VanDerWaalsContact O-N 3.16Å; K209-A212 PolarHBondContact O-N 3.42Å; E210-A212 VanDerWaalsContact C-N 3.33Å; E210-A212 PolarHBondContact O-N 3.44Å; A212-S214 VanDerWaalsContact C-N 3.35Å; A212-S214 PolarHBondContact O-N 3.09Å; A212-L215 PolarHBondContact O-N 2.71Å; A212-L216 WeakPolarHBondContact O-CG 3.21Å; A212-L216 PolarHBondContact O-N 2.83Å; A212-L236 HydrophobicContact CB-CD1 4.09Å
213A93.6Very high92.1Very high8 Ų841.4 Ų41.47%0.06622%0.222CC..Hα-helixtrans-59.1-45.6176.400000111.6K209 E210 T211 L215 L216 V217 L233 L236K209-A213 PolarHBondContact O-N 2.67Å; E210-A213 PolarHBondContact O-N 3.45Å; T211-A213 PolarHBondContact O-N 3.48Å; A213-L215 VanDerWaalsContact C-N 3.35Å; A213-L215 PolarHBondContact O-N 2.71Å; A213-L216 PolarHBondContact O-N 3.26Å; A213-V217 WeakPolarHBondContact O-CG2 3.11Å; A213-V217 PolarHBondContact O-N 2.77Å; A213-L233 HydrophobicContact CB-CD1 4.48Å; A213-L236 HydrophobicContact CB-CD1 3.77Å
214S92.6Very high91.9Very high56 Ų5644.1 Ų44.139%0.39223%0.234SC..Hα-helixtrans-61.5-41.7178.871.20000112.8E210 T211 A212 V217 Q218E210-S214 PolarHBondContact O-N 3Å; T211-S214 PolarHBondContact O-N 3.36Å; T211-S214 PolarHBondContact O-OG 2.78Å; A212-S214 VanDerWaalsContact C-N 3.35Å; A212-S214 PolarHBondContact O-N 3.09Å; S214-V217 PolarHBondContact O-N 3.47Å; S214-Q218 VanDerWaalsContact O-CG 3.28Å; S214-Q218 WeakPolarHBondContact O-CG 3.18Å; S214-Q218 PolarHBondContact O-N 3.42Å
215L93.7Very high91.7Very high11 Ų1144 Ų446%0.05823%0.231CC..Hα-helixtrans-68.7-37.8178.3-69.2167000112.1L196 H199 T211 A212 A213 Q218 A219L196-L215 HydrophobicContact CD2-CD2 3.75Å; H199-L215 HydrophobicContact CB-CD1 4.34Å; H199-L215 WeakPolarHBondContact CD2-CD1 3.3Å; T211-L215 VanDerWaalsContact O-CG 3.29Å; T211-L215 WeakPolarHBondContact O-CG 3.32Å; T211-L215 PolarHBondContact O-N 3.08Å; A212-L215 PolarHBondContact O-N 2.71Å; A213-L215 VanDerWaalsContact C-N 3.35Å; A213-L215 PolarHBondContact O-N 2.71Å; L215-Q218 PolarHBondContact O-N 3.45Å; L215-A219 WeakPolarHBondContact O-CB 3.46Å; L215-A219 PolarHBondContact O-N 2.89Å
216L95.1Very high91.8Very high0 Ų039.3 Ų39.30%021%0.213CC..Hα-helixtrans-64.1-45.3174.5-75170.1000111.6Y197 S200 A212 A213 Q218 A219 I220 A229 E232 L233 L236Y197-L216 HydrophobicContact CD2-CD2 4.12Å; S200-L216 WeakPolarHBondContact OG-CD2 3.09Å; S200-L216 WeakPolarHBondContact OG-CG 3.39Å; A212-L216 WeakPolarHBondContact O-CG 3.21Å; A212-L216 PolarHBondContact O-N 2.83Å; A213-L216 PolarHBondContact O-N 3.26Å; L216-Q218 VanDerWaalsContact C-N 3.29Å; L216-Q218 PolarHBondContact O-N 3.15Å; L216-A219 WeakPolarHBondContact O-CB 3.27Å; L216-A219 PolarHBondContact O-N 3.31Å; L216-I220 WeakPolarHBondContact O-CB 3.49Å; L216-I220 WeakPolarHBondContact O-CD1 3.01Å; L216-I220 VanDerWaalsContact O-CG1 3.26Å; L216-I220 WeakPolarHBondContact O-CG1 3.27Å; L216-I220 PolarHBondContact O-N 3.48Å; L216-A229 HydrophobicContact CD2-CB 3.8Å; L216-E232 HydrophobicContact CD1-CB 4.06Å; L216-E232 HydrophobicContact CD2-CB 4.31Å; L216-L233 HydrophobicContact CB-CD1 4.31Å; L216-L233 HydrophobicContact CD1-CB 4.2Å; L216-L233 HydrophobicContact CD1-CD1 4.38Å; L216-L236 HydrophobicContact CD1-CD1 3.76Å
217V92.9Very high91.9Very high14 Ų1438 Ų389%0.08521%0.206CC..Hα-helixtrans-60.4-41.5175.8171.90000111A213 S214 I220 N221 L233 L246 N247 L248A213-V217 WeakPolarHBondContact O-CG2 3.11Å; A213-V217 PolarHBondContact O-N 2.77Å; S214-V217 PolarHBondContact O-N 3.47Å; V217-I220 PolarHBondContact O-N 2.81Å; V217-N221 WeakPolarHBondContact O-CB 3.45Å; V217-N221 VanDerWaalsContact O-CG 3.26Å; V217-N221 PolarHBondContact O-N 2.7Å; V217-N221 PolarHBondContact O-ND2 3.13Å; V217-L233 HydrophobicContact CG2-CD2 4.33Å; V217-L246 HydrophobicContact CG2-CB 4.35Å; V217-L246 HydrophobicContact CG2-CD2 3.85Å; V217-L246 HydrophobicContact CG2-CG 4.48Å; V217-N247 WeakPolarHBondContact CG1-O 3.38Å; V217-L248 HydrophobicContact CG2-CD2 4.13Å
218Q91Very high92.3Very high61 Ų6135.6 Ų35.629%0.28518%0.181SC..Hα-helixtrans-63.7-44.7174.6-71.3169.22.500112.1N179 L196 S214 L215 L216 I220 N221 L222N179-Q218 PolarHBondContact OD1-OE1 3.39Å; N179-Q218 VanDerWaalsContact OD1-OE1 3.07Å; L196-Q218 HydrophobicContact CD1-CB 3.96Å; S214-Q218 VanDerWaalsContact O-CG 3.28Å; S214-Q218 WeakPolarHBondContact O-CG 3.18Å; S214-Q218 PolarHBondContact O-N 3.42Å; L215-Q218 PolarHBondContact O-N 3.45Å; L216-Q218 VanDerWaalsContact C-N 3.29Å; L216-Q218 PolarHBondContact O-N 3.15Å; Q218-I220 VanDerWaalsContact C-N 3.31Å; Q218-I220 PolarHBondContact O-N 3.18Å; Q218-N221 PolarHBondContact O-N 3Å; Q218-L222 WeakPolarHBondContact O-CG 3.38Å; Q218-L222 PolarHBondContact O-N 2.8Å
219A93.2Very high92.4Very high0 Ų033 Ų330%017%0.168CC..Hα-helixtrans-58.6-45.1176.700000111.4S193 L196 L215 L216 L222 N223 L226 A229S193-A219 WeakPolarHBondContact CB-O 3.34Å; S193-A219 WeakPolarHBondContact O-CB 3.34Å; L196-A219 HydrophobicContact CB-CB 3.82Å; L196-A219 HydrophobicContact CD1-CB 4.46Å; L215-A219 WeakPolarHBondContact O-CB 3.46Å; L215-A219 PolarHBondContact O-N 2.89Å; L216-A219 WeakPolarHBondContact O-CB 3.27Å; L216-A219 PolarHBondContact O-N 3.31Å; A219-L222 PolarHBondContact O-N 2.93Å; A219-N223 PolarHBondContact O-N 3.12Å; A219-L226 HydrophobicContact CB-CD2 4.17Å; A219-A229 HydrophobicContact CB-CB 4.45Å
220I93.1Very high92.6Very high0 Ų028.3 Ų28.30%015%0.147CC..Hα-helixtrans-61.6-46.2175.8-71.4163.5000110.5L216 V217 Q218 L222 N223 F224 A229 W230 L233 L248 P249L216-I220 WeakPolarHBondContact O-CB 3.49Å; L216-I220 WeakPolarHBondContact O-CD1 3.01Å; L216-I220 VanDerWaalsContact O-CG1 3.26Å; L216-I220 WeakPolarHBondContact O-CG1 3.27Å; L216-I220 PolarHBondContact O-N 3.48Å; V217-I220 PolarHBondContact O-N 2.81Å; Q218-I220 VanDerWaalsContact C-N 3.31Å; Q218-I220 PolarHBondContact O-N 3.18Å; I220-L222 PolarHBondContact O-N 3.38Å; I220-N223 CarbonylContact O-C 3.55Å; I220-N223 PolarHBondContact O-N 3.38Å; I220-N223 VanDerWaalsContact O-N 3.13Å; I220-F224 WeakPolarHBondContact O-CA 3.34Å; I220-F224 WeakPolarHBondContact O-CD1 3.49Å; I220-F224 PolarHBondContact O-N 3.47Å; I220-F224 VanDerWaalsContact O-N 3.14Å; I220-A229 HydrophobicContact CD1-CB 4.43Å; I220-A229 HydrophobicContact CG1-CB 3.92Å; I220-W230 HydrophobicContact CB-CZ2 4.43Å; I220-W230 HydrophobicContact CD1-CD2 3.76Å; I220-W230 HydrophobicContact CD1-CE3 3.78Å; I220-W230 HydrophobicContact CD1-CG 4.19Å; I220-W230 HydrophobicContact CD1-CZ3 4.23Å; I220-W230 HydrophobicContact CG1-CD2 4.07Å; I220-W230 HydrophobicContact CG1-CG 4.33Å; I220-W230 HydrophobicContact CG1-CZ2 4.49Å; I220-W230 HydrophobicContact CG2-CD2 4.24Å; I220-W230 HydrophobicContact CG2-CH2 3.6Å; I220-W230 HydrophobicContact CG2-CZ2 3.16Å; I220-W230 HydrophobicContact CG2-CZ3 4.27Å; I220-L233 HydrophobicContact CD1-CD2 3.69Å; I220-L248 HydrophobicContact CD1-CD2 4.37Å; I220-L248 HydrophobicContact CG2-CD2 4.46Å; I220-P249 HydrophobicContact CG2-CG 4.21Å
221N90.1Very high92.8Very high70 Ų7027.2 Ų27.237%0.37414%0.138SC..Hα-helixtrans-65-26.1179.9-75.2-25.1000113.5V217 Q218 N247 P249V217-N221 WeakPolarHBondContact O-CB 3.45Å; V217-N221 VanDerWaalsContact O-CG 3.26Å; V217-N221 PolarHBondContact O-N 2.7Å; V217-N221 PolarHBondContact O-ND2 3.13Å; Q218-N221 PolarHBondContact O-N 3Å; N221-N247 PolarHBondContact ND2-O 3.46Å; N221-N247 VanDerWaalsContact ND2-O 3.15Å; N221-P249 VanDerWaalsContact OD1-CD 3.26Å; N221-P249 WeakPolarHBondContact OD1-CD 3.32Å; N221-P249 VanDerWaalsContact OD1-CG 3.29Å; N221-P249 WeakPolarHBondContact OD1-CG 3.33Å
222L88.4Confident93Very high56 Ų5626.8 Ų26.829%0.29313%0.132SC..Hα-helixtrans-81-34.3172.3-70.1179.8000112.9I178 K189 D192 L196 Q218 A219 I220I178-L222 HydrophobicContact CG2-CD1 4.06Å; K189-L222 HydrophobicContact CG-CD2 4.45Å; D192-L222 HydrophobicContact CB-CD1 4.11Å; L196-L222 HydrophobicContact CD1-CD1 3.67Å; Q218-L222 WeakPolarHBondContact O-CG 3.38Å; Q218-L222 PolarHBondContact O-N 2.8Å; A219-L222 PolarHBondContact O-N 2.93Å; I220-L222 PolarHBondContact O-N 3.38Å
223N89.1Confident93Very high18 Ų1826.8 Ų26.810%0.09613%0.132CC..  trans-144.496.8-179.7-178.58000111S193 A219 I220 Y225 L226S193-N223 WeakPolarHBondContact OG-CB 3.39Å; A219-N223 PolarHBondContact O-N 3.12Å; I220-N223 CarbonylContact O-C 3.55Å; I220-N223 PolarHBondContact O-N 3.38Å; I220-N223 VanDerWaalsContact O-N 3.13Å; N223-Y225 PolarHBondContact O-N 2.8Å; N223-Y225 VanDerWaalsContact O-N 3.08Å; N223-Y225 PolarHBondContact OD1-N 3.44Å; N223-Y225 VanDerWaalsContact OD1-N 3.17Å; N223-L226 HydrophobicContact CB-CB 4.36Å; N223-L226 WeakPolarHBondContact O-CB 3.27Å; N223-L226 PolarHBondContact O-N 2.83Å
224F90.2Very high93Very high56 Ų5626.9 Ų26.925%0.24613%0.132CC..THydrogen-bonded Turntrans-59.4-24-179.1-55.3-32.4000113.5I220 L226 W230 P249I220-F224 WeakPolarHBondContact O-CA 3.34Å; I220-F224 WeakPolarHBondContact O-CD1 3.49Å; I220-F224 PolarHBondContact O-N 3.47Å; I220-F224 VanDerWaalsContact O-N 3.14Å; F224-L226 VanDerWaalsContact C-N 3.35Å; F224-W230 PolarHBondContact O-NE1 3.49Å; F224-P249 HydrophobicContact CD1-CB 4.06Å; F224-P249 HydrophobicContact CD1-CG 3.46Å; F224-P249 VanDerWaalsContact CD1-CG 3.46Å; F224-P249 HydrophobicContact CE1-CB 3.81Å; F224-P249 HydrophobicContact CE1-CG 3.32Å; F224-P249 HydrophobicContact CG-CG 4.49Å; F224-P249 HydrophobicContact CZ-CB 4.26Å; F224-P249 HydrophobicContact CZ-CG 4.23Å
225Y89.8Confident92.9Very high39 Ų3929 Ų2915%0.15314%0.139CC..THydrogen-bonded Turntrans-94.79.4-174-44.6-61.3000113.4N19 S23 N223 W227 W255 M256N19-Y225 HydrophobicContact CB-CD1 3.96Å; N19-Y225 HydrophobicContact CB-CD2 4.37Å; N19-Y225 HydrophobicContact CB-CE1 3.92Å; N19-Y225 HydrophobicContact CB-CE2 4.32Å; N19-Y225 HydrophobicContact CB-CG 4.19Å; N19-Y225 WeakPolarHBondContact ND2-CE1 3.24Å; N19-Y225 VanDerWaalsContact ND2-CZ 3.32Å; N19-Y225 PolarHBondContact ND2-OH 2.85Å; S23-Y225 WeakPolarHBondContact OG-CB 3.42Å; S23-Y225 PolarHBondContact OG-O 2.73Å; N223-Y225 PolarHBondContact O-N 2.8Å; N223-Y225 VanDerWaalsContact O-N 3.08Å; N223-Y225 PolarHBondContact OD1-N 3.44Å; N223-Y225 VanDerWaalsContact OD1-N 3.17Å; Y225-W227 VanDerWaalsContact C-N 3.28Å; Y225-W227 PolarHBondContact O-N 2.97Å; Y225-W255 AromaticContact CD1-NE1 3.98Å; Y225-W255 AromaticContact CE1-NE1 3.72Å; Y225-M256 VanDerWaalsContact C-SD 3.6Å; Y225-M256 VanDerWaalsContact CA-SD 3.56Å; Y225-M256 WeakPolarHBondContact O-CE 3.37Å
226L92Very high92.8Very high2 Ų228.9 Ų28.91%0.0114%0.138CC..  trans-78.572.7175.1-172.860.7000111.3F194 A219 N223 F224 P228 A229 W230F194-L226 HydrophobicContact CD1-CD1 3.64Å; F194-L226 HydrophobicContact CE1-CD1 3.19Å; F194-L226 HydrophobicContact CE2-CD1 4.33Å; F194-L226 HydrophobicContact CG-CD1 4.37Å; F194-L226 HydrophobicContact CZ-CD1 3.58Å; A219-L226 HydrophobicContact CB-CD2 4.17Å; N223-L226 HydrophobicContact CB-CB 4.36Å; N223-L226 WeakPolarHBondContact O-CB 3.27Å; N223-L226 PolarHBondContact O-N 2.83Å; F224-L226 VanDerWaalsContact C-N 3.35Å; L226-P228 HydrophobicContact CD1-CG 3.67Å; L226-P228 HydrophobicContact CG-CG 4.18Å; L226-A229 HydrophobicContact CB-CB 4.38Å; L226-A229 HydrophobicContact CD2-CB 3.77Å; L226-A229 HydrophobicContact CG-CB 3.81Å; L226-A229 WeakPolarHBondContact O-CB 3.29Å; L226-A229 PolarHBondContact O-N 3.27Å; L226-W230 PolarHBondContact O-N 3.45Å
227W94.7Very high92.6Very high9 Ų929 Ų293%0.03414%0.138CC..Hα-helixtrans-45.3-44.8176.8179.4-115.9000115.9W38 Y225 A229 W230 Y231 M256 F259 K263W38-W227 AromaticContact CD2-CD1 3.64Å; W38-W227 HydrophobicContact CD2-CD2 4.09Å; W38-W227 AromaticContact CD2-CE2 3.74Å; W38-W227 HydrophobicContact CD2-CG 4.03Å; W38-W227 HydrophobicContact CD2-CZ2 4.37Å; W38-W227 AromaticContact CD2-NE1 3.44Å; W38-W227 AromaticContact CE2-CE2 3.62Å; W38-W227 AromaticContact CE2-CZ2 3.79Å; W38-W227 AromaticContact CE2-NE1 3.79Å; W38-W227 HydrophobicContact CE3-CB 4Å; W38-W227 AromaticContact CE3-CD1 3.36Å; W38-W227 AromaticContact CE3-CD2 3.77Å; W38-W227 HydrophobicContact CE3-CD2 3.77Å; W38-W227 AromaticContact CE3-CE2 3.93Å; W38-W227 AromaticContact CE3-CG 3.41Å; W38-W227 HydrophobicContact CE3-CG 3.41Å; W38-W227 VanDerWaalsContact CE3-CG 3.41Å; W38-W227 AromaticContact CE3-NE1 3.67Å; W38-W227 AromaticContact CG-NE1 3.73Å; W38-W227 AromaticContact CH2-CD2 3.49Å; W38-W227 HydrophobicContact CH2-CD2 3.49Å; W38-W227 VanDerWaalsContact CH2-CD2 3.49Å; W38-W227 AromaticContact CH2-CE2 3.87Å; W38-W227 AromaticContact CH2-CE3 3.51Å; W38-W227 HydrophobicContact CH2-CE3 3.51Å; W38-W227 AromaticContact CH2-CG 3.96Å; W38-W227 HydrophobicContact CH2-CG 3.96Å; W38-W227 HydrophobicContact CH2-CH2 4.27Å; W38-W227 HydrophobicContact CH2-CZ2 4.25Å; W38-W227 AromaticContact CH2-CZ3 3.92Å; W38-W227 HydrophobicContact CH2-CZ3 3.92Å; W38-W227 AromaticContact CZ2-CD2 3.83Å; W38-W227 HydrophobicContact CZ2-CD2 3.83Å; W38-W227 AromaticContact CZ2-CE2 3.69Å; W38-W227 AromaticContact CZ2-CE3 3.98Å; W38-W227 HydrophobicContact CZ2-CE3 3.98Å; W38-W227 AromaticContact CZ2-CH2 3.88Å; W38-W227 HydrophobicContact CZ2-CH2 3.88Å; W38-W227 AromaticContact CZ2-CZ2 3.73Å; W38-W227 HydrophobicContact CZ2-CZ2 3.73Å; W38-W227 HydrophobicContact CZ2-CZ3 4.01Å; W38-W227 HydrophobicContact CZ3-CB 3.75Å; W38-W227 AromaticContact CZ3-CD1 3.84Å; W38-W227 AromaticContact CZ3-CD2 3.46Å; W38-W227 HydrophobicContact CZ3-CD2 3.46Å; W38-W227 VanDerWaalsContact CZ3-CD2 3.46Å; W38-W227 AromaticContact CZ3-CE2 3.99Å; W38-W227 AromaticContact CZ3-CE3 3.88Å; W38-W227 HydrophobicContact CZ3-CE3 3.88Å; W38-W227 AromaticContact CZ3-CG 3.38Å; W38-W227 HydrophobicContact CZ3-CG 3.38Å; Y225-W227 VanDerWaalsContact C-N 3.28Å; Y225-W227 PolarHBondContact O-N 2.97Å; W227-A229 PolarHBondContact O-N 3.36Å; W227-W230 HydrophobicContact CE3-CB 3.85Å; W227-W230 HydrophobicContact CE3-CG 4.46Å; W227-W230 HydrophobicContact CZ3-CB 4.04Å; W227-W230 WeakPolarHBondContact O-CB 3.1Å; W227-W230 PolarHBondContact O-N 2.92Å; W227-W230 VanDerWaalsContact O-N 3.09Å; W227-Y231 HydrophobicContact CZ2-CD2 4.12Å; W227-Y231 PolarHBondContact O-N 3.13Å; W227-M256 HydrophobicContact CB-SD 4.04Å; W227-F259 HydrophobicContact CH2-CB 3.8Å; W227-F259 HydrophobicContact CZ3-CB 3.73Å; W227-K263 HydrophobicContact CH2-CD 3.97Å; W227-K263 HydrophobicContact CZ2-CD 4.09Å
228P95.7Very high92.3Very high2 Ų230.7 Ų30.71%0.01315%0.146CC..Hα-helixtrans-59.3-33.4179.718.8-30.2000113.3L32 S35 Y197 L226 Y231 E232L32-P228 HydrophobicContact CD1-CG 4.03Å; S35-P228 WeakPolarHBondContact OG-CB 3.25Å; Y197-P228 HydrophobicContact CD2-CB 4.48Å; Y197-P228 HydrophobicContact CE1-CB 4.31Å; Y197-P228 HydrophobicContact CE2-CB 3.72Å; L226-P228 HydrophobicContact CD1-CG 3.67Å; L226-P228 HydrophobicContact CG-CG 4.18Å; P228-Y231 PolarHBondContact O-N 2.98Å; P228-E232 WeakPolarHBondContact O-CG 3.43Å; P228-E232 PolarHBondContact O-N 3.32Å
229A95.9Very high92.1Very high0 Ų030.9 Ų30.90%015%0.149CC..Hα-helixtrans-68.6-40.6175.600000111.8Y197 L216 A219 I220 L226 W227 Y231 L233Y197-A229 HydrophobicContact CD2-CB 4.1Å; L216-A229 HydrophobicContact CD2-CB 3.8Å; A219-A229 HydrophobicContact CB-CB 4.45Å; I220-A229 HydrophobicContact CD1-CB 4.43Å; I220-A229 HydrophobicContact CG1-CB 3.92Å; L226-A229 HydrophobicContact CB-CB 4.38Å; L226-A229 HydrophobicContact CD2-CB 3.77Å; L226-A229 HydrophobicContact CG-CB 3.81Å; L226-A229 WeakPolarHBondContact O-CB 3.29Å; L226-A229 PolarHBondContact O-N 3.27Å; W227-A229 PolarHBondContact O-N 3.36Å; A229-Y231 VanDerWaalsContact C-N 3.35Å; A229-L233 WeakPolarHBondContact O-CB 3.23Å; A229-L233 PolarHBondContact O-N 3.32Å
230W96Very high91.6Very high0 Ų035.2 Ų35.20%017%0.167CC..Hα-helixtrans-59.9-45.8172.2-70.7106.8000111.9I220 F224 L226 W227 L233 V234 L248 R257 F260I220-W230 HydrophobicContact CB-CZ2 4.43Å; I220-W230 HydrophobicContact CD1-CD2 3.76Å; I220-W230 HydrophobicContact CD1-CE3 3.78Å; I220-W230 HydrophobicContact CD1-CG 4.19Å; I220-W230 HydrophobicContact CD1-CZ3 4.23Å; I220-W230 HydrophobicContact CG1-CD2 4.07Å; I220-W230 HydrophobicContact CG1-CG 4.33Å; I220-W230 HydrophobicContact CG1-CZ2 4.49Å; I220-W230 HydrophobicContact CG2-CD2 4.24Å; I220-W230 HydrophobicContact CG2-CH2 3.6Å; I220-W230 HydrophobicContact CG2-CZ2 3.16Å; I220-W230 HydrophobicContact CG2-CZ3 4.27Å; F224-W230 PolarHBondContact O-NE1 3.49Å; L226-W230 PolarHBondContact O-N 3.45Å; W227-W230 HydrophobicContact CE3-CB 3.85Å; W227-W230 HydrophobicContact CE3-CG 4.46Å; W227-W230 HydrophobicContact CZ3-CB 4.04Å; W227-W230 WeakPolarHBondContact O-CB 3.1Å; W227-W230 PolarHBondContact O-N 2.92Å; W227-W230 VanDerWaalsContact O-N 3.09Å; W230-L233 WeakPolarHBondContact O-CB 3.45Å; W230-L233 PolarHBondContact O-N 2.86Å; W230-V234 WeakPolarHBondContact O-CG2 3.46Å; W230-V234 PolarHBondContact O-N 3.44Å; W230-L248 HydrophobicContact CH2-CD2 4.14Å; W230-L248 HydrophobicContact CZ3-CD1 4.15Å; W230-L248 HydrophobicContact CZ3-CD2 3.88Å; W230-L248 HydrophobicContact CZ3-CG 4.46Å; W230-R257 HydrophobicContact CH2-CB 4.15Å; W230-R257 HydrophobicContact CH2-CG 4.07Å; W230-R257 HydrophobicContact CZ3-CG 4.33Å; W230-F260 HydrophobicContact CB-CB 4.38Å; W230-F260 HydrophobicContact CB-CD2 4.45Å; W230-F260 HydrophobicContact CD2-CB 4.26Å; W230-F260 HydrophobicContact CD2-CG 4.41Å; W230-F260 HydrophobicContact CE3-CB 3.65Å; W230-F260 AromaticContact CE3-CD1 3.72Å; W230-F260 HydrophobicContact CE3-CD1 3.72Å; W230-F260 AromaticContact CE3-CD2 3.68Å; W230-F260 HydrophobicContact CE3-CD2 3.68Å; W230-F260 HydrophobicContact CE3-CE1 4.22Å; W230-F260 HydrophobicContact CE3-CE2 4.17Å; W230-F260 AromaticContact CE3-CG 3.39Å; W230-F260 HydrophobicContact CE3-CG 3.39Å; W230-F260 HydrophobicContact CE3-CZ 4.39Å; W230-F260 HydrophobicContact CZ3-CB 4.23Å; W230-F260 AromaticContact CZ3-CD1 3.61Å; W230-F260 HydrophobicContact CZ3-CD1 3.61Å; W230-F260 HydrophobicContact CZ3-CD2 4.37Å; W230-F260 AromaticContact CZ3-CE1 3.95Å; W230-F260 HydrophobicContact CZ3-CE1 3.95Å; W230-F260 AromaticContact CZ3-CG 3.82Å; W230-F260 HydrophobicContact CZ3-CG 3.82Å; W230-F260 HydrophobicContact CZ3-CZ 4.41Å; W230-F260 WeakPolarHBondContact O-CD2 3.33Å
231Y95.2Very high91.2Very high114 Ų11441.5 Ų41.545%0.44720%0.197SC..Hα-helixtrans-60.4-49.7-178.9-175.7-98.2000112W227 P228 A229 L233 V234W227-Y231 HydrophobicContact CZ2-CD2 4.12Å; W227-Y231 PolarHBondContact O-N 3.13Å; P228-Y231 PolarHBondContact O-N 2.98Å; A229-Y231 VanDerWaalsContact C-N 3.35Å; Y231-L233 VanDerWaalsContact C-N 3.28Å; Y231-L233 PolarHBondContact O-N 3.49Å; Y231-V234 WeakPolarHBondContact O-CB 3.47Å; Y231-V234 PolarHBondContact O-N 3.33Å
232E95.2Very high90.9Very high46 Ų4641 Ų4122%0.21519%0.191CC..Hα-helixtrans-65.4-30.8177.3-65.4-63.3151.900112.5Y197 L201 L204 L216 P228 V234 D235Y197-E232 HydrophobicContact CE2-CG 3.94Å; L201-E232 HydrophobicContact CD2-CG 3.83Å; L204-E232 HydrophobicContact CD1-CB 4.29Å; L216-E232 HydrophobicContact CD1-CB 4.06Å; L216-E232 HydrophobicContact CD2-CB 4.31Å; P228-E232 WeakPolarHBondContact O-CG 3.43Å; P228-E232 PolarHBondContact O-N 3.32Å; E232-V234 VanDerWaalsContact C-N 3.28Å; E232-V234 PolarHBondContact O-N 2.86Å; E232-D235 PolarHBondContact O-N 3.35Å
233L95.3Very high90.7Very high0 Ų039.1 Ų39.10%018%0.181CC..Hα-helixtrans-66.3-30.3177.5-175.662.5000112.3A213 L216 V217 I220 A229 W230 Y231 D235 L236 I237 L246 L248 F260A213-L233 HydrophobicContact CB-CD1 4.48Å; L216-L233 HydrophobicContact CB-CD1 4.31Å; L216-L233 HydrophobicContact CD1-CB 4.2Å; L216-L233 HydrophobicContact CD1-CD1 4.38Å; V217-L233 HydrophobicContact CG2-CD2 4.33Å; I220-L233 HydrophobicContact CD1-CD2 3.69Å; A229-L233 WeakPolarHBondContact O-CB 3.23Å; A229-L233 PolarHBondContact O-N 3.32Å; W230-L233 WeakPolarHBondContact O-CB 3.45Å; W230-L233 PolarHBondContact O-N 2.86Å; Y231-L233 VanDerWaalsContact C-N 3.28Å; Y231-L233 PolarHBondContact O-N 3.49Å; L233-D235 PolarHBondContact O-N 3.15Å; L233-L236 PolarHBondContact O-N 3.37Å; L233-L236 VanDerWaalsContact O-N 3.16Å; L233-I237 HydrophobicContact CG-CD1 4.38Å; L233-I237 PolarHBondContact O-N 3.42Å; L233-L246 HydrophobicContact CD1-CD1 4.27Å; L233-L246 HydrophobicContact CD2-CD1 4.42Å; L233-L248 HydrophobicContact CD2-CD2 3.9Å; L233-F260 HydrophobicContact CB-CE2 4.01Å; L233-F260 HydrophobicContact CD2-CE2 3.86Å; L233-F260 HydrophobicContact CD2-CZ 3.85Å; L233-F260 HydrophobicContact CG-CE2 3.86Å; L233-F260 HydrophobicContact CG-CZ 4.14Å
234V94.1Very high90.4Very high10 Ų1043.9 Ų43.96%0.06121%0.207CC..Hα-helixtrans-56.5-42.4176178.80000110.7W230 Y231 E232 L236 I237 F260 K263 V264 K267W230-V234 WeakPolarHBondContact O-CG2 3.46Å; W230-V234 PolarHBondContact O-N 3.44Å; Y231-V234 WeakPolarHBondContact O-CB 3.47Å; Y231-V234 PolarHBondContact O-N 3.33Å; E232-V234 VanDerWaalsContact C-N 3.28Å; E232-V234 PolarHBondContact O-N 2.86Å; V234-L236 VanDerWaalsContact C-N 3.25Å; V234-L236 PolarHBondContact O-N 2.89Å; V234-I237 PolarHBondContact O-N 3.1Å; V234-F260 HydrophobicContact CG2-CD2 3.58Å; V234-F260 HydrophobicContact CG2-CE2 3.95Å; V234-K263 HydrophobicContact CG1-CB 4.14Å; V234-K263 HydrophobicContact CG2-CB 3.98Å; V234-V264 HydrophobicContact CB-CG2 4.42Å; V234-V264 HydrophobicContact CG1-CG2 4.18Å; V234-V264 HydrophobicContact CG2-CG2 4.13Å; V234-K267 HydrophobicContact CG1-CD 4.18Å; V234-K267 WeakPolarHBondContact O-CD 3.38Å; V234-K267 PolarHBondContact O-NZ 2.76Å
235D90Very high90.1Very high102 Ų10246 Ų4655%0.54523%0.228SC..Hα-helixtrans-69.8-22.5-176.8-74.3-18.3000112.9E232 L233 K267E232-D235 PolarHBondContact O-N 3.35Å; L233-D235 PolarHBondContact O-N 3.15Å; D235-K267 VanDerWaalsContact CA-NZ 3.34Å; D235-K267 PolarHBondContact O-NZ 2.96Å
236L91.6Very high89.8Confident8 Ų845.9 Ų45.94%0.04223%0.229CC..Hα-helixtrans-85.3-15.6177.7-72.3-179.1000115.3L204 K209 A212 A213 L216 L233 V234 K242L204-L236 HydrophobicContact CD2-CD1 3.78Å; L204-L236 HydrophobicContact CD2-CD2 3.37Å; L204-L236 HydrophobicContact CD2-CG 3.74Å; K209-L236 HydrophobicContact CB-CD2 3.83Å; K209-L236 HydrophobicContact CD-CD2 4.28Å; K209-L236 HydrophobicContact CG-CD2 3.91Å; A212-L236 HydrophobicContact CB-CD1 4.09Å; A213-L236 HydrophobicContact CB-CD1 3.77Å; L216-L236 HydrophobicContact CD1-CD1 3.76Å; L233-L236 PolarHBondContact O-N 3.37Å; L233-L236 VanDerWaalsContact O-N 3.16Å; V234-L236 VanDerWaalsContact C-N 3.25Å; V234-L236 PolarHBondContact O-N 2.89Å; L236-K242 PolarHBondContact O-NZ 3Å
237I91.3Very high89.3Confident1 Ų152.2 Ų52.21%0.00526%0.263CS..  trans-83.2118.1179.6-67.2169.1000109.2L233 V234 M243 L246 F260 V264 K267L233-I237 HydrophobicContact CG-CD1 4.38Å; L233-I237 PolarHBondContact O-N 3.42Å; V234-I237 PolarHBondContact O-N 3.1Å; I237-M243 HydrophobicContact CD1-CB 4.49Å; I237-M243 HydrophobicContact CG2-CB 4.18Å; I237-L246 HydrophobicContact CD1-CD1 4.01Å; I237-L246 HydrophobicContact CG1-CD1 4.1Å; I237-F260 HydrophobicContact CD1-CE1 4.38Å; I237-F260 HydrophobicContact CD1-CE2 3.84Å; I237-F260 HydrophobicContact CD1-CZ 3.36Å; I237-V264 HydrophobicContact CB-CG1 4.46Å; I237-V264 HydrophobicContact CD1-CG1 4.38Å; I237-V264 HydrophobicContact CD1-CG2 3.74Å; I237-V264 HydrophobicContact CG2-CG1 3.83Å; I237-K267 PolarHBondContact O-NZ 3.45Å
238E87.1Confident88.9Confident51 Ų5153.1 Ų53.124%0.23827%0.268CS..  trans-98.7-37.2-179.8-57.4-170.217400112L268 R423 H424E238-L268 WeakPolarHBondContact O-CD2 3.26Å; E238-R423 IonicContact OE1-NH1 3.49Å; E238-R423 IonicContact OE2-CZ 2.65Å; E238-R423 IonicContact OE2-NH1 3.22Å; E238-R423 PolarHBondContact OE2-NH1 3.41Å; E238-R423 IonicContact OE2-NH2 3.81Å; E238-H424 PolarHBondContact O-CE1 3.28Å; E238-H424 VanDerWaalsContact O-CE1 3.32Å
239N85.7Confident88.3Confident65 Ų6553.6 Ų53.635%0.34827%0.271SS..SBendtrans-137.7157.5-174.4-63.9-21000110.8E241 K242 M243N239-E241 VanDerWaalsContact C-N 3.29Å; N239-E241 PolarHBondContact O-N 2.71Å; N239-K242 WeakPolarHBondContact O-CB 3.39Å; N239-K242 PolarHBondContact O-N 3.18Å; N239-K242 VanDerWaalsContact O-N 3.14Å; N239-M243 PolarHBondContact O-N 3.34Å
240K83.8Confident87.5Confident90 Ų9058.5 Ų58.539%0.39130%0.302SS..Hα-helixtrans-58.9-35.9175.9-175175.3178174.20113.6K242 M243 N244 L268K240-K242 VanDerWaalsContact C-N 3.31Å; K240-K242 PolarHBondContact O-N 3.44Å; K240-M243 WeakPolarHBondContact O-CB 3.48Å; K240-M243 PolarHBondContact O-N 3.28Å; K240-N244 PolarHBondContact O-N 3.21Å; K240-N244 VanDerWaalsContact O-N 3.07Å; K240-L268 HydrophobicContact CB-CD1 4.49Å
241E83.3Confident86.7Confident132 Ų13263.1 Ų63.162%0.61733%0.326SS*.Hα-helixtrans-60.8-43.4176.4-64.1-178169.500111.4N239 M243 N244 C245N239-E241 VanDerWaalsContact C-N 3.29Å; N239-E241 PolarHBondContact O-N 2.71Å; E241-M243 VanDerWaalsContact C-N 3.31Å; E241-M243 PolarHBondContact O-N 2.89Å; E241-N244 PolarHBondContact O-N 3.24Å; E241-N244 VanDerWaalsContact O-N 3.14Å; E241-C245 PolarHBondContact O-N 3.15Å; E241-C245 PolarHBondContact O-SG 3.23Å
242K83.9Confident85.6Confident59 Ų5962.5 Ų62.526%0.25733%0.331SS..Hα-helixtrans-60.6-43.1177.1-167.4174.8-175.7-177.80110.6L236 N239 K240 N244 C245 L246L236-K242 PolarHBondContact O-NZ 3Å; N239-K242 WeakPolarHBondContact O-CB 3.39Å; N239-K242 PolarHBondContact O-N 3.18Å; N239-K242 VanDerWaalsContact O-N 3.14Å; K240-K242 VanDerWaalsContact C-N 3.31Å; K240-K242 PolarHBondContact O-N 3.44Å; K242-N244 VanDerWaalsContact C-N 3.33Å; K242-N244 PolarHBondContact O-N 2.87Å; K242-C245 PolarHBondContact O-N 2.91Å; K242-L246 VanDerWaalsContact O-CG 3.31Å; K242-L246 WeakPolarHBondContact O-CG 3.49Å; K242-L246 PolarHBondContact O-N 3.46Å
243M84.8Confident84.7Confident17 Ų1767.3 Ų67.38%0.08435%0.353CS..Hα-helixtrans-56.9-45.4174.7-176.2-175.7179.100112.1I237 N239 K240 E241 C245 L246 F260 E261 V264 F265I237-M243 HydrophobicContact CD1-CB 4.49Å; I237-M243 HydrophobicContact CG2-CB 4.18Å; N239-M243 PolarHBondContact O-N 3.34Å; K240-M243 WeakPolarHBondContact O-CB 3.48Å; K240-M243 PolarHBondContact O-N 3.28Å; E241-M243 VanDerWaalsContact C-N 3.31Å; E241-M243 PolarHBondContact O-N 2.89Å; M243-C245 VanDerWaalsContact C-N 3.34Å; M243-C245 PolarHBondContact O-N 3.34Å; M243-L246 PolarHBondContact O-N 3.45Å; M243-F260 HydrophobicContact CE-CE1 4.41Å; M243-E261 HydrophobicContact CE-CB 4.08Å; M243-E261 HydrophobicContact CE-CG 3.58Å; M243-V264 HydrophobicContact SD-CB 4.38Å; M243-V264 HydrophobicContact SD-CG1 3.69Å; M243-F265 HydrophobicContact CE-CE1 4.5Å; M243-F265 HydrophobicContact CE-CZ 4.18Å; M243-F265 HydrophobicContact SD-CE1 4.17Å; M243-F265 HydrophobicContact SD-CZ 4.4Å
244N83.7Confident84.2Confident119 Ų11967.4 Ų67.464%0.63635%0.354SS*.Hα-helixtrans-70.5-27.3179.1-67.5-18.7000113.5K240 E241 K242 L246K240-N244 PolarHBondContact O-N 3.21Å; K240-N244 VanDerWaalsContact O-N 3.07Å; E241-N244 PolarHBondContact O-N 3.24Å; E241-N244 VanDerWaalsContact O-N 3.14Å; K242-N244 VanDerWaalsContact C-N 3.33Å; K242-N244 PolarHBondContact O-N 2.87Å; N244-L246 VanDerWaalsContact C-N 3.32Å
245C83.4Confident84Confident101 Ų10167.1 Ų67.168%0.68235%0.352SS*.Hα-helixtrans-78.1-14.7176.8-67.70000113.5E241 K242 M243E241-C245 PolarHBondContact O-N 3.15Å; E241-C245 PolarHBondContact O-SG 3.23Å; K242-C245 PolarHBondContact O-N 2.91Å; M243-C245 VanDerWaalsContact C-N 3.34Å; M243-C245 PolarHBondContact O-N 3.34Å
246L83.4Confident84.2Confident35 Ų3562.3 Ų62.318%0.18333%0.326CS..SBendtrans-78.2127.2177.3-63167.1000109.4V217 L233 I237 K242 M243 N244 L248V217-L246 HydrophobicContact CG2-CB 4.35Å; V217-L246 HydrophobicContact CG2-CD2 3.85Å; V217-L246 HydrophobicContact CG2-CG 4.48Å; L233-L246 HydrophobicContact CD1-CD1 4.27Å; L233-L246 HydrophobicContact CD2-CD1 4.42Å; I237-L246 HydrophobicContact CD1-CD1 4.01Å; I237-L246 HydrophobicContact CG1-CD1 4.1Å; K242-L246 VanDerWaalsContact O-CG 3.31Å; K242-L246 WeakPolarHBondContact O-CG 3.49Å; K242-L246 PolarHBondContact O-N 3.46Å; M243-L246 PolarHBondContact O-N 3.45Å; N244-L246 VanDerWaalsContact C-N 3.32Å; L246-L248 HydrophobicContact CB-CD1 4.15Å; L246-L248 HydrophobicContact CB-CG 3.91Å; L246-L248 PolarHBondContact O-N 2.84Å
247N82.1Confident84.2Confident136 Ų13664.5 Ų64.573%0.72733%0.334SS*.  trans-74.571.3173.4-69.7-14.8000110.2V217 N221V217-N247 WeakPolarHBondContact CG1-O 3.38Å; N221-N247 PolarHBondContact ND2-O 3.46Å; N221-N247 VanDerWaalsContact ND2-O 3.15Å
248L85.8Confident84.3Confident27 Ų2765 Ų6514%0.14134%0.336CS..  trans-88.1148.5175.7-65171.6000110.3V217 I220 W230 L233 L246 T250 F260V217-L248 HydrophobicContact CG2-CD2 4.13Å; I220-L248 HydrophobicContact CD1-CD2 4.37Å; I220-L248 HydrophobicContact CG2-CD2 4.46Å; W230-L248 HydrophobicContact CH2-CD2 4.14Å; W230-L248 HydrophobicContact CZ3-CD1 4.15Å; W230-L248 HydrophobicContact CZ3-CD2 3.88Å; W230-L248 HydrophobicContact CZ3-CG 4.46Å; L233-L248 HydrophobicContact CD2-CD2 3.9Å; L246-L248 HydrophobicContact CB-CD1 4.15Å; L246-L248 HydrophobicContact CB-CG 3.91Å; L246-L248 PolarHBondContact O-N 2.84Å; L248-T250 PolarHBondContact O-N 3.09Å; L248-F260 HydrophobicContact CD1-CE1 3.57Å; L248-F260 HydrophobicContact CD1-CZ 3.91Å
249P82.2Confident84.7Confident12 Ų1263 Ų638%0.07833%0.326CS..  trans-58.3132.7176-20.131.6000110.7I220 N221 F224 C254 R257I220-P249 HydrophobicContact CG2-CG 4.21Å; N221-P249 VanDerWaalsContact OD1-CD 3.26Å; N221-P249 WeakPolarHBondContact OD1-CD 3.32Å; N221-P249 VanDerWaalsContact OD1-CG 3.29Å; N221-P249 WeakPolarHBondContact OD1-CG 3.33Å; F224-P249 HydrophobicContact CD1-CB 4.06Å; F224-P249 HydrophobicContact CD1-CG 3.46Å; F224-P249 VanDerWaalsContact CD1-CG 3.46Å; F224-P249 HydrophobicContact CE1-CB 3.81Å; F224-P249 HydrophobicContact CE1-CG 3.32Å; F224-P249 HydrophobicContact CG-CG 4.49Å; F224-P249 HydrophobicContact CZ-CB 4.26Å; F224-P249 HydrophobicContact CZ-CG 4.23Å; P249-C254 HydrophobicContact CB-CB 4.28Å; P249-R257 WeakPolarHBondContact O-CD 3.41Å
250T80.1Confident85.1Confident104 Ų10460 Ų6064%0.63831%0.31SS*.  trans-106.41.8178.654.80000113.3L248L248-T250 PolarHBondContact O-N 3.09Å
251D78.3Confident85.6Confident96 Ų9657.1 Ų57.151%0.51330%0.298SS..  trans-68.8139-178.4-58.3-32.2000110.8E253 C254D251-E253 PolarHBondContact O-N 3.08Å; D251-E253 VanDerWaalsContact O-N 3.09Å; D251-C254 VanDerWaalsContact O-CB 3.26Å; D251-C254 WeakPolarHBondContact O-CB 3.39Å; D251-C254 PolarHBondContact O-N 3.44Å
252D71.9Confident86.2Confident101 Ų10150.9 Ų50.954%0.5427%0.269SS..THydrogen-bonded Turntrans-60.8-21.1179.6-70.5-25.6000112.9C254D252-C254 PolarHBondContact O-N 3.23Å
253E76.4Confident86.7Confident147 Ų14749.8 Ų49.869%0.68726%0.264SS*.THydrogen-bonded Turntrans-67-20.1173.1-61.9-171.3168.900112.8D251 W255D251-E253 PolarHBondContact O-N 3.08Å; D251-E253 VanDerWaalsContact O-N 3.09Å; E253-W255 VanDerWaalsContact O-CD1 3.3Å; E253-W255 PolarHBondContact O-N 3.07Å
254C85.9Confident87.2Confident3 Ų349 Ų492%0.0226%0.26CS..  trans-83.554.3179.9-162.40000112.3P249 D251 D252 M256 R257P249-C254 HydrophobicContact CB-CB 4.28Å; D251-C254 VanDerWaalsContact O-CB 3.26Å; D251-C254 WeakPolarHBondContact O-CB 3.39Å; D251-C254 PolarHBondContact O-N 3.44Å; D252-C254 PolarHBondContact O-N 3.23Å; C254-M256 PolarHBondContact O-N 3.21Å; C254-M256 VanDerWaalsContact O-N 3.09Å; C254-R257 WeakPolarHBondContact O-CB 3.23Å; C254-R257 PolarHBondContact O-N 3.38Å
255W89.5Confident87.6Confident4 Ų444.3 Ų44.32%0.01524%0.235CC..THydrogen-bonded Turntrans-59.7-25-173.860.9-91.3000114.7I11 V16 N19 I20 L42 Y225 E253 R257 Y258 F259 F286I11-W255 HydrophobicContact CD1-CB 4Å; I11-W255 HydrophobicContact CG1-CB 4.18Å; I11-W255 HydrophobicContact CG2-CB 4.29Å; V16-W255 HydrophobicContact CG1-CD2 4.41Å; V16-W255 HydrophobicContact CG1-CH2 4.22Å; V16-W255 HydrophobicContact CG1-CZ2 3.95Å; V16-W255 HydrophobicContact CG2-CD2 4.16Å; V16-W255 HydrophobicContact CG2-CG 4.06Å; N19-W255 HydrophobicContact CB-CZ2 4.41Å; I20-W255 HydrophobicContact CD1-CH2 3.94Å; I20-W255 HydrophobicContact CD1-CZ2 4.35Å; I20-W255 HydrophobicContact CG1-CH2 3.61Å; I20-W255 HydrophobicContact CG1-CZ2 3.74Å; L42-W255 HydrophobicContact CD1-CH2 4.41Å; L42-W255 HydrophobicContact CD1-CZ3 4.16Å; Y225-W255 AromaticContact CD1-NE1 3.98Å; Y225-W255 AromaticContact CE1-NE1 3.72Å; E253-W255 VanDerWaalsContact O-CD1 3.3Å; E253-W255 PolarHBondContact O-N 3.07Å; W255-R257 PolarHBondContact O-N 3.46Å; W255-Y258 HydrophobicContact CB-CD2 4.37Å; W255-Y258 WeakPolarHBondContact O-CD2 3.48Å; W255-Y258 PolarHBondContact O-N 3.26Å; W255-F259 HydrophobicContact CE3-CD2 4.28Å; W255-F259 HydrophobicContact CE3-CE2 4.05Å; W255-F259 HydrophobicContact CZ3-CD2 4.25Å; W255-F259 AromaticContact CZ3-CE2 3.97Å; W255-F259 HydrophobicContact CZ3-CE2 3.97Å; W255-F286 HydrophobicContact CE3-CZ 4.35Å
256M93.2Very high88.1Confident1 Ų140.4 Ų40.41%0.00521%0.207CC..Hα-helixtrans-63-24.2174.6-73.6-165.8-173.900112.6W38 L39 Y225 W227 C254 Y258 F259 F260W38-M256 HydrophobicContact CZ3-CE 4.43Å; L39-M256 HydrophobicContact CD2-CE 3.75Å; Y225-M256 VanDerWaalsContact C-SD 3.6Å; Y225-M256 VanDerWaalsContact CA-SD 3.56Å; Y225-M256 WeakPolarHBondContact O-CE 3.37Å; W227-M256 HydrophobicContact CB-SD 4.04Å; C254-M256 PolarHBondContact O-N 3.21Å; C254-M256 VanDerWaalsContact O-N 3.09Å; M256-Y258 PolarHBondContact O-N 3.49Å; M256-F259 PolarHBondContact O-N 3.35Å; M256-F260 PolarHBondContact O-N 3.15Å
257R92.9Very high88.5Confident53 Ų5340.6 Ų40.620%0.221%0.206CC..Hα-helixtrans-55.8-39.7174.9-168.2-172.385.7145.111.9111.5W230 P249 C254 W255 F259 F260 E261W230-R257 HydrophobicContact CH2-CB 4.15Å; W230-R257 HydrophobicContact CH2-CG 4.07Å; W230-R257 HydrophobicContact CZ3-CG 4.33Å; P249-R257 WeakPolarHBondContact O-CD 3.41Å; C254-R257 WeakPolarHBondContact O-CB 3.23Å; C254-R257 PolarHBondContact O-N 3.38Å; W255-R257 PolarHBondContact O-N 3.46Å; R257-F259 VanDerWaalsContact C-N 3.33Å; R257-F259 PolarHBondContact O-N 3.17Å; R257-F260 CarbonylContact O-C 3.56Å; R257-F260 WeakPolarHBondContact O-CA 3.5Å; R257-F260 WeakPolarHBondContact O-CB 3.43Å; R257-F260 PolarHBondContact O-N 2.97Å; R257-F260 VanDerWaalsContact O-N 3.1Å; R257-E261 HydrophobicContact CG-CG 4.17Å; R257-E261 IonicContact CZ-OE1 3.79Å; R257-E261 IonicContact NE-OE1 3.56Å; R257-E261 PolarHBondContact NE-OE1 3.4Å; R257-E261 IonicContact NH1-OE1 2.85Å; R257-E261 IonicContact NH2-OE1 2.95Å; R257-E261 PolarHBondContact NH2-OE1 3.45Å; R257-E261 IonicContact NH2-OE2 3.76Å; R257-E261 WeakPolarHBondContact O-CG 3.46Å; R257-E261 PolarHBondContact O-N 2.99Å
258Y93Very high88.9Confident12 Ų1235.4 Ų35.45%0.04718%0.178CC..Hα-helixtrans-62.2-39.5-179.8-59.4-54.7000112.6F9 I11 W255 M256 F260 E261 A262 I277 L281F9-Y258 HydrophobicContact CB-CE2 4.04Å; F9-Y258 HydrophobicContact CD1-CD1 4.11Å; F9-Y258 HydrophobicContact CD1-CD2 4.43Å; F9-Y258 AromaticContact CD1-CE1 3.52Å; F9-Y258 HydrophobicContact CD1-CE1 3.52Å; F9-Y258 AromaticContact CD1-CE2 3.9Å; F9-Y258 HydrophobicContact CD1-CE2 3.9Å; F9-Y258 AromaticContact CD1-CZ 3.4Å; F9-Y258 HydrophobicContact CD2-CD1 4.35Å; F9-Y258 HydrophobicContact CD2-CD2 4.08Å; F9-Y258 HydrophobicContact CD2-CE2 4.26Å; F9-Y258 HydrophobicContact CD2-CG 4.13Å; F9-Y258 AromaticContact CE1-CD1 3.66Å; F9-Y258 HydrophobicContact CE1-CD1 3.66Å; F9-Y258 AromaticContact CE1-CE1 3.28Å; F9-Y258 HydrophobicContact CE1-CE1 3.28Å; F9-Y258 HydrophobicContact CE1-CE2 4.43Å; F9-Y258 HydrophobicContact CE1-CG 4.37Å; F9-Y258 AromaticContact CE1-CZ 3.72Å; F9-Y258 AromaticContact CE2-CD1 3.93Å; F9-Y258 HydrophobicContact CE2-CD1 3.93Å; F9-Y258 HydrophobicContact CE2-CD2 4.38Å; F9-Y258 HydrophobicContact CE2-CE1 4.32Å; F9-Y258 AromaticContact CE2-CG 3.96Å; F9-Y258 HydrophobicContact CE2-CG 3.96Å; F9-Y258 HydrophobicContact CG-CD1 4.44Å; F9-Y258 HydrophobicContact CG-CD2 4.11Å; F9-Y258 HydrophobicContact CG-CE1 4.15Å; F9-Y258 AromaticContact CG-CE2 3.81Å; F9-Y258 HydrophobicContact CG-CE2 3.81Å; F9-Y258 HydrophobicContact CG-CG 4.42Å; F9-Y258 AromaticContact CG-CZ 3.83Å; F9-Y258 AromaticContact CZ-CD1 3.56Å; F9-Y258 HydrophobicContact CZ-CD1 3.56Å; F9-Y258 AromaticContact CZ-CE1 3.72Å; F9-Y258 HydrophobicContact CZ-CE1 3.72Å; F9-Y258 HydrophobicContact CZ-CG 4.08Å; I11-Y258 HydrophobicContact CD1-CD2 4.1Å; I11-Y258 HydrophobicContact CD1-CE2 4.15Å; I11-Y258 HydrophobicContact CG1-CE2 4.41Å; W255-Y258 HydrophobicContact CB-CD2 4.37Å; W255-Y258 WeakPolarHBondContact O-CD2 3.48Å; W255-Y258 PolarHBondContact O-N 3.26Å; M256-Y258 PolarHBondContact O-N 3.49Å; Y258-F260 VanDerWaalsContact C-N 3.34Å; Y258-E261 PolarHBondContact O-N 3.08Å; Y258-A262 WeakPolarHBondContact O-CB 3.48Å; Y258-A262 PolarHBondContact O-N 3.14Å; Y258-I277 WeakPolarHBondContact O-CG2 3.35Å; Y258-L281 HydrophobicContact CD2-CD2 4.34Å; Y258-L281 HydrophobicContact CG-CD2 4.48Å
259F94.9Very high89.2Confident9 Ų935.6 Ų35.64%0.03918%0.178CC..Hα-helixtrans-65.9-39.1174-73.6-84.6000111.8W38 L42 W227 W255 M256 R257 K263 L281 F286 L292W38-F259 HydrophobicContact CH2-CD2 4.3Å; W38-F259 HydrophobicContact CH2-CG 4.28Å; W38-F259 HydrophobicContact CZ2-CB 4.15Å; W38-F259 AromaticContact CZ2-CD1 3.92Å; W38-F259 HydrophobicContact CZ2-CD1 3.92Å; W38-F259 HydrophobicContact CZ2-CD2 4.28Å; W38-F259 HydrophobicContact CZ2-CE1 4.36Å; W38-F259 AromaticContact CZ2-CG 3.86Å; W38-F259 HydrophobicContact CZ2-CG 3.86Å; L42-F259 HydrophobicContact CD1-CE2 4.38Å; L42-F259 HydrophobicContact CD1-CZ 4.28Å; L42-F259 HydrophobicContact CD2-CE1 4.07Å; L42-F259 HydrophobicContact CD2-CE2 4.5Å; L42-F259 HydrophobicContact CD2-CZ 3.68Å; W227-F259 HydrophobicContact CH2-CB 3.8Å; W227-F259 HydrophobicContact CZ3-CB 3.73Å; W255-F259 HydrophobicContact CE3-CD2 4.28Å; W255-F259 HydrophobicContact CE3-CE2 4.05Å; W255-F259 HydrophobicContact CZ3-CD2 4.25Å; W255-F259 AromaticContact CZ3-CE2 3.97Å; W255-F259 HydrophobicContact CZ3-CE2 3.97Å; M256-F259 PolarHBondContact O-N 3.35Å; R257-F259 VanDerWaalsContact C-N 3.33Å; R257-F259 PolarHBondContact O-N 3.17Å; F259-K263 WeakPolarHBondContact O-CG 3.44Å; F259-K263 PolarHBondContact O-N 3.35Å; F259-K263 VanDerWaalsContact O-N 3.13Å; F259-L281 HydrophobicContact CD1-CD1 4.07Å; F259-L281 HydrophobicContact CD2-CD1 4.18Å; F259-L281 HydrophobicContact CD2-CD2 4.48Å; F259-L281 HydrophobicContact CE1-CD1 4.07Å; F259-L281 HydrophobicContact CE2-CD1 4.17Å; F259-L281 HydrophobicContact CE2-CD2 4.02Å; F259-L281 HydrophobicContact CG-CD1 4.13Å; F259-L281 HydrophobicContact CZ-CD1 4.12Å; F259-L281 HydrophobicContact CZ-CD2 4.35Å; F259-F286 HydrophobicContact CE2-CE2 4.45Å; F259-F286 HydrophobicContact CZ-CD2 4.33Å; F259-F286 HydrophobicContact CZ-CG 4.27Å; F259-L292 HydrophobicContact CD1-CD1 4.44Å; F259-L292 HydrophobicContact CE1-CD1 3.75Å; F259-L292 HydrophobicContact CZ-CD1 4.49Å
260F95Very high89.6Confident1 Ų137 Ų370%0.00418%0.184CC..Hα-helixtrans-63.6-49.3174.4161.6-97.1000111.9W230 L233 V234 I237 M243 L248 M256 R257 Y258 A262 K263 V264W230-F260 HydrophobicContact CB-CB 4.38Å; W230-F260 HydrophobicContact CB-CD2 4.45Å; W230-F260 HydrophobicContact CD2-CB 4.26Å; W230-F260 HydrophobicContact CD2-CG 4.41Å; W230-F260 HydrophobicContact CE3-CB 3.65Å; W230-F260 AromaticContact CE3-CD1 3.72Å; W230-F260 HydrophobicContact CE3-CD1 3.72Å; W230-F260 AromaticContact CE3-CD2 3.68Å; W230-F260 HydrophobicContact CE3-CD2 3.68Å; W230-F260 HydrophobicContact CE3-CE1 4.22Å; W230-F260 HydrophobicContact CE3-CE2 4.17Å; W230-F260 AromaticContact CE3-CG 3.39Å; W230-F260 HydrophobicContact CE3-CG 3.39Å; W230-F260 HydrophobicContact CE3-CZ 4.39Å; W230-F260 HydrophobicContact CZ3-CB 4.23Å; W230-F260 AromaticContact CZ3-CD1 3.61Å; W230-F260 HydrophobicContact CZ3-CD1 3.61Å; W230-F260 HydrophobicContact CZ3-CD2 4.37Å; W230-F260 AromaticContact CZ3-CE1 3.95Å; W230-F260 HydrophobicContact CZ3-CE1 3.95Å; W230-F260 AromaticContact CZ3-CG 3.82Å; W230-F260 HydrophobicContact CZ3-CG 3.82Å; W230-F260 HydrophobicContact CZ3-CZ 4.41Å; W230-F260 WeakPolarHBondContact O-CD2 3.33Å; L233-F260 HydrophobicContact CB-CE2 4.01Å; L233-F260 HydrophobicContact CD2-CE2 3.86Å; L233-F260 HydrophobicContact CD2-CZ 3.85Å; L233-F260 HydrophobicContact CG-CE2 3.86Å; L233-F260 HydrophobicContact CG-CZ 4.14Å; V234-F260 HydrophobicContact CG2-CD2 3.58Å; V234-F260 HydrophobicContact CG2-CE2 3.95Å; I237-F260 HydrophobicContact CD1-CE1 4.38Å; I237-F260 HydrophobicContact CD1-CE2 3.84Å; I237-F260 HydrophobicContact CD1-CZ 3.36Å; M243-F260 HydrophobicContact CE-CE1 4.41Å; L248-F260 HydrophobicContact CD1-CE1 3.57Å; L248-F260 HydrophobicContact CD1-CZ 3.91Å; M256-F260 PolarHBondContact O-N 3.15Å; R257-F260 CarbonylContact O-C 3.56Å; R257-F260 WeakPolarHBondContact O-CA 3.5Å; R257-F260 WeakPolarHBondContact O-CB 3.43Å; R257-F260 PolarHBondContact O-N 2.97Å; R257-F260 VanDerWaalsContact O-N 3.1Å; Y258-F260 VanDerWaalsContact C-N 3.34Å; F260-A262 VanDerWaalsContact C-N 3.34Å; F260-A262 PolarHBondContact O-N 3.35Å; F260-K263 PolarHBondContact O-N 3Å; F260-K263 VanDerWaalsContact O-N 3.15Å; F260-V264 HydrophobicContact CD2-CG2 4.1Å; F260-V264 HydrophobicContact CE1-CG2 4.19Å; F260-V264 HydrophobicContact CE2-CG2 3.73Å; F260-V264 HydrophobicContact CZ-CG2 3.81Å; F260-V264 WeakPolarHBondContact O-CG2 3.44Å; F260-V264 PolarHBondContact O-N 3.05Å
261E93.5Very high90.1Very high30 Ų3032.3 Ų32.314%0.1416%0.156CC..Hα-helixtrans-58.1-46.5178.2-70.5-178.9163.200111.1M243 R257 Y258 K263 V264 F265 I277M243-E261 HydrophobicContact CE-CB 4.08Å; M243-E261 HydrophobicContact CE-CG 3.58Å; R257-E261 HydrophobicContact CG-CG 4.17Å; R257-E261 IonicContact CZ-OE1 3.79Å; R257-E261 IonicContact NE-OE1 3.56Å; R257-E261 PolarHBondContact NE-OE1 3.4Å; R257-E261 IonicContact NH1-OE1 2.85Å; R257-E261 IonicContact NH2-OE1 2.95Å; R257-E261 PolarHBondContact NH2-OE1 3.45Å; R257-E261 IonicContact NH2-OE2 3.76Å; R257-E261 WeakPolarHBondContact O-CG 3.46Å; R257-E261 PolarHBondContact O-N 2.99Å; Y258-E261 PolarHBondContact O-N 3.08Å; E261-K263 VanDerWaalsContact C-N 3.32Å; E261-K263 PolarHBondContact O-N 3.49Å; E261-V264 PolarHBondContact O-N 3.03Å; E261-F265 HydrophobicContact CB-CD2 4.45Å; E261-F265 HydrophobicContact CB-CE2 4.11Å; E261-F265 WeakPolarHBondContact O-CB 3.45Å; E261-F265 WeakPolarHBondContact O-CD2 3.34Å; E261-F265 WeakPolarHBondContact O-CG 3.22Å; E261-F265 PolarHBondContact O-N 3.4Å; E261-I277 HydrophobicContact CB-CD1 3.98Å
262A95.3Very high90.7Very high1 Ų135.1 Ų35.11%0.00817%0.166CC..Hα-helixtrans-57.6-45176.100000111.9Y258 F260 F265 L266 I277 L278Y258-A262 WeakPolarHBondContact O-CB 3.48Å; Y258-A262 PolarHBondContact O-N 3.14Å; F260-A262 VanDerWaalsContact C-N 3.34Å; F260-A262 PolarHBondContact O-N 3.35Å; A262-F265 PolarHBondContact O-N 2.88Å; A262-L266 WeakPolarHBondContact O-CG 3.42Å; A262-L266 PolarHBondContact O-N 2.98Å; A262-I277 HydrophobicContact CB-CB 4.37Å; A262-I277 HydrophobicContact CB-CG2 4.06Å; A262-L278 HydrophobicContact CB-CD2 3.8Å; A262-L278 HydrophobicContact CB-CG 3.89Å
263K95.2Very high91.8Very high36 Ų3634.5 Ų34.516%0.15716%0.156CC..Hα-helixtrans-65.5-40.3177.8-77.4-171.6172.1-61.90113.2W227 V234 F259 F260 E261 L266 K267 E295W227-K263 HydrophobicContact CH2-CD 3.97Å; W227-K263 HydrophobicContact CZ2-CD 4.09Å; V234-K263 HydrophobicContact CG1-CB 4.14Å; V234-K263 HydrophobicContact CG2-CB 3.98Å; F259-K263 WeakPolarHBondContact O-CG 3.44Å; F259-K263 PolarHBondContact O-N 3.35Å; F259-K263 VanDerWaalsContact O-N 3.13Å; F260-K263 PolarHBondContact O-N 3Å; F260-K263 VanDerWaalsContact O-N 3.15Å; E261-K263 VanDerWaalsContact C-N 3.32Å; E261-K263 PolarHBondContact O-N 3.49Å; K263-L266 PolarHBondContact O-N 3.2Å; K263-K267 PolarHBondContact O-N 3.43Å; K263-E295 IonicContact NZ-OE1 2.63Å; K263-E295 PolarHBondContact NZ-OE1 2.95Å; K263-E295 IonicContact NZ-OE2 3.79Å; K263-E295 PolarHBondContact NZ-OE2 3.11Å
264V94.5Very high92.7Very high1 Ų127.5 Ų27.51%0.00612%0.123CC..Hα-helixtrans-63-45.4174.71730000110.2V234 I237 M243 F260 E261 L266 K267 L268V234-V264 HydrophobicContact CB-CG2 4.42Å; V234-V264 HydrophobicContact CG1-CG2 4.18Å; V234-V264 HydrophobicContact CG2-CG2 4.13Å; I237-V264 HydrophobicContact CB-CG1 4.46Å; I237-V264 HydrophobicContact CD1-CG1 4.38Å; I237-V264 HydrophobicContact CD1-CG2 3.74Å; I237-V264 HydrophobicContact CG2-CG1 3.83Å; M243-V264 HydrophobicContact SD-CB 4.38Å; M243-V264 HydrophobicContact SD-CG1 3.69Å; F260-V264 HydrophobicContact CD2-CG2 4.1Å; F260-V264 HydrophobicContact CE1-CG2 4.19Å; F260-V264 HydrophobicContact CE2-CG2 3.73Å; F260-V264 HydrophobicContact CZ-CG2 3.81Å; F260-V264 WeakPolarHBondContact O-CG2 3.44Å; F260-V264 PolarHBondContact O-N 3.05Å; E261-V264 PolarHBondContact O-N 3.03Å; V264-L266 PolarHBondContact O-N 3.39Å; V264-K267 WeakPolarHBondContact O-CB 3.4Å; V264-K267 PolarHBondContact O-N 3.29Å; V264-K267 VanDerWaalsContact O-N 3.16Å; V264-L268 HydrophobicContact CG1-CD1 3.82Å; V264-L268 HydrophobicContact CG1-CG 4.26Å; V264-L268 WeakPolarHBondContact O-CG 3.38Å; V264-L268 PolarHBondContact O-N 3.15Å
265F93.8Very high93.2Very high21 Ų2128.3 Ų28.39%0.09213%0.127CC..Hα-helixtrans-63.7-38.5177.8-68.2-40.2000112.8M243 E261 A262 K267 L268 H269 E270 R273 A274 I277M243-F265 HydrophobicContact CE-CE1 4.5Å; M243-F265 HydrophobicContact CE-CZ 4.18Å; M243-F265 HydrophobicContact SD-CE1 4.17Å; M243-F265 HydrophobicContact SD-CZ 4.4Å; E261-F265 HydrophobicContact CB-CD2 4.45Å; E261-F265 HydrophobicContact CB-CE2 4.11Å; E261-F265 WeakPolarHBondContact O-CB 3.45Å; E261-F265 WeakPolarHBondContact O-CD2 3.34Å; E261-F265 WeakPolarHBondContact O-CG 3.22Å; E261-F265 PolarHBondContact O-N 3.4Å; A262-F265 PolarHBondContact O-N 2.88Å; F265-K267 PolarHBondContact O-N 2.95Å; F265-L268 CarbonylContact O-C 3.26Å; F265-L268 PolarHBondContact O-N 3.5Å; F265-H269 PolarHBondContact O-N 3.23Å; F265-H269 VanDerWaalsContact O-N 3.14Å; F265-E270 HydrophobicContact CB-CB 4.15Å; F265-E270 HydrophobicContact CD1-CB 4.27Å; F265-E270 WeakPolarHBondContact CD1-OE2 3.31Å; F265-E270 VanDerWaalsContact CE1-OE2 3.29Å; F265-E270 WeakPolarHBondContact CE1-OE2 3.33Å; F265-E270 PolarHBondContact O-N 3.19Å; F265-R273 HydrophobicContact CD2-CB 4.14Å; F265-R273 HydrophobicContact CE2-CB 4.48Å; F265-R273 HydrophobicContact CG-CB 4.32Å; F265-A274 HydrophobicContact CB-CB 3.86Å; F265-I277 HydrophobicContact CD2-CD1 3.73Å; F265-I277 HydrophobicContact CE2-CD1 3.58Å
266L93.5Very high93.5Very high19 Ų1932.9 Ų32.910%0.09915%0.149CC..Hα-helixtrans-60.9-43.8171.6-71176.5000112A262 K263 V264 L268 H269 A274 L298 A299 E302A262-L266 WeakPolarHBondContact O-CG 3.42Å; A262-L266 PolarHBondContact O-N 2.98Å; K263-L266 PolarHBondContact O-N 3.2Å; V264-L266 PolarHBondContact O-N 3.39Å; L266-L268 VanDerWaalsContact C-N 3.32Å; L266-L268 PolarHBondContact O-N 3.32Å; L266-H269 PolarHBondContact O-N 2.91Å; L266-H269 VanDerWaalsContact O-N 3.15Å; L266-A274 HydrophobicContact CD2-CB 3.59Å; L266-A274 HydrophobicContact CG-CB 3.7Å; L266-L298 HydrophobicContact CD1-CB 4.33Å; L266-A299 HydrophobicContact CD2-CB 3.8Å; L266-E302 HydrophobicContact CD2-CG 4.28Å
267K91.7Very high93.6Very high39 Ų3933.6 Ų33.617%0.1715%0.153CC..Hα-helixtrans-64.5-35.5177.8-175.5-173.9178.9-159.60112.9V234 D235 I237 K263 V264 F265 H269V234-K267 HydrophobicContact CG1-CD 4.18Å; V234-K267 WeakPolarHBondContact O-CD 3.38Å; V234-K267 PolarHBondContact O-NZ 2.76Å; D235-K267 VanDerWaalsContact CA-NZ 3.34Å; D235-K267 PolarHBondContact O-NZ 2.96Å; I237-K267 PolarHBondContact O-NZ 3.45Å; K263-K267 PolarHBondContact O-N 3.43Å; V264-K267 WeakPolarHBondContact O-CB 3.4Å; V264-K267 PolarHBondContact O-N 3.29Å; V264-K267 VanDerWaalsContact O-N 3.16Å; F265-K267 PolarHBondContact O-N 2.95Å; K267-H269 PolarHBondContact O-N 2.66Å
268L91.3Very high93.8Very high27 Ų2731.1 Ų31.114%0.14114%0.143CC..THydrogen-bonded Turntrans-84.88.2177-62-179.7000113E238 K240 V264 F265 L266 E270E238-L268 WeakPolarHBondContact O-CD2 3.26Å; K240-L268 HydrophobicContact CB-CD1 4.49Å; V264-L268 HydrophobicContact CG1-CD1 3.82Å; V264-L268 HydrophobicContact CG1-CG 4.26Å; V264-L268 WeakPolarHBondContact O-CG 3.38Å; V264-L268 PolarHBondContact O-N 3.15Å; F265-L268 CarbonylContact O-C 3.26Å; F265-L268 PolarHBondContact O-N 3.5Å; L266-L268 VanDerWaalsContact C-N 3.32Å; L266-L268 PolarHBondContact O-N 3.32Å; L268-E270 VanDerWaalsContact C-N 3.25Å; L268-E270 HydrophobicContact CB-CG 4.34Å; L268-E270 PolarHBondContact O-N 3.3Å
269H90.7Very high93.9Very high30 Ų3033.6 Ų33.614%0.13916%0.157CC..THydrogen-bonded Turntrans56.730-176.6-52.6-70.3000116F265 L266 K267 G271 E302 H424 Y426 M456F265-H269 PolarHBondContact O-N 3.23Å; F265-H269 VanDerWaalsContact O-N 3.14Å; L266-H269 PolarHBondContact O-N 2.91Å; L266-H269 VanDerWaalsContact O-N 3.15Å; K267-H269 PolarHBondContact O-N 2.66Å; H269-G271 VanDerWaalsContact C-N 3.29Å; H269-G271 PolarHBondContact O-N 3.47Å; H269-E302 IonicContact CE1-OE2 3.48Å; H269-E302 IonicContact CG-OE2 3.34Å; H269-E302 IonicContact ND1-OE2 2.7Å; H269-E302 PolarHBondContact ND1-OE2 3.17Å; H269-H424 PolarHBondContact NE2-O 3.11Å; H269-Y426 AromaticContact CE1-CD1 3.53Å; H269-Y426 AromaticContact ND1-CD1 3.99Å; H269-Y426 AromaticContact NE2-CD1 3.77Å; H269-M456 HydrophobicContact CB-CG 4Å; H269-M456 HydrophobicContact CB-SD 3.26Å; H269-M456 WeakPolarHBondContact CB-SD 3.37Å
270E90.1Very high93.9Very high43 Ų4336.2 Ų36.220%0.20117%0.168CC..  trans-93.760.1174.3-60.4-179.3151.900110F265 L268 E272 R273 A274F265-E270 HydrophobicContact CB-CB 4.15Å; F265-E270 HydrophobicContact CD1-CB 4.27Å; F265-E270 WeakPolarHBondContact CD1-OE2 3.31Å; F265-E270 VanDerWaalsContact CE1-OE2 3.29Å; F265-E270 WeakPolarHBondContact CE1-OE2 3.33Å; F265-E270 PolarHBondContact O-N 3.19Å; L268-E270 VanDerWaalsContact C-N 3.25Å; L268-E270 HydrophobicContact CB-CG 4.34Å; L268-E270 PolarHBondContact O-N 3.3Å; E270-E272 VanDerWaalsContact C-N 3.28Å; E270-E272 PolarHBondContact O-N 3.34Å; E270-R273 PolarHBondContact O-N 3.21Å; E270-R273 IonicContact OE1-CZ 3.53Å; E270-R273 IonicContact OE1-NH1 3.8Å; E270-R273 PolarHBondContact OE1-NH1 3.06Å; E270-R273 IonicContact OE1-NH2 3.58Å; E270-R273 PolarHBondContact OE1-NH2 3.18Å; E270-R273 IonicContact OE2-CZ 2.65Å; E270-R273 IonicContact OE2-NE 3.89Å; E270-R273 IonicContact OE2-NH1 2.82Å; E270-R273 PolarHBondContact OE2-NH1 3.15Å; E270-R273 IonicContact OE2-NH2 3.55Å; E270-R273 PolarHBondContact OE2-NH2 3.47Å; E270-A274 PolarHBondContact O-N 2.9Å; E270-A274 VanDerWaalsContact O-N 3.11Å
271G90.5Very high93.9Very high5 Ų536.1 Ų36.15%0.05217%0.168CC..Hα-helixtrans-56.6-34-170.300000114.9H269 L275H269-G271 VanDerWaalsContact C-N 3.29Å; H269-G271 PolarHBondContact O-N 3.47Å; G271-L275 VanDerWaalsContact O-CB 3.25Å; G271-L275 WeakPolarHBondContact O-CB 3.45Å; G271-L275 PolarHBondContact O-N 3.3Å
272E92.9Very high93.8Very high155 Ų15536.1 Ų36.172%0.72417%0.171SC*.Hα-helixtrans-67.6-45.8-178.5-63.1-175.5164.600111.7E270 L275 E276 L303E270-E272 VanDerWaalsContact C-N 3.28Å; E270-E272 PolarHBondContact O-N 3.34Å; E272-L275 PolarHBondContact O-N 3.13Å; E272-E276 PolarHBondContact O-N 3.4Å; E272-L303 HydrophobicContact CB-CD2 4.42Å; E272-L303 HydrophobicContact CG-CD2 3.52Å
273R93.5Very high93.7Very high87 Ų8741.4 Ų41.433%0.32820%0.196SC..Hα-helixtrans-68.7-40177.7-80.9-175.2-87.8156.6-10.7111.7F265 E270 L275 E276 I277F265-R273 HydrophobicContact CD2-CB 4.14Å; F265-R273 HydrophobicContact CE2-CB 4.48Å; F265-R273 HydrophobicContact CG-CB 4.32Å; E270-R273 PolarHBondContact O-N 3.21Å; E270-R273 IonicContact OE1-CZ 3.53Å; E270-R273 IonicContact OE1-NH1 3.8Å; E270-R273 PolarHBondContact OE1-NH1 3.06Å; E270-R273 IonicContact OE1-NH2 3.58Å; E270-R273 PolarHBondContact OE1-NH2 3.18Å; E270-R273 IonicContact OE2-CZ 2.65Å; E270-R273 IonicContact OE2-NE 3.89Å; E270-R273 IonicContact OE2-NH1 2.82Å; E270-R273 PolarHBondContact OE2-NH1 3.15Å; E270-R273 IonicContact OE2-NH2 3.55Å; E270-R273 PolarHBondContact OE2-NH2 3.47Å; R273-L275 VanDerWaalsContact C-N 3.33Å; R273-E276 PolarHBondContact O-N 3.11Å; R273-I277 WeakPolarHBondContact O-CG1 3.31Å; R273-I277 PolarHBondContact O-N 3.17Å; R273-I277 VanDerWaalsContact O-N 3.14Å
274A96Very high93.4Very high0 Ų040.5 Ų40.50%019%0.194CC..Hα-helixtrans-57.7-49.4172.300000110.7F265 L266 E270 E276 I277 L278F265-A274 HydrophobicContact CB-CB 3.86Å; L266-A274 HydrophobicContact CD2-CB 3.59Å; L266-A274 HydrophobicContact CG-CB 3.7Å; E270-A274 PolarHBondContact O-N 2.9Å; E270-A274 VanDerWaalsContact O-N 3.11Å; A274-E276 PolarHBondContact O-N 3.03Å; A274-I277 PolarHBondContact O-N 2.67Å; A274-L278 WeakPolarHBondContact O-CB 3.31Å; A274-L278 WeakPolarHBondContact O-CD1 3.35Å; A274-L278 WeakPolarHBondContact O-CG 3.39Å; A274-L278 PolarHBondContact O-N 3.04Å
275L96.5Very high93.1Very high20 Ų2041.5 Ų41.511%0.10520%0.204CC..Hα-helixtrans-60.6-43.9179.3-176.864000111.8G271 E272 R273 I277 L278 L279 I296 A299 Y300 L303G271-L275 VanDerWaalsContact O-CB 3.25Å; G271-L275 WeakPolarHBondContact O-CB 3.45Å; G271-L275 PolarHBondContact O-N 3.3Å; E272-L275 PolarHBondContact O-N 3.13Å; R273-L275 VanDerWaalsContact C-N 3.33Å; L275-I277 PolarHBondContact O-N 2.88Å; L275-L278 PolarHBondContact O-N 3.32Å; L275-L279 HydrophobicContact CD1-CD1 4.08Å; L275-L279 HydrophobicContact CD1-CD2 4.44Å; L275-L279 HydrophobicContact CD1-CG 4Å; L275-L279 HydrophobicContact CD2-CD1 4.44Å; L275-L279 HydrophobicContact CG-CD1 3.87Å; L275-L279 HydrophobicContact CG-CG 4.2Å; L275-L279 WeakPolarHBondContact O-CB 3.44Å; L275-L279 VanDerWaalsContact O-CG 3.29Å; L275-L279 WeakPolarHBondContact O-CG 3.09Å; L275-L279 PolarHBondContact O-N 2.9Å; L275-I296 HydrophobicContact CD1-CG2 4.07Å; L275-A299 HydrophobicContact CB-CB 4.06Å; L275-A299 HydrophobicContact CD1-CB 4.1Å; L275-Y300 HydrophobicContact CD1-CD1 4.46Å; L275-Y300 HydrophobicContact CD1-CE1 4.03Å; L275-Y300 HydrophobicContact CD1-CE2 4.27Å; L275-Y300 HydrophobicContact CD2-CD1 4.06Å; L275-Y300 HydrophobicContact CD2-CE1 3.55Å; L275-Y300 HydrophobicContact CG-CE1 4.46Å; L275-L303 HydrophobicContact CB-CD1 4.33Å; L275-L303 HydrophobicContact CD2-CD1 3.69Å
276E96.2Very high93Very high100 Ų10040.5 Ų40.547%0.46720%0.2SC..Hα-helixtrans-56.7-47.8177.6-171.6-172.8169.100111.6E272 R273 A274 L279 K280E272-E276 PolarHBondContact O-N 3.4Å; R273-E276 PolarHBondContact O-N 3.11Å; A274-E276 PolarHBondContact O-N 3.03Å; E276-L279 PolarHBondContact O-N 3.07Å; E276-K280 HydrophobicContact CG-CD 4.47Å; E276-K280 WeakPolarHBondContact O-CG 3.48Å; E276-K280 PolarHBondContact O-N 3.25Å; E276-K280 WeakPolarHBondContact OE1-CE 3.4Å; E276-K280 IonicContact OE1-NZ 3.74Å; E276-K280 PolarHBondContact OE1-NZ 3.45Å
277I95.2Very high92.8Very high17 Ų1742.2 Ų42.29%0.08721%0.214CC..Hα-helixtrans-64.7-43.8178.5-65.9172.7000110.8F9 Y258 E261 A262 F265 R273 A274 L275 L279 K280 L281F9-I277 HydrophobicContact CE2-CG2 4.09Å; F9-I277 HydrophobicContact CZ-CG1 4.48Å; F9-I277 HydrophobicContact CZ-CG2 4.25Å; Y258-I277 WeakPolarHBondContact O-CG2 3.35Å; E261-I277 HydrophobicContact CB-CD1 3.98Å; A262-I277 HydrophobicContact CB-CB 4.37Å; A262-I277 HydrophobicContact CB-CG2 4.06Å; F265-I277 HydrophobicContact CD2-CD1 3.73Å; F265-I277 HydrophobicContact CE2-CD1 3.58Å; R273-I277 WeakPolarHBondContact O-CG1 3.31Å; R273-I277 PolarHBondContact O-N 3.17Å; R273-I277 VanDerWaalsContact O-N 3.14Å; A274-I277 PolarHBondContact O-N 2.67Å; L275-I277 PolarHBondContact O-N 2.88Å; I277-L279 PolarHBondContact O-N 3.44Å; I277-K280 PolarHBondContact O-N 3.19Å; I277-L281 HydrophobicContact CG2-CD1 4.05Å; I277-L281 HydrophobicContact CG2-CG 4.46Å; I277-L281 WeakPolarHBondContact O-CB 3.36Å; I277-L281 WeakPolarHBondContact O-CG 3.32Å; I277-L281 PolarHBondContact O-N 2.84Å
278L96.6Very high92.8Very high1 Ų146.9 Ų46.91%0.00523%0.23CC..Hα-helixtrans-65.4-38.5-179-68.1167.2000112.4A262 A274 L275 L281 S282 L292 E295 I296 A299A262-L278 HydrophobicContact CB-CD2 3.8Å; A262-L278 HydrophobicContact CB-CG 3.89Å; A274-L278 WeakPolarHBondContact O-CB 3.31Å; A274-L278 WeakPolarHBondContact O-CD1 3.35Å; A274-L278 WeakPolarHBondContact O-CG 3.39Å; A274-L278 PolarHBondContact O-N 3.04Å; L275-L278 PolarHBondContact O-N 3.32Å; L278-L281 PolarHBondContact O-N 2.93Å; L278-S282 WeakPolarHBondContact O-CB 3.02Å; L278-S282 PolarHBondContact O-N 3.14Å; L278-L292 HydrophobicContact CB-CD1 4.4Å; L278-L292 HydrophobicContact CD2-CD1 3.49Å; L278-L292 VanDerWaalsContact CD2-CD1 3.49Å; L278-E295 HydrophobicContact CD1-CB 3.9Å; L278-E295 HydrophobicContact CD2-CB 3.71Å; L278-E295 HydrophobicContact CD2-CG 4.46Å; L278-E295 HydrophobicContact CG-CB 4.48Å; L278-I296 HydrophobicContact CB-CG1 3.74Å; L278-I296 HydrophobicContact CD1-CG1 4.4Å; L278-A299 HydrophobicContact CD1-CB 4.03Å
279L95.8Very high92.9Very high64 Ų6445.6 Ų45.634%0.33522%0.224SC..Hα-helixtrans-67.8-43.9175-69.7176.3000111.2L275 E276 I277 L281 S282 E283 I296L275-L279 HydrophobicContact CD1-CD1 4.08Å; L275-L279 HydrophobicContact CD1-CD2 4.44Å; L275-L279 HydrophobicContact CD1-CG 4Å; L275-L279 HydrophobicContact CD2-CD1 4.44Å; L275-L279 HydrophobicContact CG-CD1 3.87Å; L275-L279 HydrophobicContact CG-CG 4.2Å; L275-L279 WeakPolarHBondContact O-CB 3.44Å; L275-L279 VanDerWaalsContact O-CG 3.29Å; L275-L279 WeakPolarHBondContact O-CG 3.09Å; L275-L279 PolarHBondContact O-N 2.9Å; E276-L279 PolarHBondContact O-N 3.07Å; I277-L279 PolarHBondContact O-N 3.44Å; L279-L281 VanDerWaalsContact C-N 3.29Å; L279-L281 PolarHBondContact O-N 2.95Å; L279-S282 WeakPolarHBondContact O-CB 3.43Å; L279-S282 PolarHBondContact O-N 3.46Å; L279-S282 VanDerWaalsContact O-N 3.09Å; L279-E283 WeakPolarHBondContact O-CG 3.44Å; L279-E283 PolarHBondContact O-N 2.98Å; L279-I296 HydrophobicContact CD2-CD1 4.49Å
280K94.7Very high93.1Very high63 Ų6345.2 Ų45.227%0.27422%0.222SC..Hα-helixtrans-60.4-37.9173.4-73.1179.1-175.2170.90112.4F9 E276 I277 S284F9-K280 HydrophobicContact CD2-CB 3.77Å; F9-K280 HydrophobicContact CE1-CD 4.41Å; F9-K280 HydrophobicContact CE2-CB 3.51Å; F9-K280 HydrophobicContact CE2-CD 4.22Å; F9-K280 HydrophobicContact CZ-CB 4.17Å; F9-K280 HydrophobicContact CZ-CD 4.01Å; E276-K280 HydrophobicContact CG-CD 4.47Å; E276-K280 WeakPolarHBondContact O-CG 3.48Å; E276-K280 PolarHBondContact O-N 3.25Å; E276-K280 WeakPolarHBondContact OE1-CE 3.4Å; E276-K280 IonicContact OE1-NZ 3.74Å; E276-K280 PolarHBondContact OE1-NZ 3.45Å; I277-K280 PolarHBondContact O-N 3.19Å; K280-S284 WeakPolarHBondContact O-CB 3.48Å; K280-S284 PolarHBondContact O-N 3.31Å
281L93.7Very high93.3Very high0 Ų044 Ų440%022%0.217CC..Hα-helixtrans-65.1-43.2172.5-77170.7000111.5F9 I11 Y258 F259 I277 L278 L279 E283 S284 F286 L292F9-L281 HydrophobicContact CD2-CD2 4.17Å; F9-L281 HydrophobicContact CD2-CG 4.28Å; F9-L281 HydrophobicContact CE2-CG 4.22Å; I11-L281 HydrophobicContact CD1-CD2 4.17Å; Y258-L281 HydrophobicContact CD2-CD2 4.34Å; Y258-L281 HydrophobicContact CG-CD2 4.48Å; F259-L281 HydrophobicContact CD1-CD1 4.07Å; F259-L281 HydrophobicContact CD2-CD1 4.18Å; F259-L281 HydrophobicContact CD2-CD2 4.48Å; F259-L281 HydrophobicContact CE1-CD1 4.07Å; F259-L281 HydrophobicContact CE2-CD1 4.17Å; F259-L281 HydrophobicContact CE2-CD2 4.02Å; F259-L281 HydrophobicContact CG-CD1 4.13Å; F259-L281 HydrophobicContact CZ-CD1 4.12Å; F259-L281 HydrophobicContact CZ-CD2 4.35Å; I277-L281 HydrophobicContact CG2-CD1 4.05Å; I277-L281 HydrophobicContact CG2-CG 4.46Å; I277-L281 WeakPolarHBondContact O-CB 3.36Å; I277-L281 WeakPolarHBondContact O-CG 3.32Å; I277-L281 PolarHBondContact O-N 2.84Å; L278-L281 PolarHBondContact O-N 2.93Å; L279-L281 VanDerWaalsContact C-N 3.29Å; L279-L281 PolarHBondContact O-N 2.95Å; L281-E283 VanDerWaalsContact C-N 3.33Å; L281-E283 PolarHBondContact O-N 3.14Å; L281-S284 WeakPolarHBondContact CA-OG 3.37Å; L281-S284 PolarHBondContact O-N 3.49Å; L281-S284 PolarHBondContact O-OG 3.25Å; L281-F286 HydrophobicContact CB-CD2 4.5Å; L281-F286 HydrophobicContact CD2-CD2 4.19Å; L281-F286 HydrophobicContact CD2-CE2 4.26Å; L281-F286 WeakPolarHBondContact O-CD2 3.38Å; L281-F286 PolarHBondContact O-N 2.92Å; L281-L292 HydrophobicContact CB-CD1 4.07Å; L281-L292 HydrophobicContact CB-CD2 4.29Å; L281-L292 HydrophobicContact CD1-CD1 4.27Å
282S93.3Very high93.6Very high29 Ų2943.9 Ų43.920%0.20322%0.215CC..Iπ-helixtrans-58.5-46.1176.3178.10000111.5L278 L279 S284 G285 S287L278-S282 WeakPolarHBondContact O-CB 3.02Å; L278-S282 PolarHBondContact O-N 3.14Å; L279-S282 WeakPolarHBondContact O-CB 3.43Å; L279-S282 PolarHBondContact O-N 3.46Å; L279-S282 VanDerWaalsContact O-N 3.09Å; S282-S284 VanDerWaalsContact C-N 3.32Å; S282-S284 PolarHBondContact O-N 3.47Å; S282-G285 PolarHBondContact O-N 3.39Å; S282-S287 WeakPolarHBondContact O-CB 3.36Å; S282-S287 PolarHBondContact O-N 3.35Å; S282-S287 WeakPolarHBondContact OG-CA 3.11Å; S282-S287 VanDerWaalsContact OG-CB 3.3Å; S282-S287 WeakPolarHBondContact OG-CB 3.42Å
283E91.7Very high93.7Very high112 Ų11238.5 Ų38.552%0.52319%0.19SC..Iπ-helixtrans-67-30.3177.4-70175.9-179.100113.3I7 L279 L281 G285I7-E283 VanDerWaalsContact CB-OE2 3.28Å; I7-E283 WeakPolarHBondContact CB-OE2 3.49Å; I7-E283 WeakPolarHBondContact CG2-OE2 3.44Å; L279-E283 WeakPolarHBondContact O-CG 3.44Å; L279-E283 PolarHBondContact O-N 2.98Å; L281-E283 VanDerWaalsContact C-N 3.33Å; L281-E283 PolarHBondContact O-N 3.14Å; E283-G285 PolarHBondContact O-N 2.89Å
284S90Very high93.9Very high17 Ų1734.3 Ų34.312%0.11917%0.174CC..Iπ-helixtrans-69.5-11.417772.30000114.1L13 K280 L281 S282 F286L13-S284 VanDerWaalsContact CD2-O 3.24Å; L13-S284 WeakPolarHBondContact CD2-O 3.49Å; K280-S284 WeakPolarHBondContact O-CB 3.48Å; K280-S284 PolarHBondContact O-N 3.31Å; L281-S284 WeakPolarHBondContact CA-OG 3.37Å; L281-S284 PolarHBondContact O-N 3.49Å; L281-S284 PolarHBondContact O-OG 3.25Å; S282-S284 VanDerWaalsContact C-N 3.32Å; S282-S284 PolarHBondContact O-N 3.47Å; S284-F286 WeakPolarHBondContact OG-CD2 3.28Å
285G87.8Confident93.9Very high22 Ų2235.5 Ų35.523%0.22718%0.179CC..Iπ-helixtrans131.5-4.2176.500000115S282 E283S282-G285 PolarHBondContact O-N 3.39Å; E283-G285 PolarHBondContact O-N 2.89Å
286F91.1Very high94Very high0 Ų034.9 Ų34.90%018%0.176CC..Iπ-helixtrans-92.110.7-178.5-59.2-73.6000113.9I11 V16 L42 L46 W255 F259 L281 S284 R288 S289 L292I11-F286 HydrophobicContact CD1-CE2 4.29Å; V16-F286 HydrophobicContact CG1-CE1 4.05Å; V16-F286 HydrophobicContact CG1-CZ 3.83Å; L42-F286 HydrophobicContact CD2-CD1 3.85Å; L42-F286 HydrophobicContact CD2-CE1 4.32Å; L46-F286 HydrophobicContact CD2-CD1 4.03Å; L46-F286 HydrophobicContact CD2-CE1 3.78Å; L46-F286 HydrophobicContact CD2-CZ 4.43Å; L46-F286 HydrophobicContact CG-CE1 4.37Å; W255-F286 HydrophobicContact CE3-CZ 4.35Å; F259-F286 HydrophobicContact CE2-CE2 4.45Å; F259-F286 HydrophobicContact CZ-CD2 4.33Å; F259-F286 HydrophobicContact CZ-CG 4.27Å; L281-F286 HydrophobicContact CB-CD2 4.5Å; L281-F286 HydrophobicContact CD2-CD2 4.19Å; L281-F286 HydrophobicContact CD2-CE2 4.26Å; L281-F286 WeakPolarHBondContact O-CD2 3.38Å; L281-F286 PolarHBondContact O-N 2.92Å; S284-F286 WeakPolarHBondContact OG-CD2 3.28Å; F286-R288 PolarHBondContact O-N 3.18Å; F286-S289 VanDerWaalsContact O-CB 3.32Å; F286-S289 WeakPolarHBondContact O-CB 3.49Å; F286-S289 PolarHBondContact O-N 2.98Å; F286-L292 HydrophobicContact CB-CD2 3.7Å; F286-L292 WeakPolarHBondContact O-CD2 3.25Å
287S89.7Confident94Very high56 Ų5630.1 Ų30.139%0.39215%0.154SC..THydrogen-bonded Turntrans-55.7-26.2-175.3590000115.4S282 Q293S282-S287 WeakPolarHBondContact O-CB 3.36Å; S282-S287 PolarHBondContact O-N 3.35Å; S282-S287 WeakPolarHBondContact OG-CA 3.11Å; S282-S287 VanDerWaalsContact OG-CB 3.3Å; S282-S287 WeakPolarHBondContact OG-CB 3.42Å; S287-Q293 PolarHBondContact O-NE2 3.42Å
288R91.2Very high94.1Very high136 Ų13630.8 Ų30.851%0.51316%0.157SC..THydrogen-bonded Turntrans-87.5-5.4177.6-66.7-177.9178.5-179.71114.1N47 F286 H290N47-R288 PolarHBondContact ND2-NH1 3.45Å; F286-R288 PolarHBondContact O-N 3.18Å; R288-H290 PolarHBondContact O-N 3.32Å
289S94.3Very high94Very high0 Ų030.7 Ų30.70%016%0.157CC..  trans-70119.5178.5167.10000109.2D41 S45 F286 N291 L292 Q293D41-S289 PolarHBondContact OD2-OG 3.43Å; S45-S289 VanDerWaalsContact CB-N 3.26Å; F286-S289 VanDerWaalsContact O-CB 3.32Å; F286-S289 WeakPolarHBondContact O-CB 3.49Å; F286-S289 PolarHBondContact O-N 2.98Å; S289-N291 PolarHBondContact O-N 3.43Å; S289-N291 PolarHBondContact OG-N 3.25Å; S289-L292 PolarHBondContact O-N 3Å; S289-L292 PolarHBondContact OG-N 3.2Å; S289-L292 VanDerWaalsContact OG-N 3.15Å; S289-Q293 WeakPolarHBondContact O-CB 3.36Å; S289-Q293 VanDerWaalsContact O-CG 3.29Å; S289-Q293 WeakPolarHBondContact O-CG 3.45Å; S289-Q293 PolarHBondContact O-N 2.75Å
290H94.9Very high94.1Very high23 Ų2329.7 Ų29.711%0.10615%0.149CC..Hα-helixtrans-65.8-33.8178.1-58.6105.4000111.1D41 W44 R288 A294 L316D41-H290 IonicContact OD1-CG 2.9Å; D41-H290 PolarHBondContact OD1-N 3.5Å; D41-H290 IonicContact OD1-ND1 3.21Å; D41-H290 PolarHBondContact OD1-ND1 2.89Å; D41-H290 VanDerWaalsContact OD1-ND1 3.12Å; D41-H290 PolarHBondContact OD2-N 3.31Å; W44-H290 AromaticContact CH2-CE1 3.88Å; W44-H290 AromaticContact CZ3-CE1 3.33Å; W44-H290 WeakPolarHBondContact CZ3-CE1 3.32Å; R288-H290 PolarHBondContact O-N 3.32Å; H290-A294 WeakPolarHBondContact O-CB 3.38Å; H290-A294 PolarHBondContact O-N 3.41Å; H290-L316 HydrophobicContact CB-CD1 3.77Å
291N94.4Very high94.1Very high18 Ų1827.7 Ų27.710%0.09614%0.142CC..Hα-helixtrans-63.6-48.7174-68.3-38.2000110.8D41 S289 Q293 A294 E295 R323D41-N291 WeakPolarHBondContact CB-ND2 3.28Å; D41-N291 WeakPolarHBondContact OD2-CB 3.45Å; D41-N291 PolarHBondContact OD2-N 2.94Å; D41-N291 PolarHBondContact OD2-ND2 3.36Å; D41-N291 VanDerWaalsContact OD2-ND2 3.14Å; S289-N291 PolarHBondContact O-N 3.43Å; S289-N291 PolarHBondContact OG-N 3.25Å; N291-Q293 PolarHBondContact O-N 2.81Å; N291-A294 WeakPolarHBondContact O-CB 3.31Å; N291-A294 PolarHBondContact O-N 3.07Å; N291-A294 VanDerWaalsContact O-N 3.17Å; N291-E295 WeakPolarHBondContact O-CG 3.5Å; N291-E295 PolarHBondContact O-N 3.32Å; N291-R323 PolarHBondContact OD1-NH1 3.48Å; N291-R323 PolarHBondContact OD1-NH2 2.88Å
292L95.6Very high94Very high2 Ų229.3 Ų29.31%0.0115%0.149CC..Hα-helixtrans-60.4-45177-175.974.2000111.7F259 L278 L281 F286 S289 A294 E295 I296F259-L292 HydrophobicContact CD1-CD1 4.44Å; F259-L292 HydrophobicContact CE1-CD1 3.75Å; F259-L292 HydrophobicContact CZ-CD1 4.49Å; L278-L292 HydrophobicContact CB-CD1 4.4Å; L278-L292 HydrophobicContact CD2-CD1 3.49Å; L278-L292 VanDerWaalsContact CD2-CD1 3.49Å; L281-L292 HydrophobicContact CB-CD1 4.07Å; L281-L292 HydrophobicContact CB-CD2 4.29Å; L281-L292 HydrophobicContact CD1-CD1 4.27Å; F286-L292 HydrophobicContact CB-CD2 3.7Å; F286-L292 WeakPolarHBondContact O-CD2 3.25Å; S289-L292 PolarHBondContact O-N 3Å; S289-L292 PolarHBondContact OG-N 3.2Å; S289-L292 VanDerWaalsContact OG-N 3.15Å; L292-A294 PolarHBondContact O-N 2.92Å; L292-E295 PolarHBondContact O-N 3.22Å; L292-E295 VanDerWaalsContact O-N 3.11Å; L292-I296 HydrophobicContact CG-CD1 4.26Å; L292-I296 WeakPolarHBondContact O-CG1 3.46Å; L292-I296 PolarHBondContact O-N 2.81Å
293Q96.6Very high93.9Very high41 Ų4130.8 Ų30.819%0.19215%0.154CC..Hα-helixtrans-59.6-36176.7-73.7175.6-7.300112.6S287 S289 N291 G297 Q312 L316S287-Q293 PolarHBondContact O-NE2 3.42Å; S289-Q293 WeakPolarHBondContact O-CB 3.36Å; S289-Q293 VanDerWaalsContact O-CG 3.29Å; S289-Q293 WeakPolarHBondContact O-CG 3.45Å; S289-Q293 PolarHBondContact O-N 2.75Å; N291-Q293 PolarHBondContact O-N 2.81Å; Q293-G297 PolarHBondContact O-N 2.85Å; Q293-G297 VanDerWaalsContact O-N 3.1Å; Q293-Q312 PolarHBondContact O-NE2 2.78Å; Q293-L316 HydrophobicContact CB-CD1 4.16Å
294A96.7Very high93.7Very high0 Ų028.8 Ų28.80%014%0.142CC..Hα-helixtrans-65.9-45.7172.600000111.7H290 N291 L292 I296 G297 L298 L316 N326H290-A294 WeakPolarHBondContact O-CB 3.38Å; H290-A294 PolarHBondContact O-N 3.41Å; N291-A294 WeakPolarHBondContact O-CB 3.31Å; N291-A294 PolarHBondContact O-N 3.07Å; N291-A294 VanDerWaalsContact O-N 3.17Å; L292-A294 PolarHBondContact O-N 2.92Å; A294-I296 VanDerWaalsContact C-N 3.29Å; A294-I296 PolarHBondContact O-N 3.33Å; A294-G297 WeakPolarHBondContact O-CA 3.34Å; A294-G297 PolarHBondContact O-N 3.2Å; A294-G297 VanDerWaalsContact O-N 3.08Å; A294-L298 WeakPolarHBondContact O-CG 3.41Å; A294-L298 PolarHBondContact O-N 3.26Å; A294-L316 HydrophobicContact CB-CD2 3.68Å; A294-N326 VanDerWaalsContact CB-ND2 3.32Å; A294-N326 WeakPolarHBondContact CB-ND2 3.44Å
295E96.7Very high93.8Very high24 Ų2429.5 Ų29.511%0.11215%0.149CC..Hα-helixtrans-61.7-37176.6-58.7-62.5140.300111.7K263 L278 N291 L292 G297 L298 A299K263-E295 IonicContact NZ-OE1 2.63Å; K263-E295 PolarHBondContact NZ-OE1 2.95Å; K263-E295 IonicContact NZ-OE2 3.79Å; K263-E295 PolarHBondContact NZ-OE2 3.11Å; L278-E295 HydrophobicContact CD1-CB 3.9Å; L278-E295 HydrophobicContact CD2-CB 3.71Å; L278-E295 HydrophobicContact CD2-CG 4.46Å; L278-E295 HydrophobicContact CG-CB 4.48Å; N291-E295 WeakPolarHBondContact O-CG 3.5Å; N291-E295 PolarHBondContact O-N 3.32Å; L292-E295 PolarHBondContact O-N 3.22Å; L292-E295 VanDerWaalsContact O-N 3.11Å; E295-G297 VanDerWaalsContact C-N 3.32Å; E295-L298 WeakPolarHBondContact O-CB 3.49Å; E295-L298 PolarHBondContact O-N 3.47Å; E295-A299 PolarHBondContact O-N 2.92Å
296I97.4Very high94Very high7 Ų730.3 Ų30.34%0.03615%0.147CC..Hα-helixtrans-61.9-42.6172.6-67.2168000110.4L275 L278 L279 L292 A294 L298 A299 Y300 Q312L275-I296 HydrophobicContact CD1-CG2 4.07Å; L278-I296 HydrophobicContact CB-CG1 3.74Å; L278-I296 HydrophobicContact CD1-CG1 4.4Å; L279-I296 HydrophobicContact CD2-CD1 4.49Å; L292-I296 HydrophobicContact CG-CD1 4.26Å; L292-I296 WeakPolarHBondContact O-CG1 3.46Å; L292-I296 PolarHBondContact O-N 2.81Å; A294-I296 VanDerWaalsContact C-N 3.29Å; A294-I296 PolarHBondContact O-N 3.33Å; I296-L298 VanDerWaalsContact C-N 3.35Å; I296-A299 WeakPolarHBondContact O-CB 3.44Å; I296-A299 PolarHBondContact O-N 2.83Å; I296-Y300 HydrophobicContact CG2-CD2 3.82Å; I296-Y300 HydrophobicContact CG2-CE2 3.42Å; I296-Y300 VanDerWaalsContact CG2-CE2 3.42Å; I296-Y300 VanDerWaalsContact O-CD2 3.27Å; I296-Y300 WeakPolarHBondContact O-CD2 3.45Å; I296-Y300 PolarHBondContact O-N 3.33Å; I296-Q312 HydrophobicContact CG2-CG 4.12Å
297G96.7Very high94.2Very high0 Ų036.5 Ų36.50%018%0.176CC..Hα-helixtrans-61.2-41.7174.200000112.7Q293 A294 E295 Y300 N301Q293-G297 PolarHBondContact O-N 2.85Å; Q293-G297 VanDerWaalsContact O-N 3.1Å; A294-G297 WeakPolarHBondContact O-CA 3.34Å; A294-G297 PolarHBondContact O-N 3.2Å; A294-G297 VanDerWaalsContact O-N 3.08Å; E295-G297 VanDerWaalsContact C-N 3.32Å; G297-Y300 PolarHBondContact O-N 3.24Å; G297-N301 WeakPolarHBondContact O-CB 3.35Å; G297-N301 PolarHBondContact O-N 3.12Å
298L96.4Very high94.5Very high31 Ų3138.1 Ų38.116%0.16218%0.18CC..Hα-helixtrans-62.4-42.8173.6-65.6175.3000111.4L266 A294 E295 I296 Y300 N301 E302 F313 T329L266-L298 HydrophobicContact CD1-CB 4.33Å; A294-L298 WeakPolarHBondContact O-CG 3.41Å; A294-L298 PolarHBondContact O-N 3.26Å; E295-L298 WeakPolarHBondContact O-CB 3.49Å; E295-L298 PolarHBondContact O-N 3.47Å; I296-L298 VanDerWaalsContact C-N 3.35Å; L298-Y300 PolarHBondContact O-N 3.27Å; L298-N301 WeakPolarHBondContact O-CB 3.41Å; L298-N301 PolarHBondContact O-N 3.26Å; L298-E302 WeakPolarHBondContact O-CG 3.42Å; L298-E302 PolarHBondContact O-N 3.02Å; L298-F313 HydrophobicContact CD2-CZ 4.18Å; L298-F313 HydrophobicContact CG-CZ 4.45Å; L298-T329 HydrophobicContact CD2-CG2 3.63Å; L298-T329 WeakPolarHBondContact CD2-OG1 3.2Å
299A96.5Very high94.8Very high0 Ų031.6 Ų31.60%016%0.155CC..Hα-helixtrans-61.2-45.2176.900000112.2L266 L275 L278 E295 I296 N301 E302 L303L266-A299 HydrophobicContact CD2-CB 3.8Å; L275-A299 HydrophobicContact CB-CB 4.06Å; L275-A299 HydrophobicContact CD1-CB 4.1Å; L278-A299 HydrophobicContact CD1-CB 4.03Å; E295-A299 PolarHBondContact O-N 2.92Å; I296-A299 WeakPolarHBondContact O-CB 3.44Å; I296-A299 PolarHBondContact O-N 2.83Å; A299-N301 VanDerWaalsContact C-N 3.29Å; A299-N301 PolarHBondContact O-N 3.16Å; A299-E302 PolarHBondContact O-N 3.49Å; A299-L303 WeakPolarHBondContact O-CB 3.41Å; A299-L303 VanDerWaalsContact O-CG 3.32Å; A299-L303 WeakPolarHBondContact O-CG 3.48Å; A299-L303 PolarHBondContact O-N 3.15Å
300Y96.6Very high95Very high42 Ų4233.3 Ų33.317%0.16516%0.163CC..Hα-helixtrans-63.2-35.3174.5-73.9-53.6000112.9L275 I296 G297 L298 L303 R304 A305 L308 Q312L275-Y300 HydrophobicContact CD1-CD1 4.46Å; L275-Y300 HydrophobicContact CD1-CE1 4.03Å; L275-Y300 HydrophobicContact CD1-CE2 4.27Å; L275-Y300 HydrophobicContact CD2-CD1 4.06Å; L275-Y300 HydrophobicContact CD2-CE1 3.55Å; L275-Y300 HydrophobicContact CG-CE1 4.46Å; I296-Y300 HydrophobicContact CG2-CD2 3.82Å; I296-Y300 HydrophobicContact CG2-CE2 3.42Å; I296-Y300 VanDerWaalsContact CG2-CE2 3.42Å; I296-Y300 VanDerWaalsContact O-CD2 3.27Å; I296-Y300 WeakPolarHBondContact O-CD2 3.45Å; I296-Y300 PolarHBondContact O-N 3.33Å; G297-Y300 PolarHBondContact O-N 3.24Å; L298-Y300 PolarHBondContact O-N 3.27Å; Y300-L303 CarbonylContact O-C 3.01Å; Y300-L303 PolarHBondContact O-N 3.33Å; Y300-R304 PolarHBondContact O-N 3.49Å; Y300-R304 VanDerWaalsContact O-N 3.12Å; Y300-A305 HydrophobicContact CD1-CB 4.29Å; Y300-A305 PolarHBondContact O-N 3.32Å; Y300-L308 HydrophobicContact CD1-CB 3.92Å; Y300-L308 HydrophobicContact CD1-CD1 4.08Å; Y300-L308 HydrophobicContact CD2-CB 4.31Å; Y300-L308 HydrophobicContact CE1-CB 4.18Å; Y300-L308 HydrophobicContact CE1-CD1 3.81Å; Y300-L308 HydrophobicContact CG-CB 4.01Å; Y300-Q312 HydrophobicContact CD2-CB 4.28Å; Y300-Q312 HydrophobicContact CD2-CG 4.48Å
301N94.4Very high95.1Very high22 Ų2238.3 Ų38.312%0.11818%0.184CC..Hα-helixtrans-66.5-43.7175.5178.970.2000111.9G297 L298 A299 L303 R304 A309 V333G297-N301 WeakPolarHBondContact O-CB 3.35Å; G297-N301 PolarHBondContact O-N 3.12Å; L298-N301 WeakPolarHBondContact O-CB 3.41Å; L298-N301 PolarHBondContact O-N 3.26Å; A299-N301 VanDerWaalsContact C-N 3.29Å; A299-N301 PolarHBondContact O-N 3.16Å; N301-L303 VanDerWaalsContact C-N 3.29Å; N301-L303 PolarHBondContact O-N 3.11Å; N301-R304 WeakPolarHBondContact O-CA 3.4Å; N301-R304 PolarHBondContact O-N 3.27Å; N301-A309 HydrophobicContact CB-CB 4.4Å; N301-V333 HydrophobicContact CB-CG2 4.24Å; N301-V333 WeakPolarHBondContact OD1-CG2 3.48Å
302E91.3Very high95.2Very high33 Ų3338.9 Ų38.915%0.15419%0.186CC..Hα-helixtrans-62.6-37.2174.3-68.5-55122.700111.9L266 H269 L298 A299 R304L266-E302 HydrophobicContact CD2-CG 4.28Å; H269-E302 IonicContact CE1-OE2 3.48Å; H269-E302 IonicContact CG-OE2 3.34Å; H269-E302 IonicContact ND1-OE2 2.7Å; H269-E302 PolarHBondContact ND1-OE2 3.17Å; L298-E302 WeakPolarHBondContact O-CG 3.42Å; L298-E302 PolarHBondContact O-N 3.02Å; A299-E302 PolarHBondContact O-N 3.49Å; E302-R304 PolarHBondContact O-N 3.39Å
303L91.4Very high95.3Very high60 Ų6039 Ų3931%0.31419%0.187SC..THydrogen-bonded Turntrans-73.3-2.4172.3-68.9176.1000114.1E272 L275 A299 Y300 N301 A305E272-L303 HydrophobicContact CB-CD2 4.42Å; E272-L303 HydrophobicContact CG-CD2 3.52Å; L275-L303 HydrophobicContact CB-CD1 4.33Å; L275-L303 HydrophobicContact CD2-CD1 3.69Å; A299-L303 WeakPolarHBondContact O-CB 3.41Å; A299-L303 VanDerWaalsContact O-CG 3.32Å; A299-L303 WeakPolarHBondContact O-CG 3.48Å; A299-L303 PolarHBondContact O-N 3.15Å; Y300-L303 CarbonylContact O-C 3.01Å; Y300-L303 PolarHBondContact O-N 3.33Å; N301-L303 VanDerWaalsContact C-N 3.29Å; N301-L303 PolarHBondContact O-N 3.11Å; L303-A305 PolarHBondContact O-N 2.98Å; L303-A305 VanDerWaalsContact O-N 3.08Å
304R88.9Confident95.4Very high71 Ų7140.6 Ų40.627%0.26819%0.193SC..THydrogen-bonded Turntrans57.421.7-177.7-71.6-100.2-90.4-78.9-19.4114.2Y300 N301 E302 M306 Y426 D459Y300-R304 PolarHBondContact O-N 3.49Å; Y300-R304 VanDerWaalsContact O-N 3.12Å; N301-R304 WeakPolarHBondContact O-CA 3.4Å; N301-R304 PolarHBondContact O-N 3.27Å; E302-R304 PolarHBondContact O-N 3.39Å; R304-M306 VanDerWaalsContact CD-CE 3.44Å; R304-M306 HydrophobicContact CG-CE 4.35Å; R304-M306 PolarHBondContact O-N 3.12Å; R304-Y426 PolarHBondContact NH1-OH 3.43Å; R304-D459 IonicContact CZ-OD1 3.78Å; R304-D459 IonicContact CZ-OD2 3.77Å; R304-D459 IonicContact NH1-OD2 3.82Å; R304-D459 PolarHBondContact NH1-OD2 3.25Å; R304-D459 IonicContact NH2-OD1 3.83Å; R304-D459 PolarHBondContact NH2-OD1 3.43Å; R304-D459 IonicContact NH2-OD2 3.77Å; R304-D459 PolarHBondContact NH2-OD2 3.03Å
305A91.3Very high95.4Very high32 Ų3245.4 Ų45.426%0.26422%0.215SC..  trans-80.269.3172.400000109.9Y300 L303 E307 L308 A309Y300-A305 HydrophobicContact CD1-CB 4.29Å; Y300-A305 PolarHBondContact O-N 3.32Å; L303-A305 PolarHBondContact O-N 2.98Å; L303-A305 VanDerWaalsContact O-N 3.08Å; A305-E307 PolarHBondContact O-N 3.01Å; A305-L308 HydrophobicContact CB-CB 4.18Å; A305-L308 HydrophobicContact CB-CD1 4.12Å; A305-L308 HydrophobicContact CB-CG 4.4Å; A305-L308 PolarHBondContact O-N 3.18Å; A305-A309 PolarHBondContact O-N 3.33Å
306M92.7Very high95.3Very high38 Ų3844.7 Ų44.719%0.18721%0.213CC..Hα-helixtrans-54.9-44.2-167.6-66.6-64.1170.100113.6R304 L308 A309 K310 V336R304-M306 VanDerWaalsContact CD-CE 3.44Å; R304-M306 HydrophobicContact CG-CE 4.35Å; R304-M306 PolarHBondContact O-N 3.12Å; M306-L308 PolarHBondContact O-N 2.9Å; M306-A309 PolarHBondContact O-N 3.36Å; M306-K310 VanDerWaalsContact O-CB 3.24Å; M306-K310 WeakPolarHBondContact O-CB 3.34Å; M306-K310 PolarHBondContact O-N 3.4Å; M306-V336 HydrophobicContact CE-CB 4.3Å; M306-V336 HydrophobicContact CE-CG1 3.66Å; M306-V336 HydrophobicContact CG-CG1 4.19Å; M306-V336 HydrophobicContact SD-CB 4.15Å; M306-V336 HydrophobicContact SD-CG1 3.81Å
307E94.4Very high95.3Very high131 Ų13145.1 Ų45.161%0.61221%0.214SC*.Hα-helixtrans-65.5-38.3178.6-69.7-57146.900113A305 K311A305-E307 PolarHBondContact O-N 3.01Å; E307-K311 WeakPolarHBondContact O-CB 3.43Å; E307-K311 PolarHBondContact O-N 3.42Å
308L96.4Very high95.3Very high89 Ų8950.1 Ų50.147%0.46624%0.241SC..Hα-helixtrans-70.3-43176.1-64.3-178.8000111Y300 A305 M306 K311 Q312Y300-L308 HydrophobicContact CD1-CB 3.92Å; Y300-L308 HydrophobicContact CD1-CD1 4.08Å; Y300-L308 HydrophobicContact CD2-CB 4.31Å; Y300-L308 HydrophobicContact CE1-CB 4.18Å; Y300-L308 HydrophobicContact CE1-CD1 3.81Å; Y300-L308 HydrophobicContact CG-CB 4.01Å; A305-L308 HydrophobicContact CB-CB 4.18Å; A305-L308 HydrophobicContact CB-CD1 4.12Å; A305-L308 HydrophobicContact CB-CG 4.4Å; A305-L308 PolarHBondContact O-N 3.18Å; M306-L308 PolarHBondContact O-N 2.9Å; L308-K311 PolarHBondContact O-N 2.94Å; L308-Q312 VanDerWaalsContact O-CB 3.3Å; L308-Q312 WeakPolarHBondContact O-CB 3.38Å; L308-Q312 PolarHBondContact O-N 3.43Å
309A97.6Very high95.2Very high0 Ų051.6 Ų51.60%026%0.257CS..Hα-helixtrans-59.3-47.8174.900000110.9N301 A305 M306 K311 Q312 F313 V333N301-A309 HydrophobicContact CB-CB 4.4Å; A305-A309 PolarHBondContact O-N 3.33Å; M306-A309 PolarHBondContact O-N 3.36Å; A309-K311 PolarHBondContact O-N 2.96Å; A309-Q312 PolarHBondContact O-N 3.43Å; A309-F313 VanDerWaalsContact O-CD2 3.22Å; A309-F313 WeakPolarHBondContact O-CD2 3.26Å; A309-F313 PolarHBondContact O-N 3.33Å; A309-V333 HydrophobicContact CB-CG1 4.05Å; A309-V333 HydrophobicContact CB-CG2 4.09Å
310K97.7Very high95Very high36 Ų3653.4 Ų53.416%0.15727%0.27CS..Hα-helixtrans-58.2-48.9177.5-179.9179.1-179.5178.90111.2M306 Q312 K314 V333 L334 C337 D339M306-K310 VanDerWaalsContact O-CB 3.24Å; M306-K310 WeakPolarHBondContact O-CB 3.34Å; M306-K310 PolarHBondContact O-N 3.4Å; K310-Q312 PolarHBondContact O-N 3.06Å; K310-K314 WeakPolarHBondContact O-CB 3.45Å; K310-K314 PolarHBondContact O-N 3.48Å; K310-V333 HydrophobicContact CB-CG1 3.87Å; K310-L334 HydrophobicContact CD-CD2 4.3Å; K310-L334 HydrophobicContact CG-CD2 4.08Å; K310-C337 HydrophobicContact CD-CB 4.4Å; K310-D339 WeakPolarHBondContact CE-OD2 3.48Å; K310-D339 IonicContact NZ-OD2 3.66Å; K310-D339 PolarHBondContact NZ-OD2 2.93Å
311K97.7Very high94.9Very high128 Ų12853.9 Ų53.956%0.55728%0.278SS*.Hα-helixtrans-60.3-45.5177.7-175.7179.9178.9-177.60111.5E307 L308 A309 K314 Q315E307-K311 WeakPolarHBondContact O-CB 3.43Å; E307-K311 PolarHBondContact O-N 3.42Å; L308-K311 PolarHBondContact O-N 2.94Å; A309-K311 PolarHBondContact O-N 2.96Å; K311-K314 PolarHBondContact O-N 2.87Å; K311-Q315 VanDerWaalsContact O-CG 3.3Å; K311-Q315 WeakPolarHBondContact O-CG 3.45Å; K311-Q315 PolarHBondContact O-N 3.06Å
312Q97.3Very high94.9Very high29 Ų2957.6 Ų57.614%0.13630%0.304CS..Hα-helixtrans-62.9-49-179.7-176.761.725.100111.7Q293 I296 Y300 L308 A309 K310 K314 Q315 L316Q293-Q312 PolarHBondContact O-NE2 2.78Å; I296-Q312 HydrophobicContact CG2-CG 4.12Å; Y300-Q312 HydrophobicContact CD2-CB 4.28Å; Y300-Q312 HydrophobicContact CD2-CG 4.48Å; L308-Q312 VanDerWaalsContact O-CB 3.3Å; L308-Q312 WeakPolarHBondContact O-CB 3.38Å; L308-Q312 PolarHBondContact O-N 3.43Å; A309-Q312 PolarHBondContact O-N 3.43Å; K310-Q312 PolarHBondContact O-N 3.06Å; Q312-K314 PolarHBondContact O-N 2.9Å; Q312-Q315 PolarHBondContact O-N 3.29Å; Q312-L316 PolarHBondContact O-N 2.94Å
313F97.9Very high95Very high6 Ų657.6 Ų57.63%0.02630%0.303CS..Hα-helixtrans-66.5-36.8177.7-78.6-63.7000112.6L298 A309 L316 F317 N326 T329 Y330 V333L298-F313 HydrophobicContact CD2-CZ 4.18Å; L298-F313 HydrophobicContact CG-CZ 4.45Å; A309-F313 VanDerWaalsContact O-CD2 3.22Å; A309-F313 WeakPolarHBondContact O-CD2 3.26Å; A309-F313 PolarHBondContact O-N 3.33Å; F313-L316 HydrophobicContact CD1-CD2 4.36Å; F313-L316 PolarHBondContact O-N 3.33Å; F313-F317 VanDerWaalsContact O-CB 3.29Å; F313-F317 WeakPolarHBondContact O-CB 3.16Å; F313-F317 PolarHBondContact O-N 3.46Å; F313-N326 HydrophobicContact CE1-CB 4.49Å; F313-T329 WeakPolarHBondContact CZ-OG1 3.24Å; F313-Y330 HydrophobicContact CB-CD1 4.38Å; F313-Y330 HydrophobicContact CB-CD2 3.21Å; F313-Y330 HydrophobicContact CB-CE2 3.72Å; F313-Y330 HydrophobicContact CB-CG 3.59Å; F313-Y330 HydrophobicContact CD2-CD2 4.34Å; F313-Y330 AromaticContact CG-CD2 3.94Å; F313-Y330 HydrophobicContact CG-CD2 3.94Å; F313-Y330 HydrophobicContact CG-CG 4.12Å; F313-V333 HydrophobicContact CD2-CG2 4.24Å; F313-V333 HydrophobicContact CE2-CG2 4.15Å
314K97.1Very high95.2Very high74 Ų7455.1 Ų55.132%0.32229%0.29SS..Hα-helixtrans-63.2-41.4174.5-176.2164.6-179163.20111.8K310 K311 Q312 F317 N318 E342K310-K314 WeakPolarHBondContact O-CB 3.45Å; K310-K314 PolarHBondContact O-N 3.48Å; K311-K314 PolarHBondContact O-N 2.87Å; Q312-K314 PolarHBondContact O-N 2.9Å; K314-F317 PolarHBondContact O-N 2.91Å; K314-N318 WeakPolarHBondContact O-CB 3.47Å; K314-N318 PolarHBondContact O-N 3.45Å; K314-N318 PolarHBondContact O-ND2 3.42Å; K314-E342 IonicContact NZ-OE1 2.94Å; K314-E342 PolarHBondContact NZ-OE1 3.49Å; K314-E342 IonicContact NZ-OE2 2.95Å
315Q96.5Very high95.5Very high100 Ų10053.1 Ų53.147%0.46729%0.285SS..Hα-helixtrans-62.6-46174-74.2177.22.800111.7K311 Q312 F317 N318 A319K311-Q315 VanDerWaalsContact O-CG 3.3Å; K311-Q315 WeakPolarHBondContact O-CG 3.45Å; K311-Q315 PolarHBondContact O-N 3.06Å; Q312-Q315 PolarHBondContact O-N 3.29Å; Q315-F317 PolarHBondContact O-N 3.28Å; Q315-N318 PolarHBondContact O-N 3.09Å; Q315-A319 WeakPolarHBondContact O-CB 3.02Å; Q315-A319 PolarHBondContact O-N 3.37Å
316L96.2Very high95.7Very high10 Ų1053.6 Ų53.65%0.05228%0.283CS..Hα-helixtrans-59.7-45.3176175.160.1000111.9H290 Q293 A294 Q312 F313 N318 A319 C320H290-L316 HydrophobicContact CB-CD1 3.77Å; Q293-L316 HydrophobicContact CB-CD1 4.16Å; A294-L316 HydrophobicContact CB-CD2 3.68Å; Q312-L316 PolarHBondContact O-N 2.94Å; F313-L316 HydrophobicContact CD1-CD2 4.36Å; F313-L316 PolarHBondContact O-N 3.33Å; L316-N318 PolarHBondContact O-N 3.36Å; L316-A319 PolarHBondContact O-N 2.88Å; L316-C320 PolarHBondContact O-N 3.08Å
317F96.3Very high95.9Very high15 Ų1552.2 Ų52.27%0.06628%0.277CS..Hα-helixtrans-62.7-41.8178.5-179.1-93.6000111.8F313 K314 Q315 A319 C320 P321 Y330 Y345 L346 H349F313-F317 VanDerWaalsContact O-CB 3.29Å; F313-F317 WeakPolarHBondContact O-CB 3.16Å; F313-F317 PolarHBondContact O-N 3.46Å; K314-F317 PolarHBondContact O-N 2.91Å; Q315-F317 PolarHBondContact O-N 3.28Å; F317-A319 VanDerWaalsContact C-N 3.35Å; F317-C320 CarbonylContact O-C 3.45Å; F317-C320 VanDerWaalsContact O-C 3.26Å; F317-C320 PolarHBondContact O-N 3.2Å; F317-P321 VanDerWaalsContact O-CA 3.28Å; F317-P321 WeakPolarHBondContact O-CA 3.27Å; F317-P321 WeakPolarHBondContact O-CD 3.17Å; F317-P321 WeakPolarHBondContact O-CG 3.27Å; F317-P321 VanDerWaalsContact O-N 3.09Å; F317-Y330 HydrophobicContact CB-CE1 4.18Å; F317-Y330 HydrophobicContact CG-CE1 4.27Å; F317-Y345 AromaticContact CE1-CE1 3.76Å; F317-Y345 HydrophobicContact CE1-CE1 3.76Å; F317-Y345 HydrophobicContact CZ-CE1 4.24Å; F317-L346 HydrophobicContact CD2-CD1 3.79Å; F317-L346 HydrophobicContact CE2-CD1 3.47Å; F317-L346 VanDerWaalsContact CE2-CD1 3.47Å; F317-L346 HydrophobicContact CZ-CD1 4.06Å; F317-H349 AromaticContact CE2-ND1 3.74Å; F317-H349 HydrophobicContact CZ-CB 4.32Å; F317-H349 AromaticContact CZ-CE1 3.83Å; F317-H349 AromaticContact CZ-CG 3.79Å; F317-H349 AromaticContact CZ-ND1 3.52Å
318N95.9Very high95.9Very high105 Ų10546.5 Ų46.556%0.56125%0.25SS*.Hα-helixtrans-68-33.9176.3-69.7-17.9000112.7K314 Q315 L316K314-N318 WeakPolarHBondContact O-CB 3.47Å; K314-N318 PolarHBondContact O-N 3.45Å; K314-N318 PolarHBondContact O-ND2 3.42Å; Q315-N318 PolarHBondContact O-N 3.09Å; L316-N318 PolarHBondContact O-N 3.36Å
319A94.2Very high95.9Very high62 Ų6243.1 Ų43.151%0.51223%0.233SC..Hα-helixtrans-70.5-38.5177.300000112.2Q315 L316 F317Q315-A319 WeakPolarHBondContact O-CB 3.02Å; Q315-A319 PolarHBondContact O-N 3.37Å; L316-A319 PolarHBondContact O-N 2.88Å; F317-A319 VanDerWaalsContact C-N 3.35Å
320C93.7Very high95.9Very high39 Ų3943.4 Ų43.426%0.26424%0.235SC..  trans-138.681.8178.4-165.90000112.1L316 F317 C322 R323L316-C320 PolarHBondContact O-N 3.08Å; F317-C320 CarbonylContact O-C 3.45Å; F317-C320 VanDerWaalsContact O-C 3.26Å; F317-C320 PolarHBondContact O-N 3.2Å; C320-C322 VanDerWaalsContact C-N 3.26Å; C320-C322 PolarHBondContact O-N 2.8Å; C320-R323 HydrophobicContact CB-CB 4.14Å; C320-R323 WeakPolarHBondContact O-CB 3.36Å; C320-R323 PolarHBondContact O-N 2.93Å; C320-R323 VanDerWaalsContact O-N 3.15Å
321P94.4Very high95.9Very high52 Ų5241.7 Ų41.734%0.33823%0.227SC..THydrogen-bonded Turntrans-60.7-34.2-177.9-2635000113.2F317 R323 H349 L353F317-P321 VanDerWaalsContact O-CA 3.28Å; F317-P321 WeakPolarHBondContact O-CA 3.27Å; F317-P321 WeakPolarHBondContact O-CD 3.17Å; F317-P321 WeakPolarHBondContact O-CG 3.27Å; F317-P321 VanDerWaalsContact O-N 3.09Å; P321-R323 PolarHBondContact O-N 3.29Å; P321-H349 PolarHBondContact O-CE1 2.5Å; P321-L353 WeakPolarHBondContact O-CD1 3.46Å
322C94.2Very high95.9Very high99 Ų9936.4 Ų36.467%0.66921%0.205SC*.THydrogen-bonded Turntrans-72.5-9.6-178.3-57.90000114.3C320 L324C320-C322 VanDerWaalsContact C-N 3.26Å; C320-C322 PolarHBondContact O-N 2.8Å; C322-L324 PolarHBondContact O-N 3.33Å
323R94.2Very high95.9Very high33 Ų3335 Ų3513%0.12520%0.198CC..  trans-79120.1179.8178.1-174.2171.8100.51110N291 C320 P321 D325 V327N291-R323 PolarHBondContact OD1-NH1 3.48Å; N291-R323 PolarHBondContact OD1-NH2 2.88Å; C320-R323 HydrophobicContact CB-CB 4.14Å; C320-R323 WeakPolarHBondContact O-CB 3.36Å; C320-R323 PolarHBondContact O-N 2.93Å; C320-R323 VanDerWaalsContact O-N 3.15Å; P321-R323 PolarHBondContact O-N 3.29Å; R323-D325 HydrophobicContact CG-CB 4.22Å; R323-D325 IonicContact CZ-OD2 2.88Å; R323-D325 IonicContact NH1-OD2 3.69Å; R323-D325 IonicContact NH2-OD2 3.55Å; R323-V327 WeakPolarHBondContact O-CG2 3.39Å
324L95.4Very high95.9Very high9 Ų934.8 Ų34.85%0.04720%0.197CC..  trans-1045.2175.7-56.7170.9000113.9C322 C350 L353 D354C322-L324 PolarHBondContact O-N 3.33Å; L324-C350 HydrophobicContact CD2-CB 3.96Å; L324-C350 VanDerWaalsContact CD2-SG 3.6Å; L324-L353 HydrophobicContact CD1-CB 4.19Å; L324-L353 HydrophobicContact CD2-CD1 3.99Å; L324-L353 HydrophobicContact CG-CD1 4.41Å; L324-D354 HydrophobicContact CD1-CB 3.69Å
325D94.1Very high95.9Very high29 Ų2934.6 Ų34.616%0.15520%0.196CC..THydrogen-bonded Turntrans-75.3133.8175.6-49.7-23.3000110.4K37 R323 V327 R357K37-D325 WeakPolarHBondContact CE-OD2 3.4Å; K37-D325 VanDerWaalsContact NZ-CG 3.34Å; K37-D325 IonicContact NZ-OD1 3.66Å; K37-D325 PolarHBondContact NZ-OD1 3.44Å; K37-D325 IonicContact NZ-OD2 3.13Å; K37-D325 PolarHBondContact NZ-OD2 2.94Å; R323-D325 HydrophobicContact CG-CB 4.22Å; R323-D325 IonicContact CZ-OD2 2.88Å; R323-D325 IonicContact NH1-OD2 3.69Å; R323-D325 IonicContact NH2-OD2 3.55Å; D325-V327 PolarHBondContact O-N 3.47Å; D325-R357 IonicContact OD1-CZ 3.73Å; D325-R357 IonicContact OD1-NH1 3.84Å; D325-R357 PolarHBondContact OD1-NH1 3.38Å; D325-R357 IonicContact OD1-NH2 3.91Å; D325-R357 PolarHBondContact OD1-NH2 3.21Å
326N95Very high95.7Very high42 Ų4233.8 Ų33.823%0.22520%0.198CC..THydrogen-bonded Turntrans64.49.8-179.2-54.3-20.1000115.1A294 F313 D328 T329 Y330A294-N326 VanDerWaalsContact CB-ND2 3.32Å; A294-N326 WeakPolarHBondContact CB-ND2 3.44Å; F313-N326 HydrophobicContact CE1-CB 4.49Å; N326-D328 WeakPolarHBondContact CA-OD1 3.33Å; N326-D328 PolarHBondContact O-N 3.39Å; N326-T329 PolarHBondContact O-N 3.28Å; N326-T329 VanDerWaalsContact O-N 3.1Å; N326-T329 PolarHBondContact O-OG1 3.21Å; N326-Y330 PolarHBondContact O-N 3.04Å; N326-Y330 VanDerWaalsContact O-N 3.16Å
327V96.7Very high95.6Very high9 Ų934.8 Ų34.86%0.05521%0.206CC..Hα-helixtrans-68-26.9178.5-179.20000111.9R323 D325 Y330 S331 L346 V363R323-V327 WeakPolarHBondContact O-CG2 3.39Å; D325-V327 PolarHBondContact O-N 3.47Å; V327-Y330 PolarHBondContact O-N 3.08Å; V327-S331 WeakPolarHBondContact O-CB 3.3Å; V327-S331 PolarHBondContact O-N 3.11Å; V327-S331 PolarHBondContact O-OG 3.14Å; V327-L346 HydrophobicContact CG1-CD1 3.78Å; V327-L346 HydrophobicContact CG1-CD2 3.89Å; V327-L346 HydrophobicContact CG1-CG 3.98Å; V327-V363 HydrophobicContact CB-CG2 4.35Å; V327-V363 HydrophobicContact CG1-CG2 3.62Å
328D96.3Very high95.6Very high11 Ų1141.5 Ų41.56%0.05924%0.237CC..Hα-helixtrans-53.6-49.4166.458.1-55.3000111.5N326 S331 N332 E359 C362 Y391 L393N326-D328 WeakPolarHBondContact CA-OD1 3.33Å; N326-D328 PolarHBondContact O-N 3.39Å; D328-S331 PolarHBondContact O-N 2.97Å; D328-S331 PolarHBondContact O-OG 3.29Å; D328-N332 PolarHBondContact O-N 2.78Å; D328-E359 HydrophobicContact CB-CB 4.44Å; D328-C362 HydrophobicContact CB-CB 4.13Å; D328-Y391 VanDerWaalsContact CB-OH 3.25Å; D328-Y391 WeakPolarHBondContact CB-OH 3.28Å; D328-Y391 PolarHBondContact OD2-OH 2.98Å; D328-L393 HydrophobicContact CB-CD2 4.21Å; D328-L393 WeakPolarHBondContact OD2-CD2 3.35Å
329T96.1Very high95.6Very high18 Ų1838 Ų3811%0.1122%0.218CC..Hα-helixtrans-67.7-38.2177.160.80000112.6L298 F313 N326 S331 N332 V333L298-T329 HydrophobicContact CD2-CG2 3.63Å; L298-T329 WeakPolarHBondContact CD2-OG1 3.2Å; F313-T329 WeakPolarHBondContact CZ-OG1 3.24Å; N326-T329 PolarHBondContact O-N 3.28Å; N326-T329 VanDerWaalsContact O-N 3.1Å; N326-T329 PolarHBondContact O-OG1 3.21Å; T329-S331 VanDerWaalsContact C-N 3.3Å; T329-S331 PolarHBondContact O-N 3.21Å; T329-N332 WeakPolarHBondContact O-CB 3.28Å; T329-N332 PolarHBondContact O-N 2.93Å; T329-V333 WeakPolarHBondContact O-CG2 3.39Å; T329-V333 PolarHBondContact O-N 3.46Å
330Y97.7Very high95.6Very high6 Ų638 Ų382%0.02422%0.215CC..Hα-helixtrans-58.7-43.5171.9179.5-148.7000111.5F313 F317 N326 V327 N332 V333 L334 L346F313-Y330 HydrophobicContact CB-CD1 4.38Å; F313-Y330 HydrophobicContact CB-CD2 3.21Å; F313-Y330 HydrophobicContact CB-CE2 3.72Å; F313-Y330 HydrophobicContact CB-CG 3.59Å; F313-Y330 HydrophobicContact CD2-CD2 4.34Å; F313-Y330 AromaticContact CG-CD2 3.94Å; F313-Y330 HydrophobicContact CG-CD2 3.94Å; F313-Y330 HydrophobicContact CG-CG 4.12Å; F317-Y330 HydrophobicContact CB-CE1 4.18Å; F317-Y330 HydrophobicContact CG-CE1 4.27Å; N326-Y330 PolarHBondContact O-N 3.04Å; N326-Y330 VanDerWaalsContact O-N 3.16Å; V327-Y330 PolarHBondContact O-N 3.08Å; Y330-N332 VanDerWaalsContact C-N 3.32Å; Y330-N332 PolarHBondContact O-N 3.32Å; Y330-V333 PolarHBondContact O-N 2.83Å; Y330-L334 HydrophobicContact CD1-CD1 4.45Å; Y330-L334 HydrophobicContact CD2-CD1 4.14Å; Y330-L334 HydrophobicContact CD2-CD2 4.46Å; Y330-L334 HydrophobicContact CD2-CG 3.94Å; Y330-L334 HydrophobicContact CE1-CD1 4.07Å; Y330-L334 HydrophobicContact CE2-CD1 3.76Å; Y330-L334 HydrophobicContact CE2-CD2 3.73Å; Y330-L334 HydrophobicContact CE2-CG 3.63Å; Y330-L334 HydrophobicContact CG-CD1 4.49Å; Y330-L334 WeakPolarHBondContact O-CG 3.47Å; Y330-L334 PolarHBondContact O-N 2.93Å; Y330-L346 HydrophobicContact CD1-CD1 3.84Å; Y330-L346 HydrophobicContact CD1-CD2 3.45Å; Y330-L346 VanDerWaalsContact CD1-CD2 3.45Å; Y330-L346 HydrophobicContact CD1-CG 4.27Å; Y330-L346 HydrophobicContact CE1-CD1 3.86Å; Y330-L346 HydrophobicContact CE1-CD2 3.85Å; Y330-L346 HydrophobicContact CE1-CG 4.38Å; Y330-L346 HydrophobicContact CG-CD2 4.11Å
331S97.8Very high95.8Very high0 Ų042.2 Ų42.20%024%0.235CC..Hα-helixtrans-65.3-33.7177.173.60000113.3V327 D328 T329 L334 F335 N366V327-S331 WeakPolarHBondContact O-CB 3.3Å; V327-S331 PolarHBondContact O-N 3.11Å; V327-S331 PolarHBondContact O-OG 3.14Å; D328-S331 PolarHBondContact O-N 2.97Å; D328-S331 PolarHBondContact O-OG 3.29Å; T329-S331 VanDerWaalsContact C-N 3.3Å; T329-S331 PolarHBondContact O-N 3.21Å; S331-L334 PolarHBondContact O-N 3.19Å; S331-F335 VanDerWaalsContact O-CB 3.3Å; S331-F335 WeakPolarHBondContact O-CB 3.42Å; S331-F335 PolarHBondContact O-N 2.91Å; S331-N366 PolarHBondContact OG-ND2 3.19Å
332N96.7Very high95.9Very high17 Ų1742 Ų429%0.09123%0.23CC..Hα-helixtrans-66.2-42.3172.7-68.2-23.1000111.5D328 T329 Y330 L334 F335 V336 N366D328-N332 PolarHBondContact O-N 2.78Å; T329-N332 WeakPolarHBondContact O-CB 3.28Å; T329-N332 PolarHBondContact O-N 2.93Å; Y330-N332 VanDerWaalsContact C-N 3.32Å; Y330-N332 PolarHBondContact O-N 3.32Å; N332-L334 VanDerWaalsContact C-N 3.35Å; N332-F335 WeakPolarHBondContact O-CB 3.47Å; N332-F335 PolarHBondContact O-N 3.29Å; N332-V336 WeakPolarHBondContact O-CG2 3.46Å; N332-V336 PolarHBondContact O-N 2.96Å; N332-N366 PolarHBondContact OD1-ND2 3.22Å
333V97.1Very high96Very high0 Ų037.3 Ų37.30%020%0.198CC..Hα-helixtrans-61.1-46175.7173.10000110.2N301 A309 K310 F313 T329 Y330 F335 V336 C337N301-V333 HydrophobicContact CB-CG2 4.24Å; N301-V333 WeakPolarHBondContact OD1-CG2 3.48Å; A309-V333 HydrophobicContact CB-CG1 4.05Å; A309-V333 HydrophobicContact CB-CG2 4.09Å; K310-V333 HydrophobicContact CB-CG1 3.87Å; F313-V333 HydrophobicContact CD2-CG2 4.24Å; F313-V333 HydrophobicContact CE2-CG2 4.15Å; T329-V333 WeakPolarHBondContact O-CG2 3.39Å; T329-V333 PolarHBondContact O-N 3.46Å; Y330-V333 PolarHBondContact O-N 2.83Å; V333-F335 VanDerWaalsContact C-N 3.32Å; V333-F335 PolarHBondContact O-N 3.27Å; V333-V336 PolarHBondContact O-N 3.26Å; V333-C337 WeakPolarHBondContact O-CB 3.39Å; V333-C337 PolarHBondContact O-N 3.45Å; V333-C337 PolarHBondContact O-SG 2.97Å; V333-C337 VanDerWaalsContact O-SG 3.39Å
334L97.7Very high96.2Very high0 Ų037 Ų370%020%0.202CC..Hα-helixtrans-63-37.6176.3-67.3176.9000112.8K310 Y330 S331 N332 C337 E338 D339 E342 L343 L346K310-L334 HydrophobicContact CD-CD2 4.3Å; K310-L334 HydrophobicContact CG-CD2 4.08Å; Y330-L334 HydrophobicContact CD1-CD1 4.45Å; Y330-L334 HydrophobicContact CD2-CD1 4.14Å; Y330-L334 HydrophobicContact CD2-CD2 4.46Å; Y330-L334 HydrophobicContact CD2-CG 3.94Å; Y330-L334 HydrophobicContact CE1-CD1 4.07Å; Y330-L334 HydrophobicContact CE2-CD1 3.76Å; Y330-L334 HydrophobicContact CE2-CD2 3.73Å; Y330-L334 HydrophobicContact CE2-CG 3.63Å; Y330-L334 HydrophobicContact CG-CD1 4.49Å; Y330-L334 WeakPolarHBondContact O-CG 3.47Å; Y330-L334 PolarHBondContact O-N 2.93Å; S331-L334 PolarHBondContact O-N 3.19Å; N332-L334 VanDerWaalsContact C-N 3.35Å; L334-C337 PolarHBondContact O-N 3.32Å; L334-E338 PolarHBondContact O-N 3.43Å; L334-E338 VanDerWaalsContact O-N 3.16Å; L334-D339 HydrophobicContact CD2-CB 4.21Å; L334-D339 PolarHBondContact O-N 2.92Å; L334-E342 HydrophobicContact CD1-CB 4.06Å; L334-E342 HydrophobicContact CD2-CB 3.89Å; L334-L343 HydrophobicContact CB-CB 4.18Å; L334-L343 HydrophobicContact CB-CD1 4.41Å; L334-L343 HydrophobicContact CD1-CB 4.34Å; L334-L343 HydrophobicContact CD1-CD1 4.5Å; L334-L346 HydrophobicContact CD1-CB 4.5Å; L334-L346 HydrophobicContact CD1-CD2 3.92Å
335F96.8Very high96.3Very high70 Ų7042.6 Ų42.631%0.30722%0.224SC..Hα-helixtrans-61.9-48.3175180-81.2000111.3S331 N332 V333 C337 E338 L343 N366 L370S331-F335 VanDerWaalsContact O-CB 3.3Å; S331-F335 WeakPolarHBondContact O-CB 3.42Å; S331-F335 PolarHBondContact O-N 2.91Å; N332-F335 WeakPolarHBondContact O-CB 3.47Å; N332-F335 PolarHBondContact O-N 3.29Å; V333-F335 VanDerWaalsContact C-N 3.32Å; V333-F335 PolarHBondContact O-N 3.27Å; F335-C337 VanDerWaalsContact C-N 3.34Å; F335-C337 PolarHBondContact O-N 3.39Å; F335-E338 WeakPolarHBondContact O-CA 3.25Å; F335-E338 PolarHBondContact O-N 3.07Å; F335-L343 HydrophobicContact CB-CD2 4.47Å; F335-N366 HydrophobicContact CD2-CB 4.38Å; F335-L370 HydrophobicContact CD2-CB 3.81Å; F335-L370 HydrophobicContact CD2-CD1 4.16Å; F335-L370 HydrophobicContact CD2-CG 4.49Å; F335-L370 HydrophobicContact CE2-CB 3.93Å; F335-L370 HydrophobicContact CE2-CD1 4.27Å
336V93.8Very high96.5Very high84 Ų8441.3 Ų41.351%0.50922%0.217SC..Hα-helixtrans-67.8-34.6179.3175.90000111.9M306 N332 V333 E338M306-V336 HydrophobicContact CE-CB 4.3Å; M306-V336 HydrophobicContact CE-CG1 3.66Å; M306-V336 HydrophobicContact CG-CG1 4.19Å; M306-V336 HydrophobicContact SD-CB 4.15Å; M306-V336 HydrophobicContact SD-CG1 3.81Å; N332-V336 WeakPolarHBondContact O-CG2 3.46Å; N332-V336 PolarHBondContact O-N 2.96Å; V333-V336 PolarHBondContact O-N 3.26Å; V336-E338 PolarHBondContact O-N 3.39Å
337C94.4Very high96.6Very high31 Ų3139.6 Ų39.621%0.20921%0.209CC..THydrogen-bonded Turntrans-73.7-1.1171.2-71.70000113.9K310 V333 L334 F335 D339K310-C337 HydrophobicContact CD-CB 4.4Å; V333-C337 WeakPolarHBondContact O-CB 3.39Å; V333-C337 PolarHBondContact O-N 3.45Å; V333-C337 PolarHBondContact O-SG 2.97Å; V333-C337 VanDerWaalsContact O-SG 3.39Å; L334-C337 PolarHBondContact O-N 3.32Å; F335-C337 VanDerWaalsContact C-N 3.34Å; F335-C337 PolarHBondContact O-N 3.39Å; C337-D339 PolarHBondContact O-N 2.93Å; C337-D339 VanDerWaalsContact O-N 3.1Å
338E94.5Very high96.6Very high155 Ų15545.1 Ų45.172%0.72423%0.233SC*.THydrogen-bonded Turntrans53.127.8-175-57.4-173.216100114.4L334 F335 V336 S340L334-E338 PolarHBondContact O-N 3.43Å; L334-E338 VanDerWaalsContact O-N 3.16Å; F335-E338 WeakPolarHBondContact O-CA 3.25Å; F335-E338 PolarHBondContact O-N 3.07Å; V336-E338 PolarHBondContact O-N 3.39Å; E338-S340 PolarHBondContact O-N 3.16Å
339D95.9Very high96.7Very high31 Ų3146.3 Ų46.317%0.16624%0.238CC..  trans-83.381.5179.9-166-25.3000111K310 L334 C337 N341 E342 L343K310-D339 WeakPolarHBondContact CE-OD2 3.48Å; K310-D339 IonicContact NZ-OD2 3.66Å; K310-D339 PolarHBondContact NZ-OD2 2.93Å; L334-D339 HydrophobicContact CD2-CB 4.21Å; L334-D339 PolarHBondContact O-N 2.92Å; C337-D339 PolarHBondContact O-N 2.93Å; C337-D339 VanDerWaalsContact O-N 3.1Å; D339-N341 PolarHBondContact O-N 3.22Å; D339-N341 PolarHBondContact OD1-N 3.27Å; D339-E342 HydrophobicContact CB-CB 4.46Å; D339-E342 PolarHBondContact OD1-N 3.31Å; D339-E342 VanDerWaalsContact OD2-CG 3.26Å; D339-E342 WeakPolarHBondContact OD2-CG 3.5Å; D339-L343 VanDerWaalsContact O-CB 3.28Å; D339-L343 WeakPolarHBondContact O-CB 3.22Å; D339-L343 PolarHBondContact O-N 2.98Å; D339-L343 VanDerWaalsContact O-N 3.08Å
340S95.5Very high96.7Very high64 Ų6445.4 Ų45.445%0.44823%0.233SC..Hα-helixtrans-62.5-28.5-178.167.40000113.8E338 A344E338-S340 PolarHBondContact O-N 3.16Å; S340-A344 VanDerWaalsContact O-CB 3.24Å; S340-A344 WeakPolarHBondContact O-CB 3.24Å; S340-A344 PolarHBondContact O-N 3.1Å; S340-A344 VanDerWaalsContact O-N 3.09Å
341N96.8Very high96.7Very high126 Ų12647.7 Ų47.767%0.67425%0.247SC*.Hα-helixtrans-77.2-50.7-174.5-67.2-29.3000110.8D339 L343 A344 Y345D339-N341 PolarHBondContact O-N 3.22Å; D339-N341 PolarHBondContact OD1-N 3.27Å; N341-L343 VanDerWaalsContact C-N 3.33Å; N341-A344 PolarHBondContact O-N 3.37Å; N341-Y345 PolarHBondContact O-N 2.99Å
342E96.7Very high96.7Very high48 Ų4852.8 Ų52.822%0.22428%0.275CS..Hα-helixtrans-65.5-38.6176.7-68.2-70.7172.600110.9K314 L334 D339 A344 Y345 L346K314-E342 IonicContact NZ-OE1 2.94Å; K314-E342 PolarHBondContact NZ-OE1 3.49Å; K314-E342 IonicContact NZ-OE2 2.95Å; L334-E342 HydrophobicContact CD1-CB 4.06Å; L334-E342 HydrophobicContact CD2-CB 3.89Å; D339-E342 HydrophobicContact CB-CB 4.46Å; D339-E342 PolarHBondContact OD1-N 3.31Å; D339-E342 VanDerWaalsContact OD2-CG 3.26Å; D339-E342 WeakPolarHBondContact OD2-CG 3.5Å; E342-A344 VanDerWaalsContact C-N 3.35Å; E342-A344 PolarHBondContact O-N 3.23Å; E342-Y345 PolarHBondContact O-N 2.9Å; E342-L346 WeakPolarHBondContact O-CB 3.43Å; E342-L346 PolarHBondContact O-N 3.5Å
343L97.8Very high96.7Very high0 Ų055.6 Ų55.60%029%0.29CS..Hα-helixtrans-64.6-38.7176.9-176.757.9000112.1L334 F335 D339 N341 L346 A347 V363 N366 F367 L370L334-L343 HydrophobicContact CB-CB 4.18Å; L334-L343 HydrophobicContact CB-CD1 4.41Å; L334-L343 HydrophobicContact CD1-CB 4.34Å; L334-L343 HydrophobicContact CD1-CD1 4.5Å; F335-L343 HydrophobicContact CB-CD2 4.47Å; D339-L343 VanDerWaalsContact O-CB 3.28Å; D339-L343 WeakPolarHBondContact O-CB 3.22Å; D339-L343 PolarHBondContact O-N 2.98Å; D339-L343 VanDerWaalsContact O-N 3.08Å; N341-L343 VanDerWaalsContact C-N 3.33Å; L343-L346 PolarHBondContact O-N 3.5Å; L343-A347 WeakPolarHBondContact O-CB 3.35Å; L343-A347 PolarHBondContact O-N 3.11Å; L343-V363 HydrophobicContact CD1-CG1 4.5Å; L343-N366 HydrophobicContact CD2-CB 4.48Å; L343-F367 HydrophobicContact CD2-CB 4.48Å; L343-F367 HydrophobicContact CG-CB 4.18Å; L343-L370 HydrophobicContact CD2-CB 4.07Å; L343-L370 HydrophobicContact CD2-CD2 3.66Å
344A97.8Very high96.6Very high27 Ų2758.9 Ų58.922%0.22331%0.307CS..Hα-helixtrans-64.3-44.2174.700000112.1S340 N341 E342 A347 H348 F367S340-A344 VanDerWaalsContact O-CB 3.24Å; S340-A344 WeakPolarHBondContact O-CB 3.24Å; S340-A344 PolarHBondContact O-N 3.1Å; S340-A344 VanDerWaalsContact O-N 3.09Å; N341-A344 PolarHBondContact O-N 3.37Å; E342-A344 VanDerWaalsContact C-N 3.35Å; E342-A344 PolarHBondContact O-N 3.23Å; A344-A347 PolarHBondContact O-N 3.4Å; A344-H348 PolarHBondContact O-N 2.85Å; A344-F367 HydrophobicContact CB-CD2 4Å; A344-F367 HydrophobicContact CB-CE2 3.55Å
345Y97.5Very high96.4Very high127 Ų12765.5 Ų65.550%0.49833%0.332SS..Hα-helixtrans-61.4-47176.6175.4-107.2000111.2F317 N341 E342 A347 H348 H349F317-Y345 AromaticContact CE1-CE1 3.76Å; F317-Y345 HydrophobicContact CE1-CE1 3.76Å; F317-Y345 HydrophobicContact CZ-CE1 4.24Å; N341-Y345 PolarHBondContact O-N 2.99Å; E342-Y345 PolarHBondContact O-N 2.9Å; Y345-A347 PolarHBondContact O-N 2.74Å; Y345-H348 PolarHBondContact O-N 2.99Å; Y345-H349 VanDerWaalsContact O-CB 3.31Å; Y345-H349 WeakPolarHBondContact O-CB 3.36Å; Y345-H349 PolarHBondContact O-N 3.44Å
346L97.5Very high96.2Very high2 Ų270.3 Ų70.31%0.0135%0.349CS..Hα-helixtrans-58.3-48.7176.6-172.863.7000111.5F317 V327 Y330 L334 E342 L343 H348 H349 C350 V363F317-L346 HydrophobicContact CD2-CD1 3.79Å; F317-L346 HydrophobicContact CE2-CD1 3.47Å; F317-L346 VanDerWaalsContact CE2-CD1 3.47Å; F317-L346 HydrophobicContact CZ-CD1 4.06Å; V327-L346 HydrophobicContact CG1-CD1 3.78Å; V327-L346 HydrophobicContact CG1-CD2 3.89Å; V327-L346 HydrophobicContact CG1-CG 3.98Å; Y330-L346 HydrophobicContact CD1-CD1 3.84Å; Y330-L346 HydrophobicContact CD1-CD2 3.45Å; Y330-L346 VanDerWaalsContact CD1-CD2 3.45Å; Y330-L346 HydrophobicContact CD1-CG 4.27Å; Y330-L346 HydrophobicContact CE1-CD1 3.86Å; Y330-L346 HydrophobicContact CE1-CD2 3.85Å; Y330-L346 HydrophobicContact CE1-CG 4.38Å; Y330-L346 HydrophobicContact CG-CD2 4.11Å; L334-L346 HydrophobicContact CD1-CB 4.5Å; L334-L346 HydrophobicContact CD1-CD2 3.92Å; E342-L346 WeakPolarHBondContact O-CB 3.43Å; E342-L346 PolarHBondContact O-N 3.5Å; L343-L346 PolarHBondContact O-N 3.5Å; L346-H348 PolarHBondContact O-N 2.87Å; L346-H349 PolarHBondContact O-N 2.87Å; L346-C350 WeakPolarHBondContact O-CB 3.21Å; L346-C350 PolarHBondContact O-N 3.18Å; L346-C350 PolarHBondContact O-SG 3.32Å; L346-V363 HydrophobicContact CB-CG1 4.45Å; L346-V363 HydrophobicContact CD2-CG1 4.03Å; L346-V363 HydrophobicContact CG-CG1 3.93Å
347A97.4Very high96.2Very high6 Ų668.9 Ų68.95%0.0534%0.335CS..Hα-helixtrans-59.6-47179.900000112.2L343 A344 Y345 V351 V363 V364 F367L343-A347 WeakPolarHBondContact O-CB 3.35Å; L343-A347 PolarHBondContact O-N 3.11Å; A344-A347 PolarHBondContact O-N 3.4Å; Y345-A347 PolarHBondContact O-N 2.74Å; A347-V351 VanDerWaalsContact O-CG2 3.24Å; A347-V351 WeakPolarHBondContact O-CG2 3.31Å; A347-V351 PolarHBondContact O-N 2.97Å; A347-V351 VanDerWaalsContact O-N 3.11Å; A347-V363 HydrophobicContact CB-CG1 4.06Å; A347-V364 HydrophobicContact CB-CG2 4.38Å; A347-F367 HydrophobicContact CB-CB 3.94Å; A347-F367 HydrophobicContact CB-CG 4.12Å
348H97.6Very high96.3Very high124 Ų12467.9 Ų67.957%0.57433%0.328SS*.Hα-helixtrans-63.6-42.6177.5-178.1-103.1000111.7A344 Y345 L346 V351 N352A344-H348 PolarHBondContact O-N 2.85Å; Y345-H348 PolarHBondContact O-N 2.99Å; L346-H348 PolarHBondContact O-N 2.87Å; H348-V351 PolarHBondContact O-N 3.05Å; H348-N352 PolarHBondContact CE1-ND2 3.37Å; H348-N352 PolarHBondContact ND1-ND2 3.08Å; H348-N352 PolarHBondContact NE2-ND2 3.48Å; H348-N352 VanDerWaalsContact O-CG 3.23Å; H348-N352 PolarHBondContact O-N 3.42Å; H348-N352 VanDerWaalsContact O-N 3.15Å; H348-N352 PolarHBondContact O-ND2 2.66Å
349H97.6Very high96.4Very high36 Ų3662.3 Ų62.317%0.16730%0.303CS..Hα-helixtrans-61.1-48.9178.2-173.2-90.6000112.2F317 P321 Y345 L346 V351 N352 L353F317-H349 AromaticContact CE2-ND1 3.74Å; F317-H349 HydrophobicContact CZ-CB 4.32Å; F317-H349 AromaticContact CZ-CE1 3.83Å; F317-H349 AromaticContact CZ-CG 3.79Å; F317-H349 AromaticContact CZ-ND1 3.52Å; P321-H349 PolarHBondContact O-CE1 2.5Å; Y345-H349 VanDerWaalsContact O-CB 3.31Å; Y345-H349 WeakPolarHBondContact O-CB 3.36Å; Y345-H349 PolarHBondContact O-N 3.44Å; L346-H349 PolarHBondContact O-N 2.87Å; H349-V351 PolarHBondContact O-N 2.96Å; H349-N352 PolarHBondContact O-N 2.89Å; H349-L353 WeakPolarHBondContact CE1-CD1 3.38Å; H349-L353 PolarHBondContact O-N 2.99Å; H349-L353 VanDerWaalsContact O-N 3.15Å
350C97.1Very high96.5Very high0 Ų061 Ų610%030%0.295CS..Hα-helixtrans-64.4-38.8-179.6-64.30000112.7L324 L346 N352 L353 D354 T360L324-C350 HydrophobicContact CD2-CB 3.96Å; L324-C350 VanDerWaalsContact CD2-SG 3.6Å; L346-C350 WeakPolarHBondContact O-CB 3.21Å; L346-C350 PolarHBondContact O-N 3.18Å; L346-C350 PolarHBondContact O-SG 3.32Å; C350-N352 VanDerWaalsContact C-N 3.3Å; C350-N352 PolarHBondContact O-N 3.08Å; C350-L353 PolarHBondContact O-N 3.26Å; C350-D354 CarbonylContact O-C 3.51Å; C350-D354 PolarHBondContact O-N 3.05Å; C350-T360 HydrophobicContact CB-CG2 3.74Å
351V97Very high96.5Very high53 Ų5358.2 Ų58.232%0.32128%0.276SS..Hα-helixtrans-63.8-37176.6170.30000111.8A347 H348 H349 R355 T360 V364A347-V351 VanDerWaalsContact O-CG2 3.24Å; A347-V351 WeakPolarHBondContact O-CG2 3.31Å; A347-V351 PolarHBondContact O-N 2.97Å; A347-V351 VanDerWaalsContact O-N 3.11Å; H348-V351 PolarHBondContact O-N 3.05Å; H349-V351 PolarHBondContact O-N 2.96Å; V351-R355 HydrophobicContact CG1-CG 4.49Å; V351-T360 HydrophobicContact CG2-CG2 3.94Å; V351-V364 HydrophobicContact CG2-CG2 3.39Å
352N96.9Very high96.5Very high107 Ų10752.2 Ų52.257%0.57224%0.244SC*.Hα-helixtrans-71-31.9178.1-69.7-20.8000112.8H348 H349 C350H348-N352 PolarHBondContact CE1-ND2 3.37Å; H348-N352 PolarHBondContact ND1-ND2 3.08Å; H348-N352 PolarHBondContact NE2-ND2 3.48Å; H348-N352 VanDerWaalsContact O-CG 3.23Å; H348-N352 PolarHBondContact O-N 3.42Å; H348-N352 VanDerWaalsContact O-N 3.15Å; H348-N352 PolarHBondContact O-ND2 2.66Å; H349-N352 PolarHBondContact O-N 2.89Å; C350-N352 VanDerWaalsContact C-N 3.3Å; C350-N352 PolarHBondContact O-N 3.08Å
353L96.5Very high96.6Very high77 Ų7749.9 Ų49.940%0.40323%0.233SC..Hα-helixtrans-77.1-55.2176.8-72.1178.8000112.5P321 L324 H349 C350P321-L353 WeakPolarHBondContact O-CD1 3.46Å; L324-L353 HydrophobicContact CD1-CB 4.19Å; L324-L353 HydrophobicContact CD2-CD1 3.99Å; L324-L353 HydrophobicContact CG-CD1 4.41Å; H349-L353 WeakPolarHBondContact CE1-CD1 3.38Å; H349-L353 PolarHBondContact O-N 2.99Å; H349-L353 VanDerWaalsContact O-N 3.15Å; C350-L353 PolarHBondContact O-N 3.26Å
354D95.3Very high96.6Very high69 Ų6950.3 Ų50.337%0.36924%0.235SC..  trans-153.2103.4179.6-173-7.7000111L324 C350 Y356 R357 T360L324-D354 HydrophobicContact CD1-CB 3.69Å; C350-D354 CarbonylContact O-C 3.51Å; C350-D354 PolarHBondContact O-N 3.05Å; D354-Y356 PolarHBondContact O-N 2.87Å; D354-Y356 PolarHBondContact OD1-N 3.13Å; D354-R357 HydrophobicContact CB-CB 4.2Å; D354-T360 VanDerWaalsContact O-CB 3.24Å; D354-T360 WeakPolarHBondContact O-CB 3.35Å; D354-T360 VanDerWaalsContact O-CG2 3.28Å; D354-T360 WeakPolarHBondContact O-CG2 3.29Å; D354-T360 PolarHBondContact O-OG1 3.11Å
355R95Very high96.5Very high138 Ų13849 Ų4952%0.52123%0.225SC..THydrogen-bonded Turntrans-68.6-30.6-179.8-173.7178.4-173.2-177.83.7113.5V351V351-R355 HydrophobicContact CG1-CG 4.49Å
356Y91Very high96.6Very high171 Ų17143 Ų4367%0.67120%0.201SC*.THydrogen-bonded Turntrans-107.335.1-170.6-62.9-68.8000112.2D354 L387D354-Y356 PolarHBondContact O-N 2.87Å; D354-Y356 PolarHBondContact OD1-N 3.13Å; Y356-L387 WeakPolarHBondContact O-CD1 3.5Å
357R94.9Very high96.6Very high55 Ų5544.6 Ų44.621%0.20821%0.208CC..  trans-102.9142.7172.1-177.5161.6-178.5177-4.5111.2D325 D354 E359 T360 C361D325-R357 IonicContact OD1-CZ 3.73Å; D325-R357 IonicContact OD1-NH1 3.84Å; D325-R357 PolarHBondContact OD1-NH1 3.38Å; D325-R357 IonicContact OD1-NH2 3.91Å; D325-R357 PolarHBondContact OD1-NH2 3.21Å; D354-R357 HydrophobicContact CB-CB 4.2Å; R357-E359 HydrophobicContact CG-CB 4.5Å; R357-E359 WeakPolarHBondContact CG-OE2 3.42Å; R357-E359 IonicContact CZ-OE1 3.66Å; R357-E359 IonicContact CZ-OE2 3.38Å; R357-E359 VanDerWaalsContact NE-CD 3.28Å; R357-E359 IonicContact NE-OE1 3.12Å; R357-E359 PolarHBondContact NE-OE1 3.39Å; R357-E359 IonicContact NE-OE2 3.02Å; R357-E359 PolarHBondContact NE-OE2 3.38Å; R357-E359 IonicContact NH2-OE1 3.64Å; R357-E359 PolarHBondContact NH2-OE1 2.97Å; R357-E359 IonicContact NH2-OE2 2.66Å; R357-E359 PolarHBondContact O-N 3.02Å; R357-T360 PolarHBondContact O-N 3.48Å; R357-C361 PolarHBondContact O-N 3.38Å; R357-C361 PolarHBondContact O-SG 3.03Å; R357-C361 VanDerWaalsContact O-SG 3.37Å
358A95.2Very high96.6Very high9 Ų945.9 Ų45.97%0.07421%0.213CC..Hα-helixtrans-63.1-42.2-175.700000111.8C361 C362 A384 L387 K388 Y391A358-C361 PolarHBondContact O-N 3.45Å; A358-C362 PolarHBondContact O-N 2.98Å; A358-A384 WeakPolarHBondContact O-CB 3.13Å; A358-L387 HydrophobicContact CB-CB 4.14Å; A358-K388 HydrophobicContact CB-CB 4.06Å; A358-Y391 HydrophobicContact CB-CD1 4.08Å; A358-Y391 HydrophobicContact CB-CE1 4Å
359E97Very high96.6Very high39 Ų3940.2 Ų40.218%0.18219%0.188CC..Hα-helixtrans-63.8-45.7175.9-58.891.9142.700111D328 R357 C361 C362 V363D328-E359 HydrophobicContact CB-CB 4.44Å; R357-E359 HydrophobicContact CG-CB 4.5Å; R357-E359 WeakPolarHBondContact CG-OE2 3.42Å; R357-E359 IonicContact CZ-OE1 3.66Å; R357-E359 IonicContact CZ-OE2 3.38Å; R357-E359 VanDerWaalsContact NE-CD 3.28Å; R357-E359 IonicContact NE-OE1 3.12Å; R357-E359 PolarHBondContact NE-OE1 3.39Å; R357-E359 IonicContact NE-OE2 3.02Å; R357-E359 PolarHBondContact NE-OE2 3.38Å; R357-E359 IonicContact NH2-OE1 3.64Å; R357-E359 PolarHBondContact NH2-OE1 2.97Å; R357-E359 IonicContact NH2-OE2 2.66Å; R357-E359 PolarHBondContact O-N 3.02Å; E359-C361 VanDerWaalsContact C-N 3.32Å; E359-C361 PolarHBondContact O-N 3.06Å; E359-C362 WeakPolarHBondContact O-CA 3.43Å; E359-C362 VanDerWaalsContact O-CB 3.25Å; E359-C362 WeakPolarHBondContact O-CB 3.49Å; E359-C362 PolarHBondContact O-N 3.27Å; E359-V363 VanDerWaalsContact O-CG2 3.28Å; E359-V363 WeakPolarHBondContact O-CG2 2.95Å; E359-V363 PolarHBondContact O-N 3.09Å
360T97.4Very high96.5Very high2 Ų241 Ų411%0.01219%0.193CC..Hα-helixtrans-57.9-44.8175-57.50000111.8C350 V351 D354 R357 C362 V363 V364C350-T360 HydrophobicContact CB-CG2 3.74Å; V351-T360 HydrophobicContact CG2-CG2 3.94Å; D354-T360 VanDerWaalsContact O-CB 3.24Å; D354-T360 WeakPolarHBondContact O-CB 3.35Å; D354-T360 VanDerWaalsContact O-CG2 3.28Å; D354-T360 WeakPolarHBondContact O-CG2 3.29Å; D354-T360 PolarHBondContact O-OG1 3.11Å; R357-T360 PolarHBondContact O-N 3.48Å; T360-C362 VanDerWaalsContact C-N 3.27Å; T360-C362 PolarHBondContact O-N 2.93Å; T360-V363 PolarHBondContact O-N 2.8Å; T360-V364 HydrophobicContact CG2-CG2 4.48Å; T360-V364 WeakPolarHBondContact O-CG2 3.32Å; T360-V364 PolarHBondContact O-N 3.16Å
361C96.9Very high96.4Very high6 Ų648.5 Ų48.54%0.04122%0.221CC..Hα-helixtrans-61.9-36.8176.6-70.20000111.9R357 A358 E359 G365 A384R357-C361 PolarHBondContact O-N 3.38Å; R357-C361 PolarHBondContact O-SG 3.03Å; R357-C361 VanDerWaalsContact O-SG 3.37Å; A358-C361 PolarHBondContact O-N 3.45Å; E359-C361 VanDerWaalsContact C-N 3.32Å; E359-C361 PolarHBondContact O-N 3.06Å; C361-G365 PolarHBondContact O-N 3.41Å; C361-A384 HydrophobicContact CB-CB 3.67Å
362C97.2Very high96.3Very high0 Ų048.1 Ų48.10%023%0.229CC..Hα-helixtrans-63.3-47.3174.1-169.40000111.9D328 A358 E359 T360 V364 G365 N366 F381 V394 L397D328-C362 HydrophobicContact CB-CB 4.13Å; A358-C362 PolarHBondContact O-N 2.98Å; E359-C362 WeakPolarHBondContact O-CA 3.43Å; E359-C362 VanDerWaalsContact O-CB 3.25Å; E359-C362 WeakPolarHBondContact O-CB 3.49Å; E359-C362 PolarHBondContact O-N 3.27Å; T360-C362 VanDerWaalsContact C-N 3.27Å; T360-C362 PolarHBondContact O-N 2.93Å; C362-V364 VanDerWaalsContact C-N 3.34Å; C362-V364 PolarHBondContact O-N 2.95Å; C362-G365 WeakPolarHBondContact O-CA 3.46Å; C362-G365 PolarHBondContact O-N 2.68Å; C362-G365 VanDerWaalsContact O-N 3.11Å; C362-N366 PolarHBondContact O-N 3.21Å; C362-F381 WeakPolarHBondContact O-CE1 3.18Å; C362-V394 HydrophobicContact CB-CG2 4.26Å; C362-L397 WeakPolarHBondContact SG-CD1 3.37Å
363V97.8Very high96.4Very high0 Ų046.2 Ų46.20%022%0.216CC..Hα-helixtrans-58.7-46178.5176.40000111.2V327 L343 L346 A347 E359 T360 G365 N366 F367V327-V363 HydrophobicContact CB-CG2 4.35Å; V327-V363 HydrophobicContact CG1-CG2 3.62Å; L343-V363 HydrophobicContact CD1-CG1 4.5Å; L346-V363 HydrophobicContact CB-CG1 4.45Å; L346-V363 HydrophobicContact CD2-CG1 4.03Å; L346-V363 HydrophobicContact CG-CG1 3.93Å; A347-V363 HydrophobicContact CB-CG1 4.06Å; E359-V363 VanDerWaalsContact O-CG2 3.28Å; E359-V363 WeakPolarHBondContact O-CG2 2.95Å; E359-V363 PolarHBondContact O-N 3.09Å; T360-V363 PolarHBondContact O-N 2.8Å; V363-G365 VanDerWaalsContact C-N 3.31Å; V363-G365 PolarHBondContact O-N 3.34Å; V363-N366 PolarHBondContact O-N 3.1Å; V363-F367 PolarHBondContact O-N 2.9Å
364V97.6Very high96.4Very high8 Ų844.5 Ų44.55%0.04821%0.206CC..Hα-helixtrans-66.4-36.1177.6178.30000111.3A347 V351 T360 C362 F367 F368 Y380A347-V364 HydrophobicContact CB-CG2 4.38Å; V351-V364 HydrophobicContact CG2-CG2 3.39Å; T360-V364 HydrophobicContact CG2-CG2 4.48Å; T360-V364 WeakPolarHBondContact O-CG2 3.32Å; T360-V364 PolarHBondContact O-N 3.16Å; C362-V364 VanDerWaalsContact C-N 3.34Å; C362-V364 PolarHBondContact O-N 2.95Å; V364-F367 WeakPolarHBondContact O-CB 3.45Å; V364-F367 PolarHBondContact O-N 3.36Å; V364-F368 HydrophobicContact CG1-CD2 3.76Å; V364-F368 HydrophobicContact CG1-CE2 3.52Å; V364-F368 WeakPolarHBondContact O-CD2 3.48Å; V364-F368 PolarHBondContact O-N 3.27Å; V364-F368 VanDerWaalsContact O-N 3.09Å; V364-Y380 HydrophobicContact CB-CD1 3.93Å; V364-Y380 HydrophobicContact CB-CE1 4.2Å; V364-Y380 HydrophobicContact CB-CG 4.3Å; V364-Y380 HydrophobicContact CG1-CD1 3.56Å; V364-Y380 HydrophobicContact CG1-CD2 3.97Å; V364-Y380 HydrophobicContact CG1-CE1 3.49Å; V364-Y380 VanDerWaalsContact CG1-CE1 3.49Å; V364-Y380 HydrophobicContact CG1-CE2 3.95Å; V364-Y380 HydrophobicContact CG1-CG 3.79Å
365G97.1Very high96.4Very high0 Ų048.1 Ų48.10%022%0.221CC..Hα-helixtrans-56.8-54172.200000111.6C361 C362 V363 F367 F368 G369 A377C361-G365 PolarHBondContact O-N 3.41Å; C362-G365 WeakPolarHBondContact O-CA 3.46Å; C362-G365 PolarHBondContact O-N 2.68Å; C362-G365 VanDerWaalsContact O-N 3.11Å; V363-G365 VanDerWaalsContact C-N 3.31Å; V363-G365 PolarHBondContact O-N 3.34Å; G365-F367 VanDerWaalsContact C-N 3.3Å; G365-F367 PolarHBondContact O-N 3.37Å; G365-F368 PolarHBondContact O-N 3Å; G365-F368 VanDerWaalsContact O-N 3.08Å; G365-G369 PolarHBondContact O-N 3.46Å; G365-A377 VanDerWaalsContact O-CB 3.31Å; G365-A377 WeakPolarHBondContact O-CB 3.43Å
366N98Very high96.5Very high1 Ų146.4 Ų46.41%0.00522%0.217CC..Hα-helixtrans-58.3-40.1177-73.1-18.3000112.7S331 N332 F335 L343 C362 V363 F368 G369 L370 F381S331-N366 PolarHBondContact OG-ND2 3.19Å; N332-N366 PolarHBondContact OD1-ND2 3.22Å; F335-N366 HydrophobicContact CD2-CB 4.38Å; L343-N366 HydrophobicContact CD2-CB 4.48Å; C362-N366 PolarHBondContact O-N 3.21Å; V363-N366 PolarHBondContact O-N 3.1Å; N366-F368 VanDerWaalsContact C-N 3.34Å; N366-F368 PolarHBondContact O-N 3.14Å; N366-G369 PolarHBondContact O-N 2.91Å; N366-L370 PolarHBondContact O-N 3.33Å; N366-F381 VanDerWaalsContact OD1-CZ 3.32Å; N366-F381 WeakPolarHBondContact OD1-CZ 3.35Å
367F97.7Very high96.8Very high35 Ų3538.2 Ų38.215%0.15419%0.185CC..Hα-helixtrans-59.3-43.2174.9165.9-101.6000112.6L343 A344 A347 V363 V364 G365 R371L343-F367 HydrophobicContact CD2-CB 4.48Å; L343-F367 HydrophobicContact CG-CB 4.18Å; A344-F367 HydrophobicContact CB-CD2 4Å; A344-F367 HydrophobicContact CB-CE2 3.55Å; A347-F367 HydrophobicContact CB-CB 3.94Å; A347-F367 HydrophobicContact CB-CG 4.12Å; V363-F367 PolarHBondContact O-N 2.9Å; V364-F367 WeakPolarHBondContact O-CB 3.45Å; V364-F367 PolarHBondContact O-N 3.36Å; G365-F367 VanDerWaalsContact C-N 3.3Å; G365-F367 PolarHBondContact O-N 3.37Å; F367-R371 VanDerWaalsContact CE2-NE 3.3Å; F367-R371 PolarHBondContact O-N 3.43Å
368F98Very high96.9Very high33 Ų3335.9 Ų35.915%0.14518%0.177CC..Hα-helixtrans-72.1-36.1175.9-77.6-63.1000112.5V364 G365 N366 R371 G372 Q373 K376 A377 Y380V364-F368 HydrophobicContact CG1-CD2 3.76Å; V364-F368 HydrophobicContact CG1-CE2 3.52Å; V364-F368 WeakPolarHBondContact O-CD2 3.48Å; V364-F368 PolarHBondContact O-N 3.27Å; V364-F368 VanDerWaalsContact O-N 3.09Å; G365-F368 PolarHBondContact O-N 3Å; G365-F368 VanDerWaalsContact O-N 3.08Å; N366-F368 VanDerWaalsContact C-N 3.34Å; N366-F368 PolarHBondContact O-N 3.14Å; F368-R371 PolarHBondContact O-N 3.44Å; F368-G372 PolarHBondContact O-N 3.07Å; F368-Q373 HydrophobicContact CB-CB 4.32Å; F368-Q373 HydrophobicContact CD1-CB 4.19Å; F368-Q373 PolarHBondContact O-N 2.94Å; F368-K376 HydrophobicContact CB-CB 4.27Å; F368-K376 HydrophobicContact CD1-CB 4.25Å; F368-K376 HydrophobicContact CD1-CD 4.19Å; F368-K376 HydrophobicContact CD2-CB 4.4Å; F368-K376 HydrophobicContact CE1-CD 4.12Å; F368-K376 HydrophobicContact CG-CB 4.06Å; F368-A377 HydrophobicContact CB-CB 4.14Å; F368-Y380 AromaticContact CD2-CD2 3.79Å; F368-Y380 HydrophobicContact CD2-CD2 3.79Å; F368-Y380 AromaticContact CD2-CE2 3.84Å; F368-Y380 HydrophobicContact CD2-CE2 3.84Å; F368-Y380 AromaticContact CE2-CD2 3.84Å; F368-Y380 HydrophobicContact CE2-CD2 3.84Å; F368-Y380 AromaticContact CE2-CE2 3.38Å; F368-Y380 HydrophobicContact CE2-CE2 3.38Å; F368-Y380 AromaticContact CE2-CZ 4Å; F368-Y380 HydrophobicContact CZ-CE2 4.34Å
369G97Very high97Very high5 Ų539.3 Ų39.35%0.05219%0.193CC..Hα-helixtrans-58.6-47.9174.500000111.5G365 N366 R371 G372 E401G365-G369 PolarHBondContact O-N 3.46Å; N366-G369 PolarHBondContact O-N 2.91Å; G369-R371 PolarHBondContact O-N 3.14Å; G369-G372 PolarHBondContact O-N 3.4Å; G369-E401 WeakPolarHBondContact CA-OE1 3.33Å
370L95.8Very high96.9Very high53 Ų5340.1 Ų40.128%0.27720%0.195SC..Hα-helixtrans-65.1-25.6179-168.864.4000112.5F335 L343 N366 G372F335-L370 HydrophobicContact CD2-CB 3.81Å; F335-L370 HydrophobicContact CD2-CD1 4.16Å; F335-L370 HydrophobicContact CD2-CG 4.49Å; F335-L370 HydrophobicContact CE2-CB 3.93Å; F335-L370 HydrophobicContact CE2-CD1 4.27Å; L343-L370 HydrophobicContact CD2-CB 4.07Å; L343-L370 HydrophobicContact CD2-CD2 3.66Å; N366-L370 PolarHBondContact O-N 3.33Å; L370-G372 VanDerWaalsContact C-N 3.26Å; L370-G372 PolarHBondContact O-N 3.24Å
371R95.9Very high96.9Very high157 Ų15740 Ų4059%0.59219%0.194SC*.THydrogen-bonded Turntrans-82.84.9173.1-74.9-170.2173-134.42.2113.9F367 F368 G369 Q373F367-R371 VanDerWaalsContact CE2-NE 3.3Å; F367-R371 PolarHBondContact O-N 3.43Å; F368-R371 PolarHBondContact O-N 3.44Å; G369-R371 PolarHBondContact O-N 3.14Å; R371-Q373 PolarHBondContact O-N 2.64Å
372G95Very high96.8Very high46 Ų4646.5 Ų46.547%0.47422%0.218SC..THydrogen-bonded Turntrans70.513.8-175.800000114.3F368 G369 L370 H374F368-G372 PolarHBondContact O-N 3.07Å; G369-G372 PolarHBondContact O-N 3.4Å; L370-G372 VanDerWaalsContact C-N 3.26Å; L370-G372 PolarHBondContact O-N 3.24Å; G372-H374 VanDerWaalsContact C-N 3.33Å; G372-H374 PolarHBondContact O-CD2 3.29Å; G372-H374 PolarHBondContact O-N 2.61Å
373Q97.2Very high96.6Very high67 Ų6751.6 Ų51.631%0.31324%0.237SC..  trans-95.160.1179.3-64.6-17831.300110.7F368 R371 E375 K376 A377F368-Q373 HydrophobicContact CB-CB 4.32Å; F368-Q373 HydrophobicContact CD1-CB 4.19Å; F368-Q373 PolarHBondContact O-N 2.94Å; R371-Q373 PolarHBondContact O-N 2.64Å; Q373-E375 PolarHBondContact O-N 3.14Å; Q373-K376 HydrophobicContact CB-CB 4.37Å; Q373-K376 HydrophobicContact CB-CD 4.49Å; Q373-K376 PolarHBondContact O-N 3.33Å; Q373-K376 VanDerWaalsContact OE1-CD 3.32Å; Q373-A377 PolarHBondContact O-N 3.49Å
374H97.5Very high96.5Very high41 Ų4151.6 Ų51.619%0.1924%0.237CC..Hα-helixtrans-57.3-40.8-171.1-53.5-62.9000113.9G372 K376 A377 V378 E401 L405G372-H374 VanDerWaalsContact C-N 3.33Å; G372-H374 PolarHBondContact O-CD2 3.29Å; G372-H374 PolarHBondContact O-N 2.61Å; H374-K376 VanDerWaalsContact C-N 3.29Å; H374-K376 PolarHBondContact O-N 3.48Å; H374-A377 WeakPolarHBondContact O-CB 3.48Å; H374-A377 PolarHBondContact O-N 2.88Å; H374-A377 VanDerWaalsContact O-N 3.15Å; H374-V378 WeakPolarHBondContact O-CG2 3.24Å; H374-V378 PolarHBondContact O-N 3.11Å; H374-E401 WeakPolarHBondContact CA-OE2 3.5Å; H374-E401 WeakPolarHBondContact CB-OE2 3.39Å; H374-E401 IonicContact CE1-OE2 2.88Å; H374-E401 IonicContact CG-OE2 2.91Å; H374-E401 IonicContact ND1-OE2 2.7Å; H374-E401 PolarHBondContact ND1-OE2 3.16Å; H374-L405 HydrophobicContact CB-CD1 4.14Å; H374-L405 HydrophobicContact CB-CD2 3.78Å; H374-L405 HydrophobicContact CB-CG 3.7Å
375E95.9Very high96.2Very high145 Ų14551.9 Ų51.968%0.67824%0.238SC*.Hα-helixtrans-60.1-40.1177-63.3-174.8164.500112.2Q373 I379 L405Q373-E375 PolarHBondContact O-N 3.14Å; E375-I379 WeakPolarHBondContact O-CG1 3.43Å; E375-I379 PolarHBondContact O-N 3.5Å; E375-L405 HydrophobicContact CG-CD1 4.39Å; E375-L405 HydrophobicContact CG-CD2 3.97Å
376K96.9Very high95.8Very high101 Ų10158.3 Ų58.344%0.43927%0.266SS..Hα-helixtrans-70.8-39176.4-67.4-172.6-167.2163.70111.2F368 Q373 H374 V378 I379 Y380F368-K376 HydrophobicContact CB-CB 4.27Å; F368-K376 HydrophobicContact CD1-CB 4.25Å; F368-K376 HydrophobicContact CD1-CD 4.19Å; F368-K376 HydrophobicContact CD2-CB 4.4Å; F368-K376 HydrophobicContact CE1-CD 4.12Å; F368-K376 HydrophobicContact CG-CB 4.06Å; Q373-K376 HydrophobicContact CB-CB 4.37Å; Q373-K376 HydrophobicContact CB-CD 4.49Å; Q373-K376 PolarHBondContact O-N 3.33Å; Q373-K376 VanDerWaalsContact OE1-CD 3.32Å; H374-K376 VanDerWaalsContact C-N 3.29Å; H374-K376 PolarHBondContact O-N 3.48Å; K376-V378 VanDerWaalsContact C-N 3.32Å; K376-V378 PolarHBondContact O-N 3.26Å; K376-I379 WeakPolarHBondContact O-CB 3.36Å; K376-I379 PolarHBondContact O-N 3.37Å; K376-I379 VanDerWaalsContact O-N 3.15Å; K376-Y380 WeakPolarHBondContact O-CD2 3.49Å; K376-Y380 PolarHBondContact O-N 3.16Å; K376-Y380 VanDerWaalsContact O-N 3.14Å
377A97.5Very high95.4Very high0 Ų062.3 Ų62.30%029%0.287CS..Hα-helixtrans-55.3-50174.700000110.7G365 F368 Q373 H374 I379 Y380 F381 E401G365-A377 VanDerWaalsContact O-CB 3.31Å; G365-A377 WeakPolarHBondContact O-CB 3.43Å; F368-A377 HydrophobicContact CB-CB 4.14Å; Q373-A377 PolarHBondContact O-N 3.49Å; H374-A377 WeakPolarHBondContact O-CB 3.48Å; H374-A377 PolarHBondContact O-N 2.88Å; H374-A377 VanDerWaalsContact O-N 3.15Å; A377-I379 VanDerWaalsContact C-N 3.31Å; A377-I379 PolarHBondContact O-N 2.8Å; A377-Y380 PolarHBondContact O-N 3.23Å; A377-F381 HydrophobicContact CB-CD2 4.39Å; A377-F381 HydrophobicContact CB-CE2 4Å; A377-F381 WeakPolarHBondContact O-CD2 3.42Å; A377-F381 WeakPolarHBondContact O-CG 3.34Å; A377-F381 PolarHBondContact O-N 3.34Å; A377-E401 HydrophobicContact CB-CG 3.96Å
378V97Very high95Very high6 Ų665.7 Ų65.74%0.03630%0.302CS..Hα-helixtrans-58-39.1176.2174.70000112.3H374 K376 Y380 F381 R382 E401 F402 L405H374-V378 WeakPolarHBondContact O-CG2 3.24Å; H374-V378 PolarHBondContact O-N 3.11Å; K376-V378 VanDerWaalsContact C-N 3.32Å; K376-V378 PolarHBondContact O-N 3.26Å; V378-Y380 VanDerWaalsContact C-N 3.35Å; V378-Y380 PolarHBondContact O-N 3.19Å; V378-F381 PolarHBondContact O-N 2.92Å; V378-R382 HydrophobicContact CG1-CG 4.37Å; V378-R382 WeakPolarHBondContact O-CB 3.36Å; V378-R382 VanDerWaalsContact O-CG 3.31Å; V378-R382 WeakPolarHBondContact O-CG 3.29Å; V378-R382 PolarHBondContact O-N 3.16Å; V378-E401 HydrophobicContact CG2-CB 3.6Å; V378-E401 HydrophobicContact CG2-CG 4.3Å; V378-F402 HydrophobicContact CG1-CE1 4.34Å; V378-F402 HydrophobicContact CG1-CE2 4.29Å; V378-F402 HydrophobicContact CG1-CZ 3.79Å; V378-F402 HydrophobicContact CG2-CE1 4.41Å; V378-F402 HydrophobicContact CG2-CZ 4.41Å; V378-L405 HydrophobicContact CG2-CD1 4.44Å
379I96Very high94.5Very high81 Ų8166 Ų6642%0.41531%0.307SS..Hα-helixtrans-60.7-44.2176-68.8165.8000111.1E375 K376 A377 R382 R383E375-I379 WeakPolarHBondContact O-CG1 3.43Å; E375-I379 PolarHBondContact O-N 3.5Å; K376-I379 WeakPolarHBondContact O-CB 3.36Å; K376-I379 PolarHBondContact O-N 3.37Å; K376-I379 VanDerWaalsContact O-N 3.15Å; A377-I379 VanDerWaalsContact C-N 3.31Å; A377-I379 PolarHBondContact O-N 2.8Å; I379-R382 PolarHBondContact O-N 3.3Å; I379-R383 WeakPolarHBondContact O-CG 3.25Å; I379-R383 PolarHBondContact O-N 2.83Å; I379-R383 VanDerWaalsContact O-N 3.11Å
380Y95.9Very high94Very high55 Ų5568.5 Ų68.522%0.21633%0.327CS..Hα-helixtrans-71-38.7178.8-83.1-85.9000112.4V364 F368 K376 A377 V378 R382 R383 A384V364-Y380 HydrophobicContact CB-CD1 3.93Å; V364-Y380 HydrophobicContact CB-CE1 4.2Å; V364-Y380 HydrophobicContact CB-CG 4.3Å; V364-Y380 HydrophobicContact CG1-CD1 3.56Å; V364-Y380 HydrophobicContact CG1-CD2 3.97Å; V364-Y380 HydrophobicContact CG1-CE1 3.49Å; V364-Y380 VanDerWaalsContact CG1-CE1 3.49Å; V364-Y380 HydrophobicContact CG1-CE2 3.95Å; V364-Y380 HydrophobicContact CG1-CG 3.79Å; F368-Y380 AromaticContact CD2-CD2 3.79Å; F368-Y380 HydrophobicContact CD2-CD2 3.79Å; F368-Y380 AromaticContact CD2-CE2 3.84Å; F368-Y380 HydrophobicContact CD2-CE2 3.84Å; F368-Y380 AromaticContact CE2-CD2 3.84Å; F368-Y380 HydrophobicContact CE2-CD2 3.84Å; F368-Y380 AromaticContact CE2-CE2 3.38Å; F368-Y380 HydrophobicContact CE2-CE2 3.38Å; F368-Y380 AromaticContact CE2-CZ 4Å; F368-Y380 HydrophobicContact CZ-CE2 4.34Å; K376-Y380 WeakPolarHBondContact O-CD2 3.49Å; K376-Y380 PolarHBondContact O-N 3.16Å; K376-Y380 VanDerWaalsContact O-N 3.14Å; A377-Y380 PolarHBondContact O-N 3.23Å; V378-Y380 VanDerWaalsContact C-N 3.35Å; V378-Y380 PolarHBondContact O-N 3.19Å; Y380-R382 VanDerWaalsContact C-N 3.35Å; Y380-R382 PolarHBondContact O-N 2.78Å; Y380-R383 VanDerWaalsContact CZ-NH1 3.29Å; Y380-R383 WeakPolarHBondContact O-CA 3.27Å; Y380-R383 WeakPolarHBondContact O-CB 3.44Å; Y380-R383 PolarHBondContact O-N 2.78Å; Y380-R383 VanDerWaalsContact O-N 3.08Å; Y380-A384 PolarHBondContact O-N 3.05Å
381F96.9Very high93.9Very high0 Ų066.8 Ų66.80%032%0.317CS..Hα-helixtrans-62.8-40.3172.5-67-44.9000112.5C362 N366 A377 V378 R383 A384 L385 V394 L397 I398 E401C362-F381 WeakPolarHBondContact O-CE1 3.18Å; N366-F381 VanDerWaalsContact OD1-CZ 3.32Å; N366-F381 WeakPolarHBondContact OD1-CZ 3.35Å; A377-F381 HydrophobicContact CB-CD2 4.39Å; A377-F381 HydrophobicContact CB-CE2 4Å; A377-F381 WeakPolarHBondContact O-CD2 3.42Å; A377-F381 WeakPolarHBondContact O-CG 3.34Å; A377-F381 PolarHBondContact O-N 3.34Å; V378-F381 PolarHBondContact O-N 2.92Å; F381-R383 VanDerWaalsContact C-N 3.26Å; F381-R383 PolarHBondContact O-N 3.43Å; F381-A384 WeakPolarHBondContact O-CA 3.44Å; F381-A384 WeakPolarHBondContact O-CB 3.48Å; F381-A384 PolarHBondContact O-N 3.31Å; F381-L385 PolarHBondContact O-N 2.91Å; F381-V394 HydrophobicContact CB-CG1 3.69Å; F381-V394 HydrophobicContact CD1-CG1 3.99Å; F381-V394 HydrophobicContact CG-CG1 4.16Å; F381-V394 WeakPolarHBondContact O-CG1 3.4Å; F381-L397 HydrophobicContact CE1-CB 4.1Å; F381-L397 HydrophobicContact CE1-CD1 3.79Å; F381-L397 HydrophobicContact CE2-CB 4.07Å; F381-L397 HydrophobicContact CZ-CB 3.85Å; F381-L397 HydrophobicContact CZ-CD1 4.04Å; F381-L397 HydrophobicContact CZ-CG 4.48Å; F381-I398 HydrophobicContact CB-CD1 3.68Å; F381-I398 HydrophobicContact CB-CG1 3.35Å; F381-I398 HydrophobicContact CD2-CG1 4.03Å; F381-I398 HydrophobicContact CG-CG1 3.98Å; F381-E401 HydrophobicContact CD2-CG 4.05Å; F381-E401 HydrophobicContact CE2-CG 3.59Å
382R94.3Very high93.8Very high143 Ų14360 Ų6054%0.5429%0.293SS..Hα-helixtrans-61-34.4171.7-76.4177.5174.7176.2-1.3112.5V378 I379 Y380 L385 K386V378-R382 HydrophobicContact CG1-CG 4.37Å; V378-R382 WeakPolarHBondContact O-CB 3.36Å; V378-R382 VanDerWaalsContact O-CG 3.31Å; V378-R382 WeakPolarHBondContact O-CG 3.29Å; V378-R382 PolarHBondContact O-N 3.16Å; I379-R382 PolarHBondContact O-N 3.3Å; Y380-R382 VanDerWaalsContact C-N 3.35Å; Y380-R382 PolarHBondContact O-N 2.78Å; R382-L385 PolarHBondContact O-N 3.16Å; R382-K386 WeakPolarHBondContact O-CG 3.32Å; R382-K386 PolarHBondContact O-N 3.43Å
383R93.8Very high93.8Very high106 Ų10658.6 Ų58.640%0.428%0.275SS..Hα-helixtrans-65.8-41.7171.7-69.1172.8-179.2166.50.8111.5I379 Y380 F381 L385 K386 L387I379-R383 WeakPolarHBondContact O-CG 3.25Å; I379-R383 PolarHBondContact O-N 2.83Å; I379-R383 VanDerWaalsContact O-N 3.11Å; Y380-R383 VanDerWaalsContact CZ-NH1 3.29Å; Y380-R383 WeakPolarHBondContact O-CA 3.27Å; Y380-R383 WeakPolarHBondContact O-CB 3.44Å; Y380-R383 PolarHBondContact O-N 2.78Å; Y380-R383 VanDerWaalsContact O-N 3.08Å; F381-R383 VanDerWaalsContact C-N 3.26Å; F381-R383 PolarHBondContact O-N 3.43Å; R383-L385 VanDerWaalsContact C-N 3.31Å; R383-L385 PolarHBondContact O-N 3.03Å; R383-K386 WeakPolarHBondContact O-CB 3.26Å; R383-K386 PolarHBondContact O-N 2.94Å; R383-L387 PolarHBondContact O-N 2.97Å
384A94.6Very high93.8Very high0 Ų055.4 Ų55.40%026%0.26CS..Hα-helixtrans-59.2-42.9174.200000111.5A358 C361 Y380 F381 K386 L387 K388 V394A358-A384 WeakPolarHBondContact O-CB 3.13Å; C361-A384 HydrophobicContact CB-CB 3.67Å; Y380-A384 PolarHBondContact O-N 3.05Å; F381-A384 WeakPolarHBondContact O-CA 3.44Å; F381-A384 WeakPolarHBondContact O-CB 3.48Å; F381-A384 PolarHBondContact O-N 3.31Å; A384-K386 VanDerWaalsContact C-N 3.34Å; A384-K386 PolarHBondContact O-N 3.15Å; A384-L387 WeakPolarHBondContact O-CB 3.47Å; A384-L387 PolarHBondContact O-N 3.44Å; A384-L387 VanDerWaalsContact O-N 3.13Å; A384-K388 PolarHBondContact O-N 3.42Å; A384-V394 HydrophobicContact CB-CG1 4.19Å; A384-V394 HydrophobicContact CB-CG2 4.16Å
385L91.8Very high93.8Very high15 Ų1555.5 Ų55.58%0.07926%0.259CS..Hα-helixtrans-66.9-31176.9-68.4-179.7000113.9F381 R382 R383 L387 K388 P389 V394 W395 I398F381-L385 PolarHBondContact O-N 2.91Å; R382-L385 PolarHBondContact O-N 3.16Å; R383-L385 VanDerWaalsContact C-N 3.31Å; R383-L385 PolarHBondContact O-N 3.03Å; L385-L387 PolarHBondContact O-N 3.45Å; L385-K388 CarbonylContact O-C 3.6Å; L385-K388 VanDerWaalsContact O-C 3.28Å; L385-P389 VanDerWaalsContact O-CA 3.31Å; L385-P389 WeakPolarHBondContact O-CA 3.41Å; L385-V394 HydrophobicContact CD1-CG1 4.43Å; L385-V394 HydrophobicContact CD2-CB 4.02Å; L385-V394 HydrophobicContact CD2-CG1 3.87Å; L385-V394 HydrophobicContact CG-CB 4.47Å; L385-V394 HydrophobicContact CG-CG1 3.77Å; L385-W395 HydrophobicContact CD1-CD2 3.76Å; L385-W395 HydrophobicContact CD1-CE3 3.92Å; L385-W395 HydrophobicContact CD1-CG 4.49Å; L385-W395 HydrophobicContact CD1-CH2 3.79Å; L385-W395 HydrophobicContact CD1-CZ2 3.6Å; L385-W395 HydrophobicContact CD1-CZ3 3.94Å; L385-W395 HydrophobicContact CD2-CD2 4.19Å; L385-W395 HydrophobicContact CD2-CG 4.19Å; L385-W395 HydrophobicContact CD2-CZ2 4.37Å; L385-I398 HydrophobicContact CD1-CD1 3.36Å; L385-I398 HydrophobicContact CG-CD1 4.2Å
386K88.7Confident93.8Very high135 Ų13548.7 Ų48.759%0.58723%0.227SC*.Hα-helixtrans-63.1-31.9172.1-74.9-179.3-178.9-167.20112.1R382 R383 A384R382-K386 WeakPolarHBondContact O-CG 3.32Å; R382-K386 PolarHBondContact O-N 3.43Å; R383-K386 WeakPolarHBondContact O-CB 3.26Å; R383-K386 PolarHBondContact O-N 2.94Å; A384-K386 VanDerWaalsContact C-N 3.34Å; A384-K386 PolarHBondContact O-N 3.15Å
387L89.1Confident93.8Very high85 Ų8544.8 Ų44.845%0.44521%0.211SC..Hα-helixtrans-84.4-43.2179.1-62167.7000111.8Y356 A358 R383 A384 L385Y356-L387 WeakPolarHBondContact O-CD1 3.5Å; A358-L387 HydrophobicContact CB-CB 4.14Å; R383-L387 PolarHBondContact O-N 2.97Å; A384-L387 WeakPolarHBondContact O-CB 3.47Å; A384-L387 PolarHBondContact O-N 3.44Å; A384-L387 VanDerWaalsContact O-N 3.13Å; L385-L387 PolarHBondContact O-N 3.45Å
388K89.9Confident93.8Very high106 Ų10645 Ų4546%0.46121%0.212SC..  trans-130.295.9176.8-172.3179.3177.9179.40109.7A358 A384 L385 A390 Y391A358-K388 HydrophobicContact CB-CB 4.06Å; A384-K388 PolarHBondContact O-N 3.42Å; L385-K388 CarbonylContact O-C 3.6Å; L385-K388 VanDerWaalsContact O-C 3.28Å; K388-A390 VanDerWaalsContact C-N 3.34Å; K388-A390 PolarHBondContact O-N 2.91Å; K388-Y391 HydrophobicContact CB-CD1 4.25Å; K388-Y391 HydrophobicContact CD-CD1 4.04Å; K388-Y391 HydrophobicContact CD-CD2 4.48Å; K388-Y391 HydrophobicContact CD-CG 3.94Å; K388-Y391 HydrophobicContact CG-CG 4.4Å; K388-Y391 VanDerWaalsContact O-CB 3.24Å; K388-Y391 WeakPolarHBondContact O-CB 3Å; K388-Y391 PolarHBondContact O-N 3.08Å
389P87Confident93.8Very high40 Ų4044.7 Ų44.726%0.2621%0.21SC..THydrogen-bonded Turntrans-64.4-36.6-177.6-25.735.4000113.8L385 Y391 W395L385-P389 VanDerWaalsContact O-CA 3.31Å; L385-P389 WeakPolarHBondContact O-CA 3.41Å; P389-Y391 PolarHBondContact O-N 3.32Å; P389-Y391 VanDerWaalsContact O-N 3.15Å; P389-W395 PolarHBondContact O-NE1 3.31Å; P389-W395 VanDerWaalsContact O-NE1 3.17Å
390A87.5Confident93.8Very high56 Ų5643.9 Ų43.946%0.46320%0.204SC..THydrogen-bonded Turntrans-83.226.2179.900000113.4K388 S392 Y421K388-A390 VanDerWaalsContact C-N 3.34Å; K388-A390 PolarHBondContact O-N 2.91Å; A390-S392 PolarHBondContact O-N 3.41Å; A390-S392 VanDerWaalsContact O-N 3.11Å; A390-Y421 HydrophobicContact CB-CD1 3.56Å; A390-Y421 HydrophobicContact CB-CE1 3.72Å; A390-Y421 HydrophobicContact CB-CG 4.28Å
391Y93.7Very high93.9Very high17 Ų1741.6 Ų41.67%0.06720%0.196CC..  trans-85.883.4-177.3-158169.4000111.2D328 A358 K388 P389 L393 V394 W395D328-Y391 VanDerWaalsContact CB-OH 3.25Å; D328-Y391 WeakPolarHBondContact CB-OH 3.28Å; D328-Y391 PolarHBondContact OD2-OH 2.98Å; A358-Y391 HydrophobicContact CB-CD1 4.08Å; A358-Y391 HydrophobicContact CB-CE1 4Å; K388-Y391 HydrophobicContact CB-CD1 4.25Å; K388-Y391 HydrophobicContact CD-CD1 4.04Å; K388-Y391 HydrophobicContact CD-CD2 4.48Å; K388-Y391 HydrophobicContact CD-CG 3.94Å; K388-Y391 HydrophobicContact CG-CG 4.4Å; K388-Y391 VanDerWaalsContact O-CB 3.24Å; K388-Y391 WeakPolarHBondContact O-CB 3Å; K388-Y391 PolarHBondContact O-N 3.08Å; P389-Y391 PolarHBondContact O-N 3.32Å; P389-Y391 VanDerWaalsContact O-N 3.15Å; Y391-L393 VanDerWaalsContact C-N 3.33Å; Y391-L393 HydrophobicContact CD2-CB 4.08Å; Y391-L393 HydrophobicContact CE2-CB 3.82Å; Y391-L393 HydrophobicContact CE2-CD2 4.27Å; Y391-L393 PolarHBondContact O-N 3.47Å; Y391-V394 HydrophobicContact CD1-CB 4.24Å; Y391-V394 HydrophobicContact CD1-CG2 3.34Å; Y391-V394 HydrophobicContact CD2-CG2 4.04Å; Y391-V394 HydrophobicContact CE1-CG2 3.55Å; Y391-V394 HydrophobicContact CE2-CG2 4.23Å; Y391-V394 HydrophobicContact CG-CB 4.13Å; Y391-V394 HydrophobicContact CG-CG2 3.6Å; Y391-V394 PolarHBondContact O-N 2.8Å; Y391-V394 VanDerWaalsContact O-N 3.12Å; Y391-W395 PolarHBondContact O-N 3.38Å
392S93.1Very high93.9Very high14 Ų1442.7 Ų42.710%0.09820%0.201CC..Hα-helixtrans-50.7-46.9-176.8-174.90000113.9A390 V394 W395 T396 A418 N422A390-S392 PolarHBondContact O-N 3.41Å; A390-S392 VanDerWaalsContact O-N 3.11Å; S392-V394 VanDerWaalsContact C-N 3.27Å; S392-V394 PolarHBondContact O-N 3.12Å; S392-W395 WeakPolarHBondContact O-CB 3.49Å; S392-W395 PolarHBondContact O-N 3.06Å; S392-W395 VanDerWaalsContact O-N 3.11Å; S392-T396 PolarHBondContact O-N 3.17Å; S392-T396 VanDerWaalsContact O-N 3.12Å; S392-T396 PolarHBondContact O-OG1 3.26Å; S392-A418 PolarHBondContact OG-O 3.19Å; S392-N422 VanDerWaalsContact OG-CB 3.27Å; S392-N422 WeakPolarHBondContact OG-CB 3.45Å
393L95.2Very high93.9Very high18 Ų1838.6 Ų38.69%0.09419%0.188CC..Hα-helixtrans-55.9-42.8-178.9175.766000112.3D328 Y391 W395 T396 L397D328-L393 HydrophobicContact CB-CD2 4.21Å; D328-L393 WeakPolarHBondContact OD2-CD2 3.35Å; Y391-L393 VanDerWaalsContact C-N 3.33Å; Y391-L393 HydrophobicContact CD2-CB 4.08Å; Y391-L393 HydrophobicContact CE2-CB 3.82Å; Y391-L393 HydrophobicContact CE2-CD2 4.27Å; Y391-L393 PolarHBondContact O-N 3.47Å; L393-W395 VanDerWaalsContact C-N 3.34Å; L393-W395 PolarHBondContact O-N 3.39Å; L393-T396 WeakPolarHBondContact O-CB 3.24Å; L393-T396 PolarHBondContact O-N 3.02Å; L393-L397 HydrophobicContact CG-CD1 4.2Å; L393-L397 WeakPolarHBondContact O-CG 3.31Å; L393-L397 PolarHBondContact O-N 3.47Å
394V96.6Very high94Very high0 Ų039.1 Ų39.10%020%0.195CC..Hα-helixtrans-68.1-35.7-179.1175.40000111.2C362 F381 A384 L385 Y391 S392 T396 L397 I398C362-V394 HydrophobicContact CB-CG2 4.26Å; F381-V394 HydrophobicContact CB-CG1 3.69Å; F381-V394 HydrophobicContact CD1-CG1 3.99Å; F381-V394 HydrophobicContact CG-CG1 4.16Å; F381-V394 WeakPolarHBondContact O-CG1 3.4Å; A384-V394 HydrophobicContact CB-CG1 4.19Å; A384-V394 HydrophobicContact CB-CG2 4.16Å; L385-V394 HydrophobicContact CD1-CG1 4.43Å; L385-V394 HydrophobicContact CD2-CB 4.02Å; L385-V394 HydrophobicContact CD2-CG1 3.87Å; L385-V394 HydrophobicContact CG-CB 4.47Å; L385-V394 HydrophobicContact CG-CG1 3.77Å; Y391-V394 HydrophobicContact CD1-CB 4.24Å; Y391-V394 HydrophobicContact CD1-CG2 3.34Å; Y391-V394 HydrophobicContact CD2-CG2 4.04Å; Y391-V394 HydrophobicContact CE1-CG2 3.55Å; Y391-V394 HydrophobicContact CE2-CG2 4.23Å; Y391-V394 HydrophobicContact CG-CB 4.13Å; Y391-V394 HydrophobicContact CG-CG2 3.6Å; Y391-V394 PolarHBondContact O-N 2.8Å; Y391-V394 VanDerWaalsContact O-N 3.12Å; S392-V394 VanDerWaalsContact C-N 3.27Å; S392-V394 PolarHBondContact O-N 3.12Å; V394-T396 VanDerWaalsContact C-N 3.34Å; V394-L397 PolarHBondContact O-N 3.37Å; V394-I398 HydrophobicContact CG1-CD1 4.08Å; V394-I398 HydrophobicContact CG1-CG1 4.4Å; V394-I398 VanDerWaalsContact O-CG1 3.28Å; V394-I398 WeakPolarHBondContact O-CG1 3.34Å; V394-I398 PolarHBondContact O-N 2.97Å
395W97.3Very high94Very high43 Ų4342 Ų4216%0.16321%0.211CC..Hα-helixtrans-61.7-42.8173-75.9111.9000112.1L385 P389 Y391 S392 L393 I398 G399 A414 Q417 A418 Y421L385-W395 HydrophobicContact CD1-CD2 3.76Å; L385-W395 HydrophobicContact CD1-CE3 3.92Å; L385-W395 HydrophobicContact CD1-CG 4.49Å; L385-W395 HydrophobicContact CD1-CH2 3.79Å; L385-W395 HydrophobicContact CD1-CZ2 3.6Å; L385-W395 HydrophobicContact CD1-CZ3 3.94Å; L385-W395 HydrophobicContact CD2-CD2 4.19Å; L385-W395 HydrophobicContact CD2-CG 4.19Å; L385-W395 HydrophobicContact CD2-CZ2 4.37Å; P389-W395 PolarHBondContact O-NE1 3.31Å; P389-W395 VanDerWaalsContact O-NE1 3.17Å; Y391-W395 PolarHBondContact O-N 3.38Å; S392-W395 WeakPolarHBondContact O-CB 3.49Å; S392-W395 PolarHBondContact O-N 3.06Å; S392-W395 VanDerWaalsContact O-N 3.11Å; L393-W395 VanDerWaalsContact C-N 3.34Å; L393-W395 PolarHBondContact O-N 3.39Å; W395-I398 PolarHBondContact O-N 3.14Å; W395-G399 PolarHBondContact O-N 3.3Å; W395-A414 HydrophobicContact CE3-CB 4.28Å; W395-Q417 HydrophobicContact CD2-CB 3.66Å; W395-Q417 HydrophobicContact CE3-CB 3.73Å; W395-Q417 HydrophobicContact CE3-CG 4.29Å; W395-Q417 HydrophobicContact CG-CB 4.13Å; W395-Q417 HydrophobicContact CH2-CB 4.28Å; W395-Q417 HydrophobicContact CH2-CG 4.16Å; W395-Q417 HydrophobicContact CZ2-CB 4.24Å; W395-Q417 HydrophobicContact CZ2-CG 4.42Å; W395-Q417 HydrophobicContact CZ3-CB 4.04Å; W395-Q417 HydrophobicContact CZ3-CG 4.09Å; W395-A418 HydrophobicContact CB-CB 3.63Å; W395-Y421 AromaticContact CD1-CD2 3.75Å; W395-Y421 AromaticContact CD1-CE2 3.96Å; W395-Y421 AromaticContact NE1-CD2 3.72Å; W395-Y421 AromaticContact NE1-CE2 3.42Å
396T97.2Very high94.1Very high1 Ų152.1 Ų52.11%0.00625%0.248CC..Hα-helixtrans-60.6-46.1173.9-50.40000111.1S392 L393 V394 I398 G399 H400 Y415 D425 R427 A428S392-T396 PolarHBondContact O-N 3.17Å; S392-T396 VanDerWaalsContact O-N 3.12Å; S392-T396 PolarHBondContact O-OG1 3.26Å; L393-T396 WeakPolarHBondContact O-CB 3.24Å; L393-T396 PolarHBondContact O-N 3.02Å; V394-T396 VanDerWaalsContact C-N 3.34Å; T396-I398 PolarHBondContact O-N 2.82Å; T396-G399 WeakPolarHBondContact O-CA 3.28Å; T396-G399 PolarHBondContact O-N 2.89Å; T396-G399 VanDerWaalsContact O-N 3.08Å; T396-H400 PolarHBondContact O-N 3.05Å; T396-Y415 HydrophobicContact CG2-CD1 4.45Å; T396-Y415 HydrophobicContact CG2-CE1 4.24Å; T396-Y415 WeakPolarHBondContact O-CE1 3.49Å; T396-D425 PolarHBondContact OG1-OD2 3.39Å; T396-R427 HydrophobicContact CG2-CB 3.87Å; T396-A428 HydrophobicContact CG2-CB 4.49Å
397L97.1Very high94.4Very high19 Ų1949.1 Ų49.110%0.09924%0.238CC..Hα-helixtrans-63.4-41.4178.2-68172.4000112.5C362 F381 L393 V394 G399 H400 E401C362-L397 WeakPolarHBondContact SG-CD1 3.37Å; F381-L397 HydrophobicContact CE1-CB 4.1Å; F381-L397 HydrophobicContact CE1-CD1 3.79Å; F381-L397 HydrophobicContact CE2-CB 4.07Å; F381-L397 HydrophobicContact CZ-CB 3.85Å; F381-L397 HydrophobicContact CZ-CD1 4.04Å; F381-L397 HydrophobicContact CZ-CG 4.48Å; L393-L397 HydrophobicContact CG-CD1 4.2Å; L393-L397 WeakPolarHBondContact O-CG 3.31Å; L393-L397 PolarHBondContact O-N 3.47Å; V394-L397 PolarHBondContact O-N 3.37Å; L397-G399 PolarHBondContact O-N 3.22Å; L397-H400 PolarHBondContact O-N 3.32Å; L397-H400 VanDerWaalsContact O-N 3.14Å; L397-E401 WeakPolarHBondContact O-CG 3.24Å; L397-E401 PolarHBondContact O-N 3.16Å
398I97.4Very high94.6Very high4 Ų446.5 Ų46.52%0.02123%0.225CC..Hα-helixtrans-59-38.9172.5-72.1171.6000110.9F381 L385 V394 W395 T396 E401 F402 A414F381-I398 HydrophobicContact CB-CD1 3.68Å; F381-I398 HydrophobicContact CB-CG1 3.35Å; F381-I398 HydrophobicContact CD2-CG1 4.03Å; F381-I398 HydrophobicContact CG-CG1 3.98Å; L385-I398 HydrophobicContact CD1-CD1 3.36Å; L385-I398 HydrophobicContact CG-CD1 4.2Å; V394-I398 HydrophobicContact CG1-CD1 4.08Å; V394-I398 HydrophobicContact CG1-CG1 4.4Å; V394-I398 VanDerWaalsContact O-CG1 3.28Å; V394-I398 WeakPolarHBondContact O-CG1 3.34Å; V394-I398 PolarHBondContact O-N 2.97Å; W395-I398 PolarHBondContact O-N 3.14Å; T396-I398 PolarHBondContact O-N 2.82Å; I398-E401 PolarHBondContact O-N 3.39Å; I398-F402 HydrophobicContact CG2-CD2 3.45Å; I398-F402 VanDerWaalsContact CG2-CD2 3.45Å; I398-F402 HydrophobicContact CG2-CE2 3.29Å; I398-F402 HydrophobicContact CG2-CZ 4.41Å; I398-F402 VanDerWaalsContact O-CD2 3.24Å; I398-F402 WeakPolarHBondContact O-CD2 3.42Å; I398-F402 PolarHBondContact O-N 2.69Å; I398-A414 HydrophobicContact CB-CB 4.32Å; I398-A414 HydrophobicContact CG2-CB 3.82Å
399G96.4Very high94.7Very high0 Ų045.2 Ų45.20%022%0.224CC..Hα-helixtrans-58.7-46.7173.800000112.3W395 T396 L397 F402 M403 Y415W395-G399 PolarHBondContact O-N 3.3Å; T396-G399 WeakPolarHBondContact O-CA 3.28Å; T396-G399 PolarHBondContact O-N 2.89Å; T396-G399 VanDerWaalsContact O-N 3.08Å; L397-G399 PolarHBondContact O-N 3.22Å; G399-F402 PolarHBondContact O-N 3.01Å; G399-M403 PolarHBondContact O-N 2.97Å; G399-Y415 VanDerWaalsContact C-CZ 3.4Å; G399-Y415 PolarHBondContact O-OH 3.41Å
400H96.4Very high95Very high64 Ų6444.4 Ų44.430%0.29622%0.221SC..Hα-helixtrans-62.3-44.9176.2-60.3146.6000111.6T396 L397 F402 M403 E404 Y415T396-H400 PolarHBondContact O-N 3.05Å; L397-H400 PolarHBondContact O-N 3.32Å; L397-H400 VanDerWaalsContact O-N 3.14Å; H400-F402 VanDerWaalsContact C-N 3.32Å; H400-F402 PolarHBondContact O-N 3.4Å; H400-M403 WeakPolarHBondContact O-CB 3.25Å; H400-M403 PolarHBondContact O-N 3.17Å; H400-M403 VanDerWaalsContact O-N 3.13Å; H400-E404 PolarHBondContact O-N 2.95Å; H400-Y415 WeakPolarHBondContact CA-OH 3.27Å; H400-Y415 AromaticContact CD2-CE1 4Å; H400-Y415 AromaticContact CD2-CZ 3.94Å; H400-Y415 PolarHBondContact CD2-OH 2.88Å; H400-Y415 PolarHBondContact N-OH 3.44Å; H400-Y415 VanDerWaalsContact N-OH 3.15Å
401E96.9Very high95.3Very high7 Ų741.8 Ų41.83%0.03320%0.199CC..Hα-helixtrans-63.5-36.7177.4-63.5-59.9157.400112.6G369 H374 A377 V378 F381 L397 I398 M403 E404 L405G369-E401 WeakPolarHBondContact CA-OE1 3.33Å; H374-E401 WeakPolarHBondContact CA-OE2 3.5Å; H374-E401 WeakPolarHBondContact CB-OE2 3.39Å; H374-E401 IonicContact CE1-OE2 2.88Å; H374-E401 IonicContact CG-OE2 2.91Å; H374-E401 IonicContact ND1-OE2 2.7Å; H374-E401 PolarHBondContact ND1-OE2 3.16Å; A377-E401 HydrophobicContact CB-CG 3.96Å; V378-E401 HydrophobicContact CG2-CB 3.6Å; V378-E401 HydrophobicContact CG2-CG 4.3Å; F381-E401 HydrophobicContact CD2-CG 4.05Å; F381-E401 HydrophobicContact CE2-CG 3.59Å; L397-E401 WeakPolarHBondContact O-CG 3.24Å; L397-E401 PolarHBondContact O-N 3.16Å; I398-E401 PolarHBondContact O-N 3.39Å; E401-M403 VanDerWaalsContact C-N 3.33Å; E401-E404 PolarHBondContact O-N 3.46Å; E401-L405 WeakPolarHBondContact O-CG 3.11Å; E401-L405 PolarHBondContact O-N 2.67Å
402F97.5Very high95.4Very high23 Ų2341.3 Ų41.310%0.10120%0.197CC..Hα-helixtrans-71-29.3175.1-80.3-52.1000113.1V378 I398 G399 H400 L405 R406 N407 A410 A411V378-F402 HydrophobicContact CG1-CE1 4.34Å; V378-F402 HydrophobicContact CG1-CE2 4.29Å; V378-F402 HydrophobicContact CG1-CZ 3.79Å; V378-F402 HydrophobicContact CG2-CE1 4.41Å; V378-F402 HydrophobicContact CG2-CZ 4.41Å; I398-F402 HydrophobicContact CG2-CD2 3.45Å; I398-F402 VanDerWaalsContact CG2-CD2 3.45Å; I398-F402 HydrophobicContact CG2-CE2 3.29Å; I398-F402 HydrophobicContact CG2-CZ 4.41Å; I398-F402 VanDerWaalsContact O-CD2 3.24Å; I398-F402 WeakPolarHBondContact O-CD2 3.42Å; I398-F402 PolarHBondContact O-N 2.69Å; G399-F402 PolarHBondContact O-N 3.01Å; H400-F402 VanDerWaalsContact C-N 3.32Å; H400-F402 PolarHBondContact O-N 3.4Å; F402-L405 HydrophobicContact CD1-CD1 3.99Å; F402-L405 HydrophobicContact CE1-CD1 4.33Å; F402-L405 CarbonylContact O-C 3.49Å; F402-L405 PolarHBondContact O-N 3.03Å; F402-R406 PolarHBondContact O-N 3.41Å; F402-R406 VanDerWaalsContact O-N 3.15Å; F402-N407 HydrophobicContact CD1-CB 4.2Å; F402-N407 PolarHBondContact O-N 2.77Å; F402-A410 HydrophobicContact CB-CB 4.37Å; F402-A410 HydrophobicContact CD1-CB 3.84Å; F402-A410 HydrophobicContact CD2-CB 3.79Å; F402-A410 HydrophobicContact CE1-CB 4Å; F402-A410 HydrophobicContact CE2-CB 3.95Å; F402-A410 HydrophobicContact CG-CB 3.75Å; F402-A410 HydrophobicContact CZ-CB 4.06Å; F402-A411 HydrophobicContact CB-CB 3.78Å
403M94.9Very high95.5Very high57 Ų5745.6 Ų45.628%0.28122%0.216SC..Hα-helixtrans-63.4-45.3170.6171.6169.5-17600110.9G399 H400 E401 L405 R406 Q434 M435G399-M403 PolarHBondContact O-N 2.97Å; H400-M403 WeakPolarHBondContact O-CB 3.25Å; H400-M403 PolarHBondContact O-N 3.17Å; H400-M403 VanDerWaalsContact O-N 3.13Å; E401-M403 VanDerWaalsContact C-N 3.33Å; M403-L405 VanDerWaalsContact C-N 3.31Å; M403-L405 PolarHBondContact O-N 3.11Å; M403-R406 WeakPolarHBondContact O-CA 3.39Å; M403-R406 PolarHBondContact O-N 3.35Å; M403-Q434 HydrophobicContact CE-CB 4.28Å; M403-M435 HydrophobicContact CB-CE 3.71Å; M403-M435 HydrophobicContact CB-SD 4.43Å; M403-M435 HydrophobicContact CE-CE 4.07Å; M403-M435 HydrophobicContact CG-CE 3.48Å; M403-M435 VanDerWaalsContact CG-CE 3.48Å; M403-M435 HydrophobicContact SD-CE 3.34Å; M403-M435 WeakPolarHBondContact SD-CE 3.27Å
404E94.7Very high95.4Very high117 Ų11744.9 Ų44.955%0.54721%0.212SC..Hα-helixtrans-62.2-37.5174-65.2-53.7136.300112.3H400 E401 R406H400-E404 PolarHBondContact O-N 2.95Å; E401-E404 PolarHBondContact O-N 3.46Å; E404-R406 PolarHBondContact O-N 2.92Å
405L95.7Very high95.4Very high62 Ų6244.9 Ų44.933%0.32521%0.212SC..THydrogen-bonded Turntrans-72.3-0.2172-68.7171.1000114H374 E375 V378 E401 F402 M403 N407H374-L405 HydrophobicContact CB-CD1 4.14Å; H374-L405 HydrophobicContact CB-CD2 3.78Å; H374-L405 HydrophobicContact CB-CG 3.7Å; E375-L405 HydrophobicContact CG-CD1 4.39Å; E375-L405 HydrophobicContact CG-CD2 3.97Å; V378-L405 HydrophobicContact CG2-CD1 4.44Å; E401-L405 WeakPolarHBondContact O-CG 3.11Å; E401-L405 PolarHBondContact O-N 2.67Å; F402-L405 HydrophobicContact CD1-CD1 3.99Å; F402-L405 HydrophobicContact CE1-CD1 4.33Å; F402-L405 CarbonylContact O-C 3.49Å; F402-L405 PolarHBondContact O-N 3.03Å; M403-L405 VanDerWaalsContact C-N 3.31Å; M403-L405 PolarHBondContact O-N 3.11Å; L405-N407 PolarHBondContact O-N 3.05Å; L405-N407 VanDerWaalsContact O-N 3.14Å
406R94.2Very high95.3Very high226 Ų22645.3 Ų45.385%0.85321%0.214SC*.THydrogen-bonded Turntrans55.125.9-175.6-54.4-175.2178.7-152.8-1.8113.9F402 M403 E404 T408F402-R406 PolarHBondContact O-N 3.41Å; F402-R406 VanDerWaalsContact O-N 3.15Å; M403-R406 WeakPolarHBondContact O-CA 3.39Å; M403-R406 PolarHBondContact O-N 3.35Å; E404-R406 PolarHBondContact O-N 2.92Å; R406-T408 PolarHBondContact O-N 2.86Å
407N94.2Very high95.1Very high73 Ų7347.7 Ų47.739%0.3923%0.225SC..  trans-96.482.6175.9-170.5-18.6000110.1F402 L405 N409 A410 A411F402-N407 HydrophobicContact CD1-CB 4.2Å; F402-N407 PolarHBondContact O-N 2.77Å; L405-N407 PolarHBondContact O-N 3.05Å; L405-N407 VanDerWaalsContact O-N 3.14Å; N407-N409 PolarHBondContact O-N 3.38Å; N407-A410 HydrophobicContact CB-CB 4.3Å; N407-A410 PolarHBondContact O-N 3.31Å; N407-A410 WeakPolarHBondContact OD1-CB 3.35Å; N407-A410 PolarHBondContact OD1-N 3.03Å; N407-A411 WeakPolarHBondContact O-CB 3.29Å; N407-A411 PolarHBondContact O-N 2.83Å
408T93Very high95Very high29 Ų2946.8 Ų46.818%0.17822%0.22CC..Hα-helixtrans-60.7-41.9-174.952.60000113.1R406 A410 A411 I412 M435 V438R406-T408 PolarHBondContact O-N 2.86Å; T408-A410 PolarHBondContact O-N 3.23Å; T408-A411 PolarHBondContact O-N 2.85Å; T408-I412 VanDerWaalsContact O-CG1 3.27Å; T408-I412 WeakPolarHBondContact O-CG1 3.38Å; T408-I412 PolarHBondContact O-N 3.1Å; T408-M435 HydrophobicContact CG2-SD 4.33Å; T408-V438 HydrophobicContact CG2-CB 4.45Å; T408-V438 HydrophobicContact CG2-CG1 3.77Å
409N92.3Very high94.9Very high79 Ų7947.7 Ų47.742%0.42223%0.225SC..Hα-helixtrans-64-44-179.1-69.2-32000112.2N407 H413N407-N409 PolarHBondContact O-N 3.38Å; N409-H413 PolarHBondContact O-N 3.01Å; N409-H413 VanDerWaalsContact O-N 3.14Å
410A93Very high94.6Very high24 Ų2452.8 Ų52.820%0.19826%0.255CS..Hα-helixtrans-68-38.1177.300000111.9F402 N407 T408 H413 A414F402-A410 HydrophobicContact CB-CB 4.37Å; F402-A410 HydrophobicContact CD1-CB 3.84Å; F402-A410 HydrophobicContact CD2-CB 3.79Å; F402-A410 HydrophobicContact CE1-CB 4Å; F402-A410 HydrophobicContact CE2-CB 3.95Å; F402-A410 HydrophobicContact CG-CB 3.75Å; F402-A410 HydrophobicContact CZ-CB 4.06Å; N407-A410 HydrophobicContact CB-CB 4.3Å; N407-A410 PolarHBondContact O-N 3.31Å; N407-A410 WeakPolarHBondContact OD1-CB 3.35Å; N407-A410 PolarHBondContact OD1-N 3.03Å; T408-A410 PolarHBondContact O-N 3.23Å; A410-H413 PolarHBondContact O-N 3.13Å; A410-A414 WeakPolarHBondContact O-CB 3.49Å; A410-A414 PolarHBondContact O-N 2.88Å
411A95.4Very high94.3Very high0 Ų054.5 Ų54.50%026%0.26CS..Hα-helixtrans-62.3-47.5175.400000111.7F402 N407 T408 H413 A414 Y415 M435F402-A411 HydrophobicContact CB-CB 3.78Å; N407-A411 WeakPolarHBondContact O-CB 3.29Å; N407-A411 PolarHBondContact O-N 2.83Å; T408-A411 PolarHBondContact O-N 2.85Å; A411-H413 VanDerWaalsContact C-N 3.31Å; A411-H413 PolarHBondContact O-N 3.18Å; A411-A414 PolarHBondContact O-N 2.7Å; A411-A414 VanDerWaalsContact O-N 3.14Å; A411-Y415 HydrophobicContact CB-CD2 4.5Å; A411-Y415 HydrophobicContact CB-CE2 4.15Å; A411-Y415 WeakPolarHBondContact O-CD2 3.33Å; A411-Y415 PolarHBondContact O-N 3.23Å; A411-M435 HydrophobicContact CB-CG 3.97Å; A411-M435 HydrophobicContact CB-SD 3.49Å; A411-M435 WeakPolarHBondContact CB-SD 3.32Å
412I95.8Very high93.9Very high7 Ų757 Ų574%0.03627%0.273CS..Hα-helixtrans-57.5-45.2176.5-69.7167000110.8T408 A414 R416 L432 M435 L439 V633T408-I412 VanDerWaalsContact O-CG1 3.27Å; T408-I412 WeakPolarHBondContact O-CG1 3.38Å; T408-I412 PolarHBondContact O-N 3.1Å; I412-A414 PolarHBondContact O-N 3.01Å; I412-R416 HydrophobicContact CG2-CG 4.43Å; I412-R416 WeakPolarHBondContact O-CB 3.17Å; I412-R416 WeakPolarHBondContact O-CG 3.45Å; I412-R416 PolarHBondContact O-N 3.39Å; I412-L432 HydrophobicContact CB-CD2 4.37Å; I412-L432 HydrophobicContact CG1-CD2 4.43Å; I412-L432 HydrophobicContact CG2-CD2 4.03Å; I412-M435 HydrophobicContact CD1-CB 4.04Å; I412-M435 HydrophobicContact CG1-CB 3.52Å; I412-M435 HydrophobicContact CG1-CG 3.91Å; I412-L439 HydrophobicContact CD1-CD1 3.62Å; I412-V633 HydrophobicContact CD1-CG1 4.23Å
413H93.6Very high93.6Very high105 Ų10561.8 Ų61.849%0.48629%0.291SS..Hα-helixtrans-60.1-46.2176.7-179.383.9000111.7N409 A410 A411 R416 Q417N409-H413 PolarHBondContact O-N 3.01Å; N409-H413 VanDerWaalsContact O-N 3.14Å; A410-H413 PolarHBondContact O-N 3.13Å; A411-H413 VanDerWaalsContact C-N 3.31Å; A411-H413 PolarHBondContact O-N 3.18Å; H413-R416 PolarHBondContact O-N 3.31Å; H413-Q417 WeakPolarHBondContact O-CG 3.47Å; H413-Q417 PolarHBondContact O-N 3.46Å
414A94.2Very high93.4Very high2 Ų259.7 Ų59.72%0.01728%0.281CS..Hα-helixtrans-62.5-46.4-179.700000112.4W395 I398 A410 A411 I412 R416 Q417 A418W395-A414 HydrophobicContact CE3-CB 4.28Å; I398-A414 HydrophobicContact CB-CB 4.32Å; I398-A414 HydrophobicContact CG2-CB 3.82Å; A410-A414 WeakPolarHBondContact O-CB 3.49Å; A410-A414 PolarHBondContact O-N 2.88Å; A411-A414 PolarHBondContact O-N 2.7Å; A411-A414 VanDerWaalsContact O-N 3.14Å; I412-A414 PolarHBondContact O-N 3.01Å; A414-R416 PolarHBondContact O-N 3.37Å; A414-Q417 PolarHBondContact O-N 2.94Å; A414-A418 PolarHBondContact O-N 3.43Å
415Y96.9Very high93.3Very high0 Ų054.4 Ų54.40%026%0.256CS..Hα-helixtrans-65.3-38.5176.6-64.6-56.8000112.7T396 G399 H400 A411 Q417 A418 L419 A428 L432 M435T396-Y415 HydrophobicContact CG2-CD1 4.45Å; T396-Y415 HydrophobicContact CG2-CE1 4.24Å; T396-Y415 WeakPolarHBondContact O-CE1 3.49Å; G399-Y415 VanDerWaalsContact C-CZ 3.4Å; G399-Y415 PolarHBondContact O-OH 3.41Å; H400-Y415 WeakPolarHBondContact CA-OH 3.27Å; H400-Y415 AromaticContact CD2-CE1 4Å; H400-Y415 AromaticContact CD2-CZ 3.94Å; H400-Y415 PolarHBondContact CD2-OH 2.88Å; H400-Y415 PolarHBondContact N-OH 3.44Å; H400-Y415 VanDerWaalsContact N-OH 3.15Å; A411-Y415 HydrophobicContact CB-CD2 4.5Å; A411-Y415 HydrophobicContact CB-CE2 4.15Å; A411-Y415 WeakPolarHBondContact O-CD2 3.33Å; A411-Y415 PolarHBondContact O-N 3.23Å; Y415-Q417 VanDerWaalsContact C-N 3.33Å; Y415-Q417 PolarHBondContact O-N 3.48Å; Y415-A418 WeakPolarHBondContact O-CB 3.39Å; Y415-A418 PolarHBondContact O-N 3.26Å; Y415-L419 WeakPolarHBondContact O-CG 3.47Å; Y415-L419 PolarHBondContact O-N 2.91Å; Y415-L419 VanDerWaalsContact O-N 3.07Å; Y415-A428 HydrophobicContact CD1-CB 4.3Å; Y415-L432 HydrophobicContact CD2-CD2 4.36Å; Y415-L432 HydrophobicContact CG-CG 4.38Å; Y415-M435 HydrophobicContact CD2-CG 4.15Å; Y415-M435 HydrophobicContact CE2-CG 3.9Å
416R94.9Very high93.2Very high52 Ų5252.2 Ų52.220%0.19624%0.244CC..Hα-helixtrans-59-44.7173.3-79.2178.4169.1174-4.6111.5I412 H413 A414 A418 L419 V420 L432 Y436 S636 E640I412-R416 HydrophobicContact CG2-CG 4.43Å; I412-R416 WeakPolarHBondContact O-CB 3.17Å; I412-R416 WeakPolarHBondContact O-CG 3.45Å; I412-R416 PolarHBondContact O-N 3.39Å; H413-R416 PolarHBondContact O-N 3.31Å; A414-R416 PolarHBondContact O-N 3.37Å; R416-A418 VanDerWaalsContact C-N 3.32Å; R416-A418 PolarHBondContact O-N 3.45Å; R416-L419 PolarHBondContact O-N 3.5Å; R416-V420 WeakPolarHBondContact O-CG2 3.45Å; R416-V420 PolarHBondContact O-N 3.05Å; R416-V420 VanDerWaalsContact O-N 3.08Å; R416-L432 HydrophobicContact CG-CD1 4.46Å; R416-L432 HydrophobicContact CG-CD2 4.29Å; R416-Y436 PolarHBondContact NH2-OH 3.33Å; R416-Y436 VanDerWaalsContact NH2-OH 3.11Å; R416-S636 PolarHBondContact NH1-OG 2.97Å; R416-S636 VanDerWaalsContact NH1-OG 3.12Å; R416-E640 IonicContact CZ-OE2 2.83Å; R416-E640 IonicContact NE-OE2 3.05Å; R416-E640 IonicContact NH2-OE2 2.66Å
417Q92.8Very high93.2Very high51 Ų5144.3 Ų44.324%0.23821%0.214CC..Hα-helixtrans-62.4-39.2175.4-69.4-59.7-36.100111.9W395 H413 A414 Y415 L419 V420 Y421W395-Q417 HydrophobicContact CD2-CB 3.66Å; W395-Q417 HydrophobicContact CE3-CB 3.73Å; W395-Q417 HydrophobicContact CE3-CG 4.29Å; W395-Q417 HydrophobicContact CG-CB 4.13Å; W395-Q417 HydrophobicContact CH2-CB 4.28Å; W395-Q417 HydrophobicContact CH2-CG 4.16Å; W395-Q417 HydrophobicContact CZ2-CB 4.24Å; W395-Q417 HydrophobicContact CZ2-CG 4.42Å; W395-Q417 HydrophobicContact CZ3-CB 4.04Å; W395-Q417 HydrophobicContact CZ3-CG 4.09Å; H413-Q417 WeakPolarHBondContact O-CG 3.47Å; H413-Q417 PolarHBondContact O-N 3.46Å; A414-Q417 PolarHBondContact O-N 2.94Å; Y415-Q417 VanDerWaalsContact C-N 3.33Å; Y415-Q417 PolarHBondContact O-N 3.48Å; Q417-L419 VanDerWaalsContact C-N 3.29Å; Q417-L419 PolarHBondContact O-N 2.87Å; Q417-V420 PolarHBondContact O-N 3.45Å; Q417-Y421 WeakPolarHBondContact O-CD2 3.11Å; Q417-Y421 PolarHBondContact O-N 2.86Å
418A94.7Very high93.3Very high0 Ų040.9 Ų40.90%020%0.195CC..Hα-helixtrans-56.1-45.9174.200000111.3S392 W395 A414 Y415 R416 V420 Y421 N422 A428S392-A418 PolarHBondContact OG-O 3.19Å; W395-A418 HydrophobicContact CB-CB 3.63Å; A414-A418 PolarHBondContact O-N 3.43Å; Y415-A418 WeakPolarHBondContact O-CB 3.39Å; Y415-A418 PolarHBondContact O-N 3.26Å; R416-A418 VanDerWaalsContact C-N 3.32Å; R416-A418 PolarHBondContact O-N 3.45Å; A418-V420 PolarHBondContact O-N 3.34Å; A418-Y421 PolarHBondContact O-N 2.8Å; A418-Y421 VanDerWaalsContact O-N 3.16Å; A418-N422 PolarHBondContact O-N 3.02Å; A418-A428 HydrophobicContact CB-CB 3.86Å
419L94.6Very high93.4Very high24 Ų2441 Ų4113%0.12619%0.192CC..Hα-helixtrans-68.8-29.1179.7-65.5-179.6000114.3Y415 R416 Q417 Y421 N422 R423 A428 W429 L432Y415-L419 WeakPolarHBondContact O-CG 3.47Å; Y415-L419 PolarHBondContact O-N 2.91Å; Y415-L419 VanDerWaalsContact O-N 3.07Å; R416-L419 PolarHBondContact O-N 3.5Å; Q417-L419 VanDerWaalsContact C-N 3.29Å; Q417-L419 PolarHBondContact O-N 2.87Å; L419-Y421 VanDerWaalsContact C-N 3.27Å; L419-Y421 PolarHBondContact O-N 3.3Å; L419-N422 CarbonylContact O-C 3.56Å; L419-R423 PolarHBondContact O-N 3.5Å; L419-A428 HydrophobicContact CD2-CB 3.71Å; L419-A428 HydrophobicContact CG-CB 3.96Å; L419-W429 HydrophobicContact CD1-CD2 3.75Å; L419-W429 HydrophobicContact CD1-CE3 3.95Å; L419-W429 HydrophobicContact CD1-CG 4.34Å; L419-W429 HydrophobicContact CD1-CH2 3.94Å; L419-W429 HydrophobicContact CD1-CZ2 3.78Å; L419-W429 HydrophobicContact CD1-CZ3 4.03Å; L419-W429 HydrophobicContact CD2-CD2 4.03Å; L419-W429 HydrophobicContact CD2-CG 4Å; L419-W429 HydrophobicContact CD2-CZ2 4.15Å; L419-W429 VanDerWaalsContact CD2-NE1 3.27Å; L419-W429 HydrophobicContact CG-CZ2 4.48Å; L419-L432 HydrophobicContact CD1-CD1 3.49Å; L419-L432 VanDerWaalsContact CD1-CD1 3.49Å
420V90.9Very high93.6Very high106 Ų10639.4 Ų39.464%0.64218%0.181SC*.Hα-helixtrans-61.8-38.7171.9171.60000110.8R416 Q417 A418R416-V420 WeakPolarHBondContact O-CG2 3.45Å; R416-V420 PolarHBondContact O-N 3.05Å; R416-V420 VanDerWaalsContact O-N 3.08Å; Q417-V420 PolarHBondContact O-N 3.45Å; A418-V420 PolarHBondContact O-N 3.34Å
421Y89.3Confident93.8Very high101 Ų10138.3 Ų38.340%0.39617%0.172SC..Hα-helixtrans-86.6-36-180-65.6-65.3000113.5A390 W395 Q417 A418 L419A390-Y421 HydrophobicContact CB-CD1 3.56Å; A390-Y421 HydrophobicContact CB-CE1 3.72Å; A390-Y421 HydrophobicContact CB-CG 4.28Å; W395-Y421 AromaticContact CD1-CD2 3.75Å; W395-Y421 AromaticContact CD1-CE2 3.96Å; W395-Y421 AromaticContact NE1-CD2 3.72Å; W395-Y421 AromaticContact NE1-CE2 3.42Å; Q417-Y421 WeakPolarHBondContact O-CD2 3.11Å; Q417-Y421 PolarHBondContact O-N 2.86Å; A418-Y421 PolarHBondContact O-N 2.8Å; A418-Y421 VanDerWaalsContact O-N 3.16Å; L419-Y421 VanDerWaalsContact C-N 3.27Å; L419-Y421 PolarHBondContact O-N 3.3Å
422N90.3Very high93.8Very high58 Ų5838.3 Ų38.331%0.3117%0.172SC..  trans-141.799.6175-175.58.6000111.3S392 A418 L419 H424 D425S392-N422 VanDerWaalsContact OG-CB 3.27Å; S392-N422 WeakPolarHBondContact OG-CB 3.45Å; A418-N422 PolarHBondContact O-N 3.02Å; L419-N422 CarbonylContact O-C 3.56Å; N422-H424 PolarHBondContact O-N 3.44Å; N422-H424 WeakPolarHBondContact OD1-CB 3.1Å; N422-H424 PolarHBondContact OD1-N 3.47Å; N422-D425 HydrophobicContact CB-CB 4.45Å; N422-D425 PolarHBondContact O-N 2.84Å
423R91.1Very high93.8Very high124 Ų12438 Ų3847%0.46817%0.17SC..THydrogen-bonded Turntrans-65-19.6176.379.8179.2-111.2-157.1-6.3113.9E238 L419 D425 W429E238-R423 IonicContact OE1-NH1 3.49Å; E238-R423 IonicContact OE2-CZ 2.65Å; E238-R423 IonicContact OE2-NH1 3.22Å; E238-R423 PolarHBondContact OE2-NH1 3.41Å; E238-R423 IonicContact OE2-NH2 3.81Å; L419-R423 PolarHBondContact O-N 3.5Å; R423-D425 VanDerWaalsContact C-N 3.34Å; R423-W429 PolarHBondContact O-NE1 2.87Å
424H90.3Very high93.9Very high14 Ų1434.7 Ų34.77%0.06516%0.155CC..THydrogen-bonded Turntrans-88.3-0.9-178.6-61.2-78.5000112E238 H269 N422 Y426E238-H424 PolarHBondContact O-CE1 3.28Å; E238-H424 VanDerWaalsContact O-CE1 3.32Å; H269-H424 PolarHBondContact NE2-O 3.11Å; N422-H424 PolarHBondContact O-N 3.44Å; N422-H424 WeakPolarHBondContact OD1-CB 3.1Å; N422-H424 PolarHBondContact OD1-N 3.47Å; H424-Y426 PolarHBondContact O-N 2.94Å
425D91.9Very high94Very high5 Ų534.8 Ų34.83%0.02716%0.155CC..  trans-73.691.5175.4-165.7-11.4000111.1T396 N422 R423 R427 A428 W429T396-D425 PolarHBondContact OG1-OD2 3.39Å; N422-D425 HydrophobicContact CB-CB 4.45Å; N422-D425 PolarHBondContact O-N 2.84Å; R423-D425 VanDerWaalsContact C-N 3.34Å; D425-R427 PolarHBondContact O-N 3.23Å; D425-R427 VanDerWaalsContact O-N 3.11Å; D425-R427 WeakPolarHBondContact OD1-CB 3.41Å; D425-R427 IonicContact OD1-CZ 2.64Å; D425-R427 PolarHBondContact OD1-N 3.35Å; D425-R427 IonicContact OD1-NE 3.31Å; D425-R427 PolarHBondContact OD1-NE 3.48Å; D425-R427 IonicContact OD1-NH2 3.75Å; D425-R427 PolarHBondContact OD1-NH2 3.15Å; D425-R427 IonicContact OD2-CZ 2.86Å; D425-R427 IonicContact OD2-NE 2.82Å; D425-R427 IonicContact OD2-NH2 2.8Å; D425-R427 PolarHBondContact OD2-NH2 3.05Å; D425-A428 HydrophobicContact CB-CB 4.36Å; D425-A428 PolarHBondContact O-N 2.88Å; D425-A428 VanDerWaalsContact O-N 3.09Å; D425-W429 PolarHBondContact O-N 3.26Å
426Y93.5Very high93.9Very high17 Ų1734.8 Ų34.87%0.06716%0.155CC..Hα-helixtrans-56.7-27.1179.479-89.6000113.1H269 R304 H424 A428 W429 Y430 M456 L462H269-Y426 AromaticContact CE1-CD1 3.53Å; H269-Y426 AromaticContact ND1-CD1 3.99Å; H269-Y426 AromaticContact NE2-CD1 3.77Å; R304-Y426 PolarHBondContact NH1-OH 3.43Å; H424-Y426 PolarHBondContact O-N 2.94Å; Y426-A428 VanDerWaalsContact C-N 3.34Å; Y426-W429 WeakPolarHBondContact O-CB 3.47Å; Y426-W429 PolarHBondContact O-N 3.5Å; Y426-Y430 WeakPolarHBondContact O-CB 3.46Å; Y426-Y430 PolarHBondContact O-N 3.14Å; Y426-M456 HydrophobicContact CD1-CB 4.47Å; Y426-M456 HydrophobicContact CD1-CG 3.56Å; Y426-M456 HydrophobicContact CD2-CB 4.14Å; Y426-M456 HydrophobicContact CD2-CG 4.06Å; Y426-M456 HydrophobicContact CE1-CG 3.94Å; Y426-M456 HydrophobicContact CE2-CG 4.39Å; Y426-M456 HydrophobicContact CG-CB 4.05Å; Y426-M456 HydrophobicContact CG-CG 3.63Å; Y426-L462 HydrophobicContact CD2-CD1 3.93Å; Y426-L462 HydrophobicContact CE2-CD1 4.45Å
427R94.5Very high93.8Very high60 Ų6033.8 Ų33.823%0.22615%0.153CC..Hα-helixtrans-69.4-35.1-179.8-57166.4-62.3-172.43.2111.2T396 D425 Y430 G431T396-R427 HydrophobicContact CG2-CB 3.87Å; D425-R427 PolarHBondContact O-N 3.23Å; D425-R427 VanDerWaalsContact O-N 3.11Å; D425-R427 WeakPolarHBondContact OD1-CB 3.41Å; D425-R427 IonicContact OD1-CZ 2.64Å; D425-R427 PolarHBondContact OD1-N 3.35Å; D425-R427 IonicContact OD1-NE 3.31Å; D425-R427 PolarHBondContact OD1-NE 3.48Å; D425-R427 IonicContact OD1-NH2 3.75Å; D425-R427 PolarHBondContact OD1-NH2 3.15Å; D425-R427 IonicContact OD2-CZ 2.86Å; D425-R427 IonicContact OD2-NE 2.82Å; D425-R427 IonicContact OD2-NH2 2.8Å; D425-R427 PolarHBondContact OD2-NH2 3.05Å; R427-Y430 PolarHBondContact O-N 3.41Å; R427-G431 PolarHBondContact O-N 3.42Å
428A95.6Very high93.9Very high0 Ų035.4 Ų35.40%017%0.165CC..Hα-helixtrans-70.1-38175.200000111.5T396 Y415 A418 L419 D425 Y426 G431 L432T396-A428 HydrophobicContact CG2-CB 4.49Å; Y415-A428 HydrophobicContact CD1-CB 4.3Å; A418-A428 HydrophobicContact CB-CB 3.86Å; L419-A428 HydrophobicContact CD2-CB 3.71Å; L419-A428 HydrophobicContact CG-CB 3.96Å; D425-A428 HydrophobicContact CB-CB 4.36Å; D425-A428 PolarHBondContact O-N 2.88Å; D425-A428 VanDerWaalsContact O-N 3.09Å; Y426-A428 VanDerWaalsContact C-N 3.34Å; A428-G431 PolarHBondContact O-N 3.34Å; A428-L432 WeakPolarHBondContact O-CG 3.37Å; A428-L432 PolarHBondContact O-N 2.94Å
429W96.9Very high93.9Very high32 Ų3236 Ų3612%0.12117%0.169CC..Hα-helixtrans-61.3-46.2171.3-71.2105.5000111.9L419 R423 D425 Y426 L432 G433 Y447 Y448 E451 A452 L455L419-W429 HydrophobicContact CD1-CD2 3.75Å; L419-W429 HydrophobicContact CD1-CE3 3.95Å; L419-W429 HydrophobicContact CD1-CG 4.34Å; L419-W429 HydrophobicContact CD1-CH2 3.94Å; L419-W429 HydrophobicContact CD1-CZ2 3.78Å; L419-W429 HydrophobicContact CD1-CZ3 4.03Å; L419-W429 HydrophobicContact CD2-CD2 4.03Å; L419-W429 HydrophobicContact CD2-CG 4Å; L419-W429 HydrophobicContact CD2-CZ2 4.15Å; L419-W429 VanDerWaalsContact CD2-NE1 3.27Å; L419-W429 HydrophobicContact CG-CZ2 4.48Å; R423-W429 PolarHBondContact O-NE1 2.87Å; D425-W429 PolarHBondContact O-N 3.26Å; Y426-W429 WeakPolarHBondContact O-CB 3.47Å; Y426-W429 PolarHBondContact O-N 3.5Å; W429-L432 PolarHBondContact O-N 3.39Å; W429-G433 PolarHBondContact O-N 3.34Å; W429-Y447 HydrophobicContact CZ3-CE1 4.24Å; W429-Y448 AromaticContact CE3-CD1 3.63Å; W429-Y448 HydrophobicContact CE3-CD1 3.63Å; W429-Y448 HydrophobicContact CE3-CE1 4.29Å; W429-Y448 AromaticContact CZ3-CD1 3.63Å; W429-Y448 HydrophobicContact CZ3-CD1 3.63Å; W429-Y448 AromaticContact CZ3-CE1 3.86Å; W429-Y448 HydrophobicContact CZ3-CE1 3.86Å; W429-E451 HydrophobicContact CD2-CB 3.88Å; W429-E451 HydrophobicContact CE3-CB 3.62Å; W429-E451 HydrophobicContact CE3-CG 4.14Å; W429-E451 HydrophobicContact CG-CB 4.39Å; W429-E451 HydrophobicContact CZ3-CB 4.04Å; W429-E451 HydrophobicContact CZ3-CG 4.05Å; W429-A452 HydrophobicContact CB-CB 3.74Å; W429-L455 HydrophobicContact CG-CD1 4.29Å
430Y96.4Very high93.8Very high46 Ų4639.5 Ų39.518%0.1819%0.187CC..Hα-helixtrans-61.2-47.4175.9-179.8-112.4000112.1Y426 R427 L432 G433 Q434 Y449 L462 A465Y426-Y430 WeakPolarHBondContact O-CB 3.46Å; Y426-Y430 PolarHBondContact O-N 3.14Å; R427-Y430 PolarHBondContact O-N 3.41Å; Y430-L432 VanDerWaalsContact C-N 3.31Å; Y430-L432 PolarHBondContact O-N 3.32Å; Y430-G433 WeakPolarHBondContact O-CA 3.4Å; Y430-G433 PolarHBondContact O-N 3.3Å; Y430-Q434 VanDerWaalsContact CE1-CD 3.41Å; Y430-Q434 HydrophobicContact CE1-CG 4.13Å; Y430-Q434 VanDerWaalsContact CE1-NE2 3.31Å; Y430-Q434 HydrophobicContact CE2-CG 4.39Å; Y430-Q434 PolarHBondContact O-N 2.72Å; Y430-Q434 PolarHBondContact OH-NE2 2.91Å; Y430-Y449 AromaticContact CD2-CD1 3.76Å; Y430-Y449 HydrophobicContact CD2-CD1 3.76Å; Y430-Y449 AromaticContact CD2-CE1 3.43Å; Y430-Y449 HydrophobicContact CD2-CE1 3.43Å; Y430-Y449 VanDerWaalsContact CD2-CE1 3.43Å; Y430-Y449 HydrophobicContact CE2-CD1 4.22Å; Y430-Y449 AromaticContact CE2-CE1 3.61Å; Y430-Y449 HydrophobicContact CE2-CE1 3.61Å; Y430-Y449 HydrophobicContact CG-CE1 4.39Å; Y430-Y449 WeakPolarHBondContact O-CE1 3.42Å; Y430-L462 HydrophobicContact CD1-CD2 4.44Å; Y430-L462 HydrophobicContact CD2-CD2 3.17Å; Y430-L462 HydrophobicContact CE2-CD2 3.8Å; Y430-L462 HydrophobicContact CG-CD2 3.54Å; Y430-A465 HydrophobicContact CE2-CB 3.95Å
431G95.7Very high94Very high0 Ų035.9 Ų35.90%017%0.165CC..Hα-helixtrans-59.2-38.9176.500000112.9R427 A428 Q434 M435R427-G431 PolarHBondContact O-N 3.42Å; A428-G431 PolarHBondContact O-N 3.34Å; G431-Q434 PolarHBondContact O-N 3.44Å; G431-M435 WeakPolarHBondContact O-CG 3.46Å; G431-M435 PolarHBondContact O-N 2.99Å
432L96.5Very high94.1Very high1 Ų133 Ų331%0.00516%0.158CC..Hα-helixtrans-62.8-45.4170.8-76.2174000111.9I412 Y415 R416 L419 A428 W429 Y430 Q434 M435 Y436 Y448I412-L432 HydrophobicContact CB-CD2 4.37Å; I412-L432 HydrophobicContact CG1-CD2 4.43Å; I412-L432 HydrophobicContact CG2-CD2 4.03Å; Y415-L432 HydrophobicContact CD2-CD2 4.36Å; Y415-L432 HydrophobicContact CG-CG 4.38Å; R416-L432 HydrophobicContact CG-CD1 4.46Å; R416-L432 HydrophobicContact CG-CD2 4.29Å; L419-L432 HydrophobicContact CD1-CD1 3.49Å; L419-L432 VanDerWaalsContact CD1-CD1 3.49Å; A428-L432 WeakPolarHBondContact O-CG 3.37Å; A428-L432 PolarHBondContact O-N 2.94Å; W429-L432 PolarHBondContact O-N 3.39Å; Y430-L432 VanDerWaalsContact C-N 3.31Å; Y430-L432 PolarHBondContact O-N 3.32Å; L432-Q434 VanDerWaalsContact C-N 3.27Å; L432-Q434 PolarHBondContact O-N 3.26Å; L432-M435 PolarHBondContact O-N 3.28Å; L432-M435 VanDerWaalsContact O-N 3.08Å; L432-Y436 HydrophobicContact CD2-CE2 4.36Å; L432-Y436 WeakPolarHBondContact O-CD2 3.47Å; L432-Y436 PolarHBondContact O-N 3.23Å; L432-Y448 HydrophobicContact CB-CD1 3.82Å; L432-Y448 HydrophobicContact CB-CD2 4.47Å; L432-Y448 HydrophobicContact CB-CE1 4.3Å; L432-Y448 HydrophobicContact CB-CG 3.94Å; L432-Y448 HydrophobicContact CD1-CD1 3.87Å; L432-Y448 HydrophobicContact CD1-CE1 3.73Å; L432-Y448 HydrophobicContact CG-CD1 4.49Å
433G96.1Very high94.2Very high0 Ų033.7 Ų33.70%017%0.167CC..Hα-helixtrans-53.3-45.4175.700000112.3W429 Y430 Y436 E437 S445 Y449W429-G433 PolarHBondContact O-N 3.34Å; Y430-G433 WeakPolarHBondContact O-CA 3.4Å; Y430-G433 PolarHBondContact O-N 3.3Å; G433-Y436 PolarHBondContact O-N 3.01Å; G433-E437 VanDerWaalsContact O-CB 3.3Å; G433-E437 WeakPolarHBondContact O-CB 3.47Å; G433-E437 PolarHBondContact O-N 3.44Å; G433-S445 PolarHBondContact O-OG 3.37Å; G433-Y449 VanDerWaalsContact C-CZ 3.48Å
434Q95.8Very high94.3Very high36 Ų3629.3 Ų29.317%0.16815%0.152CC..Hα-helixtrans-64.3-40.4175.4-68.5-177.7-47.500112.3M403 Y430 G431 L432 E437 V438 Y449M403-Q434 HydrophobicContact CE-CB 4.28Å; Y430-Q434 VanDerWaalsContact CE1-CD 3.41Å; Y430-Q434 HydrophobicContact CE1-CG 4.13Å; Y430-Q434 VanDerWaalsContact CE1-NE2 3.31Å; Y430-Q434 HydrophobicContact CE2-CG 4.39Å; Y430-Q434 PolarHBondContact O-N 2.72Å; Y430-Q434 PolarHBondContact OH-NE2 2.91Å; G431-Q434 PolarHBondContact O-N 3.44Å; L432-Q434 VanDerWaalsContact C-N 3.27Å; L432-Q434 PolarHBondContact O-N 3.26Å; Q434-E437 WeakPolarHBondContact O-CB 3.31Å; Q434-E437 PolarHBondContact O-N 3.42Å; Q434-V438 WeakPolarHBondContact O-CG2 3.45Å; Q434-V438 PolarHBondContact O-N 3.45Å; Q434-Y449 WeakPolarHBondContact CA-OH 3.38Å; Q434-Y449 HydrophobicContact CG-CE1 4.25Å; Q434-Y449 VanDerWaalsContact CG-OH 3.23Å; Q434-Y449 WeakPolarHBondContact CG-OH 3.45Å; Q434-Y449 PolarHBondContact N-OH 3.41Å
435M95.6Very high94.5Very high3 Ų328.6 Ų28.62%0.01515%0.149CC..Hα-helixtrans-65.9-42.9178-68.5-54.996.300112.2M403 T408 A411 I412 Y415 G431 L432 E437 V438 L439M403-M435 HydrophobicContact CB-CE 3.71Å; M403-M435 HydrophobicContact CB-SD 4.43Å; M403-M435 HydrophobicContact CE-CE 4.07Å; M403-M435 HydrophobicContact CG-CE 3.48Å; M403-M435 VanDerWaalsContact CG-CE 3.48Å; M403-M435 HydrophobicContact SD-CE 3.34Å; M403-M435 WeakPolarHBondContact SD-CE 3.27Å; T408-M435 HydrophobicContact CG2-SD 4.33Å; A411-M435 HydrophobicContact CB-CG 3.97Å; A411-M435 HydrophobicContact CB-SD 3.49Å; A411-M435 WeakPolarHBondContact CB-SD 3.32Å; I412-M435 HydrophobicContact CD1-CB 4.04Å; I412-M435 HydrophobicContact CG1-CB 3.52Å; I412-M435 HydrophobicContact CG1-CG 3.91Å; Y415-M435 HydrophobicContact CD2-CG 4.15Å; Y415-M435 HydrophobicContact CE2-CG 3.9Å; G431-M435 WeakPolarHBondContact O-CG 3.46Å; G431-M435 PolarHBondContact O-N 2.99Å; L432-M435 PolarHBondContact O-N 3.28Å; L432-M435 VanDerWaalsContact O-N 3.08Å; M435-E437 VanDerWaalsContact C-N 3.26Å; M435-E437 PolarHBondContact O-N 2.9Å; M435-V438 PolarHBondContact O-N 3.4Å; M435-L439 WeakPolarHBondContact O-CG 3.3Å; M435-L439 PolarHBondContact O-N 3.13Å
436Y95.2Very high94.6Very high0 Ų029.1 Ų29.10%015%0.151CC..Hα-helixtrans-69.1-28.1175.5-77.1-74.6000112.6R416 L432 G433 L439 N440 L441 F444 Y448 V633 A637R416-Y436 PolarHBondContact NH2-OH 3.33Å; R416-Y436 VanDerWaalsContact NH2-OH 3.11Å; L432-Y436 HydrophobicContact CD2-CE2 4.36Å; L432-Y436 WeakPolarHBondContact O-CD2 3.47Å; L432-Y436 PolarHBondContact O-N 3.23Å; G433-Y436 PolarHBondContact O-N 3.01Å; Y436-L439 HydrophobicContact CD1-CD1 4.45Å; Y436-L439 PolarHBondContact O-N 3.43Å; Y436-N440 PolarHBondContact O-N 3.5Å; Y436-L441 HydrophobicContact CD1-CB 4.32Å; Y436-L441 HydrophobicContact CD1-CD1 4.02Å; Y436-L441 HydrophobicContact CE1-CD1 4.44Å; Y436-L441 PolarHBondContact O-N 2.61Å; Y436-F444 HydrophobicContact CD1-CB 3.79Å; Y436-F444 HydrophobicContact CD1-CG 4.38Å; Y436-F444 HydrophobicContact CE1-CB 4.33Å; Y436-F444 HydrophobicContact CG-CB 3.97Å; Y436-Y448 AromaticContact CD2-CD2 3.4Å; Y436-Y448 HydrophobicContact CD2-CD2 3.4Å; Y436-Y448 AromaticContact CD2-CE2 3.29Å; Y436-Y448 HydrophobicContact CD2-CE2 3.29Å; Y436-Y448 HydrophobicContact CD2-CG 4.41Å; Y436-Y448 AromaticContact CE2-CD2 3.7Å; Y436-Y448 HydrophobicContact CE2-CD2 3.7Å; Y436-Y448 AromaticContact CE2-CE2 3.09Å; Y436-Y448 HydrophobicContact CE2-CE2 3.09Å; Y436-Y448 AromaticContact CE2-CZ 3.63Å; Y436-Y448 HydrophobicContact CG-CD2 4.24Å; Y436-Y448 HydrophobicContact CG-CE2 4.17Å; Y436-Y448 AromaticContact CZ-CE2 3.81Å; Y436-V633 HydrophobicContact CE1-CG1 3.89Å; Y436-A637 HydrophobicContact CE1-CB 4.17Å
437E93.3Very high94.7Very high32 Ų3230.5 Ų30.515%0.1516%0.157CC..Hα-helixtrans-64.6-49.1170.9-172.9-173.815000111.6G433 Q434 M435 L439 N440 Y449 I469 R472G433-E437 VanDerWaalsContact O-CB 3.3Å; G433-E437 WeakPolarHBondContact O-CB 3.47Å; G433-E437 PolarHBondContact O-N 3.44Å; Q434-E437 WeakPolarHBondContact O-CB 3.31Å; Q434-E437 PolarHBondContact O-N 3.42Å; M435-E437 VanDerWaalsContact C-N 3.26Å; M435-E437 PolarHBondContact O-N 2.9Å; E437-L439 PolarHBondContact O-N 3Å; E437-N440 WeakPolarHBondContact O-CA 3.47Å; E437-N440 PolarHBondContact O-N 3.35Å; E437-Y449 PolarHBondContact OE2-OH 3.15Å; E437-I469 HydrophobicContact CB-CD1 4.36Å; E437-I469 HydrophobicContact CG-CD1 3.83Å; E437-R472 IonicContact OE1-CZ 2.76Å; E437-R472 VanDerWaalsContact OE1-CZ 3.28Å; E437-R472 IonicContact OE1-NH1 2.83Å; E437-R472 PolarHBondContact OE1-NH1 2.66Å; E437-R472 IonicContact OE1-NH2 2.83Å; E437-R472 PolarHBondContact OE1-NH2 3.15Å
438V93.8Very high94.8Very high84 Ų8428.2 Ų28.251%0.50915%0.148SC..Hα-helixtrans-60.9-32.3175.7172.50000111.7T408 Q434 M435 N440T408-V438 HydrophobicContact CG2-CB 4.45Å; T408-V438 HydrophobicContact CG2-CG1 3.77Å; Q434-V438 WeakPolarHBondContact O-CG2 3.45Å; Q434-V438 PolarHBondContact O-N 3.45Å; M435-V438 PolarHBondContact O-N 3.4Å; V438-N440 PolarHBondContact O-N 3.1Å
439L94.2Very high94.8Very high13 Ų1328.3 Ų28.37%0.06815%0.148CC..THydrogen-bonded Turntrans-75.4-0.4174.2-69.5176000114I412 M435 Y436 E437 L441 V633I412-L439 HydrophobicContact CD1-CD1 3.62Å; M435-L439 WeakPolarHBondContact O-CG 3.3Å; M435-L439 PolarHBondContact O-N 3.13Å; Y436-L439 HydrophobicContact CD1-CD1 4.45Å; Y436-L439 PolarHBondContact O-N 3.43Å; E437-L439 PolarHBondContact O-N 3Å; L439-L441 VanDerWaalsContact C-N 3.32Å; L439-L441 HydrophobicContact CB-CD1 4.26Å; L439-L441 HydrophobicContact CB-CG 4.32Å; L439-L441 PolarHBondContact O-N 3.45Å; L439-V633 HydrophobicContact CD1-CG1 3.83Å
440N93.5Very high94.7Very high97 Ų9732.3 Ų32.352%0.51916%0.164SC..THydrogen-bonded Turntrans58.239.4-174.8-71.4-26.9000113.5Y436 E437 V438 P442Y436-N440 PolarHBondContact O-N 3.5Å; E437-N440 WeakPolarHBondContact O-CA 3.47Å; E437-N440 PolarHBondContact O-N 3.35Å; V438-N440 PolarHBondContact O-N 3.1Å; N440-P442 VanDerWaalsContact C-CD 3.43Å; N440-P442 WeakPolarHBondContact O-CD 3.36Å
441L94.4Very high94.7Very high31 Ų3132.9 Ų32.916%0.16217%0.168CC..  trans-11373.4176.5-66.4176.6000110.5Y436 L439 S443 F444 S445 A634Y436-L441 HydrophobicContact CD1-CB 4.32Å; Y436-L441 HydrophobicContact CD1-CD1 4.02Å; Y436-L441 HydrophobicContact CE1-CD1 4.44Å; Y436-L441 PolarHBondContact O-N 2.61Å; L439-L441 VanDerWaalsContact C-N 3.32Å; L439-L441 HydrophobicContact CB-CD1 4.26Å; L439-L441 HydrophobicContact CB-CG 4.32Å; L439-L441 PolarHBondContact O-N 3.45Å; L441-S443 VanDerWaalsContact C-N 3.31Å; L441-S443 PolarHBondContact O-N 3.12Å; L441-F444 HydrophobicContact CB-CB 4.4Å; L441-F444 HydrophobicContact CB-CD2 4.06Å; L441-F444 HydrophobicContact CD1-CD2 4.46Å; L441-F444 PolarHBondContact O-N 3.23Å; L441-S445 PolarHBondContact O-N 2.88Å; L441-A634 HydrophobicContact CD1-CB 4.41Å
442P92.5Very high94.6Very high39 Ų3932.9 Ų32.925%0.25317%0.168SC..Hα-helixtrans-65.7-29.4-170.226.3-35.6000113.7N440 L446 I469 L473N440-P442 VanDerWaalsContact C-CD 3.43Å; N440-P442 WeakPolarHBondContact O-CD 3.36Å; P442-L446 WeakPolarHBondContact O-CB 3.29Å; P442-L446 PolarHBondContact O-N 3.25Å; P442-I469 HydrophobicContact CB-CG2 4.14Å; P442-I469 VanDerWaalsContact O-CG2 3.26Å; P442-I469 WeakPolarHBondContact O-CG2 3.29Å; P442-L473 HydrophobicContact CB-CD2 3.88Å; P442-L473 HydrophobicContact CB-CG 4.13Å; P442-L473 HydrophobicContact CG-CD2 3.82Å
443S91Very high94.5Very high73 Ų7334.2 Ų34.251%0.5117%0.174SC..Hα-helixtrans-65-41.5176.8520000112.6L441 Y447L441-S443 VanDerWaalsContact C-N 3.31Å; L441-S443 PolarHBondContact O-N 3.12Å; S443-Y447 PolarHBondContact O-N 3.05Å
444F93.5Very high94.3Very high32 Ų3241.8 Ų41.814%0.1420%0.204CC..Hα-helixtrans-71.9-44.9175.5-69.8-89.1000110.8Y436 L441 L446 Y447 Y448 A637 I641Y436-F444 HydrophobicContact CD1-CB 3.79Å; Y436-F444 HydrophobicContact CD1-CG 4.38Å; Y436-F444 HydrophobicContact CE1-CB 4.33Å; Y436-F444 HydrophobicContact CG-CB 3.97Å; L441-F444 HydrophobicContact CB-CB 4.4Å; L441-F444 HydrophobicContact CB-CD2 4.06Å; L441-F444 HydrophobicContact CD1-CD2 4.46Å; L441-F444 PolarHBondContact O-N 3.23Å; F444-L446 VanDerWaalsContact C-N 3.27Å; F444-L446 PolarHBondContact O-N 3.06Å; F444-Y447 WeakPolarHBondContact O-CB 3.49Å; F444-Y447 PolarHBondContact O-N 2.82Å; F444-Y448 HydrophobicContact CB-CE2 4.43Å; F444-Y448 WeakPolarHBondContact O-CD2 3.32Å; F444-Y448 PolarHBondContact O-N 3.39Å; F444-Y448 VanDerWaalsContact O-N 3.15Å; F444-A637 HydrophobicContact CD1-CB 3.77Å; F444-A637 HydrophobicContact CE1-CB 3.47Å; F444-A637 VanDerWaalsContact CE1-CB 3.47Å; F444-A637 HydrophobicContact CZ-CB 4.25Å; F444-I641 HydrophobicContact CD1-CD1 3.49Å; F444-I641 VanDerWaalsContact CD1-CD1 3.49Å; F444-I641 HydrophobicContact CE1-CD1 3.47Å; F444-I641 VanDerWaalsContact CE1-CD1 3.47Å
445S94.6Very high94Very high0 Ų041.4 Ų41.40%020%0.203CC..Hα-helixtrans-55-43.4175.7-178.20000111.8G433 L441 Y447 Y448 Y449 I469G433-S445 PolarHBondContact O-OG 3.37Å; L441-S445 PolarHBondContact O-N 2.88Å; S445-Y447 VanDerWaalsContact C-N 3.32Å; S445-Y447 PolarHBondContact O-N 2.64Å; S445-Y448 PolarHBondContact O-N 3.26Å; S445-Y449 PolarHBondContact O-N 3.08Å; S445-Y449 WeakPolarHBondContact OG-CD2 3.22Å; S445-Y449 WeakPolarHBondContact OG-CE2 3.21Å; S445-I469 WeakPolarHBondContact OG-CD1 3.43Å
446L94.8Very high93.7Very high15 Ų1541.6 Ų41.68%0.07920%0.204CC..Hα-helixtrans-57.6-42175.6-176.565.4000112.7P442 F444 R450 L466 I469 Y470 L473P442-L446 WeakPolarHBondContact O-CB 3.29Å; P442-L446 PolarHBondContact O-N 3.25Å; F444-L446 VanDerWaalsContact C-N 3.27Å; F444-L446 PolarHBondContact O-N 3.06Å; L446-R450 WeakPolarHBondContact O-CB 3.49Å; L446-R450 VanDerWaalsContact O-CG 3.29Å; L446-R450 WeakPolarHBondContact O-CG 3.23Å; L446-R450 PolarHBondContact O-N 2.89Å; L446-L466 HydrophobicContact CD1-CG 4.26Å; L446-I469 HydrophobicContact CB-CG2 3.81Å; L446-I469 HydrophobicContact CD1-CG2 4.26Å; L446-Y470 HydrophobicContact CD1-CD1 4.07Å; L446-Y470 HydrophobicContact CD1-CE1 3.63Å; L446-Y470 HydrophobicContact CD1-CE2 4.29Å; L446-Y470 HydrophobicContact CD2-CD1 4.4Å; L446-Y470 HydrophobicContact CD2-CE1 3.81Å; L446-Y470 HydrophobicContact CG-CE1 4.37Å; L446-L473 HydrophobicContact CD2-CD1 3.88Å
447Y95.4Very high93.4Very high47 Ų4744.3 Ų44.318%0.18422%0.221CC..Hα-helixtrans-61.7-51.7177.2171.4-95000111.1W429 S443 F444 S445 Y449 R450 E451W429-Y447 HydrophobicContact CZ3-CE1 4.24Å; S443-Y447 PolarHBondContact O-N 3.05Å; F444-Y447 WeakPolarHBondContact O-CB 3.49Å; F444-Y447 PolarHBondContact O-N 2.82Å; S445-Y447 VanDerWaalsContact C-N 3.32Å; S445-Y447 PolarHBondContact O-N 2.64Å; Y447-Y449 PolarHBondContact O-N 2.86Å; Y447-R450 PolarHBondContact O-N 3.26Å; Y447-E451 HydrophobicContact CE1-CG 4.21Å; Y447-E451 HydrophobicContact CE2-CG 4.37Å; Y447-E451 PolarHBondContact O-N 3.26Å; Y447-E451 VanDerWaalsContact O-N 3.09Å
448Y95.5Very high93.1Very high11 Ų1147.2 Ų47.24%0.04324%0.241CC..Hα-helixtrans-65.3-38-177.9-69.1-72.2000112.6W429 L432 Y436 F444 S445 E451 A452W429-Y448 AromaticContact CE3-CD1 3.63Å; W429-Y448 HydrophobicContact CE3-CD1 3.63Å; W429-Y448 HydrophobicContact CE3-CE1 4.29Å; W429-Y448 AromaticContact CZ3-CD1 3.63Å; W429-Y448 HydrophobicContact CZ3-CD1 3.63Å; W429-Y448 AromaticContact CZ3-CE1 3.86Å; W429-Y448 HydrophobicContact CZ3-CE1 3.86Å; L432-Y448 HydrophobicContact CB-CD1 3.82Å; L432-Y448 HydrophobicContact CB-CD2 4.47Å; L432-Y448 HydrophobicContact CB-CE1 4.3Å; L432-Y448 HydrophobicContact CB-CG 3.94Å; L432-Y448 HydrophobicContact CD1-CD1 3.87Å; L432-Y448 HydrophobicContact CD1-CE1 3.73Å; L432-Y448 HydrophobicContact CG-CD1 4.49Å; Y436-Y448 AromaticContact CD2-CD2 3.4Å; Y436-Y448 HydrophobicContact CD2-CD2 3.4Å; Y436-Y448 AromaticContact CD2-CE2 3.29Å; Y436-Y448 HydrophobicContact CD2-CE2 3.29Å; Y436-Y448 HydrophobicContact CD2-CG 4.41Å; Y436-Y448 AromaticContact CE2-CD2 3.7Å; Y436-Y448 HydrophobicContact CE2-CD2 3.7Å; Y436-Y448 AromaticContact CE2-CE2 3.09Å; Y436-Y448 HydrophobicContact CE2-CE2 3.09Å; Y436-Y448 AromaticContact CE2-CZ 3.63Å; Y436-Y448 HydrophobicContact CG-CD2 4.24Å; Y436-Y448 HydrophobicContact CG-CE2 4.17Å; Y436-Y448 AromaticContact CZ-CE2 3.81Å; F444-Y448 HydrophobicContact CB-CE2 4.43Å; F444-Y448 WeakPolarHBondContact O-CD2 3.32Å; F444-Y448 PolarHBondContact O-N 3.39Å; F444-Y448 VanDerWaalsContact O-N 3.15Å; S445-Y448 PolarHBondContact O-N 3.26Å; Y448-E451 PolarHBondContact O-N 2.96Å; Y448-A452 PolarHBondContact O-N 2.89Å
449Y96.4Very high92.8Very high2 Ų243.6 Ų43.61%0.00822%0.219CC..Hα-helixtrans-68.3-34.5174.1-71.9-34.6000113.2Y430 G433 Q434 E437 S445 Y447 A452 Q453 A465 I469Y430-Y449 AromaticContact CD2-CD1 3.76Å; Y430-Y449 HydrophobicContact CD2-CD1 3.76Å; Y430-Y449 AromaticContact CD2-CE1 3.43Å; Y430-Y449 HydrophobicContact CD2-CE1 3.43Å; Y430-Y449 VanDerWaalsContact CD2-CE1 3.43Å; Y430-Y449 HydrophobicContact CE2-CD1 4.22Å; Y430-Y449 AromaticContact CE2-CE1 3.61Å; Y430-Y449 HydrophobicContact CE2-CE1 3.61Å; Y430-Y449 HydrophobicContact CG-CE1 4.39Å; Y430-Y449 WeakPolarHBondContact O-CE1 3.42Å; G433-Y449 VanDerWaalsContact C-CZ 3.48Å; Q434-Y449 WeakPolarHBondContact CA-OH 3.38Å; Q434-Y449 HydrophobicContact CG-CE1 4.25Å; Q434-Y449 VanDerWaalsContact CG-OH 3.23Å; Q434-Y449 WeakPolarHBondContact CG-OH 3.45Å; Q434-Y449 PolarHBondContact N-OH 3.41Å; E437-Y449 PolarHBondContact OE2-OH 3.15Å; S445-Y449 PolarHBondContact O-N 3.08Å; S445-Y449 WeakPolarHBondContact OG-CD2 3.22Å; S445-Y449 WeakPolarHBondContact OG-CE2 3.21Å; Y447-Y449 PolarHBondContact O-N 2.86Å; Y449-A452 PolarHBondContact O-N 3.1Å; Y449-Q453 WeakPolarHBondContact O-CB 3.38Å; Y449-Q453 PolarHBondContact O-N 3.06Å; Y449-A465 HydrophobicContact CD2-CB 4.38Å; Y449-A465 HydrophobicContact CE1-CB 4.24Å; Y449-A465 HydrophobicContact CE2-CB 4.04Å; Y449-I469 HydrophobicContact CD2-CG1 3.6Å; Y449-I469 HydrophobicContact CE2-CD1 4.06Å; Y449-I469 HydrophobicContact CE2-CG1 3.52Å
450R95.5Very high92.6Very high117 Ų11743.8 Ų43.844%0.44222%0.222SC..Hα-helixtrans-63.4-43.6173.7-81.2178175.8-165.1-0.4111.6L446 Y447 Q453 Y454 L466 Y470L446-R450 WeakPolarHBondContact O-CB 3.49Å; L446-R450 VanDerWaalsContact O-CG 3.29Å; L446-R450 WeakPolarHBondContact O-CG 3.23Å; L446-R450 PolarHBondContact O-N 2.89Å; Y447-R450 PolarHBondContact O-N 3.26Å; R450-Q453 PolarHBondContact O-N 3.48Å; R450-Y454 WeakPolarHBondContact O-CB 3.21Å; R450-Y454 PolarHBondContact O-N 3.19Å; R450-L466 HydrophobicContact CB-CD1 4.4Å; R450-L466 HydrophobicContact CG-CD1 3.68Å; R450-Y470 PolarHBondContact NE-OH 3.37Å; R450-Y470 PolarHBondContact NH2-OH 2.98Å
451E94.7Very high92.5Very high57 Ų5744.3 Ų44.327%0.26622%0.216SC..Hα-helixtrans-63-41.8175-67-59.1128.100111.5W429 Y447 Y448 Y454 L455W429-E451 HydrophobicContact CD2-CB 3.88Å; W429-E451 HydrophobicContact CE3-CB 3.62Å; W429-E451 HydrophobicContact CE3-CG 4.14Å; W429-E451 HydrophobicContact CG-CB 4.39Å; W429-E451 HydrophobicContact CZ3-CB 4.04Å; W429-E451 HydrophobicContact CZ3-CG 4.05Å; Y447-E451 HydrophobicContact CE1-CG 4.21Å; Y447-E451 HydrophobicContact CE2-CG 4.37Å; Y447-E451 PolarHBondContact O-N 3.26Å; Y447-E451 VanDerWaalsContact O-N 3.09Å; Y448-E451 PolarHBondContact O-N 2.96Å; E451-Y454 PolarHBondContact O-N 3.18Å; E451-L455 WeakPolarHBondContact O-CG 3.36Å; E451-L455 PolarHBondContact O-N 3.31Å; E451-L455 VanDerWaalsContact O-N 3.15Å
452A94.9Very high92.4Very high0 Ų043 Ų430%021%0.209CC..Hα-helixtrans-61.3-45.4174.600000112.2W429 Y448 Y449 Y454 L455 M456 L462W429-A452 HydrophobicContact CB-CB 3.74Å; Y448-A452 PolarHBondContact O-N 2.89Å; Y449-A452 PolarHBondContact O-N 3.1Å; A452-Y454 VanDerWaalsContact C-N 3.33Å; A452-Y454 PolarHBondContact O-N 3.16Å; A452-L455 PolarHBondContact O-N 3.36Å; A452-M456 PolarHBondContact O-N 2.87Å; A452-L462 HydrophobicContact CB-CD1 4.33Å; A452-L462 HydrophobicContact CB-CD2 4.27Å
453Q93.6Very high92.5Very high30 Ų3041.1 Ų41.114%0.1420%0.197CC..Hα-helixtrans-65.2-36.1177.5-173.2-168.723.900112.1Y449 R450 L455 M456 P457 I463 L466Y449-Q453 WeakPolarHBondContact O-CB 3.38Å; Y449-Q453 PolarHBondContact O-N 3.06Å; R450-Q453 PolarHBondContact O-N 3.48Å; Q453-L455 VanDerWaalsContact C-N 3.3Å; Q453-L455 PolarHBondContact O-N 3.5Å; Q453-M456 CarbonylContact O-C 3.52Å; Q453-M456 PolarHBondContact O-N 3.21Å; Q453-P457 WeakPolarHBondContact O-CA 3.43Å; Q453-P457 VanDerWaalsContact O-N 3.15Å; Q453-I463 HydrophobicContact CG-CG1 4.32Å; Q453-L466 HydrophobicContact CB-CD1 4.41Å
454Y92.1Very high92.7Very high159 Ų15937.9 Ų37.962%0.62417%0.174SC*.Hα-helixtrans-62.1-40.6176.3176.6-96.5000111.2R450 E451 A452R450-Y454 WeakPolarHBondContact O-CB 3.21Å; R450-Y454 PolarHBondContact O-N 3.19Å; E451-Y454 PolarHBondContact O-N 3.18Å; A452-Y454 VanDerWaalsContact C-N 3.33Å; A452-Y454 PolarHBondContact O-N 3.16Å
455L90.5Very high92.7Very high27 Ų2736.5 Ų36.514%0.14117%0.169CC..Hα-helixtrans-72.1-40.1175.7-67.4171.4000112.6W429 E451 A452 Q453W429-L455 HydrophobicContact CG-CD1 4.29Å; E451-L455 WeakPolarHBondContact O-CG 3.36Å; E451-L455 PolarHBondContact O-N 3.31Å; E451-L455 VanDerWaalsContact O-N 3.15Å; A452-L455 PolarHBondContact O-N 3.36Å; Q453-L455 VanDerWaalsContact C-N 3.3Å; Q453-L455 PolarHBondContact O-N 3.5Å
456M88.9Confident92.7Very high8 Ų836.6 Ų36.64%0.03917%0.169CC..  trans-127.280.8-178.3-87.9-62.3-91.900112.7H269 Y426 A452 Q453 T458 D459 L462H269-M456 HydrophobicContact CB-CG 4Å; H269-M456 HydrophobicContact CB-SD 3.26Å; H269-M456 WeakPolarHBondContact CB-SD 3.37Å; Y426-M456 HydrophobicContact CD1-CB 4.47Å; Y426-M456 HydrophobicContact CD1-CG 3.56Å; Y426-M456 HydrophobicContact CD2-CB 4.14Å; Y426-M456 HydrophobicContact CD2-CG 4.06Å; Y426-M456 HydrophobicContact CE1-CG 3.94Å; Y426-M456 HydrophobicContact CE2-CG 4.39Å; Y426-M456 HydrophobicContact CG-CB 4.05Å; Y426-M456 HydrophobicContact CG-CG 3.63Å; A452-M456 PolarHBondContact O-N 2.87Å; Q453-M456 CarbonylContact O-C 3.52Å; Q453-M456 PolarHBondContact O-N 3.21Å; M456-T458 VanDerWaalsContact C-N 3.26Å; M456-T458 PolarHBondContact O-N 3.1Å; M456-D459 HydrophobicContact CB-CB 4.38Å; M456-L462 HydrophobicContact CB-CD1 3.69Å
457P88.6Confident92.7Very high56 Ų5635.9 Ų35.936%0.36417%0.165SC..THydrogen-bonded Turntrans-76-11.1-176.229.5-35.8000114.4Q453Q453-P457 WeakPolarHBondContact O-CA 3.43Å; Q453-P457 VanDerWaalsContact O-N 3.15Å
458T86.8Confident92.6Very high94 Ų9435.3 Ų35.358%0.57716%0.164SC*.THydrogen-bonded Turntrans-95.4-6.9-178.852.70000113.4M456 S460 V489M456-T458 VanDerWaalsContact C-N 3.26Å; M456-T458 PolarHBondContact O-N 3.1Å; T458-S460 PolarHBondContact O-N 3.49Å; T458-V489 WeakPolarHBondContact O-CG1 3.49Å
459D88.1Confident92.6Very high8 Ų834.8 Ų34.84%0.04316%0.162CC..  trans-87.2106.9179.3-168.6-20.7000110.1R304 M456 R461 L462R304-D459 IonicContact CZ-OD1 3.78Å; R304-D459 IonicContact CZ-OD2 3.77Å; R304-D459 IonicContact NH1-OD2 3.82Å; R304-D459 PolarHBondContact NH1-OD2 3.25Å; R304-D459 IonicContact NH2-OD1 3.83Å; R304-D459 PolarHBondContact NH2-OD1 3.43Å; R304-D459 IonicContact NH2-OD2 3.77Å; R304-D459 PolarHBondContact NH2-OD2 3.03Å; M456-D459 HydrophobicContact CB-CB 4.38Å; D459-R461 VanDerWaalsContact C-N 3.27Å; D459-R461 PolarHBondContact O-N 3.42Å; D459-R461 PolarHBondContact OD1-N 2.89Å; D459-R461 IonicContact OD1-NE 2.88Å; D459-L462 HydrophobicContact CB-CB 4.46Å; D459-L462 HydrophobicContact CB-CD1 3.82Å; D459-L462 HydrophobicContact CB-CG 3.86Å; D459-L462 PolarHBondContact O-N 2.9Å
460S90.2Very high92.6Very high17 Ų1735.6 Ų35.612%0.11917%0.166CC..Hα-helixtrans-58.5-35-178.354.60000113.1T458 L462 I463 V464 G490T458-S460 PolarHBondContact O-N 3.49Å; S460-L462 VanDerWaalsContact C-N 3.35Å; S460-L462 PolarHBondContact O-N 3.46Å; S460-I463 WeakPolarHBondContact O-CB 3.35Å; S460-I463 PolarHBondContact O-N 2.65Å; S460-I463 VanDerWaalsContact O-N 3.1Å; S460-V464 WeakPolarHBondContact O-CG2 3.47Å; S460-V464 PolarHBondContact O-N 3.24Å; S460-G490 WeakPolarHBondContact CB-O 3.31Å; S460-G490 PolarHBondContact OG-O 3.46Å
461R90.3Very high92.4Very high107 Ų10730.6 Ų30.640%0.40415%0.151SC..Hα-helixtrans-64.3-38.4-179-57.9-175.1-53.9-178.57.5112.4D459 I463 V464 A465D459-R461 VanDerWaalsContact C-N 3.27Å; D459-R461 PolarHBondContact O-N 3.42Å; D459-R461 PolarHBondContact OD1-N 2.89Å; D459-R461 IonicContact OD1-NE 2.88Å; R461-I463 VanDerWaalsContact C-N 3.26Å; R461-I463 PolarHBondContact O-N 3.22Å; R461-V464 PolarHBondContact O-N 2.82Å; R461-A465 WeakPolarHBondContact O-CB 3.32Å; R461-A465 PolarHBondContact O-N 2.69Å
462L92.9Very high92.3Very high4 Ų433.8 Ų33.82%0.02116%0.161CC..Hα-helixtrans-63.1-38.4175.8-59.8-177.8000110.8Y426 Y430 A452 M456 D459 S460 L466Y426-L462 HydrophobicContact CD2-CD1 3.93Å; Y426-L462 HydrophobicContact CE2-CD1 4.45Å; Y430-L462 HydrophobicContact CD1-CD2 4.44Å; Y430-L462 HydrophobicContact CD2-CD2 3.17Å; Y430-L462 HydrophobicContact CE2-CD2 3.8Å; Y430-L462 HydrophobicContact CG-CD2 3.54Å; A452-L462 HydrophobicContact CB-CD1 4.33Å; A452-L462 HydrophobicContact CB-CD2 4.27Å; M456-L462 HydrophobicContact CB-CD1 3.69Å; D459-L462 HydrophobicContact CB-CB 4.46Å; D459-L462 HydrophobicContact CB-CD1 3.82Å; D459-L462 HydrophobicContact CB-CG 3.86Å; D459-L462 PolarHBondContact O-N 2.9Å; S460-L462 VanDerWaalsContact C-N 3.35Å; S460-L462 PolarHBondContact O-N 3.46Å; L462-L466 VanDerWaalsContact O-CB 3.31Å; L462-L466 WeakPolarHBondContact O-CB 3.37Å; L462-L466 PolarHBondContact O-N 2.99Å; L462-L466 VanDerWaalsContact O-N 3.11Å
463I94.2Very high92.2Very high0 Ų036.3 Ų36.30%017%0.173CC..Hα-helixtrans-72.4-39.8179.9-52.7176.1000110.8Q453 S460 R461 L466 G467 C482 R485 A486 V489Q453-I463 HydrophobicContact CG-CG1 4.32Å; S460-I463 WeakPolarHBondContact O-CB 3.35Å; S460-I463 PolarHBondContact O-N 2.65Å; S460-I463 VanDerWaalsContact O-N 3.1Å; R461-I463 VanDerWaalsContact C-N 3.26Å; R461-I463 PolarHBondContact O-N 3.22Å; I463-L466 PolarHBondContact O-N 2.7Å; I463-G467 PolarHBondContact O-N 3.34Å; I463-C482 HydrophobicContact CG2-CB 4.16Å; I463-C482 WeakPolarHBondContact CG2-O 3.49Å; I463-R485 HydrophobicContact CD1-CG 4.2Å; I463-R485 HydrophobicContact CG2-CB 4.41Å; I463-A486 HydrophobicContact CB-CB 3.94Å; I463-A486 HydrophobicContact CG2-CB 3.86Å; I463-V489 HydrophobicContact CD1-CG2 4.06Å
464V94.7Very high92.1Very high4 Ų442.9 Ų42.92%0.02420%0.202CC..Hα-helixtrans-62.1-52.2174.9172.50000110.5S460 R461 L466 G467 E468 Y483 A486 E495 A496 R499S460-V464 WeakPolarHBondContact O-CG2 3.47Å; S460-V464 PolarHBondContact O-N 3.24Å; R461-V464 PolarHBondContact O-N 2.82Å; V464-L466 PolarHBondContact O-N 3.37Å; V464-G467 CarbonylContact O-C 3.21Å; V464-G467 WeakPolarHBondContact O-CA 3.45Å; V464-G467 PolarHBondContact O-N 3.46Å; V464-E468 WeakPolarHBondContact O-CG 3.46Å; V464-E468 PolarHBondContact O-N 2.83Å; V464-Y483 HydrophobicContact CG1-CE1 4.29Å; V464-A486 HydrophobicContact CG2-CB 3.79Å; V464-E495 HydrophobicContact CG1-CG 4.11Å; V464-A496 HydrophobicContact CG2-CB 3.73Å; V464-R499 HydrophobicContact CG1-CG 4.47Å
465A94Very high92.1Very high3 Ų341 Ų413%0.02519%0.193CC..Hα-helixtrans-55.7-40.7177.800000111.9Y430 Y449 R461 G467 E468 I469Y430-A465 HydrophobicContact CE2-CB 3.95Å; Y449-A465 HydrophobicContact CD2-CB 4.38Å; Y449-A465 HydrophobicContact CE1-CB 4.24Å; Y449-A465 HydrophobicContact CE2-CB 4.04Å; R461-A465 WeakPolarHBondContact O-CB 3.32Å; R461-A465 PolarHBondContact O-N 2.69Å; A465-G467 PolarHBondContact O-N 2.85Å; A465-E468 WeakPolarHBondContact O-CB 3.16Å; A465-E468 PolarHBondContact O-N 3.46Å; A465-I469 WeakPolarHBondContact O-CG1 3.43Å; A465-I469 PolarHBondContact O-N 2.77Å; A465-I469 VanDerWaalsContact O-N 3.12Å
466L95Very high92.3Very high2 Ų242.6 Ų42.61%0.0120%0.199CC..Hα-helixtrans-65.5-37.9175.3-173.9145.7000112.5L446 R450 Q453 L462 I463 V464 I469 Y470 C482L446-L466 HydrophobicContact CD1-CG 4.26Å; R450-L466 HydrophobicContact CB-CD1 4.4Å; R450-L466 HydrophobicContact CG-CD1 3.68Å; Q453-L466 HydrophobicContact CB-CD1 4.41Å; L462-L466 VanDerWaalsContact O-CB 3.31Å; L462-L466 WeakPolarHBondContact O-CB 3.37Å; L462-L466 PolarHBondContact O-N 2.99Å; L462-L466 VanDerWaalsContact O-N 3.11Å; I463-L466 PolarHBondContact O-N 2.7Å; V464-L466 PolarHBondContact O-N 3.37Å; L466-I469 PolarHBondContact O-N 3.38Å; L466-Y470 HydrophobicContact CD2-CD2 3.71Å; L466-Y470 HydrophobicContact CD2-CE2 3.22Å; L466-Y470 HydrophobicContact CG-CE2 4.19Å; L466-Y470 WeakPolarHBondContact O-CD2 3.46Å; L466-Y470 PolarHBondContact O-N 3.48Å; L466-Y470 VanDerWaalsContact O-N 3.14Å; L466-C482 HydrophobicContact CD2-CB 4.28Å; L466-C482 WeakPolarHBondContact CD2-SG 3.34Å
467G94.4Very high92.4Very high0 Ų047 Ų470%022%0.223CC..Hα-helixtrans-62.4-39171.100000113I463 V464 A465 Y470 G471 A479 Y483I463-G467 PolarHBondContact O-N 3.34Å; V464-G467 CarbonylContact O-C 3.21Å; V464-G467 WeakPolarHBondContact O-CA 3.45Å; V464-G467 PolarHBondContact O-N 3.46Å; A465-G467 PolarHBondContact O-N 2.85Å; G467-Y470 PolarHBondContact O-N 2.99Å; G467-G471 PolarHBondContact O-N 3.15Å; G467-A479 WeakPolarHBondContact O-CB 3.47Å; G467-Y483 PolarHBondContact O-OH 3.29Å
468E94.2Very high92.6Very high35 Ų3547.9 Ų47.916%0.16422%0.222CC..Hα-helixtrans-63.4-43.8177.2-66-172.3123.200111.7V464 A465 Y470 G471 R472 Y483 R499V464-E468 WeakPolarHBondContact O-CG 3.46Å; V464-E468 PolarHBondContact O-N 2.83Å; A465-E468 WeakPolarHBondContact O-CB 3.16Å; A465-E468 PolarHBondContact O-N 3.46Å; E468-Y470 VanDerWaalsContact C-N 3.35Å; E468-Y470 PolarHBondContact O-N 2.94Å; E468-G471 WeakPolarHBondContact O-CA 3.32Å; E468-G471 PolarHBondContact O-N 3.24Å; E468-G471 VanDerWaalsContact O-N 3.12Å; E468-R472 PolarHBondContact O-N 3.29Å; E468-Y483 VanDerWaalsContact CA-OH 3.29Å; E468-Y483 WeakPolarHBondContact CA-OH 3.38Å; E468-Y483 PolarHBondContact N-OH 3.45Å; E468-Y483 VanDerWaalsContact N-OH 3.16Å; E468-R499 IonicContact OE1-CZ 3.68Å; E468-R499 IonicContact OE1-NE 3.3Å; E468-R499 IonicContact OE1-NH1 2.67Å; E468-R499 PolarHBondContact OE1-NH1 3.36Å; E468-R499 IonicContact OE1-NH2 3.48Å; E468-R499 PolarHBondContact OE1-NH2 3.2Å
469I95.3Very high93Very high0 Ų043.4 Ų43.40%020%0.195CC..Hα-helixtrans-64.1-39.9176.7-62.1-53.2000111.4E437 P442 S445 L446 Y449 A465 L466 G471 R472 L473E437-I469 HydrophobicContact CB-CD1 4.36Å; E437-I469 HydrophobicContact CG-CD1 3.83Å; P442-I469 HydrophobicContact CB-CG2 4.14Å; P442-I469 VanDerWaalsContact O-CG2 3.26Å; P442-I469 WeakPolarHBondContact O-CG2 3.29Å; S445-I469 WeakPolarHBondContact OG-CD1 3.43Å; L446-I469 HydrophobicContact CB-CG2 3.81Å; L446-I469 HydrophobicContact CD1-CG2 4.26Å; Y449-I469 HydrophobicContact CD2-CG1 3.6Å; Y449-I469 HydrophobicContact CE2-CD1 4.06Å; Y449-I469 HydrophobicContact CE2-CG1 3.52Å; A465-I469 WeakPolarHBondContact O-CG1 3.43Å; A465-I469 PolarHBondContact O-N 2.77Å; A465-I469 VanDerWaalsContact O-N 3.12Å; L466-I469 PolarHBondContact O-N 3.38Å; I469-G471 VanDerWaalsContact C-N 3.3Å; I469-G471 PolarHBondContact O-N 2.87Å; I469-R472 PolarHBondContact O-N 2.83Å; I469-L473 HydrophobicContact CG2-CD1 4.18Å; I469-L473 WeakPolarHBondContact O-CG 3.28Å; I469-L473 PolarHBondContact O-N 3.02Å
470Y95.2Very high93.3Very high19 Ų1943.5 Ų43.58%0.07520%0.195CC..Hα-helixtrans-61.2-39.8171.8-77.2-50000112.5L446 R450 L466 G467 E468 R472 L473 K474 R475 E478L446-Y470 HydrophobicContact CD1-CD1 4.07Å; L446-Y470 HydrophobicContact CD1-CE1 3.63Å; L446-Y470 HydrophobicContact CD1-CE2 4.29Å; L446-Y470 HydrophobicContact CD2-CD1 4.4Å; L446-Y470 HydrophobicContact CD2-CE1 3.81Å; L446-Y470 HydrophobicContact CG-CE1 4.37Å; R450-Y470 PolarHBondContact NE-OH 3.37Å; R450-Y470 PolarHBondContact NH2-OH 2.98Å; L466-Y470 HydrophobicContact CD2-CD2 3.71Å; L466-Y470 HydrophobicContact CD2-CE2 3.22Å; L466-Y470 HydrophobicContact CG-CE2 4.19Å; L466-Y470 WeakPolarHBondContact O-CD2 3.46Å; L466-Y470 PolarHBondContact O-N 3.48Å; L466-Y470 VanDerWaalsContact O-N 3.14Å; G467-Y470 PolarHBondContact O-N 2.99Å; E468-Y470 VanDerWaalsContact C-N 3.35Å; E468-Y470 PolarHBondContact O-N 2.94Å; Y470-R472 VanDerWaalsContact C-N 3.34Å; Y470-R472 PolarHBondContact O-N 3.3Å; Y470-L473 CarbonylContact O-C 3.56Å; Y470-L473 PolarHBondContact O-N 3.45Å; Y470-L473 VanDerWaalsContact O-N 3.17Å; Y470-K474 PolarHBondContact O-N 3.1Å; Y470-R475 HydrophobicContact CD1-CB 4.16Å; Y470-R475 PolarHBondContact O-N 3.42Å; Y470-E478 HydrophobicContact CD1-CB 4.08Å; Y470-E478 HydrophobicContact CD2-CB 3.86Å; Y470-E478 HydrophobicContact CE1-CB 4.22Å; Y470-E478 HydrophobicContact CE2-CB 3.93Å; Y470-E478 HydrophobicContact CG-CB 3.93Å
471G92.1Very high93.5Very high13 Ų1348.9 Ų48.913%0.13422%0.216CC..Hα-helixtrans-58.6-43.8173.300000112.5G467 E468 I469 L473 K474G467-G471 PolarHBondContact O-N 3.15Å; E468-G471 WeakPolarHBondContact O-CA 3.32Å; E468-G471 PolarHBondContact O-N 3.24Å; E468-G471 VanDerWaalsContact O-N 3.12Å; I469-G471 VanDerWaalsContact C-N 3.3Å; I469-G471 PolarHBondContact O-N 2.87Å; G471-L473 VanDerWaalsContact C-N 3.31Å; G471-L473 PolarHBondContact O-N 3.03Å; G471-K474 WeakPolarHBondContact O-CA 3.39Å; G471-K474 PolarHBondContact O-N 3.38Å
472R91.3Very high93.6Very high124 Ų12444.4 Ų44.447%0.46820%0.201SC..Hα-helixtrans-65.2-33.9175-67.2-172.3-169167.915.5112.8E437 E468 I469 Y470 K474E437-R472 IonicContact OE1-CZ 2.76Å; E437-R472 VanDerWaalsContact OE1-CZ 3.28Å; E437-R472 IonicContact OE1-NH1 2.83Å; E437-R472 PolarHBondContact OE1-NH1 2.66Å; E437-R472 IonicContact OE1-NH2 2.83Å; E437-R472 PolarHBondContact OE1-NH2 3.15Å; E468-R472 PolarHBondContact O-N 3.29Å; I469-R472 PolarHBondContact O-N 2.83Å; Y470-R472 VanDerWaalsContact C-N 3.34Å; Y470-R472 PolarHBondContact O-N 3.3Å; R472-K474 PolarHBondContact O-N 3.31Å
473L93Very high93.7Very high52 Ų5244.9 Ų44.927%0.27220%0.203SC..THydrogen-bonded Turntrans-76.84.9172.7-66.9172.8000113.3P442 L446 I469 Y470 G471 R475P442-L473 HydrophobicContact CB-CD2 3.88Å; P442-L473 HydrophobicContact CB-CG 4.13Å; P442-L473 HydrophobicContact CG-CD2 3.82Å; L446-L473 HydrophobicContact CD2-CD1 3.88Å; I469-L473 HydrophobicContact CG2-CD1 4.18Å; I469-L473 WeakPolarHBondContact O-CG 3.28Å; I469-L473 PolarHBondContact O-N 3.02Å; Y470-L473 CarbonylContact O-C 3.56Å; Y470-L473 PolarHBondContact O-N 3.45Å; Y470-L473 VanDerWaalsContact O-N 3.17Å; G471-L473 VanDerWaalsContact C-N 3.31Å; G471-L473 PolarHBondContact O-N 3.03Å; L473-R475 HydrophobicContact CB-CG 4.29Å; L473-R475 PolarHBondContact O-N 2.78Å
474K91.4Very high93.7Very high168 Ų16846 Ų4673%0.7321%0.207SC*.THydrogen-bonded Turntrans57.523.6-175.9-56.3-176.7179.1-177.90113.9Y470 G471 R472 F476Y470-K474 PolarHBondContact O-N 3.1Å; G471-K474 WeakPolarHBondContact O-CA 3.39Å; G471-K474 PolarHBondContact O-N 3.38Å; R472-K474 PolarHBondContact O-N 3.31Å; K474-F476 HydrophobicContact CB-CE2 4.17Å; K474-F476 HydrophobicContact CB-CZ 4.45Å; K474-F476 PolarHBondContact O-N 3.03Å
475R93.6Very high93.6Very high120 Ų12050.2 Ų50.245%0.45322%0.223SC..  trans-94.869.5176.7-72.1-169.9-165-175.82.9109.5Y470 L473 D477 E478 A479Y470-R475 HydrophobicContact CD1-CB 4.16Å; Y470-R475 PolarHBondContact O-N 3.42Å; L473-R475 HydrophobicContact CB-CG 4.29Å; L473-R475 PolarHBondContact O-N 2.78Å; R475-D477 PolarHBondContact O-N 3.49Å; R475-E478 WeakPolarHBondContact CB-OE2 3.44Å; R475-A479 PolarHBondContact O-N 3.25Å; R475-A479 VanDerWaalsContact O-N 3.11Å
476F93Very high93.6Very high60 Ų6050 Ų5026%0.26322%0.221SC..Hα-helixtrans-68.2-33.7-169.9-62-67.3000113.2K474 A479 K480 C507K474-F476 HydrophobicContact CB-CE2 4.17Å; K474-F476 HydrophobicContact CB-CZ 4.45Å; K474-F476 PolarHBondContact O-N 3.03Å; F476-A479 WeakPolarHBondContact O-CB 3.48Å; F476-A479 PolarHBondContact O-N 3.45Å; F476-K480 VanDerWaalsContact O-CG 3.25Å; F476-K480 WeakPolarHBondContact O-CG 3.26Å; F476-K480 PolarHBondContact O-N 3.22Å; F476-C507 VanDerWaalsContact CB-SG 3.58Å
477D91.8Very high93.3Very high102 Ų10252.7 Ų52.755%0.54523%0.232SC..Hα-helixtrans-68.3-38.7-179.8-67.1-35.9000112.5R475 K480 K481R475-D477 PolarHBondContact O-N 3.49Å; D477-K480 IonicContact OD1-NZ 2.61Å; D477-K480 PolarHBondContact OD1-NZ 3.45Å; D477-K481 WeakPolarHBondContact O-CG 3.45Å; D477-K481 PolarHBondContact O-N 2.98Å
478E93.4Very high93.2Very high73 Ų7356.4 Ų56.434%0.34126%0.257SS..Hα-helixtrans-67.4-40.6170.2-64.198.1144.300111.9Y470 R475 K480 K481 C482Y470-E478 HydrophobicContact CD1-CB 4.08Å; Y470-E478 HydrophobicContact CD2-CB 3.86Å; Y470-E478 HydrophobicContact CE1-CB 4.22Å; Y470-E478 HydrophobicContact CE2-CB 3.93Å; Y470-E478 HydrophobicContact CG-CB 3.93Å; R475-E478 WeakPolarHBondContact CB-OE2 3.44Å; E478-K480 VanDerWaalsContact C-N 3.35Å; E478-K480 PolarHBondContact O-N 3.38Å; E478-K481 WeakPolarHBondContact O-CB 3.38Å; E478-K481 PolarHBondContact O-N 3.46Å; E478-C482 PolarHBondContact O-N 3.2Å; E478-C482 PolarHBondContact O-SG 2.86Å
479A94.7Very high92.8Very high0 Ų057.6 Ų57.60%027%0.266CS..Hα-helixtrans-58.2-4617600000111.6G467 R475 F476 K481 C482 Y483G467-A479 WeakPolarHBondContact O-CB 3.47Å; R475-A479 PolarHBondContact O-N 3.25Å; R475-A479 VanDerWaalsContact O-N 3.11Å; F476-A479 WeakPolarHBondContact O-CB 3.48Å; F476-A479 PolarHBondContact O-N 3.45Å; A479-K481 VanDerWaalsContact C-N 3.33Å; A479-K481 PolarHBondContact O-N 3.07Å; A479-C482 WeakPolarHBondContact O-CB 3.45Å; A479-C482 PolarHBondContact O-N 3.39Å; A479-C482 VanDerWaalsContact O-N 3.16Å; A479-Y483 HydrophobicContact CB-CD2 4.47Å; A479-Y483 HydrophobicContact CB-CE2 3.97Å; A479-Y483 WeakPolarHBondContact O-CD2 3.43Å; A479-Y483 PolarHBondContact O-N 3.12Å
480K94.3Very high92.2Very high10 Ų1059.6 Ų59.64%0.04329%0.287CS..Hα-helixtrans-55.4-46.4175-69.9169.5-150.1171.30111.6F476 D477 E478 C482 Y483 W484 L500 C503 F504 C507 E509 F759F476-K480 VanDerWaalsContact O-CG 3.25Å; F476-K480 WeakPolarHBondContact O-CG 3.26Å; F476-K480 PolarHBondContact O-N 3.22Å; D477-K480 IonicContact OD1-NZ 2.61Å; D477-K480 PolarHBondContact OD1-NZ 3.45Å; E478-K480 VanDerWaalsContact C-N 3.35Å; E478-K480 PolarHBondContact O-N 3.38Å; K480-C482 VanDerWaalsContact C-N 3.33Å; K480-C482 PolarHBondContact O-N 3.04Å; K480-Y483 PolarHBondContact O-N 3.32Å; K480-W484 WeakPolarHBondContact O-CB 3.4Å; K480-W484 PolarHBondContact O-N 2.89Å; K480-L500 HydrophobicContact CB-CD1 4.07Å; K480-L500 HydrophobicContact CG-CD1 4.3Å; K480-C503 HydrophobicContact CG-CB 4.39Å; K480-F504 HydrophobicContact CD-CD1 4.15Å; K480-F504 HydrophobicContact CD-CE1 3.86Å; K480-F504 HydrophobicContact CG-CE1 4.27Å; K480-C507 WeakPolarHBondContact CE-SG 3.45Å; K480-C507 PolarHBondContact NZ-SG 3.3Å; K480-C507 VanDerWaalsContact NZ-SG 3.39Å; K480-E509 IonicContact NZ-OE1 2.64Å; K480-E509 PolarHBondContact NZ-OE1 3.03Å; K480-F759 HydrophobicContact CB-CZ 4.25Å
481K94Very high91.7Very high130 Ų13059.5 Ų59.557%0.56529%0.287SS*.Hα-helixtrans-61.8-40.7178.2-69.4171.4-174174.10111.9D477 E478 A479 R485 F759D477-K481 WeakPolarHBondContact O-CG 3.45Å; D477-K481 PolarHBondContact O-N 2.98Å; E478-K481 WeakPolarHBondContact O-CB 3.38Å; E478-K481 PolarHBondContact O-N 3.46Å; A479-K481 VanDerWaalsContact C-N 3.33Å; A479-K481 PolarHBondContact O-N 3.07Å; K481-R485 WeakPolarHBondContact O-CB 3.45Å; K481-R485 PolarHBondContact O-N 2.86Å; K481-F759 HydrophobicContact CG-CE1 4.39Å
482C93.4Very high91Very high14 Ų1465.3 Ų65.310%0.09531%0.314CS..Hα-helixtrans-64.1-51.1177.1-68.10000111.4I463 L466 E478 A479 K480 W484 R485 A486I463-C482 HydrophobicContact CG2-CB 4.16Å; I463-C482 WeakPolarHBondContact CG2-O 3.49Å; L466-C482 HydrophobicContact CD2-CB 4.28Å; L466-C482 WeakPolarHBondContact CD2-SG 3.34Å; E478-C482 PolarHBondContact O-N 3.2Å; E478-C482 PolarHBondContact O-SG 2.86Å; A479-C482 WeakPolarHBondContact O-CB 3.45Å; A479-C482 PolarHBondContact O-N 3.39Å; A479-C482 VanDerWaalsContact O-N 3.16Å; K480-C482 VanDerWaalsContact C-N 3.33Å; K480-C482 PolarHBondContact O-N 3.04Å; C482-W484 VanDerWaalsContact C-N 3.34Å; C482-W484 PolarHBondContact O-N 3.43Å; C482-R485 PolarHBondContact O-N 2.99Å; C482-R485 VanDerWaalsContact O-N 3.15Å; C482-A486 PolarHBondContact O-N 3.41Å
483Y95.1Very high90.5Very high13 Ų1364.2 Ų64.25%0.05131%0.314CS..Hα-helixtrans-63.1-39.8179-59.8-46.4000112.6V464 G467 E468 A479 K480 R485 A486 Y487 R499 C503V464-Y483 HydrophobicContact CG1-CE1 4.29Å; G467-Y483 PolarHBondContact O-OH 3.29Å; E468-Y483 VanDerWaalsContact CA-OH 3.29Å; E468-Y483 WeakPolarHBondContact CA-OH 3.38Å; E468-Y483 PolarHBondContact N-OH 3.45Å; E468-Y483 VanDerWaalsContact N-OH 3.16Å; A479-Y483 HydrophobicContact CB-CD2 4.47Å; A479-Y483 HydrophobicContact CB-CE2 3.97Å; A479-Y483 WeakPolarHBondContact O-CD2 3.43Å; A479-Y483 PolarHBondContact O-N 3.12Å; K480-Y483 PolarHBondContact O-N 3.32Å; Y483-R485 VanDerWaalsContact C-N 3.34Å; Y483-R485 PolarHBondContact O-N 3.19Å; Y483-A486 PolarHBondContact O-N 3.32Å; Y483-Y487 PolarHBondContact O-N 3.19Å; Y483-R499 HydrophobicContact CD1-CB 3.79Å; Y483-R499 HydrophobicContact CD2-CB 4.18Å; Y483-R499 HydrophobicContact CE1-CB 3.56Å; Y483-R499 HydrophobicContact CE1-CG 4.17Å; Y483-R499 HydrophobicContact CE2-CB 3.97Å; Y483-R499 HydrophobicContact CG-CB 4.1Å; Y483-C503 HydrophobicContact CD2-CB 4.37Å; Y483-C503 HydrophobicContact CE2-CB 4.26Å
484W93.6Very high90.1Very high25 Ų2561.7 Ų61.710%0.09530%0.301CS..Hα-helixtrans-60-44.1173.3-179.4-104.6000112.3K480 C482 Y487 C488 L500 V755 H756 F759K480-W484 WeakPolarHBondContact O-CB 3.4Å; K480-W484 PolarHBondContact O-N 2.89Å; C482-W484 VanDerWaalsContact C-N 3.34Å; C482-W484 PolarHBondContact O-N 3.43Å; W484-Y487 HydrophobicContact CE3-CD1 4.23Å; W484-Y487 HydrophobicContact CH2-CD1 4.5Å; W484-Y487 HydrophobicContact CH2-CE1 4.46Å; W484-Y487 HydrophobicContact CZ3-CD1 4.04Å; W484-Y487 HydrophobicContact CZ3-CE1 4.25Å; W484-Y487 WeakPolarHBondContact O-CB 3.35Å; W484-Y487 PolarHBondContact O-N 2.88Å; W484-C488 PolarHBondContact O-N 3.47Å; W484-C488 PolarHBondContact O-SG 3.18Å; W484-L500 HydrophobicContact CE3-CD2 3.91Å; W484-V755 HydrophobicContact CE3-CG1 3.71Å; W484-V755 HydrophobicContact CH2-CB 4.25Å; W484-V755 HydrophobicContact CH2-CG1 3.89Å; W484-V755 HydrophobicContact CZ3-CB 3.96Å; W484-V755 HydrophobicContact CZ3-CG1 3.19Å; W484-H756 HydrophobicContact CH2-CB 4.38Å; W484-H756 AromaticContact CH2-CE1 3.54Å; W484-H756 AromaticContact CH2-CG 3.74Å; W484-H756 AromaticContact CH2-ND1 3.27Å; W484-H756 VanDerWaalsContact CH2-ND1 3.27Å; W484-H756 WeakPolarHBondContact CH2-ND1 3.4Å; W484-H756 AromaticContact CZ2-CE1 3.89Å; W484-H756 AromaticContact CZ2-ND1 3.34Å; W484-H756 VanDerWaalsContact CZ2-ND1 3.34Å; W484-H756 WeakPolarHBondContact CZ2-ND1 3.39Å; W484-F759 HydrophobicContact CB-CD1 4.3Å; W484-F759 HydrophobicContact CB-CD2 4.13Å; W484-F759 HydrophobicContact CB-CE1 4.18Å; W484-F759 HydrophobicContact CB-CE2 4.01Å; W484-F759 HydrophobicContact CB-CG 4.28Å; W484-F759 HydrophobicContact CB-CZ 4.04Å; W484-F759 AromaticContact CD1-CD1 3.95Å; W484-F759 AromaticContact CD1-CD2 3.92Å; W484-F759 AromaticContact CD1-CG 3.54Å; W484-F759 HydrophobicContact CD2-CB 4.08Å; W484-F759 AromaticContact CD2-CD2 3.31Å; W484-F759 HydrophobicContact CD2-CD2 3.31Å; W484-F759 AromaticContact CD2-CE2 3.85Å; W484-F759 HydrophobicContact CD2-CE2 3.85Å; W484-F759 AromaticContact CD2-CG 3.78Å; W484-F759 HydrophobicContact CD2-CG 3.78Å; W484-F759 AromaticContact CE2-CD2 3.61Å; W484-F759 AromaticContact CE2-CG 3.79Å; W484-F759 AromaticContact CE3-CD2 3.72Å; W484-F759 HydrophobicContact CE3-CD2 3.72Å; W484-F759 AromaticContact CE3-CE2 3.97Å; W484-F759 HydrophobicContact CE3-CE2 3.97Å; W484-F759 HydrophobicContact CG-CB 4.05Å; W484-F759 HydrophobicContact CG-CD1 4.02Å; W484-F759 AromaticContact CG-CD2 3.51Å; W484-F759 HydrophobicContact CG-CD2 3.51Å; W484-F759 HydrophobicContact CG-CE1 4.35Å; W484-F759 AromaticContact CG-CE2 3.89Å; W484-F759 HydrophobicContact CG-CE2 3.89Å; W484-F759 AromaticContact CG-CG 3.59Å; W484-F759 HydrophobicContact CG-CG 3.59Å; W484-F759 HydrophobicContact CG-CZ 4.3Å; W484-F759 HydrophobicContact CH2-CD2 4.47Å; W484-F759 HydrophobicContact CZ2-CB 4.09Å; W484-F759 HydrophobicContact CZ2-CD2 4.16Å; W484-F759 HydrophobicContact CZ3-CD2 4.31Å; W484-F759 AromaticContact NE1-CD2 3.97Å; W484-F759 AromaticContact NE1-CG 3.66Å
485R93.1Very high90Very high91 Ų9156.1 Ų56.134%0.34328%0.278SS..Hα-helixtrans-64.6-41.8176.1-177.7179.4166.3175-5.5111.7I463 K481 C482 Y483 Y487 C488 V489I463-R485 HydrophobicContact CD1-CG 4.2Å; I463-R485 HydrophobicContact CG2-CB 4.41Å; K481-R485 WeakPolarHBondContact O-CB 3.45Å; K481-R485 PolarHBondContact O-N 2.86Å; C482-R485 PolarHBondContact O-N 2.99Å; C482-R485 VanDerWaalsContact O-N 3.15Å; Y483-R485 VanDerWaalsContact C-N 3.34Å; Y483-R485 PolarHBondContact O-N 3.19Å; R485-Y487 VanDerWaalsContact C-N 3.31Å; R485-Y487 PolarHBondContact O-N 2.92Å; R485-C488 PolarHBondContact O-N 2.78Å; R485-C488 VanDerWaalsContact O-N 3.14Å; R485-V489 HydrophobicContact CG-CG2 4.27Å; R485-V489 WeakPolarHBondContact O-CG2 3.38Å; R485-V489 PolarHBondContact O-N 3.41Å
486A92.6Very high89.9Confident0 Ų050.4 Ų50.40%026%0.256CS..Hα-helixtrans-59.4-43.5176.900000111.3I463 V464 C482 Y483 C488 V489 G490 A496I463-A486 HydrophobicContact CB-CB 3.94Å; I463-A486 HydrophobicContact CG2-CB 3.86Å; V464-A486 HydrophobicContact CG2-CB 3.79Å; C482-A486 PolarHBondContact O-N 3.41Å; Y483-A486 PolarHBondContact O-N 3.32Å; A486-C488 PolarHBondContact O-N 3.05Å; A486-V489 PolarHBondContact O-N 3.48Å; A486-G490 PolarHBondContact O-N 3Å; A486-A496 HydrophobicContact CB-CB 3.6Å
487Y90.4Very high89.9Confident58 Ų5847.7 Ų47.723%0.22724%0.244CC..Hα-helixtrans-59.2-45171.9171.6-105.9000112.4Y483 W484 R485 V489 G490 L497Y483-Y487 PolarHBondContact O-N 3.19Å; W484-Y487 HydrophobicContact CE3-CD1 4.23Å; W484-Y487 HydrophobicContact CH2-CD1 4.5Å; W484-Y487 HydrophobicContact CH2-CE1 4.46Å; W484-Y487 HydrophobicContact CZ3-CD1 4.04Å; W484-Y487 HydrophobicContact CZ3-CE1 4.25Å; W484-Y487 WeakPolarHBondContact O-CB 3.35Å; W484-Y487 PolarHBondContact O-N 2.88Å; R485-Y487 VanDerWaalsContact C-N 3.31Å; R485-Y487 PolarHBondContact O-N 2.92Å; Y487-V489 PolarHBondContact O-N 3.23Å; Y487-G490 PolarHBondContact O-N 3.05Å; Y487-L497 HydrophobicContact CD2-CB 4.35Å; Y487-L497 HydrophobicContact CD2-CD2 4.16Å; Y487-L497 HydrophobicContact CE2-CD2 3.95Å
488C90.6Very high89.9Confident78 Ų7843 Ų4353%0.52722%0.219SC..Hα-helixtrans-66.1-34.8179.6-66.90000113.8W484 R485 A486 G490W484-C488 PolarHBondContact O-N 3.47Å; W484-C488 PolarHBondContact O-SG 3.18Å; R485-C488 PolarHBondContact O-N 2.78Å; R485-C488 VanDerWaalsContact O-N 3.14Å; A486-C488 PolarHBondContact O-N 3.05Å; C488-G490 VanDerWaalsContact C-N 3.29Å
489V87.3Confident89.9Confident59 Ų5943 Ų4336%0.35822%0.216SC..Hα-helixtrans-71.5-28.1179.5167.90000111.5T458 I463 R485 A486 Y487T458-V489 WeakPolarHBondContact O-CG1 3.49Å; I463-V489 HydrophobicContact CD1-CG2 4.06Å; R485-V489 HydrophobicContact CG-CG2 4.27Å; R485-V489 WeakPolarHBondContact O-CG2 3.38Å; R485-V489 PolarHBondContact O-N 3.41Å; A486-V489 PolarHBondContact O-N 3.48Å; Y487-V489 PolarHBondContact O-N 3.23Å
490G82.9Confident89.9Confident42 Ų4243 Ų4343%0.43322%0.216SC..  trans118.1105.9-179.700000110.2S460 A486 Y487 C488S460-G490 WeakPolarHBondContact CB-O 3.31Å; S460-G490 PolarHBondContact OG-O 3.46Å; A486-G490 PolarHBondContact O-N 3Å; Y487-G490 PolarHBondContact O-N 3.05Å; C488-G490 VanDerWaalsContact C-N 3.29Å
491D84Confident89.8Confident17 Ų1742.6 Ų42.69%0.09121%0.214CC..  trans-116.2113.1172.9178.813.6000109E493 G494 E495 A496D491-E493 PolarHBondContact OD1-N 3.39Å; D491-G494 VanDerWaalsContact CG-N 3.31Å; D491-G494 PolarHBondContact OD1-N 3.41Å; D491-G494 VanDerWaalsContact OD1-N 3.15Å; D491-G494 VanDerWaalsContact OD2-CA 3.23Å; D491-G494 WeakPolarHBondContact OD2-CA 3.35Å; D491-G494 PolarHBondContact OD2-N 3.5Å; D491-E495 PolarHBondContact OD2-N 3.4Å; D491-A496 HydrophobicContact CB-CB 4.16Å; D491-A496 VanDerWaalsContact OD2-CB 3.23Å; D491-A496 WeakPolarHBondContact OD2-CB 3.47Å; D491-A496 PolarHBondContact OD2-N 3.09Å
492I78.5Confident89.8Confident135 Ų13538.6 Ų38.669%0.69220%0.199SC*.SBendtrans-75.5-39.9-176.4-61.3172.4000110.1N527I492-N527 PolarHBondContact O-ND2 3.07Å; I492-N527 VanDerWaalsContact O-ND2 3.07Å
493E78.9Confident89.8Confident101 Ų10138.3 Ų38.347%0.47220%0.196SC..SBendtrans-76.5-30.6-175.9-68.4167.8-168.800110.7D491 E495D491-E493 PolarHBondContact OD1-N 3.39Å; E493-E495 VanDerWaalsContact C-N 3.33Å
494G84.9Confident89.7Confident0 Ų037.7 Ų37.70%019%0.194CC..  trans867-179.500000113.3D491 A496 L497 M498 F520D491-G494 VanDerWaalsContact CG-N 3.31Å; D491-G494 PolarHBondContact OD1-N 3.41Å; D491-G494 VanDerWaalsContact OD1-N 3.15Å; D491-G494 VanDerWaalsContact OD2-CA 3.23Å; D491-G494 WeakPolarHBondContact OD2-CA 3.35Å; D491-G494 PolarHBondContact OD2-N 3.5Å; G494-A496 VanDerWaalsContact C-N 3.31Å; G494-A496 PolarHBondContact O-N 3.02Å; G494-L497 PolarHBondContact O-N 3.42Å; G494-M498 PolarHBondContact O-N 3.02Å; G494-M498 VanDerWaalsContact O-N 3.13Å; G494-F520 WeakPolarHBondContact O-CD2 3.45Å; G494-F520 WeakPolarHBondContact O-CE2 3.32Å
495E89.7Confident89.6Confident51 Ų5140.3 Ų40.324%0.23821%0.208CC..Hα-helixtrans-53.9-45176.6-176.7175-164.100112V464 D491 E493 L497 M498 R499V464-E495 HydrophobicContact CG1-CG 4.11Å; D491-E495 PolarHBondContact OD2-N 3.4Å; E493-E495 VanDerWaalsContact C-N 3.33Å; E495-L497 VanDerWaalsContact C-N 3.29Å; E495-L497 PolarHBondContact O-N 3.23Å; E495-M498 WeakPolarHBondContact O-CB 3.4Å; E495-M498 PolarHBondContact O-N 3.11Å; E495-R499 HydrophobicContact CG-CG 3.94Å; E495-R499 WeakPolarHBondContact O-CB 3.33Å; E495-R499 WeakPolarHBondContact O-CG 3.38Å; E495-R499 PolarHBondContact O-N 3.32Å; E495-R499 IonicContact OE1-CZ 2.76Å; E495-R499 IonicContact OE1-NE 3.91Å; E495-R499 PolarHBondContact OE1-NE 2.92Å; E495-R499 IonicContact OE1-NH2 3.85Å; E495-R499 PolarHBondContact OE1-NH2 2.87Å
496A91.8Very high89.5Confident0 Ų044.4 Ų44.40%022%0.223CC..Hα-helixtrans-56.4-43.6-179.600000112.1V464 A486 D491 G494 L500V464-A496 HydrophobicContact CG2-CB 3.73Å; A486-A496 HydrophobicContact CB-CB 3.6Å; D491-A496 HydrophobicContact CB-CB 4.16Å; D491-A496 VanDerWaalsContact OD2-CB 3.23Å; D491-A496 WeakPolarHBondContact OD2-CB 3.47Å; D491-A496 PolarHBondContact OD2-N 3.09Å; G494-A496 VanDerWaalsContact C-N 3.31Å; G494-A496 PolarHBondContact O-N 3.02Å; A496-L500 VanDerWaalsContact O-CB 3.3Å; A496-L500 WeakPolarHBondContact O-CB 3.44Å; A496-L500 PolarHBondContact O-N 3.15Å
497L92.5Very high89.4Confident3 Ų346.6 Ų46.62%0.01624%0.238CC..Hα-helixtrans-73.3-36.5-178.5-171.454.5000111.5Y487 G494 E495 L500 A501 A516 E519 F520Y487-L497 HydrophobicContact CD2-CB 4.35Å; Y487-L497 HydrophobicContact CD2-CD2 4.16Å; Y487-L497 HydrophobicContact CE2-CD2 3.95Å; G494-L497 PolarHBondContact O-N 3.42Å; E495-L497 VanDerWaalsContact C-N 3.29Å; E495-L497 PolarHBondContact O-N 3.23Å; L497-L500 HydrophobicContact CD1-CD2 4.19Å; L497-L500 WeakPolarHBondContact O-CB 3.48Å; L497-L500 PolarHBondContact O-N 3.27Å; L497-A501 PolarHBondContact O-N 2.92Å; L497-A516 HydrophobicContact CD1-CB 4.16Å; L497-E519 VanDerWaalsContact CD2-C 3.49Å; L497-E519 HydrophobicContact CD2-CB 3.77Å; L497-F520 HydrophobicContact CB-CD2 4.45Å; L497-F520 HydrophobicContact CD2-CB 4.03Å; L497-F520 VanDerWaalsContact CD2-N 3.28Å; L497-F520 HydrophobicContact CG-CB 4.03Å
498M92.8Very high89.4Confident3 Ų346.5 Ų46.52%0.01525%0.254CS..Hα-helixtrans-62-48.2172.1-172.960.8178.800111.6G494 E495 L500 A501 I502 Y517 F520 N534 I537G494-M498 PolarHBondContact O-N 3.02Å; G494-M498 VanDerWaalsContact O-N 3.13Å; E495-M498 WeakPolarHBondContact O-CB 3.4Å; E495-M498 PolarHBondContact O-N 3.11Å; M498-L500 VanDerWaalsContact C-N 3.31Å; M498-L500 PolarHBondContact O-N 2.99Å; M498-A501 PolarHBondContact O-N 3.46Å; M498-I502 HydrophobicContact CE-CD1 4.25Å; M498-I502 HydrophobicContact CG-CD1 4.28Å; M498-I502 WeakPolarHBondContact O-CG1 3.3Å; M498-I502 PolarHBondContact O-N 3.46Å; M498-Y517 HydrophobicContact CE-CE1 4.09Å; M498-Y517 HydrophobicContact SD-CD1 4.26Å; M498-Y517 HydrophobicContact SD-CE1 3.78Å; M498-F520 HydrophobicContact CB-CD2 4.12Å; M498-F520 HydrophobicContact CB-CE2 3.94Å; M498-F520 HydrophobicContact CB-CZ 4.43Å; M498-F520 HydrophobicContact SD-CD1 4.36Å; M498-F520 HydrophobicContact SD-CE1 4.23Å; M498-F520 HydrophobicContact SD-CZ 4.39Å; M498-N534 HydrophobicContact CE-CB 3.77Å; M498-N534 HydrophobicContact CG-CB 4.09Å; M498-N534 HydrophobicContact SD-CB 3.98Å; M498-I537 HydrophobicContact CE-CB 3.73Å; M498-I537 HydrophobicContact CE-CD1 4.04Å; M498-I537 HydrophobicContact CE-CG1 4.5Å; M498-I537 HydrophobicContact CE-CG2 3.6Å
499R93Very high89.5Confident74 Ų7444.7 Ų44.728%0.27924%0.238SC..Hα-helixtrans-64.3-35.5177-63.1-63.7-177.2138.515.3112.3V464 E468 Y483 E495 C503V464-R499 HydrophobicContact CG1-CG 4.47Å; E468-R499 IonicContact OE1-CZ 3.68Å; E468-R499 IonicContact OE1-NE 3.3Å; E468-R499 IonicContact OE1-NH1 2.67Å; E468-R499 PolarHBondContact OE1-NH1 3.36Å; E468-R499 IonicContact OE1-NH2 3.48Å; E468-R499 PolarHBondContact OE1-NH2 3.2Å; Y483-R499 HydrophobicContact CD1-CB 3.79Å; Y483-R499 HydrophobicContact CD2-CB 4.18Å; Y483-R499 HydrophobicContact CE1-CB 3.56Å; Y483-R499 HydrophobicContact CE1-CG 4.17Å; Y483-R499 HydrophobicContact CE2-CB 3.97Å; Y483-R499 HydrophobicContact CG-CB 4.1Å; E495-R499 HydrophobicContact CG-CG 3.94Å; E495-R499 WeakPolarHBondContact O-CB 3.33Å; E495-R499 WeakPolarHBondContact O-CG 3.38Å; E495-R499 PolarHBondContact O-N 3.32Å; E495-R499 IonicContact OE1-CZ 2.76Å; E495-R499 IonicContact OE1-NE 3.91Å; E495-R499 PolarHBondContact OE1-NE 2.92Å; E495-R499 IonicContact OE1-NH2 3.85Å; E495-R499 PolarHBondContact OE1-NH2 2.87Å; R499-C503 WeakPolarHBondContact O-CB 3.34Å; R499-C503 PolarHBondContact O-N 2.95Å
500L94.1Very high89.7Confident0 Ų045 Ų450%024%0.237CC..Hα-helixtrans-62.4-45.8173-177.162.8000111.4K480 W484 A496 L497 M498 C503 F504 V755K480-L500 HydrophobicContact CB-CD1 4.07Å; K480-L500 HydrophobicContact CG-CD1 4.3Å; W484-L500 HydrophobicContact CE3-CD2 3.91Å; A496-L500 VanDerWaalsContact O-CB 3.3Å; A496-L500 WeakPolarHBondContact O-CB 3.44Å; A496-L500 PolarHBondContact O-N 3.15Å; L497-L500 HydrophobicContact CD1-CD2 4.19Å; L497-L500 WeakPolarHBondContact O-CB 3.48Å; L497-L500 PolarHBondContact O-N 3.27Å; M498-L500 VanDerWaalsContact C-N 3.31Å; M498-L500 PolarHBondContact O-N 2.99Å; L500-C503 WeakPolarHBondContact O-CB 3.41Å; L500-C503 PolarHBondContact O-N 3.18Å; L500-C503 VanDerWaalsContact O-N 3.16Å; L500-F504 HydrophobicContact CD1-CD2 4.28Å; L500-F504 HydrophobicContact CD1-CE2 3.71Å; L500-F504 HydrophobicContact CD1-CZ 3.95Å; L500-F504 HydrophobicContact CD2-CE2 3.96Å; L500-F504 HydrophobicContact CG-CD2 3.98Å; L500-F504 HydrophobicContact CG-CE2 3.53Å; L500-F504 HydrophobicContact CG-CZ 4.27Å; L500-F504 WeakPolarHBondContact O-CD2 3.13Å; L500-F504 PolarHBondContact O-N 3.35Å; L500-V755 HydrophobicContact CD2-CG1 4.39Å
501A93.7Very high90.1Very high0 Ų045.4 Ų45.40%024%0.237CC..Hα-helixtrans-62.2-46.5178.800000112L497 M498 C503 F504 E505 A516 Y517L497-A501 PolarHBondContact O-N 2.92Å; M498-A501 PolarHBondContact O-N 3.46Å; A501-C503 PolarHBondContact O-N 3.42Å; A501-F504 PolarHBondContact O-N 3.05Å; A501-F504 VanDerWaalsContact O-N 3.15Å; A501-E505 PolarHBondContact O-N 2.94Å; A501-A516 HydrophobicContact CB-CB 3.73Å; A501-Y517 HydrophobicContact CB-CD1 3.64Å; A501-Y517 HydrophobicContact CB-CD2 3.9Å; A501-Y517 HydrophobicContact CB-CE1 3.52Å; A501-Y517 HydrophobicContact CB-CE2 3.8Å; A501-Y517 HydrophobicContact CB-CG 3.84Å
502I93.1Very high90.5Very high47 Ų4746.8 Ų46.824%0.24124%0.243CC..Hα-helixtrans-59.6-37.2174-64.6166.7000110.9M498 E505 R506M498-I502 HydrophobicContact CE-CD1 4.25Å; M498-I502 HydrophobicContact CG-CD1 4.28Å; M498-I502 WeakPolarHBondContact O-CG1 3.3Å; M498-I502 PolarHBondContact O-N 3.46Å; I502-E505 PolarHBondContact O-N 2.79Å; I502-R506 WeakPolarHBondContact O-CG 3.44Å; I502-R506 PolarHBondContact O-N 2.97Å
503C92.7Very high91.2Very high7 Ų740.4 Ų40.45%0.04721%0.21CC..Hα-helixtrans-66.5-40.7177.2-162.20000112K480 Y483 R499 L500 A501 R506 C507K480-C503 HydrophobicContact CG-CB 4.39Å; Y483-C503 HydrophobicContact CD2-CB 4.37Å; Y483-C503 HydrophobicContact CE2-CB 4.26Å; R499-C503 WeakPolarHBondContact O-CB 3.34Å; R499-C503 PolarHBondContact O-N 2.95Å; L500-C503 WeakPolarHBondContact O-CB 3.41Å; L500-C503 PolarHBondContact O-N 3.18Å; L500-C503 VanDerWaalsContact O-N 3.16Å; A501-C503 PolarHBondContact O-N 3.42Å; C503-R506 PolarHBondContact O-N 2.98Å; C503-C507 PolarHBondContact O-N 3.32Å; C503-C507 VanDerWaalsContact O-N 3.13Å; C503-C507 PolarHBondContact O-SG 2.82Å
504F93.6Very high91.9Very high1 Ų135.8 Ų35.80%0.00419%0.19CC..Hα-helixtrans-64.9-42.9174.6-74.8-50.6000112.4K480 L500 A501 R506 C507 G508 E509 E512 A513 A516 V755 F759K480-F504 HydrophobicContact CD-CD1 4.15Å; K480-F504 HydrophobicContact CD-CE1 3.86Å; K480-F504 HydrophobicContact CG-CE1 4.27Å; L500-F504 HydrophobicContact CD1-CD2 4.28Å; L500-F504 HydrophobicContact CD1-CE2 3.71Å; L500-F504 HydrophobicContact CD1-CZ 3.95Å; L500-F504 HydrophobicContact CD2-CE2 3.96Å; L500-F504 HydrophobicContact CG-CD2 3.98Å; L500-F504 HydrophobicContact CG-CE2 3.53Å; L500-F504 HydrophobicContact CG-CZ 4.27Å; L500-F504 WeakPolarHBondContact O-CD2 3.13Å; L500-F504 PolarHBondContact O-N 3.35Å; A501-F504 PolarHBondContact O-N 3.05Å; A501-F504 VanDerWaalsContact O-N 3.15Å; F504-R506 VanDerWaalsContact C-N 3.34Å; F504-R506 PolarHBondContact O-N 3.32Å; F504-C507 CarbonylContact O-C 3.54Å; F504-C507 PolarHBondContact O-N 2.96Å; F504-G508 PolarHBondContact O-N 2.98Å; F504-G508 VanDerWaalsContact O-N 3.13Å; F504-E509 HydrophobicContact CB-CB 4.37Å; F504-E509 HydrophobicContact CD1-CB 4.13Å; F504-E509 WeakPolarHBondContact CD1-OE2 3.28Å; F504-E509 WeakPolarHBondContact CE1-OE2 3.45Å; F504-E509 PolarHBondContact O-N 2.98Å; F504-E512 HydrophobicContact CD1-CB 4.03Å; F504-E512 HydrophobicContact CD2-CB 4.12Å; F504-E512 HydrophobicContact CE1-CB 4.09Å; F504-E512 HydrophobicContact CE2-CB 4.16Å; F504-E512 HydrophobicContact CG-CB 4.05Å; F504-E512 HydrophobicContact CZ-CB 4.16Å; F504-A513 HydrophobicContact CB-CB 3.7Å; F504-A516 HydrophobicContact CD2-CB 4.16Å; F504-A516 HydrophobicContact CE2-CB 4.41Å; F504-V755 HydrophobicContact CE2-CG1 4.39Å; F504-F759 HydrophobicContact CZ-CE2 4.09Å; F504-F759 HydrophobicContact CZ-CZ 4.25Å
505E92.1Very high92.3Very high80 Ų8035.9 Ų35.937%0.37419%0.19SC..Hα-helixtrans-57.3-46.5174.8177.3177.3170.500111.2A501 I502 C507 G508 Y517 Y541A501-E505 PolarHBondContact O-N 2.94Å; I502-E505 PolarHBondContact O-N 2.79Å; E505-C507 PolarHBondContact O-N 2.95Å; E505-G508 PolarHBondContact O-N 2.97Å; E505-G508 VanDerWaalsContact O-N 3.08Å; E505-Y517 PolarHBondContact OE2-OH 3.17Å; E505-Y541 HydrophobicContact CB-CE2 4.15Å; E505-Y541 HydrophobicContact CG-CD2 4.38Å; E505-Y541 HydrophobicContact CG-CE2 3.74Å
506R90.7Very high92.5Very high176 Ų17633.4 Ų33.466%0.66418%0.179SC*.Hα-helixtrans-64.5-25.5176-72.4179.2-177.2-165.50.7113.8I502 C503 F504I502-R506 WeakPolarHBondContact O-CG 3.44Å; I502-R506 PolarHBondContact O-N 2.97Å; C503-R506 PolarHBondContact O-N 2.98Å; F504-R506 VanDerWaalsContact C-N 3.34Å; F504-R506 PolarHBondContact O-N 3.32Å
507C91.1Very high92.6Very high47 Ų4733.4 Ų33.432%0.31818%0.179SC..Hα-helixtrans-86.8-5.9176.2-64.60000113.3F476 K480 C503 F504 E505 E509F476-C507 VanDerWaalsContact CB-SG 3.58Å; K480-C507 WeakPolarHBondContact CE-SG 3.45Å; K480-C507 PolarHBondContact NZ-SG 3.3Å; K480-C507 VanDerWaalsContact NZ-SG 3.39Å; C503-C507 PolarHBondContact O-N 3.32Å; C503-C507 VanDerWaalsContact O-N 3.13Å; C503-C507 PolarHBondContact O-SG 2.82Å; F504-C507 CarbonylContact O-C 3.54Å; F504-C507 PolarHBondContact O-N 2.96Å; E505-C507 PolarHBondContact O-N 2.95Å; C507-E509 VanDerWaalsContact C-N 3.31Å; C507-E509 HydrophobicContact CB-CG 4.13Å
508G90Very high92.6Very high55 Ų5534.9 Ų34.957%0.56719%0.188SC*.THydrogen-bonded Turntrans74.917.7-175.800000114.3F504 E505 D510F504-G508 PolarHBondContact O-N 2.98Å; F504-G508 VanDerWaalsContact O-N 3.13Å; E505-G508 PolarHBondContact O-N 2.97Å; E505-G508 VanDerWaalsContact O-N 3.08Å; G508-D510 PolarHBondContact O-N 3.33Å
509E92.1Very high92.5Very high40 Ų4036.1 Ų36.119%0.18719%0.193CC..  trans-89.871.3179.7-63.7176.4-155.500110K480 F504 C507 A511 E512 A513 K758K480-E509 IonicContact NZ-OE1 2.64Å; K480-E509 PolarHBondContact NZ-OE1 3.03Å; F504-E509 HydrophobicContact CB-CB 4.37Å; F504-E509 HydrophobicContact CD1-CB 4.13Å; F504-E509 WeakPolarHBondContact CD1-OE2 3.28Å; F504-E509 WeakPolarHBondContact CE1-OE2 3.45Å; F504-E509 PolarHBondContact O-N 2.98Å; C507-E509 VanDerWaalsContact C-N 3.31Å; C507-E509 HydrophobicContact CB-CG 4.13Å; E509-A511 PolarHBondContact O-N 3.28Å; E509-E512 HydrophobicContact CB-CB 4.39Å; E509-E512 PolarHBondContact O-N 2.8Å; E509-A513 WeakPolarHBondContact O-CB 3.49Å; E509-A513 PolarHBondContact O-N 3.32Å; E509-K758 VanDerWaalsContact CD-NZ 3.29Å; E509-K758 IonicContact OE1-NZ 3.23Å; E509-K758 IonicContact OE2-NZ 3.28Å; E509-K758 PolarHBondContact OE2-NZ 3.18Å
510D91.8Very high92.5Very high65 Ų6532.6 Ų32.635%0.34818%0.18SC..Hα-helixtrans-60.6-37.7-168.8-72.9-28.6000114.2G508 A514 Y541 Y545G508-D510 PolarHBondContact O-N 3.33Å; D510-A514 WeakPolarHBondContact O-CB 3.38Å; D510-A514 PolarHBondContact O-N 2.98Å; D510-Y541 WeakPolarHBondContact CA-OH 3.44Å; D510-Y541 PolarHBondContact OD1-OH 3.33Å; D510-Y541 VanDerWaalsContact OD1-OH 3.1Å; D510-Y545 HydrophobicContact CB-CD2 4.21Å; D510-Y545 HydrophobicContact CB-CE2 4.09Å
511A91.3Very high92.3Very high51 Ų5133 Ų3342%0.42118%0.182SC..Hα-helixtrans-70.5-42.6-177.400000111.6E509 A515E509-A511 PolarHBondContact O-N 3.28Å; A511-A515 WeakPolarHBondContact O-CB 3.38Å; A511-A515 PolarHBondContact O-N 3.35Å
512E92.2Very high92.2Very high47 Ų4736.7 Ų36.722%0.2220%0.198CC..Hα-helixtrans-70.2-36.8175.7-65.793.7143.600112.3F504 E509 A515 A516 K758F504-E512 HydrophobicContact CD1-CB 4.03Å; F504-E512 HydrophobicContact CD2-CB 4.12Å; F504-E512 HydrophobicContact CE1-CB 4.09Å; F504-E512 HydrophobicContact CE2-CB 4.16Å; F504-E512 HydrophobicContact CG-CB 4.05Å; F504-E512 HydrophobicContact CZ-CB 4.16Å; E509-E512 HydrophobicContact CB-CB 4.39Å; E509-E512 PolarHBondContact O-N 2.8Å; E512-A515 WeakPolarHBondContact O-CB 3.4Å; E512-A515 PolarHBondContact O-N 2.63Å; E512-A516 WeakPolarHBondContact O-CB 3.36Å; E512-A516 PolarHBondContact O-N 3.49Å; E512-K758 HydrophobicContact CG-CD 4.25Å; E512-K758 IonicContact OE1-NZ 2.58Å; E512-K758 PolarHBondContact OE1-NZ 2.56Å
513A93.7Very high91.9Very high0 Ų035.2 Ų35.20%019%0.191CC..Hα-helixtrans-60.9-50.1173.100000111F504 E509 A515 A516 Y517 Y541F504-A513 HydrophobicContact CB-CB 3.7Å; E509-A513 WeakPolarHBondContact O-CB 3.49Å; E509-A513 PolarHBondContact O-N 3.32Å; A513-A515 VanDerWaalsContact C-N 3.28Å; A513-A515 PolarHBondContact O-N 3.44Å; A513-A516 PolarHBondContact O-N 2.95Å; A513-Y517 WeakPolarHBondContact O-CD2 3.4Å; A513-Y517 PolarHBondContact O-N 3.33Å; A513-Y541 HydrophobicContact CB-CE1 3.7Å; A513-Y541 WeakPolarHBondContact CB-OH 3.38Å
514A93.3Very high91.7Very high5 Ų535.2 Ų35.24%0.04119%0.191CC..Hα-helixtrans-57.5-43.4175.400000111.1D510 A516 Y517 T518 Y541 L542 Y545D510-A514 WeakPolarHBondContact O-CB 3.38Å; D510-A514 PolarHBondContact O-N 2.98Å; A514-A516 PolarHBondContact O-N 3.44Å; A514-Y517 PolarHBondContact O-N 3.48Å; A514-T518 WeakPolarHBondContact O-CG2 3.46Å; A514-T518 PolarHBondContact O-N 3.49Å; A514-Y541 HydrophobicContact CB-CE1 4.3Å; A514-L542 HydrophobicContact CB-CD2 3.92Å; A514-L542 WeakPolarHBondContact O-CD2 3.19Å; A514-Y545 HydrophobicContact CB-CD1 3.65Å; A514-Y545 HydrophobicContact CB-CD2 3.98Å; A514-Y545 HydrophobicContact CB-CE1 3.79Å; A514-Y545 HydrophobicContact CB-CE2 4.12Å; A514-Y545 HydrophobicContact CB-CG 3.75Å
515A93Very high91.4Very high1 Ų141 Ų411%0.00822%0.218CC..Hα-helixtrans-60-47.6176.500000112.8A511 E512 A513 Y517 T518 E519 V751 V755A511-A515 WeakPolarHBondContact O-CB 3.38Å; A511-A515 PolarHBondContact O-N 3.35Å; E512-A515 WeakPolarHBondContact O-CB 3.4Å; E512-A515 PolarHBondContact O-N 2.63Å; A513-A515 VanDerWaalsContact C-N 3.28Å; A513-A515 PolarHBondContact O-N 3.44Å; A515-Y517 PolarHBondContact O-N 3Å; A515-T518 PolarHBondContact O-N 3.26Å; A515-T518 PolarHBondContact O-OG1 2.97Å; A515-E519 PolarHBondContact O-N 3.33Å; A515-V751 HydrophobicContact CB-CG1 3.35Å; A515-V755 HydrophobicContact CB-CG2 3.49Å; A515-V755 VanDerWaalsContact CB-CG2 3.49Å
516A93Very high91.2Very high0 Ų046.6 Ų46.60%024%0.235CC..Hα-helixtrans-61.1-42.7177.400000112.2L497 A501 F504 E512 A513 A514 E519 F520L497-A516 HydrophobicContact CD1-CB 4.16Å; A501-A516 HydrophobicContact CB-CB 3.73Å; F504-A516 HydrophobicContact CD2-CB 4.16Å; F504-A516 HydrophobicContact CE2-CB 4.41Å; E512-A516 WeakPolarHBondContact O-CB 3.36Å; E512-A516 PolarHBondContact O-N 3.49Å; A513-A516 PolarHBondContact O-N 2.95Å; A514-A516 PolarHBondContact O-N 3.44Å; A516-E519 PolarHBondContact O-N 3.01Å; A516-F520 WeakPolarHBondContact O-CB 3.42Å; A516-F520 PolarHBondContact O-N 2.85Å
517Y94.9Very high90.8Very high0 Ų041.2 Ų41.20%022%0.22CC..Hα-helixtrans-64.6-39175-75-59.7000112.7M498 A501 E505 A513 A514 A515 E519 F520 I521 I537 A538 Y541M498-Y517 HydrophobicContact CE-CE1 4.09Å; M498-Y517 HydrophobicContact SD-CD1 4.26Å; M498-Y517 HydrophobicContact SD-CE1 3.78Å; A501-Y517 HydrophobicContact CB-CD1 3.64Å; A501-Y517 HydrophobicContact CB-CD2 3.9Å; A501-Y517 HydrophobicContact CB-CE1 3.52Å; A501-Y517 HydrophobicContact CB-CE2 3.8Å; A501-Y517 HydrophobicContact CB-CG 3.84Å; E505-Y517 PolarHBondContact OE2-OH 3.17Å; A513-Y517 WeakPolarHBondContact O-CD2 3.4Å; A513-Y517 PolarHBondContact O-N 3.33Å; A514-Y517 PolarHBondContact O-N 3.48Å; A515-Y517 PolarHBondContact O-N 3Å; Y517-E519 VanDerWaalsContact C-N 3.34Å; Y517-E519 PolarHBondContact O-N 3.24Å; Y517-F520 WeakPolarHBondContact O-CB 3.5Å; Y517-F520 PolarHBondContact O-N 3.15Å; Y517-I521 WeakPolarHBondContact O-CG1 3.45Å; Y517-I521 PolarHBondContact O-N 3.24Å; Y517-I537 HydrophobicContact CE1-CG2 4.41Å; Y517-A538 HydrophobicContact CD1-CB 3.53Å; Y517-A538 HydrophobicContact CE1-CB 4.26Å; Y517-A538 HydrophobicContact CG-CB 4.2Å; Y517-Y541 AromaticContact CD2-CD1 3.25Å; Y517-Y541 HydrophobicContact CD2-CD1 3.25Å; Y517-Y541 HydrophobicContact CD2-CD2 4.43Å; Y517-Y541 AromaticContact CD2-CE1 3.9Å; Y517-Y541 HydrophobicContact CD2-CE1 3.9Å; Y517-Y541 AromaticContact CD2-CG 3.57Å; Y517-Y541 HydrophobicContact CD2-CG 3.57Å; Y517-Y541 AromaticContact CE2-CD1 3.42Å; Y517-Y541 HydrophobicContact CE2-CD1 3.42Å; Y517-Y541 VanDerWaalsContact CE2-CD1 3.42Å; Y517-Y541 AromaticContact CE2-CD2 3.75Å; Y517-Y541 HydrophobicContact CE2-CD2 3.75Å; Y517-Y541 AromaticContact CE2-CE1 3.97Å; Y517-Y541 HydrophobicContact CE2-CE1 3.97Å; Y517-Y541 HydrophobicContact CE2-CE2 4.29Å; Y517-Y541 AromaticContact CE2-CG 3.29Å; Y517-Y541 HydrophobicContact CE2-CG 3.29Å; Y517-Y541 HydrophobicContact CG-CD1 4.38Å
518T92.8Very high90.2Very high34 Ų3441.6 Ų41.621%0.20923%0.232CC..Hα-helixtrans-63.3-40.1174.360.80000112.2A514 A515 I521 K522 L542 V751A514-T518 WeakPolarHBondContact O-CG2 3.46Å; A514-T518 PolarHBondContact O-N 3.49Å; A515-T518 PolarHBondContact O-N 3.26Å; A515-T518 PolarHBondContact O-OG1 2.97Å; T518-I521 PolarHBondContact O-N 3.17Å; T518-K522 WeakPolarHBondContact O-CG 3.26Å; T518-K522 PolarHBondContact O-N 2.88Å; T518-K522 VanDerWaalsContact O-N 3.12Å; T518-L542 HydrophobicContact CG2-CD1 3.77Å; T518-L542 HydrophobicContact CG2-CD2 3.68Å; T518-L542 HydrophobicContact CG2-CG 4.41Å; T518-V751 WeakPolarHBondContact OG1-CG1 3.46Å
519E91.1Very high89.3Confident28 Ų2840.9 Ų40.913%0.13122%0.216CC..Hα-helixtrans-68.7-36.1176.1-71.3-54.9123.500111.8L497 A515 A516 Y517 K522 L523 T752L497-E519 VanDerWaalsContact CD2-C 3.49Å; L497-E519 HydrophobicContact CD2-CB 3.77Å; A515-E519 PolarHBondContact O-N 3.33Å; A516-E519 PolarHBondContact O-N 3.01Å; Y517-E519 VanDerWaalsContact C-N 3.34Å; Y517-E519 PolarHBondContact O-N 3.24Å; E519-K522 PolarHBondContact O-N 2.67Å; E519-K522 WeakPolarHBondContact OE1-CD 3.4Å; E519-K522 IonicContact OE1-NZ 3.61Å; E519-K522 PolarHBondContact OE1-NZ 3.03Å; E519-L523 WeakPolarHBondContact O-CB 3.47Å; E519-L523 PolarHBondContact O-N 3.44Å; E519-T752 VanDerWaalsContact CD-CG2 3.49Å; E519-T752 HydrophobicContact CG-CG2 4.4Å; E519-T752 WeakPolarHBondContact OE1-CG2 2.95Å
520F91.9Very high88.2Confident0 Ų045.5 Ų45.50%024%0.242CC..Hα-helixtrans-59.4-48.6173.9175.4-103.9000111.2G494 L497 M498 A516 Y517 K522 L523 C524 N534 L535 A538G494-F520 WeakPolarHBondContact O-CD2 3.45Å; G494-F520 WeakPolarHBondContact O-CE2 3.32Å; L497-F520 HydrophobicContact CB-CD2 4.45Å; L497-F520 HydrophobicContact CD2-CB 4.03Å; L497-F520 VanDerWaalsContact CD2-N 3.28Å; L497-F520 HydrophobicContact CG-CB 4.03Å; M498-F520 HydrophobicContact CB-CD2 4.12Å; M498-F520 HydrophobicContact CB-CE2 3.94Å; M498-F520 HydrophobicContact CB-CZ 4.43Å; M498-F520 HydrophobicContact SD-CD1 4.36Å; M498-F520 HydrophobicContact SD-CE1 4.23Å; M498-F520 HydrophobicContact SD-CZ 4.39Å; A516-F520 WeakPolarHBondContact O-CB 3.42Å; A516-F520 PolarHBondContact O-N 2.85Å; Y517-F520 WeakPolarHBondContact O-CB 3.5Å; Y517-F520 PolarHBondContact O-N 3.15Å; F520-K522 VanDerWaalsContact C-N 3.33Å; F520-K522 PolarHBondContact O-N 3.32Å; F520-L523 WeakPolarHBondContact O-CB 3.29Å; F520-L523 PolarHBondContact O-N 3.31Å; F520-L523 VanDerWaalsContact O-N 3.13Å; F520-C524 WeakPolarHBondContact CZ-SG 3.42Å; F520-C524 PolarHBondContact O-N 3.17Å; F520-C524 PolarHBondContact O-SG 3.18Å; F520-C524 VanDerWaalsContact O-SG 3.32Å; F520-N534 HydrophobicContact CE1-CB 3.9Å; F520-N534 HydrophobicContact CZ-CB 3.61Å; F520-L535 HydrophobicContact CD1-CD2 4.42Å; F520-L535 HydrophobicContact CE1-CD2 3.99Å; F520-L535 HydrophobicContact CE1-CG 4.22Å; F520-A538 HydrophobicContact CD1-CB 3.92Å; F520-A538 HydrophobicContact CE1-CB 4.38Å
521I90.5Very high87.5Confident10 Ų1044.7 Ų44.75%0.05124%0.236CC..Hα-helixtrans-60.4-43177.7-69160000111.3Y517 T518 L523 C524 Q525 L535 A538 Y539 L542Y517-I521 WeakPolarHBondContact O-CG1 3.45Å; Y517-I521 PolarHBondContact O-N 3.24Å; T518-I521 PolarHBondContact O-N 3.17Å; I521-L523 VanDerWaalsContact C-N 3.34Å; I521-L523 PolarHBondContact O-N 2.88Å; I521-C524 PolarHBondContact O-N 3.46Å; I521-Q525 WeakPolarHBondContact O-CB 3.24Å; I521-Q525 VanDerWaalsContact O-CG 3.26Å; I521-Q525 WeakPolarHBondContact O-CG 3.48Å; I521-Q525 PolarHBondContact O-N 3.25Å; I521-L535 HydrophobicContact CG1-CD2 4.13Å; I521-A538 HydrophobicContact CD1-CB 4.02Å; I521-A538 HydrophobicContact CG1-CB 4.03Å; I521-Y539 HydrophobicContact CD1-CD1 3.7Å; I521-Y539 HydrophobicContact CD1-CE1 3.62Å; I521-Y539 HydrophobicContact CD1-CG 4.19Å; I521-Y539 HydrophobicContact CG1-CE1 4.26Å; I521-Y539 HydrophobicContact CG2-CE1 4.02Å; I521-Y539 WeakPolarHBondContact CG2-OH 3.47Å; I521-L542 HydrophobicContact CD1-CD1 3.43Å; I521-L542 VanDerWaalsContact CD1-CD1 3.43Å
522K90.7Very high87.2Confident76 Ų7647.9 Ų47.933%0.3324%0.243SC..Hα-helixtrans-62.5-40.9175.8-70.8174.2-169.1169.40111.8T518 E519 F520 Q525 R526T518-K522 WeakPolarHBondContact O-CG 3.26Å; T518-K522 PolarHBondContact O-N 2.88Å; T518-K522 VanDerWaalsContact O-N 3.12Å; E519-K522 PolarHBondContact O-N 2.67Å; E519-K522 WeakPolarHBondContact OE1-CD 3.4Å; E519-K522 IonicContact OE1-NZ 3.61Å; E519-K522 PolarHBondContact OE1-NZ 3.03Å; F520-K522 VanDerWaalsContact C-N 3.33Å; F520-K522 PolarHBondContact O-N 3.32Å; K522-Q525 PolarHBondContact O-N 2.95Å; K522-R526 WeakPolarHBondContact O-CB 3.2Å; K522-R526 PolarHBondContact O-N 3.39Å
523L88.3Confident87.1Confident16 Ų1650 Ų508%0.08425%0.254CS..Hα-helixtrans-63.6-47.5177.9-17666.6000111.2E519 F520 I521 Q525 R526 N527E519-L523 WeakPolarHBondContact O-CB 3.47Å; E519-L523 PolarHBondContact O-N 3.44Å; F520-L523 WeakPolarHBondContact O-CB 3.29Å; F520-L523 PolarHBondContact O-N 3.31Å; F520-L523 VanDerWaalsContact O-N 3.13Å; I521-L523 VanDerWaalsContact C-N 3.34Å; I521-L523 PolarHBondContact O-N 2.88Å; L523-Q525 VanDerWaalsContact C-N 3.35Å; L523-Q525 PolarHBondContact O-N 3.47Å; L523-R526 PolarHBondContact O-N 2.98Å; L523-N527 WeakPolarHBondContact O-CB 3.39Å; L523-N527 PolarHBondContact O-N 3.4Å
524C87.8Confident86.9Confident7 Ų752 Ų525%0.04727%0.265CS..Hα-helixtrans-60.7-42.7176.2-63.90000111.8F520 I521 R526 G528 V529 L535F520-C524 WeakPolarHBondContact CZ-SG 3.42Å; F520-C524 PolarHBondContact O-N 3.17Å; F520-C524 PolarHBondContact O-SG 3.18Å; F520-C524 VanDerWaalsContact O-SG 3.32Å; I521-C524 PolarHBondContact O-N 3.46Å; C524-R526 VanDerWaalsContact C-N 3.31Å; C524-R526 PolarHBondContact O-N 3.28Å; C524-G528 WeakPolarHBondContact O-CA 3.07Å; C524-G528 PolarHBondContact O-N 3.27Å; C524-V529 PolarHBondContact O-N 3.38Å; C524-L535 HydrophobicContact CB-CD1 4.42Å; C524-L535 HydrophobicContact CB-CD2 3.88Å
525Q87.9Confident86.8Confident124 Ų12452.3 Ų52.358%0.57927%0.266SS*.Hα-helixtrans-62-37.3175.6-74.6172.22.400112.5I521 K522 L523I521-Q525 WeakPolarHBondContact O-CB 3.24Å; I521-Q525 VanDerWaalsContact O-CG 3.26Å; I521-Q525 WeakPolarHBondContact O-CG 3.48Å; I521-Q525 PolarHBondContact O-N 3.25Å; K522-Q525 PolarHBondContact O-N 2.95Å; L523-Q525 VanDerWaalsContact C-N 3.35Å; L523-Q525 PolarHBondContact O-N 3.47Å
526R86.9Confident86.7Confident196 Ų19652.3 Ų52.374%0.7427%0.266SS*.Hα-helixtrans-74.3-43.7179-171.9179.872.9171.60112.7K522 L523 C524K522-R526 WeakPolarHBondContact O-CB 3.2Å; K522-R526 PolarHBondContact O-N 3.39Å; L523-R526 PolarHBondContact O-N 2.98Å; C524-R526 VanDerWaalsContact C-N 3.31Å; C524-R526 PolarHBondContact O-N 3.28Å
527N82.7Confident86.6Confident63 Ų6355 Ų5534%0.33728%0.28SS..Hα-helixtrans-83.6-15.4-176.2-66.30.7000112.4I492 L523 V529I492-N527 PolarHBondContact O-ND2 3.07Å; I492-N527 VanDerWaalsContact O-ND2 3.07Å; L523-N527 WeakPolarHBondContact O-CB 3.39Å; L523-N527 PolarHBondContact O-N 3.4Å; N527-V529 VanDerWaalsContact C-N 3.27Å; N527-V529 HydrophobicContact CB-CG2 3.78Å; N527-V529 PolarHBondContact O-N 2.78Å
528G78.5Confident86.5Confident55 Ų5555 Ų5557%0.56728%0.28SS*.THydrogen-bonded Turntrans70.522-175.700000113.7C524C524-G528 WeakPolarHBondContact O-CA 3.07Å; C524-G528 PolarHBondContact O-N 3.27Å
529V70.6Confident86.5Confident40 Ų4054.3 Ų54.324%0.24227%0.274CS..  trans-81.8124.7-179.7-177.70000109.3C524 N527 E531C524-V529 PolarHBondContact O-N 3.38Å; N527-V529 VanDerWaalsContact C-N 3.27Å; N527-V529 HydrophobicContact CB-CG2 3.78Å; N527-V529 PolarHBondContact O-N 2.78Å; V529-E531 HydrophobicContact CG1-CG 3.98Å; V529-E531 PolarHBondContact O-N 3.44Å
530N69.7Low86.6Confident137 Ų13755.5 Ų55.573%0.73328%0.278SS*.  trans-99.363.8-177.6-71.8-24.3000112.1Q532N530-Q532 VanDerWaalsContact C-N 3.33Å; N530-Q532 PolarHBondContact O-N 2.89Å
531E77.3Confident86.7Confident48 Ų4856.8 Ų56.822%0.22428%0.284CS..  trans-7982.3167.6-70.6-169.1164.400110.5V529 I533 N534 L535V529-E531 HydrophobicContact CG1-CG 3.98Å; V529-E531 PolarHBondContact O-N 3.44Å; E531-I533 VanDerWaalsContact C-N 3.29Å; E531-I533 PolarHBondContact O-N 3.44Å; E531-N534 HydrophobicContact CB-CB 4.15Å; E531-N534 PolarHBondContact O-N 3.49Å; E531-N534 PolarHBondContact OE2-ND2 3.05Å; E531-L535 WeakPolarHBondContact O-CB 3.43Å; E531-L535 WeakPolarHBondContact O-CG 3.46Å; E531-L535 PolarHBondContact O-N 3.35Å
532Q85.5Confident86.8Confident119 Ų11956.9 Ų56.956%0.55628%0.284SS*.Hα-helixtrans-55.9-42.4-174.5-66.8-178.4-1.400112.9N530 A536 Y565N530-Q532 VanDerWaalsContact C-N 3.33Å; N530-Q532 PolarHBondContact O-N 2.89Å; Q532-A536 VanDerWaalsContact O-CB 3.32Å; Q532-A536 WeakPolarHBondContact O-CB 3.48Å; Q532-A536 PolarHBondContact O-N 3.38Å; Q532-Y565 HydrophobicContact CB-CD1 4.12Å; Q532-Y565 HydrophobicContact CB-CE1 4.27Å; Q532-Y565 HydrophobicContact CG-CE1 4.41Å
533I88.9Confident86.9Confident90 Ų9053.2 Ų53.246%0.46227%0.268SS..Hα-helixtrans-65.5-51.8-177.8-55.1-178.1000110.7E531 L535 A536 I537E531-I533 VanDerWaalsContact C-N 3.29Å; E531-I533 PolarHBondContact O-N 3.44Å; I533-L535 PolarHBondContact O-N 3.05Å; I533-A536 WeakPolarHBondContact O-CB 3.32Å; I533-A536 PolarHBondContact O-N 2.94Å; I533-I537 HydrophobicContact CG2-CD1 4.12Å; I533-I537 WeakPolarHBondContact O-CG1 3.39Å; I533-I537 PolarHBondContact O-N 3.43Å
534N89.9Confident87.1Confident42 Ų4255.3 Ų55.323%0.22528%0.279CS..Hα-helixtrans-68.7-36-177-69.6-23000112M498 F520 E531 I537 A538M498-N534 HydrophobicContact CE-CB 3.77Å; M498-N534 HydrophobicContact CG-CB 4.09Å; M498-N534 HydrophobicContact SD-CB 3.98Å; F520-N534 HydrophobicContact CE1-CB 3.9Å; F520-N534 HydrophobicContact CZ-CB 3.61Å; E531-N534 HydrophobicContact CB-CB 4.15Å; E531-N534 PolarHBondContact O-N 3.49Å; E531-N534 PolarHBondContact OE2-ND2 3.05Å; N534-I537 PolarHBondContact O-N 3.26Å; N534-A538 WeakPolarHBondContact O-CB 3.5Å; N534-A538 PolarHBondContact O-N 3.33Å
535L90.3Very high87.3Confident13 Ų1357.2 Ų57.27%0.06829%0.286CS..Hα-helixtrans-63.8-41.2172.7-75.9168.9000112F520 I521 C524 E531 I533 A538 Y539 Y565F520-L535 HydrophobicContact CD1-CD2 4.42Å; F520-L535 HydrophobicContact CE1-CD2 3.99Å; F520-L535 HydrophobicContact CE1-CG 4.22Å; I521-L535 HydrophobicContact CG1-CD2 4.13Å; C524-L535 HydrophobicContact CB-CD1 4.42Å; C524-L535 HydrophobicContact CB-CD2 3.88Å; E531-L535 WeakPolarHBondContact O-CB 3.43Å; E531-L535 WeakPolarHBondContact O-CG 3.46Å; E531-L535 PolarHBondContact O-N 3.35Å; I533-L535 PolarHBondContact O-N 3.05Å; L535-A538 PolarHBondContact O-N 3.15Å; L535-Y539 HydrophobicContact CD2-CE2 4.48Å; L535-Y539 WeakPolarHBondContact O-CD2 3.36Å; L535-Y539 PolarHBondContact O-N 3.29Å; L535-Y565 HydrophobicContact CB-CE1 4.26Å; L535-Y565 HydrophobicContact CB-CE2 4.49Å
536A90.7Very high87.5Confident0 Ų053 Ų530%027%0.266CS..Hα-helixtrans-61.6-45176.300000111.4Q532 I533 K540 Y565 T568Q532-A536 VanDerWaalsContact O-CB 3.32Å; Q532-A536 WeakPolarHBondContact O-CB 3.48Å; Q532-A536 PolarHBondContact O-N 3.38Å; I533-A536 WeakPolarHBondContact O-CB 3.32Å; I533-A536 PolarHBondContact O-N 2.94Å; A536-K540 VanDerWaalsContact O-CB 3.26Å; A536-K540 WeakPolarHBondContact O-CB 3.46Å; A536-K540 PolarHBondContact O-N 3.31Å; A536-Y565 HydrophobicContact CB-CD1 4.37Å; A536-Y565 HydrophobicContact CB-CD2 4.03Å; A536-Y565 HydrophobicContact CB-CG 3.77Å; A536-T568 HydrophobicContact CB-CG2 3.79Å
537I91.9Very high87.7Confident58 Ų5844.7 Ų44.730%0.29724%0.236SC..Hα-helixtrans-60.7-45.5175-65.5165.9000110.8M498 Y517 I533 N534 K540 Y541M498-I537 HydrophobicContact CE-CB 3.73Å; M498-I537 HydrophobicContact CE-CD1 4.04Å; M498-I537 HydrophobicContact CE-CG1 4.5Å; M498-I537 HydrophobicContact CE-CG2 3.6Å; Y517-I537 HydrophobicContact CE1-CG2 4.41Å; I533-I537 HydrophobicContact CG2-CD1 4.12Å; I533-I537 WeakPolarHBondContact O-CG1 3.39Å; I533-I537 PolarHBondContact O-N 3.43Å; N534-I537 PolarHBondContact O-N 3.26Å; I537-K540 PolarHBondContact O-N 3.27Å; I537-Y541 PolarHBondContact O-N 2.99Å
538A92.4Very high88Confident0 Ų050.6 Ų50.60%025%0.254CS..Hα-helixtrans-62.7-48.7-179.800000112.5Y517 F520 I521 N534 L535 K540 Y541 L542Y517-A538 HydrophobicContact CD1-CB 3.53Å; Y517-A538 HydrophobicContact CE1-CB 4.26Å; Y517-A538 HydrophobicContact CG-CB 4.2Å; F520-A538 HydrophobicContact CD1-CB 3.92Å; F520-A538 HydrophobicContact CE1-CB 4.38Å; I521-A538 HydrophobicContact CD1-CB 4.02Å; I521-A538 HydrophobicContact CG1-CB 4.03Å; N534-A538 WeakPolarHBondContact O-CB 3.5Å; N534-A538 PolarHBondContact O-N 3.33Å; L535-A538 PolarHBondContact O-N 3.15Å; A538-K540 VanDerWaalsContact C-N 3.31Å; A538-K540 PolarHBondContact O-N 3.46Å; A538-Y541 PolarHBondContact O-N 2.88Å; A538-L542 WeakPolarHBondContact O-CG 3.33Å; A538-L542 PolarHBondContact O-N 3.35Å
539Y94Very high88.6Confident18 Ų1854.1 Ų54.17%0.07125%0.253CS..Hα-helixtrans-64.3-37176.9-75.9-61.4000112.1I521 L535 L542 A543 K561 C562 Y565I521-Y539 HydrophobicContact CD1-CD1 3.7Å; I521-Y539 HydrophobicContact CD1-CE1 3.62Å; I521-Y539 HydrophobicContact CD1-CG 4.19Å; I521-Y539 HydrophobicContact CG1-CE1 4.26Å; I521-Y539 HydrophobicContact CG2-CE1 4.02Å; I521-Y539 WeakPolarHBondContact CG2-OH 3.47Å; L535-Y539 HydrophobicContact CD2-CE2 4.48Å; L535-Y539 WeakPolarHBondContact O-CD2 3.36Å; L535-Y539 PolarHBondContact O-N 3.29Å; Y539-L542 PolarHBondContact O-N 3.36Å; Y539-A543 WeakPolarHBondContact O-CB 3.46Å; Y539-A543 PolarHBondContact O-N 3.07Å; Y539-K561 HydrophobicContact CD1-CB 4.06Å; Y539-K561 HydrophobicContact CD1-CD 3.97Å; Y539-K561 HydrophobicContact CD2-CB 4.24Å; Y539-K561 HydrophobicContact CE1-CB 4.1Å; Y539-K561 HydrophobicContact CE1-CD 3.27Å; Y539-K561 HydrophobicContact CE1-CG 4.35Å; Y539-K561 HydrophobicContact CE2-CB 4.26Å; Y539-K561 HydrophobicContact CE2-CD 4.3Å; Y539-K561 HydrophobicContact CG-CB 4.14Å; Y539-K561 VanDerWaalsContact CZ-CD 3.47Å; Y539-C562 WeakPolarHBondContact CB-SG 3.49Å; Y539-Y565 AromaticContact CD2-CE2 3.75Å; Y539-Y565 HydrophobicContact CD2-CE2 3.75Å; Y539-Y565 HydrophobicContact CE2-CE2 4.02Å
540K92.6Very high89.3Confident54 Ų5453.7 Ų53.724%0.23526%0.257CS..Hα-helixtrans-61.9-47.8175.9176168.878.3178.70111.5A536 I537 A538 L542 A543 N544 C562 T568 E571 M575A536-K540 VanDerWaalsContact O-CB 3.26Å; A536-K540 WeakPolarHBondContact O-CB 3.46Å; A536-K540 PolarHBondContact O-N 3.31Å; I537-K540 PolarHBondContact O-N 3.27Å; A538-K540 VanDerWaalsContact C-N 3.31Å; A538-K540 PolarHBondContact O-N 3.46Å; K540-L542 VanDerWaalsContact C-N 3.32Å; K540-L542 PolarHBondContact O-N 3.22Å; K540-A543 PolarHBondContact O-N 2.95Å; K540-N544 PolarHBondContact O-N 3.38Å; K540-N544 VanDerWaalsContact O-N 3.09Å; K540-N544 PolarHBondContact O-ND2 3.28Å; K540-C562 PolarHBondContact N-SG 3.23Å; K540-C562 VanDerWaalsContact N-SG 3.35Å; K540-T568 HydrophobicContact CB-CG2 4.3Å; K540-T568 HydrophobicContact CD-CG2 4.19Å; K540-E571 WeakPolarHBondContact CD-OE2 3.48Å; K540-E571 WeakPolarHBondContact CE-OE2 3.3Å; K540-E571 IonicContact NZ-OE1 2.94Å; K540-E571 IonicContact NZ-OE2 3.75Å; K540-E571 PolarHBondContact NZ-OE2 3.09Å; K540-M575 HydrophobicContact CG-CE 4.31Å
541Y93.1Very high90.3Very high27 Ų2752 Ų5211%0.10624%0.244CC..Hα-helixtrans-60.9-44.1178.9-172.5-87.4000111.1E505 D510 A513 A514 Y517 I537 A538 N544 Y545E505-Y541 HydrophobicContact CB-CE2 4.15Å; E505-Y541 HydrophobicContact CG-CD2 4.38Å; E505-Y541 HydrophobicContact CG-CE2 3.74Å; D510-Y541 WeakPolarHBondContact CA-OH 3.44Å; D510-Y541 PolarHBondContact OD1-OH 3.33Å; D510-Y541 VanDerWaalsContact OD1-OH 3.1Å; A513-Y541 HydrophobicContact CB-CE1 3.7Å; A513-Y541 WeakPolarHBondContact CB-OH 3.38Å; A514-Y541 HydrophobicContact CB-CE1 4.3Å; Y517-Y541 AromaticContact CD2-CD1 3.25Å; Y517-Y541 HydrophobicContact CD2-CD1 3.25Å; Y517-Y541 HydrophobicContact CD2-CD2 4.43Å; Y517-Y541 AromaticContact CD2-CE1 3.9Å; Y517-Y541 HydrophobicContact CD2-CE1 3.9Å; Y517-Y541 AromaticContact CD2-CG 3.57Å; Y517-Y541 HydrophobicContact CD2-CG 3.57Å; Y517-Y541 AromaticContact CE2-CD1 3.42Å; Y517-Y541 HydrophobicContact CE2-CD1 3.42Å; Y517-Y541 VanDerWaalsContact CE2-CD1 3.42Å; Y517-Y541 AromaticContact CE2-CD2 3.75Å; Y517-Y541 HydrophobicContact CE2-CD2 3.75Å; Y517-Y541 AromaticContact CE2-CE1 3.97Å; Y517-Y541 HydrophobicContact CE2-CE1 3.97Å; Y517-Y541 HydrophobicContact CE2-CE2 4.29Å; Y517-Y541 AromaticContact CE2-CG 3.29Å; Y517-Y541 HydrophobicContact CE2-CG 3.29Å; Y517-Y541 HydrophobicContact CG-CD1 4.38Å; I537-Y541 PolarHBondContact O-N 2.99Å; A538-Y541 PolarHBondContact O-N 2.88Å; Y541-N544 PolarHBondContact O-N 3.49Å; Y541-Y545 WeakPolarHBondContact O-CB 3.47Å; Y541-Y545 PolarHBondContact O-N 3.22Å
542L93.5Very high90.8Very high11 Ų1152.5 Ų52.56%0.05825%0.245CC..Hα-helixtrans-63.4-43177.2-70.1177.1000112.9A514 T518 I521 A538 Y539 K540 N544 Y545 H546 A558A514-L542 HydrophobicContact CB-CD2 3.92Å; A514-L542 WeakPolarHBondContact O-CD2 3.19Å; T518-L542 HydrophobicContact CG2-CD1 3.77Å; T518-L542 HydrophobicContact CG2-CD2 3.68Å; T518-L542 HydrophobicContact CG2-CG 4.41Å; I521-L542 HydrophobicContact CD1-CD1 3.43Å; I521-L542 VanDerWaalsContact CD1-CD1 3.43Å; A538-L542 WeakPolarHBondContact O-CG 3.33Å; A538-L542 PolarHBondContact O-N 3.35Å; Y539-L542 PolarHBondContact O-N 3.36Å; K540-L542 VanDerWaalsContact C-N 3.32Å; K540-L542 PolarHBondContact O-N 3.22Å; L542-N544 VanDerWaalsContact C-N 3.34Å; L542-N544 PolarHBondContact O-N 3.03Å; L542-Y545 PolarHBondContact O-N 3.43Å; L542-H546 WeakPolarHBondContact O-CB 3.37Å; L542-H546 PolarHBondContact O-CD2 3.13Å; L542-H546 PolarHBondContact O-N 3.19Å; L542-A558 HydrophobicContact CB-CB 4.41Å
543A92Very high90.9Very high0 Ų054.6 Ų54.60%025%0.254CS..Hα-helixtrans-57.7-48.4175.900000111Y539 K540 Y545 H546 L547 S555 A558 A559 M575Y539-A543 WeakPolarHBondContact O-CB 3.46Å; Y539-A543 PolarHBondContact O-N 3.07Å; K540-A543 PolarHBondContact O-N 2.95Å; A543-Y545 PolarHBondContact O-N 3.08Å; A543-H546 PolarHBondContact O-N 3.14Å; A543-L547 VanDerWaalsContact O-CB 3.29Å; A543-L547 WeakPolarHBondContact O-CB 3.32Å; A543-L547 PolarHBondContact O-N 2.99Å; A543-S555 PolarHBondContact O-OG 3.32Å; A543-A558 HydrophobicContact CB-CB 3.93Å; A543-A559 HydrophobicContact CB-CB 4.24Å; A543-M575 HydrophobicContact CB-CE 4.33Å; A543-M575 HydrophobicContact CB-SD 3.9Å
544N92.2Very high90.9Very high59 Ų5953.9 Ų53.932%0.31625%0.251SS..Hα-helixtrans-63.8-39.4177.1-77.1-33000112.9K540 Y541 L542 R548 M575K540-N544 PolarHBondContact O-N 3.38Å; K540-N544 VanDerWaalsContact O-N 3.09Å; K540-N544 PolarHBondContact O-ND2 3.28Å; Y541-N544 PolarHBondContact O-N 3.49Å; L542-N544 VanDerWaalsContact C-N 3.34Å; L542-N544 PolarHBondContact O-N 3.03Å; N544-R548 VanDerWaalsContact O-CG 3.3Å; N544-R548 WeakPolarHBondContact O-CG 3.24Å; N544-R548 PolarHBondContact O-N 3.25Å; N544-M575 PolarHBondContact OD1-SD 3.32Å
545Y92.8Very high90.9Very high47 Ų4751.9 Ų51.918%0.18424%0.241CC..Hα-helixtrans-63.7-48.5177.3175.8-97.5000111.8D510 A514 Y541 L542 A543 L547 R548 K549D510-Y545 HydrophobicContact CB-CD2 4.21Å; D510-Y545 HydrophobicContact CB-CE2 4.09Å; A514-Y545 HydrophobicContact CB-CD1 3.65Å; A514-Y545 HydrophobicContact CB-CD2 3.98Å; A514-Y545 HydrophobicContact CB-CE1 3.79Å; A514-Y545 HydrophobicContact CB-CE2 4.12Å; A514-Y545 HydrophobicContact CB-CG 3.75Å; Y541-Y545 WeakPolarHBondContact O-CB 3.47Å; Y541-Y545 PolarHBondContact O-N 3.22Å; L542-Y545 PolarHBondContact O-N 3.43Å; A543-Y545 PolarHBondContact O-N 3.08Å; Y545-L547 PolarHBondContact O-N 2.85Å; Y545-R548 PolarHBondContact O-N 3.42Å; Y545-K549 HydrophobicContact CE1-CG 4.15Å; Y545-K549 HydrophobicContact CE2-CG 4.35Å; Y545-K549 WeakPolarHBondContact O-CG 2.85Å; Y545-K549 PolarHBondContact O-N 2.9Å
546H92.5Very high90.9Very high35 Ų3552.3 Ų52.316%0.16225%0.246CC..Hα-helixtrans-65.7-37.6177.9-77.6-74.3000112.2L542 A543 R548 K549 G550 H551 D554L542-H546 WeakPolarHBondContact O-CB 3.37Å; L542-H546 PolarHBondContact O-CD2 3.13Å; L542-H546 PolarHBondContact O-N 3.19Å; A543-H546 PolarHBondContact O-N 3.14Å; H546-R548 PolarHBondContact O-N 3.37Å; H546-K549 CarbonylContact O-C 3.53Å; H546-K549 PolarHBondContact O-N 3.09Å; H546-G550 PolarHBondContact O-N 3.34Å; H546-H551 HydrophobicContact CB-CB 4.25Å; H546-H551 AromaticContact ND1-ND1 3.82Å; H546-H551 PolarHBondContact O-N 3.25Å; H546-D554 HydrophobicContact CB-CB 4.22Å; H546-D554 IonicContact CE1-OD2 3.79Å; H546-D554 WeakPolarHBondContact ND1-CB 3.33Å; H546-D554 IonicContact ND1-OD2 2.77Å
547L90.6Very high90.9Very high22 Ų2257.5 Ų57.512%0.11527%0.273CS..Hα-helixtrans-58.4-46.4172.5-174.266.1000111.5A543 Y545 K549 G550 Y552 Q578 I579 L582A543-L547 VanDerWaalsContact O-CB 3.29Å; A543-L547 WeakPolarHBondContact O-CB 3.32Å; A543-L547 PolarHBondContact O-N 2.99Å; Y545-L547 PolarHBondContact O-N 2.85Å; L547-K549 VanDerWaalsContact C-N 3.31Å; L547-K549 PolarHBondContact O-N 2.92Å; L547-G550 PolarHBondContact O-N 3.44Å; L547-Y552 HydrophobicContact CD1-CD1 4.26Å; L547-Y552 HydrophobicContact CD1-CE1 4.22Å; L547-Q578 HydrophobicContact CD2-CG 4.48Å; L547-I579 HydrophobicContact CD1-CG1 3.7Å; L547-L582 HydrophobicContact CD1-CD1 3.97Å
548R89.4Confident90.8Very high188 Ų18855.2 Ų55.271%0.70926%0.263SS*.Hα-helixtrans-64.9-30.9176.9-73.3175.8-176.5-173.42.7113.3N544 Y545 H546 G550N544-R548 VanDerWaalsContact O-CG 3.3Å; N544-R548 WeakPolarHBondContact O-CG 3.24Å; N544-R548 PolarHBondContact O-N 3.25Å; Y545-R548 PolarHBondContact O-N 3.42Å; H546-R548 PolarHBondContact O-N 3.37Å; R548-G550 VanDerWaalsContact C-N 3.35Å
549K90.2Very high90.7Very high129 Ų12955.2 Ų55.256%0.56126%0.263SS*.Hα-helixtrans-83.9-7.2176.1-66.5-64.5-178.2-174.60113.7Y545 H546 L547Y545-K549 HydrophobicContact CE1-CG 4.15Å; Y545-K549 HydrophobicContact CE2-CG 4.35Å; Y545-K549 WeakPolarHBondContact O-CG 2.85Å; Y545-K549 PolarHBondContact O-N 2.9Å; H546-K549 CarbonylContact O-C 3.53Å; H546-K549 PolarHBondContact O-N 3.09Å; L547-K549 VanDerWaalsContact C-N 3.31Å; L547-K549 PolarHBondContact O-N 2.92Å
550G86.6Confident90.6Very high30 Ų3058.1 Ų58.131%0.30928%0.28SS..THydrogen-bonded Turntrans79.213.9-177.500000114.5H546 L547 R548 Y552H546-G550 PolarHBondContact O-N 3.34Å; L547-G550 PolarHBondContact O-N 3.44Å; R548-G550 VanDerWaalsContact C-N 3.35Å; G550-Y552 VanDerWaalsContact O-CD2 3.27Å; G550-Y552 WeakPolarHBondContact O-CD2 3.47Å; G550-Y552 WeakPolarHBondContact O-CE2 3.4Å; G550-Y552 PolarHBondContact O-N 3.24Å
551H90Very high90.4Very high102 Ų10259.3 Ų59.347%0.47229%0.285SS..  trans-87.876.3176-64.5-178.9000109.8H546 E553 D554 S555H546-H551 HydrophobicContact CB-CB 4.25Å; H546-H551 AromaticContact ND1-ND1 3.82Å; H546-H551 PolarHBondContact O-N 3.25Å; H551-E553 PolarHBondContact O-N 2.62Å; H551-D554 HydrophobicContact CB-CB 4.33Å; H551-D554 IonicContact ND1-OD2 3.77Å; H551-D554 PolarHBondContact O-N 2.97Å; H551-S555 WeakPolarHBondContact O-CB 3.29Å; H551-S555 PolarHBondContact O-N 3.14Å
552Y88.4Confident90.2Very high59 Ų5958 Ų5823%0.23128%0.28CS..Hα-helixtrans-63.9-34.6-171.9-58.1-68.6000114.1L547 G550 S555 A556 I579 L582 I586L547-Y552 HydrophobicContact CD1-CD1 4.26Å; L547-Y552 HydrophobicContact CD1-CE1 4.22Å; G550-Y552 VanDerWaalsContact O-CD2 3.27Å; G550-Y552 WeakPolarHBondContact O-CD2 3.47Å; G550-Y552 WeakPolarHBondContact O-CE2 3.4Å; G550-Y552 PolarHBondContact O-N 3.24Å; Y552-S555 PolarHBondContact O-N 3.31Å; Y552-A556 VanDerWaalsContact O-CB 3.32Å; Y552-A556 WeakPolarHBondContact O-CB 3.26Å; Y552-A556 PolarHBondContact O-N 3.02Å; Y552-I579 HydrophobicContact CD1-CG2 4.32Å; Y552-L582 HydrophobicContact CD1-CB 4.39Å; Y552-L582 HydrophobicContact CE1-CB 3.62Å; Y552-L582 HydrophobicContact CE1-CD1 4.13Å; Y552-I586 HydrophobicContact CD2-CD1 4Å; Y552-I586 HydrophobicContact CE2-CD1 3.18Å
553E88Confident89.9Confident163 Ų16359.9 Ų59.976%0.76229%0.29SS*.Hα-helixtrans-64.6-52.5178.4-64.1-175.7169.400111.5H551 S555 A556 L557H551-E553 PolarHBondContact O-N 2.62Å; E553-S555 VanDerWaalsContact C-N 3.3Å; E553-S555 PolarHBondContact O-N 3.07Å; E553-A556 PolarHBondContact O-N 3.44Å; E553-L557 WeakPolarHBondContact O-CG 3.38Å; E553-L557 PolarHBondContact O-N 3.22Å
554D89.1Confident89.6Confident74 Ų7466.8 Ų66.840%0.39632%0.322SS..Hα-helixtrans-60.5-41.2176.2-68.1-25.6000111.5H546 H551 A556 L557 A558H546-D554 HydrophobicContact CB-CB 4.22Å; H546-D554 IonicContact CE1-OD2 3.79Å; H546-D554 WeakPolarHBondContact ND1-CB 3.33Å; H546-D554 IonicContact ND1-OD2 2.77Å; H551-D554 HydrophobicContact CB-CB 4.33Å; H551-D554 IonicContact ND1-OD2 3.77Å; H551-D554 PolarHBondContact O-N 2.97Å; D554-A556 VanDerWaalsContact C-N 3.35Å; D554-A556 PolarHBondContact O-N 3.05Å; D554-L557 PolarHBondContact O-N 2.92Å; D554-A558 PolarHBondContact O-N 2.84Å
555S90Very high89.4Confident0 Ų065.4 Ų65.40%031%0.313CS..Hα-helixtrans-61.1-42.6176-175.90000111.7A543 H551 Y552 E553 A559 I579A543-S555 PolarHBondContact O-OG 3.32Å; H551-S555 WeakPolarHBondContact O-CB 3.29Å; H551-S555 PolarHBondContact O-N 3.14Å; Y552-S555 PolarHBondContact O-N 3.31Å; E553-S555 VanDerWaalsContact C-N 3.3Å; E553-S555 PolarHBondContact O-N 3.07Å; S555-A559 VanDerWaalsContact O-CB 3.22Å; S555-A559 WeakPolarHBondContact O-CB 3.45Å; S555-A559 PolarHBondContact O-N 3.3Å; S555-I579 VanDerWaalsContact OG-CD1 3.26Å; S555-I579 WeakPolarHBondContact OG-CD1 3.5Å
556A89.7Confident89Confident23 Ų2367.9 Ų67.919%0.1934%0.335CS..Hα-helixtrans-68.1-39.1177.700000111.6Y552 E553 D554 A559 N560 L576 I579Y552-A556 VanDerWaalsContact O-CB 3.32Å; Y552-A556 WeakPolarHBondContact O-CB 3.26Å; Y552-A556 PolarHBondContact O-N 3.02Å; E553-A556 PolarHBondContact O-N 3.44Å; D554-A556 VanDerWaalsContact C-N 3.35Å; D554-A556 PolarHBondContact O-N 3.05Å; A556-A559 PolarHBondContact O-N 3.29Å; A556-N560 VanDerWaalsContact O-CB 3.3Å; A556-N560 WeakPolarHBondContact O-CB 3.3Å; A556-N560 PolarHBondContact O-N 3.32Å; A556-N560 PolarHBondContact O-ND2 3.28Å; A556-N560 VanDerWaalsContact O-ND2 3.12Å; A556-L576 HydrophobicContact CB-CD2 4.29Å; A556-I579 HydrophobicContact CB-CD1 4.47Å; A556-I579 HydrophobicContact CB-CG2 4.4Å
557L90.9Very high88.6Confident108 Ų10871.7 Ų71.757%0.56535%0.352SS*.Hα-helixtrans-61.5-47174.9-70.9174.5000111.7E553 D554 N560 K561E553-L557 WeakPolarHBondContact O-CG 3.38Å; E553-L557 PolarHBondContact O-N 3.22Å; D554-L557 PolarHBondContact O-N 2.92Å; L557-N560 PolarHBondContact O-N 3.18Å; L557-K561 WeakPolarHBondContact O-CG 3.11Å; L557-K561 PolarHBondContact O-N 2.9Å
558A89.8Confident88.3Confident11 Ų1170.9 Ų70.99%0.09135%0.348CS..Hα-helixtrans-65.5-42.4176.500000112L542 A543 D554 N560 K561 C562L542-A558 HydrophobicContact CB-CB 4.41Å; A543-A558 HydrophobicContact CB-CB 3.93Å; D554-A558 PolarHBondContact O-N 2.84Å; A558-N560 PolarHBondContact O-N 3.14Å; A558-K561 PolarHBondContact O-N 3.42Å; A558-C562 PolarHBondContact O-N 3.46Å; A558-C562 PolarHBondContact O-SG 3.41Å
559A89.8Confident88.3Confident0 Ų068.1 Ų68.10%034%0.338CS..Hα-helixtrans-65.9-36.5177.500000112.7A543 S555 A556 K561 C562 L563 M575 L576 I579A543-A559 HydrophobicContact CB-CB 4.24Å; S555-A559 VanDerWaalsContact O-CB 3.22Å; S555-A559 WeakPolarHBondContact O-CB 3.45Å; S555-A559 PolarHBondContact O-N 3.3Å; A556-A559 PolarHBondContact O-N 3.29Å; A559-K561 VanDerWaalsContact C-N 3.34Å; A559-C562 VanDerWaalsContact O-CB 3.32Å; A559-C562 WeakPolarHBondContact O-CB 3.4Å; A559-C562 PolarHBondContact O-N 3.06Å; A559-L563 PolarHBondContact O-N 3.48Å; A559-M575 HydrophobicContact CB-CB 4.46Å; A559-L576 HydrophobicContact CB-CD2 3.85Å; A559-L576 HydrophobicContact CB-CG 3.96Å; A559-I579 HydrophobicContact CB-CD1 4.36Å
560N91.4Very high88.2Confident78 Ų7869.8 Ų69.842%0.41735%0.348SS..Hα-helixtrans-62.6-41.6173.5-78.8-33.3000111.5A556 L557 A558 C562 L563 L576A556-N560 VanDerWaalsContact O-CB 3.3Å; A556-N560 WeakPolarHBondContact O-CB 3.3Å; A556-N560 PolarHBondContact O-N 3.32Å; A556-N560 PolarHBondContact O-ND2 3.28Å; A556-N560 VanDerWaalsContact O-ND2 3.12Å; L557-N560 PolarHBondContact O-N 3.18Å; A558-N560 PolarHBondContact O-N 3.14Å; N560-C562 VanDerWaalsContact C-N 3.31Å; N560-C562 PolarHBondContact O-N 3.41Å; N560-L563 VanDerWaalsContact O-CB 3.29Å; N560-L563 WeakPolarHBondContact O-CB 3.49Å; N560-L563 PolarHBondContact O-N 3.24Å; N560-L563 VanDerWaalsContact O-N 3.14Å; N560-L576 WeakPolarHBondContact OD1-CD1 3.43Å
561K89.7Confident88.3Confident79 Ų7972.8 Ų72.834%0.34335%0.354SS..Hα-helixtrans-64.7-34.7173.3-68.3-177.5177.1-175.20112.4Y539 L557 A558 A559 L563 E564 Y565Y539-K561 HydrophobicContact CD1-CB 4.06Å; Y539-K561 HydrophobicContact CD1-CD 3.97Å; Y539-K561 HydrophobicContact CD2-CB 4.24Å; Y539-K561 HydrophobicContact CE1-CB 4.1Å; Y539-K561 HydrophobicContact CE1-CD 3.27Å; Y539-K561 HydrophobicContact CE1-CG 4.35Å; Y539-K561 HydrophobicContact CE2-CB 4.26Å; Y539-K561 HydrophobicContact CE2-CD 4.3Å; Y539-K561 HydrophobicContact CG-CB 4.14Å; Y539-K561 VanDerWaalsContact CZ-CD 3.47Å; L557-K561 WeakPolarHBondContact O-CG 3.11Å; L557-K561 PolarHBondContact O-N 2.9Å; A558-K561 PolarHBondContact O-N 3.42Å; A559-K561 VanDerWaalsContact C-N 3.34Å; K561-L563 PolarHBondContact O-N 3.27Å; K561-E564 WeakPolarHBondContact O-CB 3.33Å; K561-E564 PolarHBondContact O-N 2.64Å; K561-E564 VanDerWaalsContact O-N 3.14Å; K561-Y565 WeakPolarHBondContact O-CD2 3.23Å; K561-Y565 WeakPolarHBondContact O-CE2 3.29Å
562C87.5Confident88.2Confident0 Ų068 Ų680%033%0.331CS..Hα-helixtrans-61.5-22.6173.4-64.20000113.7Y539 K540 A558 A559 N560 E564 Y565 T568 A572Y539-C562 WeakPolarHBondContact CB-SG 3.49Å; K540-C562 PolarHBondContact N-SG 3.23Å; K540-C562 VanDerWaalsContact N-SG 3.35Å; A558-C562 PolarHBondContact O-N 3.46Å; A558-C562 PolarHBondContact O-SG 3.41Å; A559-C562 VanDerWaalsContact O-CB 3.32Å; A559-C562 WeakPolarHBondContact O-CB 3.4Å; A559-C562 PolarHBondContact O-N 3.06Å; N560-C562 VanDerWaalsContact C-N 3.31Å; N560-C562 PolarHBondContact O-N 3.41Å; C562-E564 VanDerWaalsContact C-N 3.27Å; C562-E564 PolarHBondContact O-N 2.83Å; C562-Y565 PolarHBondContact O-N 3.45Å; C562-T568 PolarHBondContact O-OG1 2.9Å; C562-A572 HydrophobicContact CB-CB 3.61Å
563L87.8Confident88.3Confident50 Ų5069.6 Ų69.626%0.26234%0.34SS..THydrogen-bonded Turntrans-70.8-23.5176.9-66171.9000113.1A559 N560 K561 Y565 R569 A572 K573 L576A559-L563 PolarHBondContact O-N 3.48Å; N560-L563 VanDerWaalsContact O-CB 3.29Å; N560-L563 WeakPolarHBondContact O-CB 3.49Å; N560-L563 PolarHBondContact O-N 3.24Å; N560-L563 VanDerWaalsContact O-N 3.14Å; K561-L563 PolarHBondContact O-N 3.27Å; L563-Y565 PolarHBondContact O-N 3.33Å; L563-R569 HydrophobicContact CD2-CG 4.1Å; L563-A572 HydrophobicContact CD2-CB 3.76Å; L563-A572 HydrophobicContact CG-CB 4.12Å; L563-K573 HydrophobicContact CD2-CG 3.72Å; L563-L576 HydrophobicContact CD1-CD1 3.75Å; L563-L576 HydrophobicContact CG-CD1 4.31Å
564E86Confident88.4Confident145 Ų14564.4 Ų64.468%0.67833%0.325SS*.THydrogen-bonded Turntrans-67.5-24.5177.8-60.3-179.2177.200111.3K561 C562K561-E564 WeakPolarHBondContact O-CB 3.33Å; K561-E564 PolarHBondContact O-N 2.64Å; K561-E564 VanDerWaalsContact O-N 3.14Å; C562-E564 VanDerWaalsContact C-N 3.27Å; C562-E564 PolarHBondContact O-N 2.83Å
565Y86.9Confident88.3Confident31 Ų3161.4 Ų61.412%0.12231%0.309CS..SBendtrans-98.8129.4-179.5-54.3-76.2000111Q532 L535 A536 Y539 K561 C562 L563 E567 R569Q532-Y565 HydrophobicContact CB-CD1 4.12Å; Q532-Y565 HydrophobicContact CB-CE1 4.27Å; Q532-Y565 HydrophobicContact CG-CE1 4.41Å; L535-Y565 HydrophobicContact CB-CE1 4.26Å; L535-Y565 HydrophobicContact CB-CE2 4.49Å; A536-Y565 HydrophobicContact CB-CD1 4.37Å; A536-Y565 HydrophobicContact CB-CD2 4.03Å; A536-Y565 HydrophobicContact CB-CG 3.77Å; Y539-Y565 AromaticContact CD2-CE2 3.75Å; Y539-Y565 HydrophobicContact CD2-CE2 3.75Å; Y539-Y565 HydrophobicContact CE2-CE2 4.02Å; K561-Y565 WeakPolarHBondContact O-CD2 3.23Å; K561-Y565 WeakPolarHBondContact O-CE2 3.29Å; C562-Y565 PolarHBondContact O-N 3.45Å; L563-Y565 PolarHBondContact O-N 3.33Å; Y565-E567 VanDerWaalsContact C-N 3.3Å; Y565-E567 PolarHBondContact O-N 3.46Å; Y565-R569 WeakPolarHBondContact O-CB 3.38Å; Y565-R569 PolarHBondContact O-N 2.94Å
566P84.9Confident88.2Confident99 Ų9963.2 Ų63.264%0.64332%0.318SS*.THydrogen-bonded Turntrans-64.1-34.1-175.523.6-32.1000113.1
567E83.5Confident88.2Confident114 Ų11470.4 Ų70.453%0.53334%0.34SS..THydrogen-bonded Turntrans-68.1-39.2-174.7-63.8168.8179.400112.8Y565Y565-E567 VanDerWaalsContact C-N 3.3Å; Y565-E567 PolarHBondContact O-N 3.46Å
568T85.6Confident88Confident5 Ų569.9 Ų69.93%0.03134%0.335CS..THydrogen-bonded Turntrans-99.34.6-177.550.80000113.4A536 K540 C562 E570 A572A536-T568 HydrophobicContact CB-CG2 3.79Å; K540-T568 HydrophobicContact CB-CG2 4.3Å; K540-T568 HydrophobicContact CD-CG2 4.19Å; C562-T568 PolarHBondContact O-OG1 2.9Å; T568-E570 PolarHBondContact O-N 3.34Å; T568-A572 WeakPolarHBondContact O-CB 3.24Å; T568-A572 PolarHBondContact O-N 3.02Å
569R88.4Confident87.8Confident130 Ų13069.8 Ų69.849%0.49133%0.333SS..Hα-helixtrans-65.8-40.9-169.4-172.5174.5-178.1178.10.7114L563 Y565 K573L563-R569 HydrophobicContact CD2-CG 4.1Å; Y565-R569 WeakPolarHBondContact O-CB 3.38Å; Y565-R569 PolarHBondContact O-N 2.94Å; R569-K573 WeakPolarHBondContact O-CG 3.5Å; R569-K573 PolarHBondContact O-N 3.35Å; R569-K573 VanDerWaalsContact O-N 3.12Å
570E88.8Confident87.7Confident164 Ų16474.4 Ų74.477%0.76636%0.361SS*.Hα-helixtrans-71.7-44.3-179.3-64.1-168.1160.400111.3T568 A572 K573 A574T568-E570 PolarHBondContact O-N 3.34Å; E570-A572 VanDerWaalsContact C-N 3.31Å; E570-A572 PolarHBondContact O-N 2.96Å; E570-K573 PolarHBondContact O-N 3.38Å; E570-A574 PolarHBondContact O-N 2.95Å
571E87.9Confident87.5Confident94 Ų9475.8 Ų75.844%0.43937%0.367SS..Hα-helixtrans-58.7-43.1172.9-62.3-178162.300110.9K540 K573 A574 M575K540-E571 WeakPolarHBondContact CD-OE2 3.48Å; K540-E571 WeakPolarHBondContact CE-OE2 3.3Å; K540-E571 IonicContact NZ-OE1 2.94Å; K540-E571 IonicContact NZ-OE2 3.75Å; K540-E571 PolarHBondContact NZ-OE2 3.09Å; E571-K573 PolarHBondContact O-N 3.2Å; E571-A574 WeakPolarHBondContact O-CB 3.38Å; E571-A574 PolarHBondContact O-N 3.02Å; E571-M575 HydrophobicContact CB-CE 4.49Å; E571-M575 WeakPolarHBondContact O-CG 3.4Å; E571-M575 PolarHBondContact O-N 3.27Å
572A88.8Confident87.1Confident0 Ų074.7 Ų74.70%037%0.365CS..Hα-helixtrans-61.5-41176.400000113.1C562 L563 T568 E570 A574 M575 L576C562-A572 HydrophobicContact CB-CB 3.61Å; L563-A572 HydrophobicContact CD2-CB 3.76Å; L563-A572 HydrophobicContact CG-CB 4.12Å; T568-A572 WeakPolarHBondContact O-CB 3.24Å; T568-A572 PolarHBondContact O-N 3.02Å; E570-A572 VanDerWaalsContact C-N 3.31Å; E570-A572 PolarHBondContact O-N 2.96Å; A572-A574 VanDerWaalsContact C-N 3.34Å; A572-M575 HydrophobicContact CB-CE 4.36Å; A572-M575 PolarHBondContact O-N 3.37Å; A572-L576 WeakPolarHBondContact O-CG 3.32Å; A572-L576 PolarHBondContact O-N 3.37Å
573K89.9Confident86.7Confident93 Ų9376.5 Ų76.540%0.40438%0.38SS..Hα-helixtrans-64.7-38.6173.9-71.6174.8-173.9172.80112L563 R569 E570 E571 R577L563-K573 HydrophobicContact CD2-CG 3.72Å; R569-K573 WeakPolarHBondContact O-CG 3.5Å; R569-K573 PolarHBondContact O-N 3.35Å; R569-K573 VanDerWaalsContact O-N 3.12Å; E570-K573 PolarHBondContact O-N 3.38Å; E571-K573 PolarHBondContact O-N 3.2Å; K573-R577 WeakPolarHBondContact O-CG 3.28Å; K573-R577 PolarHBondContact O-N 2.92Å; K573-R577 VanDerWaalsContact O-N 3.14Å
574A89.2Confident85.9Confident55 Ų5575.6 Ų75.646%0.45538%0.383SS..Hα-helixtrans-64.5-45.3175.400000111E570 E571 A572 L576 R577 Q578E570-A574 PolarHBondContact O-N 2.95Å; E571-A574 WeakPolarHBondContact O-CB 3.38Å; E571-A574 PolarHBondContact O-N 3.02Å; A572-A574 VanDerWaalsContact C-N 3.34Å; A574-L576 PolarHBondContact O-N 3.18Å; A574-R577 PolarHBondContact O-N 3.12Å; A574-Q578 PolarHBondContact O-N 3.4Å
575M87.5Confident84.7Confident11 Ų1173 Ų735%0.05437%0.373CS..Hα-helixtrans-59.2-45.6175-73.4-172.5-77.200111.8K540 A543 N544 A559 E571 A572 R577 Q578 I579K540-M575 HydrophobicContact CG-CE 4.31Å; A543-M575 HydrophobicContact CB-CE 4.33Å; A543-M575 HydrophobicContact CB-SD 3.9Å; N544-M575 PolarHBondContact OD1-SD 3.32Å; A559-M575 HydrophobicContact CB-CB 4.46Å; E571-M575 HydrophobicContact CB-CE 4.49Å; E571-M575 WeakPolarHBondContact O-CG 3.4Å; E571-M575 PolarHBondContact O-N 3.27Å; A572-M575 HydrophobicContact CB-CE 4.36Å; A572-M575 PolarHBondContact O-N 3.37Å; M575-R577 VanDerWaalsContact C-N 3.35Å; M575-R577 PolarHBondContact O-N 2.98Å; M575-Q578 WeakPolarHBondContact O-CB 3.25Å; M575-Q578 PolarHBondContact O-N 2.99Å; M575-I579 WeakPolarHBondContact O-CD1 3.4Å; M575-I579 WeakPolarHBondContact O-CG1 3.47Å; M575-I579 PolarHBondContact O-N 2.92Å
576L88.7Confident83.1Confident37 Ų3775.8 Ų75.819%0.19439%0.39CS..Hα-helixtrans-62.3-39.4178-73.2169.7000112.6A556 A559 N560 L563 A572 A574 I579 T580A556-L576 HydrophobicContact CB-CD2 4.29Å; A559-L576 HydrophobicContact CB-CD2 3.85Å; A559-L576 HydrophobicContact CB-CG 3.96Å; N560-L576 WeakPolarHBondContact OD1-CD1 3.43Å; L563-L576 HydrophobicContact CD1-CD1 3.75Å; L563-L576 HydrophobicContact CG-CD1 4.31Å; A572-L576 WeakPolarHBondContact O-CG 3.32Å; A572-L576 PolarHBondContact O-N 3.37Å; A574-L576 PolarHBondContact O-N 3.18Å; L576-I579 HydrophobicContact CD2-CD1 4.38Å; L576-I579 PolarHBondContact O-N 3.38Å; L576-T580 WeakPolarHBondContact O-CG2 3.38Å; L576-T580 PolarHBondContact O-N 3.45Å; L576-T580 PolarHBondContact O-OG1 3.31Å
577R88.3Confident81.3Confident175 Ų17580 Ų8066%0.6640%0.401SS*.Hα-helixtrans-62.5-44.8173.2-70.8173.2-174.7170.51.4111.4K573 A574 M575 I579 T580 I581K573-R577 WeakPolarHBondContact O-CG 3.28Å; K573-R577 PolarHBondContact O-N 2.92Å; K573-R577 VanDerWaalsContact O-N 3.14Å; A574-R577 PolarHBondContact O-N 3.12Å; M575-R577 VanDerWaalsContact C-N 3.35Å; M575-R577 PolarHBondContact O-N 2.98Å; R577-I579 VanDerWaalsContact C-N 3.35Å; R577-I579 PolarHBondContact O-N 3.39Å; R577-T580 WeakPolarHBondContact CA-OG1 3.02Å; R577-T580 PolarHBondContact O-N 3.42Å; R577-T580 PolarHBondContact O-OG1 3.01Å; R577-I581 WeakPolarHBondContact O-CG1 3.26Å; R577-I581 PolarHBondContact O-N 3.13Å
578Q87.2Confident79.3Confident96 Ų9682.7 Ų82.745%0.44941%0.413SS..Hα-helixtrans-61.3-43.7177.1-174.3177.97.600111.7L547 A574 M575 T580 I581 L582L547-Q578 HydrophobicContact CD2-CG 4.48Å; A574-Q578 PolarHBondContact O-N 3.4Å; M575-Q578 WeakPolarHBondContact O-CB 3.25Å; M575-Q578 PolarHBondContact O-N 2.99Å; Q578-T580 VanDerWaalsContact C-N 3.34Å; Q578-T580 PolarHBondContact O-N 3.05Å; Q578-I581 PolarHBondContact O-N 2.88Å; Q578-L582 HydrophobicContact CG-CD1 3.93Å; Q578-L582 WeakPolarHBondContact O-CG 3.43Å; Q578-L582 PolarHBondContact O-N 3.19Å
579I86.7Confident76.7Confident9 Ų988.7 Ų88.75%0.04645%0.445CS..Hα-helixtrans-60.5-43.5175.4-66.4158.9000110.5L547 Y552 S555 A556 A559 M575 L576 R577 I581 L582 A583L547-I579 HydrophobicContact CD1-CG1 3.7Å; Y552-I579 HydrophobicContact CD1-CG2 4.32Å; S555-I579 VanDerWaalsContact OG-CD1 3.26Å; S555-I579 WeakPolarHBondContact OG-CD1 3.5Å; A556-I579 HydrophobicContact CB-CD1 4.47Å; A556-I579 HydrophobicContact CB-CG2 4.4Å; A559-I579 HydrophobicContact CB-CD1 4.36Å; M575-I579 WeakPolarHBondContact O-CD1 3.4Å; M575-I579 WeakPolarHBondContact O-CG1 3.47Å; M575-I579 PolarHBondContact O-N 2.92Å; L576-I579 HydrophobicContact CD2-CD1 4.38Å; L576-I579 PolarHBondContact O-N 3.38Å; R577-I579 VanDerWaalsContact C-N 3.35Å; R577-I579 PolarHBondContact O-N 3.39Å; I579-I581 VanDerWaalsContact C-N 3.33Å; I579-I581 PolarHBondContact O-N 3.15Å; I579-L582 PolarHBondContact O-N 3.14Å; I579-A583 WeakPolarHBondContact O-CB 3.16Å; I579-A583 PolarHBondContact O-N 2.96Å
580T87.1Confident73.9Confident97 Ų9789.1 Ų89.160%0.59546%0.462SS*.Hα-helixtrans-64.9-34.3178.353.90000113.5L576 R577 Q578 G584L576-T580 WeakPolarHBondContact O-CG2 3.38Å; L576-T580 PolarHBondContact O-N 3.45Å; L576-T580 PolarHBondContact O-OG1 3.31Å; R577-T580 WeakPolarHBondContact CA-OG1 3.02Å; R577-T580 PolarHBondContact O-N 3.42Å; R577-T580 PolarHBondContact O-OG1 3.01Å; Q578-T580 VanDerWaalsContact C-N 3.34Å; Q578-T580 PolarHBondContact O-N 3.05Å; T580-G584 PolarHBondContact O-N 2.79Å
581I86.7Confident71.4Confident107 Ų10787 Ų8755%0.54946%0.462SS..Hα-helixtrans-68.6-52.7175.7-65.7165000109.4R577 Q578 I579 A583 G584 D585R577-I581 WeakPolarHBondContact O-CG1 3.26Å; R577-I581 PolarHBondContact O-N 3.13Å; Q578-I581 PolarHBondContact O-N 2.88Å; I579-I581 VanDerWaalsContact C-N 3.33Å; I579-I581 PolarHBondContact O-N 3.15Å; I581-A583 PolarHBondContact O-N 3.14Å; I581-G584 PolarHBondContact O-N 3.36Å; I581-D585 PolarHBondContact O-N 3.34Å
582L82.8Confident68.6Low57 Ų5790.7 Ų90.730%0.29848%0.484SS..Hα-helixtrans-66.4-35.2-177.2-67.6171.7000113.2L547 Y552 Q578 I579 I586L547-L582 HydrophobicContact CD1-CD1 3.97Å; Y552-L582 HydrophobicContact CD1-CB 4.39Å; Y552-L582 HydrophobicContact CE1-CB 3.62Å; Y552-L582 HydrophobicContact CE1-CD1 4.13Å; Q578-L582 HydrophobicContact CG-CD1 3.93Å; Q578-L582 WeakPolarHBondContact O-CG 3.43Å; Q578-L582 PolarHBondContact O-N 3.19Å; I579-L582 PolarHBondContact O-N 3.14Å; L582-I586 WeakPolarHBondContact O-CG1 3.38Å
583A78.7Confident65.6Low37 Ų3797.8 Ų97.831%0.30652%0.522SS..Hα-helixtrans-71.3-37.1174.200000111.8I579 I581 D585 I586I579-A583 WeakPolarHBondContact O-CB 3.16Å; I579-A583 PolarHBondContact O-N 2.96Å; I581-A583 PolarHBondContact O-N 3.14Å; A583-D585 VanDerWaalsContact C-N 3.33Å; A583-D585 PolarHBondContact O-N 2.83Å; A583-I586 PolarHBondContact O-N 3.3Å
584G70.7Confident62.6Low32 Ų3298.6 Ų98.633%0.3354%0.54SS..Hα-helixtrans-66-32.4176.500000113.7T580 I581 I586T580-G584 PolarHBondContact O-N 2.79Å; I581-G584 PolarHBondContact O-N 3.36Å; G584-I586 VanDerWaalsContact C-N 3.27Å; G584-I586 PolarHBondContact O-N 2.94Å
585D61.5Low59.7Low89 Ų89101.6 Ų101.648%0.47655%0.552SS.*Hα-helixtrans-67.1-27.4175.4-68.9-24.4000112.2I581 A583 Q588 L589I581-D585 PolarHBondContact O-N 3.34Å; A583-D585 VanDerWaalsContact C-N 3.33Å; A583-D585 PolarHBondContact O-N 2.83Å; D585-Q588 PolarHBondContact O-N 2.91Å; D585-L589 WeakPolarHBondContact O-CD1 3.37Å
586I52.3Low56.8Low91 Ų91107.2 Ų107.247%0.46758%0.582SS.*Hα-helixtrans-81-33.2-177-64.8168.6000112.5Y552 L582 A583 G584 Q588 L589Y552-I586 HydrophobicContact CD2-CD1 4Å; Y552-I586 HydrophobicContact CE2-CD1 3.18Å; L582-I586 WeakPolarHBondContact O-CG1 3.38Å; A583-I586 PolarHBondContact O-N 3.3Å; G584-I586 VanDerWaalsContact C-N 3.27Å; G584-I586 PolarHBondContact O-N 2.94Å; I586-Q588 PolarHBondContact O-N 3.07Å; I586-Q588 VanDerWaalsContact O-N 3.12Å; I586-L589 PolarHBondContact O-N 3.37Å; I586-L589 VanDerWaalsContact O-N 3.15Å
587E47.4Very low53.8Low186 Ų186112.1 Ų112.187%0.86961%0.608SS**THydrogen-bonded Turntrans-63.1-16.7172.6-73.4-170.2169.200112.6
588Q42.1Very low50.9Low171 Ų171111.2 Ų111.280%0.79962%0.615SS**THydrogen-bonded Turntrans-98-3.1177.1-62.7-167.25.400114.8D585 I586D585-Q588 PolarHBondContact O-N 2.91Å; I586-Q588 PolarHBondContact O-N 3.07Å; I586-Q588 VanDerWaalsContact O-N 3.12Å
589L31.1Very low47.9Very low132 Ų132113.2 Ų113.269%0.69163%0.629SS**  trans-125.184.5-172.5-85.2151.9000112.5D585 I586D585-L589 WeakPolarHBondContact O-CD1 3.37Å; I586-L589 PolarHBondContact O-N 3.37Å; I586-L589 VanDerWaalsContact O-N 3.15Å
590T27.8Very low45Very low138 Ų138119.5 Ų119.585%0.84766%0.661SS**  trans-109147153.5510000108.9
591P37.4Very low41.9Very low119 Ų119122.9 Ų122.977%0.77367%0.67SS**  -97.6148.2-94.536.2-29000112.5
592L28.2Very low38.8Very low173 Ų173123.5 Ų123.591%0.90668%0.679SS**  trans-148.9124.6157.3-99.2159.8000110.5
593D27.3Very low35.9Very low148 Ų148128.8 Ų128.879%0.79170%0.702SS**  trans-52.2153.7171.4-71.4-54.2000113.3
594S27Very low33.3Very low111 Ų111135.5 Ų135.578%0.77673%0.727SS**  trans74.1118.2158.973.40000117.6
595V28.2Very low31Very low118 Ų118137.8 Ų137.872%0.71574%0.738SS**  150.6107.4117.6171.40000109.6
596N25.8Very low29.2Very low129 Ų129142.5 Ų142.569%0.6975%0.754SS**  trans46.2131.7134.8-59.8-17000121.6
597N25.8Very low27.8Very low139 Ų139142.6 Ų142.674%0.74376%0.759SS**  trans58.481.8136.4-62.1-0.5000115.7
598I28.1Very low26.7Very low156 Ų156140.9 Ų140.980%0.876%0.756SS**  trans-103105.8146.7-63.1172.1000105.6I600I598-I600 VanDerWaalsContact C-N 3.3Å; I598-I600 PolarHBondContact O-N 3.49Å
599D23.5Very low25.9Very low139 Ų139140.5 Ų140.574%0.74375%0.754SS**  trans-56.995.8166.9-72.2-43.3000107.9H601D599-H601 VanDerWaalsContact C-N 3.32Å; D599-H601 PolarHBondContact O-N 3.31Å
600I25.7Very low25.5Very low140 Ų140139.4 Ų139.472%0.71876%0.756SS**  trans-69.7102.5162.9-63.6171.3000104.4I598 T602I598-I600 VanDerWaalsContact C-N 3.3Å; I598-I600 PolarHBondContact O-N 3.49Å; I600-T602 PolarHBondContact O-N 3.1Å
601H22.3Very low25.3Very low169 Ų169141.3 Ų141.378%0.78276%0.755SS**  trans-52.896158.6-83.8-76000107.3D599 E603D599-H601 VanDerWaalsContact C-N 3.32Å; D599-H601 PolarHBondContact O-N 3.31Å; H601-E603 PolarHBondContact O-N 2.94Å
602T22.3Very low24.7Very low120 Ų120145.2 Ų145.274%0.73676%0.756SS**  trans-65.777.7153.9500000105.6I600 E604I600-T602 PolarHBondContact O-N 3.1Å; T602-E604 VanDerWaalsContact C-N 3.29Å; T602-E604 PolarHBondContact O-N 3.3Å
603E21.6Very low24.6Very low168 Ų168144.3 Ų144.379%0.78575%0.751SS**  trans-57.4111.1150.3-76.7-168.7160.800104.4H601 S605H601-E603 PolarHBondContact O-N 2.94Å; E603-S605 PolarHBondContact O-N 2.88Å
604E22.4Very low24.4Very low178 Ų178144.2 Ų144.283%0.83275%0.751SS**  trans-55.178.6158-69.4179161.100106.5T602 K606T602-E604 VanDerWaalsContact C-N 3.29Å; T602-E604 PolarHBondContact O-N 3.3Å; E604-K606 PolarHBondContact O-N 2.93Å
605S24Very low24.2Very low80 Ų80147.1 Ų147.156%0.55975%0.752SS**  trans-64.897.316363.90000103.6E603 T607E603-S605 PolarHBondContact O-N 2.88Å; S605-T607 PolarHBondContact O-N 3.29Å; S605-T607 PolarHBondContact O-OG1 2.99Å
606K23Very low24Very low188 Ų188149 Ų14982%0.81776%0.758SS**  trans-54.669.2147.8-65.8174.4179.11750106.8E604 D608E604-K606 PolarHBondContact O-N 2.93Å; K606-D608 PolarHBondContact O-N 2.89Å
607T24Very low24Very low92 Ų92148 Ų14856%0.56476%0.761SS**  trans-75.9104.7160.941.70000103.1S605 H609S605-T607 PolarHBondContact O-N 3.29Å; S605-T607 PolarHBondContact O-OG1 2.99Å; T607-H609 VanDerWaalsContact C-N 3.28Å; T607-H609 PolarHBondContact O-N 3.35Å
608D23.8Very low24Very low150 Ų150150 Ų15080%0.80277%0.766SS**  trans-42.399.6166.2-64.5-40.5000107.7K606 C610K606-D608 PolarHBondContact O-N 2.89Å; D608-C610 PolarHBondContact O-N 3.01Å
609H24.2Very low24Very low163 Ų163147.3 Ų147.376%0.75576%0.757SS**  trans-59.2112170.9-91.6-66.2000105.3T607 E611T607-H609 VanDerWaalsContact C-N 3.28Å; T607-H609 PolarHBondContact O-N 3.35Å; H609-E611 PolarHBondContact O-N 2.89Å
610C23.7Very low24.3Very low110 Ų110146.5 Ų146.574%0.74376%0.762SS**  trans-9.390.2171.7-670000113D608 Y612D608-C610 PolarHBondContact O-N 3.01Å; C610-Y612 PolarHBondContact O-N 3.09Å
611E23.3Very low24.6Very low177 Ų177151 Ų15183%0.82777%0.77SS**  trans-69.467.8162-74.2-173.6161.700108H609H609-E611 PolarHBondContact O-N 2.89Å
612Y25.7Very low25Very low201 Ų201149.6 Ų149.679%0.78876%0.762SS**  trans-11582.4160.7-92.1-87.3000105.7C610C610-Y612 PolarHBondContact O-N 3.09Å
613L25.6Very low25.3Very low154 Ų154146.2 Ų146.281%0.80675%0.746SS**SBendtrans175.1-1.8143.8-91.8170.4000113.8
614D22.5Very low25.7Very low147 Ų147145.8 Ų145.879%0.78674%0.744SS**  trans-10558.5172-79-28.7000112.5N616D614-N616 VanDerWaalsContact C-N 3.28Å; D614-N616 PolarHBondContact O-N 2.79Å; D614-N616 VanDerWaalsContact O-N 3.14Å
615Q23.3Very low26.3Very low172 Ų172144.4 Ų144.480%0.80474%0.738SS**  trans-82.776161.8-73.4-1711.700110
616N24.3Very low27.1Very low156 Ų156142.4 Ų142.483%0.83472%0.724SS**  trans-15163.9162.3-97.7-23.9000110.2D614D614-N616 VanDerWaalsContact C-N 3.28Å; D614-N616 PolarHBondContact O-N 2.79Å; D614-N616 VanDerWaalsContact O-N 3.14Å
617S25.1Very low28.2Very low108 Ų108139.5 Ų139.576%0.75571%0.713SS**  trans-139.942.117660.10000113
618Q26.5Very low29.3Very low183 Ų183141.3 Ų141.386%0.85571%0.713SS**  trans-142.994.2162.9-69.5-172.1-3.600110.5
619T27.2Very low30.8Very low98 Ų98135.8 Ų135.860%0.60169%0.686SS**  trans178.983145.736.60000111R621 K622T619-R621 PolarHBondContact O-N 3.17Å; T619-K622 PolarHBondContact O-N 3.24Å
620S30.8Very low32.3Very low122 Ų122132.4 Ų132.485%0.85367%0.667SS**THydrogen-bonded Turntrans-68.715.1179.3-168.20000115.7
621R30.8Very low34.2Very low234 Ų234130.1 Ų130.188%0.88365%0.65SS**THydrogen-bonded Turntrans-127.7-6.1170.5-74.9-174.3179.2167.5-0114.1T619T619-R621 PolarHBondContact O-N 3.17Å
622K30.8Very low36.2Very low140 Ų140127 Ų12761%0.60964%0.635SS**THydrogen-bonded Turntrans-100.8-8.7171-72.4-174.2173.6-176.70112.7T619 S626T619-K622 PolarHBondContact O-N 3.24Å; K622-S626 WeakPolarHBondContact O-CB 3.43Å; K622-S626 PolarHBondContact O-N 3.29Å; K622-S626 PolarHBondContact O-OG 3.2Å
623A29.6Very low38.1Very low49 Ų49118.3 Ų118.341%0.40560%0.603SS.*Hα-helixtrans-62.3-42.9179.100000112.3S626 E627A623-S626 WeakPolarHBondContact CA-OG 3.4Å; A623-S626 CarbonylContact O-C 3.59Å; A623-S626 PolarHBondContact O-N 2.68Å; A623-S626 PolarHBondContact O-OG 3.36Å; A623-E627 PolarHBondContact O-N 3.43Å
624E30.5Very low39.6Very low160 Ų160112.1 Ų112.175%0.74857%0.574SS**Hα-helixtrans-66.5-42-178.7-65.9179176.100112.8S626 E627 F628E624-S626 VanDerWaalsContact C-N 3.33Å; E624-E627 PolarHBondContact O-N 3.45Å; E624-F628 PolarHBondContact O-N 3.24Å
625E33.7Very low41.7Very low148 Ų148111.5 Ų111.569%0.69256%0.564SS**Hα-helixtrans-66.1-36.2172.9-70.8-178.1164.600111.7S629E625-S629 WeakPolarHBondContact O-CB 3.49Å; E625-S629 PolarHBondContact O-N 3.48Å; E625-S629 PolarHBondContact O-OG 3.29Å
626S40.7Very low43.5Very low39 Ų39105.3 Ų105.327%0.27354%0.54SS..Hα-helixtrans-70-37.5176.580.60000112.4K622 A623 E624 S629 R630K622-S626 WeakPolarHBondContact O-CB 3.43Å; K622-S626 PolarHBondContact O-N 3.29Å; K622-S626 PolarHBondContact O-OG 3.2Å; A623-S626 WeakPolarHBondContact CA-OG 3.4Å; A623-S626 CarbonylContact O-C 3.59Å; A623-S626 PolarHBondContact O-N 2.68Å; A623-S626 PolarHBondContact O-OG 3.36Å; E624-S626 VanDerWaalsContact C-N 3.33Å; S626-S629 WeakPolarHBondContact CA-OG 3.25Å; S626-S629 PolarHBondContact O-N 2.97Å; S626-S629 PolarHBondContact O-OG 2.74Å; S626-R630 WeakPolarHBondContact O-CB 3.35Å; S626-R630 VanDerWaalsContact O-CG 3.23Å; S626-R630 WeakPolarHBondContact O-CG 3.3Å; S626-R630 PolarHBondContact O-N 2.63Å
627E46.9Very low45Very low127 Ų12797.9 Ų97.959%0.59350%0.5SS*.Hα-helixtrans-67.5-44.2176.1-118.6-178.1165.600111.3A623 E624 S629 R630 T631A623-E627 PolarHBondContact O-N 3.43Å; E624-E627 PolarHBondContact O-N 3.45Å; E627-S629 VanDerWaalsContact C-N 3.35Å; E627-S629 PolarHBondContact O-N 3.1Å; E627-R630 PolarHBondContact O-N 3.42Å; E627-T631 WeakPolarHBondContact O-CG2 3.31Å; E627-T631 PolarHBondContact O-N 3.49Å; E627-T631 PolarHBondContact O-OG1 2.64Å
628F47.5Very low46.4Very low130 Ų13094.9 Ų94.957%0.5748%0.482SS*.Hα-helixtrans-57.9-48.6174.3-170.7-95.3000110.9E624 R630 T631 E632E624-F628 PolarHBondContact O-N 3.24Å; F628-R630 PolarHBondContact O-N 2.97Å; F628-T631 PolarHBondContact O-N 3.4Å; F628-T631 PolarHBondContact O-OG1 3.37Å; F628-E632 HydrophobicContact CD1-CG 4.41Å; F628-E632 HydrophobicContact CE1-CG 3.98Å; F628-E632 HydrophobicContact CZ-CG 4.21Å; F628-E632 WeakPolarHBondContact CZ-OE1 3.29Å; F628-E632 PolarHBondContact O-N 3.29Å
629S53.4Low47.9Very low33 Ų3394 Ų9423%0.23148%0.475CS..Hα-helixtrans-61.4-40.1175.874.90000113.2E625 S626 E627 T631 E632 V633E625-S629 WeakPolarHBondContact O-CB 3.49Å; E625-S629 PolarHBondContact O-N 3.48Å; E625-S629 PolarHBondContact O-OG 3.29Å; S626-S629 WeakPolarHBondContact CA-OG 3.25Å; S626-S629 PolarHBondContact O-N 2.97Å; S626-S629 PolarHBondContact O-OG 2.74Å; E627-S629 VanDerWaalsContact C-N 3.35Å; E627-S629 PolarHBondContact O-N 3.1Å; S629-T631 PolarHBondContact O-N 2.9Å; S629-E632 PolarHBondContact O-N 2.81Å; S629-V633 WeakPolarHBondContact O-CB 3.39Å; S629-V633 WeakPolarHBondContact O-CG2 3.46Å; S629-V633 PolarHBondContact O-N 2.95Å
630R56.6Low49Very low92 Ų9293.7 Ų93.735%0.34747%0.467SS..Hα-helixtrans-62.4-43.8175.9-78.9172.5179.5171.34.3111.4S626 E627 F628 A634S626-R630 WeakPolarHBondContact O-CB 3.35Å; S626-R630 VanDerWaalsContact O-CG 3.23Å; S626-R630 WeakPolarHBondContact O-CG 3.3Å; S626-R630 PolarHBondContact O-N 2.63Å; E627-R630 PolarHBondContact O-N 3.42Å; F628-R630 PolarHBondContact O-N 2.97Å; R630-A634 WeakPolarHBondContact O-CB 3.04Å; R630-A634 PolarHBondContact O-N 3.38Å
631T63.1Low50Low62 Ų6290 Ų9038%0.3844%0.437SS..Hα-helixtrans-68.9-38.8179.663.80000112.4E627 F628 S629 K635E627-T631 WeakPolarHBondContact O-CG2 3.31Å; E627-T631 PolarHBondContact O-N 3.49Å; E627-T631 PolarHBondContact O-OG1 2.64Å; F628-T631 PolarHBondContact O-N 3.4Å; F628-T631 PolarHBondContact O-OG1 3.37Å; S629-T631 PolarHBondContact O-N 2.9Å; T631-K635 VanDerWaalsContact O-CB 3.26Å; T631-K635 WeakPolarHBondContact O-CB 3.45Å; T631-K635 WeakPolarHBondContact O-CD 3.25Å; T631-K635 WeakPolarHBondContact O-CG 3.36Å; T631-K635 PolarHBondContact O-N 2.92Å
632E66.9Low50.5Low112 Ų11285 Ų8552%0.52342%0.424SS..Hα-helixtrans-68.1-43.4175.5-73.9-155.9149.900112.4F628 S629 K635 S636F628-E632 HydrophobicContact CD1-CG 4.41Å; F628-E632 HydrophobicContact CE1-CG 3.98Å; F628-E632 HydrophobicContact CZ-CG 4.21Å; F628-E632 WeakPolarHBondContact CZ-OE1 3.29Å; F628-E632 PolarHBondContact O-N 3.29Å; S629-E632 PolarHBondContact O-N 2.81Å; E632-K635 PolarHBondContact O-N 3.39Å; E632-S636 WeakPolarHBondContact O-CB 3.31Å; E632-S636 PolarHBondContact O-N 3.35Å
633V63.7Low50.8Low19 Ų1981.8 Ų81.812%0.11542%0.417CS..Hα-helixtrans-63.7-43.5176173.60000110.5I412 Y436 L439 S629 S636 A637I412-V633 HydrophobicContact CD1-CG1 4.23Å; Y436-V633 HydrophobicContact CE1-CG1 3.89Å; L439-V633 HydrophobicContact CD1-CG1 3.83Å; S629-V633 WeakPolarHBondContact O-CB 3.39Å; S629-V633 WeakPolarHBondContact O-CG2 3.46Å; S629-V633 PolarHBondContact O-N 2.95Å; V633-S636 PolarHBondContact O-N 3.11Å; V633-A637 WeakPolarHBondContact O-CB 3.23Å; V633-A637 PolarHBondContact O-N 3.45Å
634A58.5Low51.1Low23 Ų2383.1 Ų83.119%0.1942%0.417CS..Hα-helixtrans-64.7-39.6175.400000112.5L441 R630 A637 A638L441-A634 HydrophobicContact CD1-CB 4.41Å; R630-A634 WeakPolarHBondContact O-CB 3.04Å; R630-A634 PolarHBondContact O-N 3.38Å; A634-A637 PolarHBondContact O-N 3.34Å; A634-A638 VanDerWaalsContact O-CB 3.23Å; A634-A638 WeakPolarHBondContact O-CB 3.28Å; A634-A638 PolarHBondContact O-N 3.5Å
635K66.2Low51.4Low134 Ų13477.7 Ų77.758%0.58340%0.397SS*.Hα-helixtrans-64.7-42.5173.9-77.4169.1-176.5172.70111.6T631 E632 K639T631-K635 VanDerWaalsContact O-CB 3.26Å; T631-K635 WeakPolarHBondContact O-CB 3.45Å; T631-K635 WeakPolarHBondContact O-CD 3.25Å; T631-K635 WeakPolarHBondContact O-CG 3.36Å; T631-K635 PolarHBondContact O-N 2.92Å; E632-K635 PolarHBondContact O-N 3.39Å; K635-K639 WeakPolarHBondContact O-CG 3.36Å; K635-K639 PolarHBondContact O-N 3.48Å; K635-K639 VanDerWaalsContact O-N 3.11Å
636S60.9Low51.6Low43 Ų4374.5 Ų74.530%0.30138%0.384SS..Hα-helixtrans-62.2-46.2174.21680000111.1R416 E632 V633 K639R416-S636 PolarHBondContact NH1-OG 2.97Å; R416-S636 VanDerWaalsContact NH1-OG 3.12Å; E632-S636 WeakPolarHBondContact O-CB 3.31Å; E632-S636 PolarHBondContact O-N 3.35Å; V633-S636 PolarHBondContact O-N 3.11Å; S636-K639 PolarHBondContact O-N 2.88Å
637A55.9Low51.4Low0 Ų075.9 Ų75.90%039%0.394CS..Hα-helixtrans-64.5-42.7178.100000112.3Y436 F444 V633 A634 K639 E640 I641Y436-A637 HydrophobicContact CE1-CB 4.17Å; F444-A637 HydrophobicContact CD1-CB 3.77Å; F444-A637 HydrophobicContact CE1-CB 3.47Å; F444-A637 VanDerWaalsContact CE1-CB 3.47Å; F444-A637 HydrophobicContact CZ-CB 4.25Å; V633-A637 WeakPolarHBondContact O-CB 3.23Å; V633-A637 PolarHBondContact O-N 3.45Å; A634-A637 PolarHBondContact O-N 3.34Å; A637-K639 PolarHBondContact O-N 3.23Å; A637-E640 PolarHBondContact O-N 3.43Å; A637-I641 WeakPolarHBondContact O-CG1 3.38Å; A637-I641 PolarHBondContact O-N 3.42Å
638A53.7Low50.6Low44 Ų4474 Ų7436%0.36439%0.387SS..Hα-helixtrans-64.8-37.1178.900000113A634 E640 Q642A634-A638 VanDerWaalsContact O-CB 3.23Å; A634-A638 WeakPolarHBondContact O-CB 3.28Å; A634-A638 PolarHBondContact O-N 3.5Å; A638-E640 PolarHBondContact O-N 3.36Å; A638-Q642 VanDerWaalsContact O-CG 3.25Å; A638-Q642 WeakPolarHBondContact O-CG 3.25Å; A638-Q642 PolarHBondContact O-N 2.8Å
639K58Low50.1Low165 Ų16574.8 Ų74.872%0.71739%0.39SS*.Hα-helixtrans-61.4-25.7175-77.8177.8-178.7-177.90113K635 S636 A637 P643K635-K639 WeakPolarHBondContact O-CG 3.36Å; K635-K639 PolarHBondContact O-N 3.48Å; K635-K639 VanDerWaalsContact O-N 3.11Å; S636-K639 PolarHBondContact O-N 2.88Å; A637-K639 PolarHBondContact O-N 3.23Å; K639-P643 WeakPolarHBondContact O-CD 3.26Å
640E51.2Low49.3Very low91 Ų9178.8 Ų78.843%0.42541%0.405SS..Hα-helixtrans-99.5-31.5-177.1-71.1176.3177.900113.6R416 A637 A638 Q642 P643 L644R416-E640 IonicContact CZ-OE2 2.83Å; R416-E640 IonicContact NE-OE2 3.05Å; R416-E640 IonicContact NH2-OE2 2.66Å; A637-E640 PolarHBondContact O-N 3.43Å; A638-E640 PolarHBondContact O-N 3.36Å; E640-Q642 PolarHBondContact O-N 3.25Å; E640-P643 WeakPolarHBondContact O-CD 3.39Å; E640-P643 VanDerWaalsContact O-CG 3.25Å; E640-P643 WeakPolarHBondContact O-CG 3.31Å; E640-L644 WeakPolarHBondContact O-CG 3.48Å; E640-L644 PolarHBondContact O-N 2.81Å
641I52.3Low48.1Very low46 Ų4676.8 Ų76.824%0.23641%0.409CS..Hα-helixtrans-64.8-29.6172.5-65.6178.6000110.8F444 A637 L644 S645F444-I641 HydrophobicContact CD1-CD1 3.49Å; F444-I641 VanDerWaalsContact CD1-CD1 3.49Å; F444-I641 HydrophobicContact CE1-CD1 3.47Å; F444-I641 VanDerWaalsContact CE1-CD1 3.47Å; A637-I641 WeakPolarHBondContact O-CG1 3.38Å; A637-I641 PolarHBondContact O-N 3.42Å; I641-L644 PolarHBondContact O-N 3.12Å; I641-S645 VanDerWaalsContact O-CB 3.26Å; I641-S645 WeakPolarHBondContact O-CB 3.48Å; I641-S645 PolarHBondContact O-N 3.23Å; I641-S645 PolarHBondContact O-OG 2.79Å
642Q40.2Very low46.7Very low128 Ų12877.9 Ų77.960%0.59841%0.411SS*.Hα-helixtrans-55.8-59174.8-73.2-98-17.500112.4A638 E640 L644 S645 I646A638-Q642 VanDerWaalsContact O-CG 3.25Å; A638-Q642 WeakPolarHBondContact O-CG 3.25Å; A638-Q642 PolarHBondContact O-N 2.8Å; E640-Q642 PolarHBondContact O-N 3.25Å; Q642-L644 VanDerWaalsContact C-N 3.34Å; Q642-L644 PolarHBondContact O-N 3Å; Q642-S645 PolarHBondContact O-N 3.47Å; Q642-S645 PolarHBondContact O-OG 3.22Å; Q642-I646 WeakPolarHBondContact O-CD1 3.46Å; Q642-I646 VanDerWaalsContact O-CG1 3.26Å; Q642-I646 WeakPolarHBondContact O-CG1 3.29Å; Q642-I646 PolarHBondContact O-N 3.36Å
643P37.6Very low45.4Very low73 Ų7375.9 Ų75.947%0.47441%0.407SS..Hα-helixtrans-65-30.5176.121.8-30.6000113.9K639 E640 I646 S647K639-P643 WeakPolarHBondContact O-CD 3.26Å; E640-P643 WeakPolarHBondContact O-CD 3.39Å; E640-P643 VanDerWaalsContact O-CG 3.25Å; E640-P643 WeakPolarHBondContact O-CG 3.31Å; P643-I646 PolarHBondContact O-N 2.95Å; P643-S647 WeakPolarHBondContact O-CB 3.46Å; P643-S647 PolarHBondContact O-N 3.42Å
644L35.3Very low44.1Very low76 Ų7678.1 Ų78.140%0.39842%0.423SS..Hα-helixtrans-69.4-36.9173.9-72.3164.8000112.3E640 I641 Q642 I646 S647 L648E640-L644 WeakPolarHBondContact O-CG 3.48Å; E640-L644 PolarHBondContact O-N 2.81Å; I641-L644 PolarHBondContact O-N 3.12Å; Q642-L644 VanDerWaalsContact C-N 3.34Å; Q642-L644 PolarHBondContact O-N 3Å; L644-I646 VanDerWaalsContact C-N 3.29Å; L644-S647 PolarHBondContact O-N 3.33Å; L644-L648 WeakPolarHBondContact O-CB 3.48Å; L644-L648 PolarHBondContact O-N 3.29Å
645S37.7Very low42.8Very low46 Ų4683.3 Ų83.332%0.32244%0.442SS..Hα-helixtrans-68.6-30.4172.4790000112I641 Q642 K649I641-S645 VanDerWaalsContact O-CB 3.26Å; I641-S645 WeakPolarHBondContact O-CB 3.48Å; I641-S645 PolarHBondContact O-N 3.23Å; I641-S645 PolarHBondContact O-OG 2.79Å; Q642-S645 PolarHBondContact O-N 3.47Å; Q642-S645 PolarHBondContact O-OG 3.22Å; S645-K649 VanDerWaalsContact O-CB 3.26Å; S645-K649 WeakPolarHBondContact O-CB 2.96Å; S645-K649 VanDerWaalsContact O-CG 3.28Å; S645-K649 WeakPolarHBondContact O-CG 3.02Å; S645-K649 PolarHBondContact O-N 2.72Å
646I37.9Very low41Very low81 Ų8181.2 Ų81.242%0.41544%0.437SS..Hα-helixtrans-71.6-45.1172.7-65.2161000109.5Q642 P643 L644 L648 K649 E650Q642-I646 WeakPolarHBondContact O-CD1 3.46Å; Q642-I646 VanDerWaalsContact O-CG1 3.26Å; Q642-I646 WeakPolarHBondContact O-CG1 3.29Å; Q642-I646 PolarHBondContact O-N 3.36Å; P643-I646 PolarHBondContact O-N 2.95Å; L644-I646 VanDerWaalsContact C-N 3.29Å; I646-L648 VanDerWaalsContact C-N 3.35Å; I646-L648 PolarHBondContact O-N 3.46Å; I646-K649 CarbonylContact O-C 3.28Å; I646-K649 PolarHBondContact O-N 2.86Å; I646-E650 HydrophobicContact CG2-CG 4.32Å; I646-E650 WeakPolarHBondContact O-CB 3.24Å; I646-E650 VanDerWaalsContact O-CG 3.3Å; I646-E650 WeakPolarHBondContact O-CG 3.34Å; I646-E650 PolarHBondContact O-N 3Å
647S35.1Very low39.6Very low69 Ų6985.5 Ų85.548%0.48345%0.452SS..Hα-helixtrans-63.7-38176.1-171.70000112.4P643 L644 E650 A651P643-S647 WeakPolarHBondContact O-CB 3.46Å; P643-S647 PolarHBondContact O-N 3.42Å; L644-S647 PolarHBondContact O-N 3.33Å; S647-E650 PolarHBondContact O-N 2.94Å; S647-A651 VanDerWaalsContact O-CB 3.25Å; S647-A651 WeakPolarHBondContact O-CB 2.73Å; S647-A651 PolarHBondContact O-N 3.02Å
648L32Very low38.5Very low88 Ų8888.4 Ų88.446%0.46147%0.473SS..Hα-helixtrans-69.3-39.9171.7-80.8171.5000112.1L644 I646 E650 A651 L652L644-L648 WeakPolarHBondContact O-CB 3.48Å; L644-L648 PolarHBondContact O-N 3.29Å; I646-L648 VanDerWaalsContact C-N 3.35Å; I646-L648 PolarHBondContact O-N 3.46Å; L648-E650 VanDerWaalsContact C-N 3.34Å; L648-A651 PolarHBondContact O-N 3.31Å; L648-L652 VanDerWaalsContact O-CB 3.27Å; L648-L652 WeakPolarHBondContact O-CB 3.34Å; L648-L652 WeakPolarHBondContact O-CD1 3.17Å; L648-L652 PolarHBondContact O-N 3.21Å
649K36.2Very low37.3Very low146 Ų14689.7 Ų89.764%0.63548%0.476SS*.Hα-helixtrans-62.3-41.6171.8-84.7178.1178.6178.50111.1S645 I646 L652 T653S645-K649 VanDerWaalsContact O-CB 3.26Å; S645-K649 WeakPolarHBondContact O-CB 2.96Å; S645-K649 VanDerWaalsContact O-CG 3.28Å; S645-K649 WeakPolarHBondContact O-CG 3.02Å; S645-K649 PolarHBondContact O-N 2.72Å; I646-K649 CarbonylContact O-C 3.28Å; I646-K649 PolarHBondContact O-N 2.86Å; K649-L652 CarbonylContact O-C 3.54Å; K649-L652 PolarHBondContact O-N 3.4Å; K649-T653 WeakPolarHBondContact O-CB 3.43Å; K649-T653 WeakPolarHBondContact O-CG2 3.43Å; K649-T653 PolarHBondContact O-N 3.03Å; K649-T653 PolarHBondContact O-OG1 3.47Å
650E36.5Very low35.8Very low117 Ų11785.8 Ų85.855%0.54747%0.466SS..Hα-helixtrans-67.3-38.3176.2-75.7174.4179.500111.9I646 S647 L648 T653 S654I646-E650 HydrophobicContact CG2-CG 4.32Å; I646-E650 WeakPolarHBondContact O-CB 3.24Å; I646-E650 VanDerWaalsContact O-CG 3.3Å; I646-E650 WeakPolarHBondContact O-CG 3.34Å; I646-E650 PolarHBondContact O-N 3Å; S647-E650 PolarHBondContact O-N 2.94Å; L648-E650 VanDerWaalsContact C-N 3.34Å; E650-T653 VanDerWaalsContact CA-OG1 3.24Å; E650-T653 WeakPolarHBondContact CA-OG1 3.2Å; E650-T653 PolarHBondContact O-OG1 2.95Å; E650-T653 VanDerWaalsContact O-OG1 3.13Å; E650-S654 VanDerWaalsContact O-CB 3.29Å; E650-S654 WeakPolarHBondContact O-CB 3.12Å; E650-S654 PolarHBondContact O-N 3.23Å; E650-S654 PolarHBondContact O-OG 2.96Å
651A31.7Very low34.6Very low50 Ų5085 Ų8541%0.41347%0.47SS..Hα-helixtrans-65.6-42.1172.200000111.1S647 L648 S654 F655S647-A651 VanDerWaalsContact O-CB 3.25Å; S647-A651 WeakPolarHBondContact O-CB 2.73Å; S647-A651 PolarHBondContact O-N 3.02Å; L648-A651 PolarHBondContact O-N 3.31Å; A651-S654 WeakPolarHBondContact CA-OG 3.49Å; A651-S654 PolarHBondContact O-OG 3.19Å; A651-F655 WeakPolarHBondContact O-CB 3.48Å; A651-F655 PolarHBondContact O-N 2.99Å
652L33.9Very low33.3Very low84 Ų8493.8 Ų93.844%0.4450%0.501SS..Hα-helixtrans-71.4-35.8175.6-86.4151.8000112.6L648 K649 F655 N656L648-L652 VanDerWaalsContact O-CB 3.27Å; L648-L652 WeakPolarHBondContact O-CB 3.34Å; L648-L652 WeakPolarHBondContact O-CD1 3.17Å; L648-L652 PolarHBondContact O-N 3.21Å; K649-L652 CarbonylContact O-C 3.54Å; K649-L652 PolarHBondContact O-N 3.4Å; L652-F655 PolarHBondContact O-N 3.46Å; L652-N656 WeakPolarHBondContact O-CB 3.5Å; L652-N656 VanDerWaalsContact O-CG 3.31Å; L652-N656 PolarHBondContact O-N 3.16Å; L652-N656 PolarHBondContact O-ND2 3.23Å
653T39.4Very low32.6Very low70 Ų7098.6 Ų98.643%0.42951%0.513SS..Hα-helixtrans-73.3-36.7175.655.20000111K649 E650 F655 N656 E657K649-T653 WeakPolarHBondContact O-CB 3.43Å; K649-T653 WeakPolarHBondContact O-CG2 3.43Å; K649-T653 PolarHBondContact O-N 3.03Å; K649-T653 PolarHBondContact O-OG1 3.47Å; E650-T653 VanDerWaalsContact CA-OG1 3.24Å; E650-T653 WeakPolarHBondContact CA-OG1 3.2Å; E650-T653 PolarHBondContact O-OG1 2.95Å; E650-T653 VanDerWaalsContact O-OG1 3.13Å; T653-F655 VanDerWaalsContact C-N 3.32Å; T653-N656 CarbonylContact O-C 3.55Å; T653-N656 PolarHBondContact O-N 2.66Å; T653-E657 WeakPolarHBondContact O-CB 3.45Å; T653-E657 WeakPolarHBondContact O-CG 3.39Å; T653-E657 PolarHBondContact O-N 3.32Å
654S36.9Very low31.9Very low66 Ų66101.7 Ų101.746%0.46253%0.525SS..Hα-helixtrans-67.8-33.6171.158.10000111.8E650 A651 S658E650-S654 VanDerWaalsContact O-CB 3.29Å; E650-S654 WeakPolarHBondContact O-CB 3.12Å; E650-S654 PolarHBondContact O-N 3.23Å; E650-S654 PolarHBondContact O-OG 2.96Å; A651-S654 WeakPolarHBondContact CA-OG 3.49Å; A651-S654 PolarHBondContact O-OG 3.19Å; S654-S658 WeakPolarHBondContact O-CB 3.29Å; S654-S658 PolarHBondContact O-N 2.99Å; S654-S658 PolarHBondContact O-OG 3.4Å
655F31.2Very low31.4Very low132 Ų132106.2 Ų106.258%0.57954%0.544SS*.Hα-helixtrans-66.1-40.8169.7-133-95.7000112.1A651 L652 T653 S658 T659A651-F655 WeakPolarHBondContact O-CB 3.48Å; A651-F655 PolarHBondContact O-N 2.99Å; L652-F655 PolarHBondContact O-N 3.46Å; T653-F655 VanDerWaalsContact C-N 3.32Å; F655-S658 PolarHBondContact O-OG 3.4Å; F655-T659 WeakPolarHBondContact O-CG2 3.18Å; F655-T659 PolarHBondContact O-N 3.38Å; F655-T659 PolarHBondContact O-OG1 2.97Å
656N28.9Very low30.7Very low90 Ų90111.8 Ų111.848%0.48157%0.569SS.*Hα-helixtrans-71.8-35.7175.8-77.6-21.1000112.3L652 T653 T659 V660L652-N656 WeakPolarHBondContact O-CB 3.5Å; L652-N656 VanDerWaalsContact O-CG 3.31Å; L652-N656 PolarHBondContact O-N 3.16Å; L652-N656 PolarHBondContact O-ND2 3.23Å; T653-N656 CarbonylContact O-C 3.55Å; T653-N656 PolarHBondContact O-N 2.66Å; N656-T659 WeakPolarHBondContact CA-OG1 3.31Å; N656-T659 PolarHBondContact O-N 3.02Å; N656-T659 PolarHBondContact O-OG1 3.49Å; N656-T659 VanDerWaalsContact O-OG1 3.09Å; N656-V660 WeakPolarHBondContact O-CB 3.32Å; N656-V660 WeakPolarHBondContact O-CG2 2.91Å; N656-V660 PolarHBondContact O-N 2.84Å
657E30.8Very low29.9Very low133 Ų133113.2 Ų113.262%0.62159%0.586SS**Hα-helixtrans-70.4-36.8176.2-78.9-178.7175.400111.3T653 T659 S661T653-E657 WeakPolarHBondContact O-CB 3.45Å; T653-E657 WeakPolarHBondContact O-CG 3.39Å; T653-E657 PolarHBondContact O-N 3.32Å; E657-T659 VanDerWaalsContact C-N 3.31Å; E657-T659 PolarHBondContact O-N 3.04Å; E657-S661 WeakPolarHBondContact O-CB 3.32Å; E657-S661 PolarHBondContact O-N 3.46Å; E657-S661 PolarHBondContact O-OG 2.98Å
658S31.7Very low29.3Very low62 Ų62119.5 Ų119.543%0.43461%0.605SS.*Hα-helixtrans-68.4-28.8174.572.90000113.1S654 F655S654-S658 WeakPolarHBondContact O-CB 3.29Å; S654-S658 PolarHBondContact O-N 2.99Å; S654-S658 PolarHBondContact O-OG 3.4Å; F655-S658 PolarHBondContact O-OG 3.4Å
659T28.8Very low28.6Very low70 Ų70123.8 Ų123.843%0.42962%0.623SS.*Hα-helixtrans-88.5-34177.548.60000113.2F655 N656 E657 R662F655-T659 WeakPolarHBondContact O-CG2 3.18Å; F655-T659 PolarHBondContact O-N 3.38Å; F655-T659 PolarHBondContact O-OG1 2.97Å; N656-T659 WeakPolarHBondContact CA-OG1 3.31Å; N656-T659 PolarHBondContact O-N 3.02Å; N656-T659 PolarHBondContact O-OG1 3.49Å; N656-T659 VanDerWaalsContact O-OG1 3.09Å; E657-T659 VanDerWaalsContact C-N 3.31Å; E657-T659 PolarHBondContact O-N 3.04Å; T659-R662 PolarHBondContact O-N 2.93Å
660V27.4Very low27.9Very low84 Ų84123 Ų12351%0.50963%0.63SS.*Hα-helixtrans-73.1-36.1173.8173.50000111N656 R662 R663 L664N656-V660 WeakPolarHBondContact O-CB 3.32Å; N656-V660 WeakPolarHBondContact O-CG2 2.91Å; N656-V660 PolarHBondContact O-N 2.84Å; V660-R662 PolarHBondContact O-N 2.6Å; V660-R663 PolarHBondContact O-N 2.99Å; V660-L664 HydrophobicContact CG1-CD1 4.29Å
661S24.5Very low27.5Very low73 Ų73122.6 Ų122.651%0.5164%0.638SS.*THydrogen-bonded Turntrans-64.4-24.5174.7-62.10000113E657E657-S661 WeakPolarHBondContact O-CB 3.32Å; E657-S661 PolarHBondContact O-N 3.46Å; E657-S661 PolarHBondContact O-OG 2.98Å
662R26.7Very low26.8Very low231 Ų231125.3 Ų125.387%0.87265%0.654SS**THydrogen-bonded Turntrans-78.4-15174.3-77.6-174.5-172-1774.6114.2T659 V660T659-R662 PolarHBondContact O-N 2.93Å; V660-R662 PolarHBondContact O-N 2.6Å
663R24.8Very low26.2Very low230 Ų230126.5 Ų126.587%0.86867%0.669SS**THydrogen-bonded Turntrans-103.2-12.1-177.8-80.4-172-178179.13115.6V660V660-R663 PolarHBondContact O-N 2.99Å
664L23.4Very low25.3Very low138 Ų138128.6 Ų128.672%0.72369%0.687SS**SBendtrans-114.92-173.3-86.2160.3000116.9V660 L666V660-L664 HydrophobicContact CG1-CD1 4.29Å; L664-L666 PolarHBondContact O-N 3.38Å
665H24.6Very low24.6Very low170 Ų170130 Ų13079%0.78770%0.702SS**  trans-9562.1170.5-79.6-62.7000112.8
666L21.8Very low24Very low164 Ų164127.8 Ų127.886%0.85971%0.708SS**  trans-130.9119.1151.9-99116.9000108.8L664L664-L666 PolarHBondContact O-N 3.38Å
667S21.2Very low23.6Very low110 Ų110131.3 Ų131.377%0.76973%0.726SS**SBendtrans103.9123.1163.783.60000118.5
668K22.4Very low23Very low201 Ų201129.5 Ų129.587%0.87472%0.724SS**  trans99.293154.8-60.8-174.8-179.7178.80119.1
669Q18.8Very low22.4Very low179 Ų179132.5 Ų132.584%0.83673%0.734SS**  trans-15.5132.8145.9-69.5171.2-22.100118.6
670T20.5Very low22Very low129 Ų129138.2 Ų138.279%0.79176%0.756SS**  45.3158.3129.867.90000121.9
671P27.4Very low21.6Very low109 Ų109138.6 Ų138.671%0.70876%0.762SS**  cis-136.4170.9140-21.4000117
672S18.1Very low21.5Very low107 Ų107138.9 Ų138.975%0.74878%0.776SS**  trans33.3126.7141.568.60000123
673S21.2Very low21.3Very low108 Ų108136.3 Ų136.376%0.75577%0.774SS**  175.1120.611360.30000113.3
674S19.8Very low21Very low115 Ų115133.7 Ų133.780%0.80478%0.776SS**  trans17.5125.6139.3580000122.1
675A22.2Very low20.8Very low96 Ų96133 Ų13379%0.79378%0.778SS**  175.5106.6129.100000107.9
676A19.4Very low20.5Very low84 Ų84130.3 Ų130.369%0.69478%0.778SS**  80.1118.168.700000114.5
677L19.1Very low20.4Very low164 Ų164127.7 Ų127.786%0.85977%0.774SS**  trans76145.7141.9-61.3155.6000116.6
678T18.9Very low20.2Very low96 Ų96129.3 Ų129.359%0.58977%0.772SS**  cis178.7138.8-1-90.30000108.6
679I19.1Very low20Very low125 Ų125125.9 Ų125.964%0.64177%0.772SS**  trans31129.4139.4-50.5168.2000118.8
680H21.1Very low20Very low190 Ų190127.5 Ų127.588%0.8877%0.772SS**  -152.7116.5120.6-102.1-64.1000113.1
681S19.3Very low20Very low91 Ų91125.1 Ų125.164%0.63677%0.773SS**  trans-72.4138.5166.142.20000111.3
682G22.4Very low19.5Very low79 Ų79127.5 Ų127.581%0.81478%0.775SS**  trans-122.1115.5169.400000110
683H21Very low19.6Very low178 Ų178129.4 Ų129.482%0.82478%0.777SS**  trans-68.6138.8-174-91-88.3000114.1
684L19.3Very low19.7Very low174 Ų174132 Ų13291%0.91178%0.782SS**  trans-78.9134.5160.3-83.8143.8000110.4
685T19Very low19.7Very low123 Ų123132.7 Ų132.776%0.75578%0.782SS**  trans-127.2113.9169.450.40000111.5
686S17.6Very low19.8Very low115 Ų115135.4 Ų135.480%0.80478%0.783SS**  trans31.2127.4136.763.20000122.8
687S20.1Very low20Very low109 Ų109139.5 Ų139.576%0.76279%0.793SS**  trans169101.1141.2154.50000106.4
688I17.6Very low20.1Very low144 Ų144143.1 Ų143.174%0.73880%0.795SS**  34.9110.180.3-53.3177.5000113.5
689C18.9Very low20.2Very low129 Ų129145.8 Ų145.887%0.87281%0.806SS**  trans-164.8141.6134.5-95.90000111
690Y18Very low20.4Very low212 Ų212151.9 Ų151.983%0.83182%0.821SS**  trans-71.1160.3-175.3-85.2-107.8000114.4
691G20Very low20.5Very low79 Ų79147.8 Ų147.881%0.81482%0.82SS**  trans-166.288.9162.900000109.9
692E17.5Very low20.6Very low160 Ų160154.7 Ų154.775%0.74883%0.832SS**  trans-68.4168.4163.5-69.1175.4146.600110.5
693D20.8Very low20.6Very low147 Ų147157.9 Ų157.979%0.78683%0.831SS**  trans98.796.1170.5-56.2-24000116.1
694D23.5Very low20.7Very low161 Ų161158.1 Ų158.186%0.86184%0.837SS**  -176.1101.7101.7-97.8-29.3000111.1N696D694-N696 PolarHBondContact O-N 3.1Å
695T19.8Very low20.7Very low131 Ų131155.9 Ų155.980%0.80483%0.83SS**  trans-75.4106.716047.40000109
696N22.6Very low20.8Very low153 Ų153154.7 Ų154.782%0.81883%0.827SS**  trans-176.485.4151.3-94.1-26.4000111.2D694D694-N696 PolarHBondContact O-N 3.1Å
697D24Very low20.9Very low170 Ų170157.5 Ų157.591%0.90983%0.832SS**  trans-165.256.3142.1-105.4-23000111.2
698R20.8Very low20.9Very low239 Ų239158.2 Ų158.290%0.90283%0.832SS**  trans-102.785.5156.9-87.5-177.2169.1167.5-1.3107
699N22.4Very low20.9Very low153 Ų153155.9 Ų155.982%0.81883%0.833SS**  trans174.376.5152.4-87.6-24.4000111.4
700R22.9Very low21Very low252 Ų252156.3 Ų156.395%0.95183%0.832SS**SBendtrans-163.2137.8148-107.3156.8-170.1-166.23.8109.5
701A23.9Very low21Very low104 Ų104151.5 Ų151.586%0.8683%0.829SS**  trans81.340.517900000117.7
702R20.2Very low21.1Very low237 Ų237153.2 Ų153.289%0.89483%0.829SS**  trans-83.6108.2132.5-82.6-178.8175.7157.8-1.4106.6
703N22.9Very low21.1Very low146 Ų146153.6 Ų153.678%0.78183%0.833SS**  trans163.592.2152.2-84.7-14.3000109.1
704L22.4Very low21.1Very low183 Ų183155.3 Ų155.396%0.95884%0.836SS**  trans-175.872.2144.5-100.5140.3000108.2
705T19.5Very low20.9Very low126 Ų126154.3 Ų154.377%0.77383%0.83SS**  trans-79.8140.7160.635.80000110.1
706S20.6Very low21Very low98 Ų98157.4 Ų157.469%0.68584%0.838SS**  trans62.6100.2150.966.60000119.1
707I21Very low20.8Very low175 Ų175155.1 Ų155.190%0.89783%0.83SS**  trans-127107.6132.5-61.7-179.1000107.3
708T19.1Very low20.6Very low124 Ų124154 Ų15476%0.76182%0.824SS**  trans-75.3150.8172.936.20000111.6
709A18.3Very low20.7Very low94 Ų94149.4 Ų149.478%0.77782%0.822SS**  trans-42.3143171.200000116
710T20.7Very low20.6Very low139 Ų139145.9 Ų145.985%0.85381%0.814SS**  trans-143.6124.5142.144.40000110.3
711S18.6Very low20.4Very low110 Ų110140.3 Ų140.377%0.76981%0.808SS**  trans-66.5144.8167.852.20000113.4
712S21Very low20.4Very low116 Ų116140.4 Ų140.481%0.81180%0.8SS**  trans-161.291.6151.2-44.70000108.3
713M18.2Very low20.4Very low167 Ų167135.9 Ų135.982%0.82380%0.798SS**  4.4125.3113.3-79.3176.878.600116.9
714E20.6Very low20.3Very low184 Ų184137.1 Ų137.186%0.8680%0.799SS**  trans174.4104.3131.3-95.1169.4-168.400107.9
715L19.6Very low20.1Very low140 Ų140137 Ų13773%0.73379%0.793SS**  47.993.690.7-82161000114.1
716M21.1Very low20.2Very low196 Ų196136.6 Ų136.697%0.96680%0.796SS**  trans-129.3115.2146.1-85.7-145.7166.900111
717T18.9Very low20.2Very low105 Ų105140.6 Ų140.664%0.64480%0.803SS**  trans-81.4156.3173.542.80000112.6
718N20.5Very low20.6Very low146 Ų146136.5 Ų136.578%0.78179%0.788SS**  trans74.8108.5146.8-63.7-15.6000120.3
719V22.5Very low20.7Very low143 Ų143136.6 Ų136.687%0.86779%0.791SS**  trans-157.198.7130.6-176.10000106.3
720A19.6Very low20.7Very low79 Ų79137.2 Ų137.265%0.65379%0.785SS**  57.5105.782.300000116
721T20.3Very low20.6Very low135 Ų135135 Ų13583%0.82878%0.775SS**  trans39.2147.2139.355.10000121.1
722P22.7Very low20.8Very low106 Ų106137.1 Ų137.169%0.68878%0.777SS**  cis-141.3155.337.135.4-14.3000116.8
723V19.6Very low21Very low142 Ų142136.1 Ų136.186%0.86177%0.768SS**  trans-95109.7165.2175.20000106.9
724H21.5Very low21Very low171 Ų171133 Ų13379%0.79276%0.761SS**  trans-109.5129.6169.1-103.5-69.4000109.9
725H19.5Very low21Very low181 Ų181131.3 Ų131.384%0.83876%0.758SS**  trans-60.8134.7172.1-71.2-84.6000113.2
726S21.7Very low21Very low118 Ų118132.5 Ų132.583%0.82577%0.765SS**  trans-163.5107.2145.147.30000111.8
727H20.3Very low21Very low181 Ų181130.6 Ų130.684%0.83875%0.754SS**  trans-74.4178.2147.4-78.4-74.7000108.9
728P28.5Very low21Very low90 Ų90130.6 Ų130.658%0.58476%0.758SS**  -127.4-171.8-52.537.5-21000110.2T730P728-T730 HydrophobicContact CG-CG2 4.33Å
729P20.4Very low21.1Very low125 Ų125132.6 Ų132.681%0.81276%0.76SS**  -126.2108.9125.430.6-19.6000108.1
730T19Very low20.9Very low107 Ų107132.4 Ų132.466%0.65675%0.754SS**  31.993.977.140.10000115.9P728P728-T730 HydrophobicContact CG-CG2 4.33Å
731S19.2Very low21Very low93 Ų93136.9 Ų136.965%0.6576%0.761SS**  78144.1114.8720000120.6
732L21.8Very low21Very low154 Ų154135.5 Ų135.581%0.80675%0.753SS**  trans111.5155149.3-64157.1000114.6
733P25.7Very low20.9Very low96 Ų96136.4 Ų136.462%0.62376%0.757SS**  -137.7-165.9-83.534.9-11.8000111.1
734C18.9Very low21Very low101 Ų101135.1 Ų135.168%0.68275%0.753SS**  trans66.9117149-64.60000117.6
735D20.9Very low21Very low148 Ų148136.7 Ų136.779%0.79176%0.761SS**  -168129.581.1-89.5-40.3000111.3E737D735-E737 PolarHBondContact O-N 3.11Å
736N18.3Very low21.3Very low165 Ų165132.4 Ų132.488%0.88275%0.748SS**  trans-76.1105.3162.4-80.8-31.9000107.2
737E21.4Very low21.7Very low157 Ų157131.1 Ų131.173%0.73474%0.736SS**  trans-10795.7157.4-75.5-164.5161.200109.5D735 F739D735-E737 PolarHBondContact O-N 3.11Å; E737-F739 PolarHBondContact O-N 3.38Å; E737-F739 VanDerWaalsContact O-N 3.1Å
738S18.9Very low22Very low105 Ų105127.4 Ų127.473%0.73472%0.722SS**  trans-58.4100.4161.150.60000110.1N740S738-N740 VanDerWaalsContact C-N 3.34Å; S738-N740 PolarHBondContact O-N 3.3Å
739F21.9Very low22Very low187 Ų187129.7 Ų129.782%0.8273%0.729SS**  trans-82.485.6159.4-90.3-88000109.2E737E737-F739 PolarHBondContact O-N 3.38Å; E737-F739 VanDerWaalsContact O-N 3.1Å
740N18.3Very low22.6Very low139 Ų139128.9 Ų128.974%0.74372%0.718SS**  trans-83.3113.7154.3-86.8-25.8000107.4S738S738-N740 VanDerWaalsContact C-N 3.34Å; S738-N740 PolarHBondContact O-N 3.3Å
741H22.4Very low23.3Very low173 Ų173126 Ų12680%0.80170%0.7SS**  trans-163.8101.6138.9-100.9-61.6000110.6
742T19.7Very low24.4Very low107 Ų107123.4 Ų123.466%0.65668%0.68SS**  trans46.6100.7130.548.90000118.7
743T20.4Very low25.8Very low125 Ų125118.7 Ų118.777%0.76766%0.66SS**  39.997124.656.30000117.7
744C22.6Very low27.1Very low115 Ų115115.7 Ų115.778%0.77764%0.644SS**  trans-142.587.7138.8-87.60000106.9T746C744-T746 HydrophobicContact CB-CG2 4.45Å; C744-T746 PolarHBondContact O-N 3.33Å
745E21Very low28.7Very low203 Ų203111.1 Ų111.195%0.94961%0.612SS**  trans-68.685.2165.2-69.8-178.1162.600107.9
746T26.1Very low30.5Very low92 Ų92107.4 Ų107.456%0.56459%0.59SS**  trans-96154.4168.154.40000109.5C744 I748C744-T746 HydrophobicContact CB-CG2 4.45Å; C744-T746 PolarHBondContact O-N 3.33Å; T746-I748 PolarHBondContact O-N 3.37Å
747P29.3Very low32.4Very low91 Ų91102.8 Ų102.859%0.59157%0.57SS**SBendtrans-82.260.5-153.735.5-35.9000112.6N749 N750P747-N749 PolarHBondContact O-N 3.24Å; P747-N750 PolarHBondContact O-N 3.31Å
748I27.1Very low34.1Very low103 Ų10399.7 Ų99.753%0.52856%0.555SS.*THydrogen-bonded Turntrans-74.4-18.3173.1-63175.6000110.8T746 N750T746-I748 PolarHBondContact O-N 3.37Å; I748-N750 VanDerWaalsContact C-N 3.3Å; I748-N750 PolarHBondContact O-N 3.25Å
749N28.5Very low36Very low138 Ų13895.7 Ų95.774%0.73852%0.524SS*.Hα-helixtrans-75.9-11.4174.2-73.8-15.2000114.3P747 T752 S753P747-N749 PolarHBondContact O-N 3.24Å; N749-T752 PolarHBondContact O-OG1 3.05Å; N749-S753 WeakPolarHBondContact O-CB 3.25Å
750N32.7Very low37Very low107 Ų10796.7 Ų96.757%0.57252%0.522SS*.Hα-helixtrans-87.8-20.4177.2-73.5-9.4000113.2P747 I748 S753 A754P747-N750 PolarHBondContact O-N 3.31Å; I748-N750 VanDerWaalsContact C-N 3.3Å; I748-N750 PolarHBondContact O-N 3.25Å; N750-S753 WeakPolarHBondContact CA-OG 3.3Å; N750-S753 PolarHBondContact O-OG 2.72Å; N750-A754 PolarHBondContact O-N 3.03Å
751V35.3Very low37.7Very low48 Ų4897.4 Ų97.429%0.29153%0.526SS..Hα-helixtrans-81-42.8-174.8-177.90000110.9A515 T518 S753 A754A515-V751 HydrophobicContact CB-CG1 3.35Å; T518-V751 WeakPolarHBondContact OG1-CG1 3.46Å; V751-S753 VanDerWaalsContact C-N 3.31Å; V751-A754 PolarHBondContact O-N 3.13Å
752T41.7Very low38Very low38 Ų3892 Ų9223%0.23351%0.508CS..Hα-helixtrans-61.8-41.2167.543.90000110.9E519 N749 A754 H756E519-T752 VanDerWaalsContact CD-CG2 3.49Å; E519-T752 HydrophobicContact CG-CG2 4.4Å; E519-T752 WeakPolarHBondContact OE1-CG2 2.95Å; N749-T752 PolarHBondContact O-OG1 3.05Å; T752-A754 VanDerWaalsContact C-N 3.31Å; T752-A754 PolarHBondContact O-N 2.88Å; T752-H756 VanDerWaalsContact O-CB 3.27Å; T752-H756 WeakPolarHBondContact O-CB 3.27Å; T752-H756 PolarHBondContact O-CD2 2.8Å; T752-H756 PolarHBondContact O-N 3.31Å
753S50.8Low38.3Very low54 Ų5491.5 Ų91.538%0.37851%0.506SS..Hα-helixtrans-67-28.717884.40000112.6N749 N750 V751 S757N749-S753 WeakPolarHBondContact O-CB 3.25Å; N750-S753 WeakPolarHBondContact CA-OG 3.3Å; N750-S753 PolarHBondContact O-OG 2.72Å; V751-S753 VanDerWaalsContact C-N 3.31Å; S753-S757 VanDerWaalsContact O-CA 3.3Å; S753-S757 WeakPolarHBondContact O-CA 3.43Å; S753-S757 WeakPolarHBondContact O-CB 3.42Å; S753-S757 PolarHBondContact O-N 3.45Å; S753-S757 PolarHBondContact O-OG 3.39Å
754A52.3Low38.5Very low34 Ų3492.9 Ų92.928%0.28152%0.515SS..Hα-helixtrans-63.6-52.7176.800000112.1N750 V751 T752 S757 K758N750-A754 PolarHBondContact O-N 3.03Å; V751-A754 PolarHBondContact O-N 3.13Å; T752-A754 VanDerWaalsContact C-N 3.31Å; T752-A754 PolarHBondContact O-N 2.88Å; A754-S757 PolarHBondContact O-OG 2.88Å; A754-S757 VanDerWaalsContact O-OG 3.05Å; A754-K758 PolarHBondContact O-N 2.67Å
755V54Low38.6Very low4 Ų491.3 Ų91.32%0.02450%0.502CS..Hα-helixtrans-68.3-44.4178.2-1600000110.4W484 L500 F504 A515 S757 F759W484-V755 HydrophobicContact CE3-CG1 3.71Å; W484-V755 HydrophobicContact CH2-CB 4.25Å; W484-V755 HydrophobicContact CH2-CG1 3.89Å; W484-V755 HydrophobicContact CZ3-CB 3.96Å; W484-V755 HydrophobicContact CZ3-CG1 3.19Å; L500-V755 HydrophobicContact CD2-CG1 4.39Å; F504-V755 HydrophobicContact CE2-CG1 4.39Å; A515-V755 HydrophobicContact CB-CG2 3.49Å; A515-V755 VanDerWaalsContact CB-CG2 3.49Å; V755-S757 PolarHBondContact O-N 3.29Å; V755-F759 HydrophobicContact CG1-CD2 4.38Å; V755-F759 HydrophobicContact CG1-CE2 4.23Å; V755-F759 VanDerWaalsContact O-CD2 3.28Å; V755-F759 WeakPolarHBondContact O-CD2 2.92Å
756H58.6Low38.8Very low71 Ų7187 Ų8733%0.32949%0.493SS..Hα-helixtrans-67-33.6178.1-76.9-69.9000113.7W484 T752 R760W484-H756 HydrophobicContact CH2-CB 4.38Å; W484-H756 AromaticContact CH2-CE1 3.54Å; W484-H756 AromaticContact CH2-CG 3.74Å; W484-H756 AromaticContact CH2-ND1 3.27Å; W484-H756 VanDerWaalsContact CH2-ND1 3.27Å; W484-H756 WeakPolarHBondContact CH2-ND1 3.4Å; W484-H756 AromaticContact CZ2-CE1 3.89Å; W484-H756 AromaticContact CZ2-ND1 3.34Å; W484-H756 VanDerWaalsContact CZ2-ND1 3.34Å; W484-H756 WeakPolarHBondContact CZ2-ND1 3.39Å; T752-H756 VanDerWaalsContact O-CB 3.27Å; T752-H756 WeakPolarHBondContact O-CB 3.27Å; T752-H756 PolarHBondContact O-CD2 2.8Å; T752-H756 PolarHBondContact O-N 3.31Å; H756-R760 WeakPolarHBondContact O-CA 3.34Å; H756-R760 WeakPolarHBondContact O-CB 2.88Å; H756-R760 VanDerWaalsContact O-CG 3.32Å; H756-R760 WeakPolarHBondContact O-CG 3.39Å; H756-R760 PolarHBondContact O-N 3Å
757S57.7Low39Very low67 Ų6788.6 Ų88.647%0.46950%0.503SS..Hα-helixtrans-71.7-37.1-179.7630000111.8S753 A754 V755 F759 R760S753-S757 VanDerWaalsContact O-CA 3.3Å; S753-S757 WeakPolarHBondContact O-CA 3.43Å; S753-S757 WeakPolarHBondContact O-CB 3.42Å; S753-S757 PolarHBondContact O-N 3.45Å; S753-S757 PolarHBondContact O-OG 3.39Å; A754-S757 PolarHBondContact O-OG 2.88Å; A754-S757 VanDerWaalsContact O-OG 3.05Å; V755-S757 PolarHBondContact O-N 3.29Å; S757-F759 PolarHBondContact O-N 3.48Å; S757-R760 PolarHBondContact O-N 3.32Å
758K57.8Low38.7Very low93 Ų9389.4 Ų89.440%0.40450%0.502SS..Hα-helixtrans-62.1-32.7177.8-156.7168.2-169.61630112.1E509 E512 A754E509-K758 VanDerWaalsContact CD-NZ 3.29Å; E509-K758 IonicContact OE1-NZ 3.23Å; E509-K758 IonicContact OE2-NZ 3.28Å; E509-K758 PolarHBondContact OE2-NZ 3.18Å; E512-K758 HydrophobicContact CG-CD 4.25Å; E512-K758 IonicContact OE1-NZ 2.58Å; E512-K758 PolarHBondContact OE1-NZ 2.56Å; A754-K758 PolarHBondContact O-N 2.67Å
759F57.4Low38.5Very low21 Ų2191.2 Ų91.29%0.09251%0.513CS..Hα-helixtrans-105.7-7.2179-60.4-73000115.1K480 K481 W484 F504 V755 S757 N761 S762K480-F759 HydrophobicContact CB-CZ 4.25Å; K481-F759 HydrophobicContact CG-CE1 4.39Å; W484-F759 HydrophobicContact CB-CD1 4.3Å; W484-F759 HydrophobicContact CB-CD2 4.13Å; W484-F759 HydrophobicContact CB-CE1 4.18Å; W484-F759 HydrophobicContact CB-CE2 4.01Å; W484-F759 HydrophobicContact CB-CG 4.28Å; W484-F759 HydrophobicContact CB-CZ 4.04Å; W484-F759 AromaticContact CD1-CD1 3.95Å; W484-F759 AromaticContact CD1-CD2 3.92Å; W484-F759 AromaticContact CD1-CG 3.54Å; W484-F759 HydrophobicContact CD2-CB 4.08Å; W484-F759 AromaticContact CD2-CD2 3.31Å; W484-F759 HydrophobicContact CD2-CD2 3.31Å; W484-F759 AromaticContact CD2-CE2 3.85Å; W484-F759 HydrophobicContact CD2-CE2 3.85Å; W484-F759 AromaticContact CD2-CG 3.78Å; W484-F759 HydrophobicContact CD2-CG 3.78Å; W484-F759 AromaticContact CE2-CD2 3.61Å; W484-F759 AromaticContact CE2-CG 3.79Å; W484-F759 AromaticContact CE3-CD2 3.72Å; W484-F759 HydrophobicContact CE3-CD2 3.72Å; W484-F759 AromaticContact CE3-CE2 3.97Å; W484-F759 HydrophobicContact CE3-CE2 3.97Å; W484-F759 HydrophobicContact CG-CB 4.05Å; W484-F759 HydrophobicContact CG-CD1 4.02Å; W484-F759 AromaticContact CG-CD2 3.51Å; W484-F759 HydrophobicContact CG-CD2 3.51Å; W484-F759 HydrophobicContact CG-CE1 4.35Å; W484-F759 AromaticContact CG-CE2 3.89Å; W484-F759 HydrophobicContact CG-CE2 3.89Å; W484-F759 AromaticContact CG-CG 3.59Å; W484-F759 HydrophobicContact CG-CG 3.59Å; W484-F759 HydrophobicContact CG-CZ 4.3Å; W484-F759 HydrophobicContact CH2-CD2 4.47Å; W484-F759 HydrophobicContact CZ2-CB 4.09Å; W484-F759 HydrophobicContact CZ2-CD2 4.16Å; W484-F759 HydrophobicContact CZ3-CD2 4.31Å; W484-F759 AromaticContact NE1-CD2 3.97Å; W484-F759 AromaticContact NE1-CG 3.66Å; F504-F759 HydrophobicContact CZ-CE2 4.09Å; F504-F759 HydrophobicContact CZ-CZ 4.25Å; V755-F759 HydrophobicContact CG1-CD2 4.38Å; V755-F759 HydrophobicContact CG1-CE2 4.23Å; V755-F759 VanDerWaalsContact O-CD2 3.28Å; V755-F759 WeakPolarHBondContact O-CD2 2.92Å; S757-F759 PolarHBondContact O-N 3.48Å; F759-N761 PolarHBondContact O-N 3.48Å; F759-N761 VanDerWaalsContact O-N 3.13Å; F759-S762 PolarHBondContact O-N 3.49Å; F759-S762 VanDerWaalsContact O-N 3.09Å; F759-S762 PolarHBondContact O-OG 3.23Å
760R42.8Very low38.3Very low207 Ų20790.7 Ų90.778%0.78151%0.509SS*.Hα-helixtrans-60.7-23.8179.6-110-178.7-177.4-173.62.1114H756 S757H756-R760 WeakPolarHBondContact O-CA 3.34Å; H756-R760 WeakPolarHBondContact O-CB 2.88Å; H756-R760 VanDerWaalsContact O-CG 3.32Å; H756-R760 WeakPolarHBondContact O-CG 3.39Å; H756-R760 PolarHBondContact O-N 3Å; S757-R760 PolarHBondContact O-N 3.32Å
761N33.6Very low37.9Very low154 Ų15492.1 Ų92.182%0.82452%0.516SS*.THydrogen-bonded Turntrans-95.36179.5-68.8-14.4000113.8F759F759-N761 PolarHBondContact O-N 3.48Å; F759-N761 VanDerWaalsContact O-N 3.13Å
762S28.9Very low37.4Very low60 Ų6096.9 Ų96.942%0.4254%0.54SS..SBendtrans-90.1118.8171.661.30000110.2F759 T764F759-S762 PolarHBondContact O-N 3.49Å; F759-S762 VanDerWaalsContact O-N 3.09Å; F759-S762 PolarHBondContact O-OG 3.23Å; S762-T764 PolarHBondContact O-N 3.3Å
763P25.6Very low36.5Very low96 Ų96101.9 Ų101.962%0.62357%0.565SS**  trans-62.9132.2-179.725.2-31.9000110.3T765P763-T765 PolarHBondContact O-N 2.8Å; P763-T765 VanDerWaalsContact O-N 3.08Å
764T25.6Very low35.2Very low154 Ų154106.1 Ų106.195%0.94558%0.583SS**  trans-7317.5173.741.30000113.1S762S762-T764 PolarHBondContact O-N 3.3Å
765T23.8Very low33.8Very low82 Ų82111.1 Ų111.150%0.50361%0.606SS.*SBendtrans-80.4145171.5480000109.5P763 V767P763-T765 PolarHBondContact O-N 2.8Å; P763-T765 VanDerWaalsContact O-N 3.08Å; T765-V767 PolarHBondContact O-N 3.05Å; T765-V767 VanDerWaalsContact O-N 3.14Å
766C25.8Very low32.3Very low114 Ų114118 Ų11877%0.7764%0.642SS**SBendtrans-40125.8170.1-68.60000108.3D768C766-D768 PolarHBondContact O-N 2.72Å
767V29.7Very low30.7Very low125 Ų125122.2 Ų122.276%0.75867%0.667SS**  trans-39.7105.8-179.31750000107.5T765 N769T765-V767 PolarHBondContact O-N 3.05Å; T765-V767 VanDerWaalsContact O-N 3.14Å; V767-N769 PolarHBondContact O-N 3.22Å
768D23.6Very low29.1Very low108 Ų108125.6 Ų125.658%0.57868%0.68SS**  trans-53.8143.8-176.7-79.1-53.9000107.6C766 I770C766-D768 PolarHBondContact O-N 2.72Å; D768-I770 PolarHBondContact O-N 3.22Å
769N23.2Very low27.5Very low141 Ų141128.3 Ų128.375%0.75470%0.699SS**  trans-55.482163.9-79.5-31.9000108.2V767 N771V767-N769 PolarHBondContact O-N 3.22Å; N769-N771 PolarHBondContact O-N 2.75Å
770I24.5Very low25.9Very low127 Ų127133.8 Ų133.865%0.65173%0.729SS**  trans-70.894.3165.6-65.4175.3000103.5D768 D772D768-I770 PolarHBondContact O-N 3.22Å; I770-D772 PolarHBondContact O-N 3.02Å
771N22.8Very low25.1Very low137 Ų137130.4 Ų130.473%0.73373%0.731SS**  trans-52.194.1156.3-82.6-30.8000106.9N769 N773N769-N771 PolarHBondContact O-N 2.75Å; N771-N773 PolarHBondContact O-N 2.62Å
772D26.2Very low24.7Very low147 Ų147130 Ų13079%0.78673%0.725SS**  trans-69.265.9161-80.5-25.4000108.6I770 N774I770-D772 PolarHBondContact O-N 3.02Å; D772-N774 VanDerWaalsContact C-N 3.31Å
773N22.3Very low24.3Very low143 Ų143135.4 Ų135.477%0.76575%0.748SS**  trans-92.574.1151.1-92.5-15.4000106.1N771N771-N773 PolarHBondContact O-N 2.62Å
774N22.5Very low24.2Very low143 Ų143139.2 Ų139.277%0.76576%0.757SS**  trans-148.1112.9158-99-23.8000110.6D772D772-N774 VanDerWaalsContact C-N 3.31Å
775N24.1Very low24.2Very low140 Ų140137.6 Ų137.675%0.74975%0.747SS**  trans72.990.8162-63.6-17.5000118N777N775-N777 PolarHBondContact O-N 3.3Å; N775-N777 VanDerWaalsContact O-N 3.09Å
776N22.9Very low24.2Very low148 Ų148142.3 Ų142.379%0.79177%0.769SS**  14.788.8107-79.5-12.1000113.7
777N24.3Very low23.9Very low159 Ų159141.3 Ų141.385%0.8576%0.763SS**  trans-127.6100.8140.8-97-19.5000106.9N775 N779N775-N777 PolarHBondContact O-N 3.3Å; N775-N777 VanDerWaalsContact O-N 3.09Å; N777-N779 PolarHBondContact O-N 3.18Å
778N23.5Very low23.5Very low138 Ų138141 Ų14174%0.73877%0.766SS**  trans-43.7110.7163.6-74.8-31.4000109.4
779N25.5Very low23.5Very low150 Ų150144.3 Ų144.380%0.80278%0.778SS**  trans-135.383.2145.8-89.6-22.5000106.3N777 V781N777-N779 PolarHBondContact O-N 3.18Å; N779-V781 VanDerWaalsContact C-N 3.25Å; N779-V781 PolarHBondContact O-N 3.24Å
780N22.6Very low23.5Very low137 Ų137146.8 Ų146.873%0.73379%0.785SS**  trans-50.797.1151.8-84.1-23.9000107.5Q782N780-Q782 VanDerWaalsContact C-N 3.27Å; N780-Q782 PolarHBondContact O-N 2.67Å
781V27.1Very low23.5Very low136 Ų136144.1 Ų144.182%0.82479%0.789SS**  trans-89.586.2153.8-177.80000104.7N779 L783N779-V781 VanDerWaalsContact C-N 3.25Å; N779-V781 PolarHBondContact O-N 3.24Å; V781-L783 PolarHBondContact O-N 3.39Å
782Q23.4Very low23.5Very low146 Ų146145.5 Ų145.568%0.68280%0.796SS**  trans-54.2133.3166.8-80.4173.6-30.200108.4N780 E784N780-Q782 VanDerWaalsContact C-N 3.27Å; N780-Q782 PolarHBondContact O-N 2.67Å; Q782-E784 VanDerWaalsContact C-N 3.29Å; Q782-E784 PolarHBondContact O-N 2.74Å
783L22.5Very low23.6Very low172 Ų172148 Ų14890%0.90180%0.803SS**  trans-57.994.1162.7-83.6119.1000108.3V781 T785V781-L783 PolarHBondContact O-N 3.39Å; L783-T785 PolarHBondContact O-N 3.2Å; L783-T785 VanDerWaalsContact O-N 3.13Å
784E23.3Very low23.5Very low176 Ų176146.2 Ų146.282%0.82280%0.802SS**  trans-7599.4165.6-79.1-176.7166.200108.6Q782 L786Q782-E784 VanDerWaalsContact C-N 3.29Å; Q782-E784 PolarHBondContact O-N 2.74Å; E784-L786 PolarHBondContact O-N 3.06Å
785T24.4Very low23.7Very low121 Ų121148 Ų14874%0.74281%0.808SS**  trans-52.4116.7157.7410000109.8L783 S787L783-T785 PolarHBondContact O-N 3.2Å; L783-T785 VanDerWaalsContact O-N 3.13Å; T785-S787 PolarHBondContact O-N 2.73Å
786L23.6Very low23.6Very low181 Ų181144.4 Ų144.495%0.94880%0.804SS**  trans-58.1102.1171.3-72.8160.6000110.8E784E784-L786 PolarHBondContact O-N 3.06Å
787S20.3Very low23.8Very low93 Ų93148.1 Ų148.165%0.6581%0.808SS**  trans-153108160.440.10000111.2T785T785-S787 PolarHBondContact O-N 2.73Å
788S21.9Very low23.7Very low117 Ų117146 Ų14682%0.81881%0.806SS**  trans62.5106.4147.763.10000121.3
789E23.7Very low23.9Very low179 Ų179142.7 Ų142.784%0.83681%0.805SS**  trans-141.9112.4142.3-78.1-168.9161.400106.7
790Q22.5Very low23.9Very low193 Ų193142.3 Ų142.390%0.90280%0.802SS**  81.5133.788.2-81.3-168.1-9.600115.1
791G24.9Very low23.8Very low71 Ų71144 Ų14473%0.73281%0.806SS**  trans125.576.7171.300000112.3
792D21.7Very low24.4Very low166 Ų166148.1 Ų148.189%0.88883%0.831SS**  48.490.290.2-80.4-19.7000114.5
793E27.9Very low24.5Very low199 Ų199148.2 Ų148.293%0.9384%0.839SS**  trans-137.5109.2142.4-79.6-164.3160.300110.3
794S21.8Very low24.6Very low106 Ų106146.9 Ų146.974%0.74184%0.836SS**  trans-71.5159.216654.30000112.8
795M25Very low24.6Very low181 Ų181145.3 Ų145.389%0.89284%0.836SS**  trans107104.7170.2-61.2-145.1-149.700111.4
796G22.7Very low24.6Very low64 Ų64146.8 Ų146.866%0.6684%0.842SS**  90.8100.950.100000108
797Y26.9Very low24.7Very low226 Ų226144.6 Ų144.689%0.88684%0.835SS**  173.9115.3128.9-98-73.9000109.7
798S22.8Very low25Very low115 Ų115148.1 Ų148.180%0.80485%0.848SS**  trans-51.4138.7161.3490000112.4
799G27.1Very low25.2Very low68 Ų68150.3 Ų150.370%0.70185%0.85SS**  trans-15897.8167.700000111.5
800N24.8Very low25.4Very low141 Ų141148.1 Ų148.175%0.75485%0.851SS**  trans43.5115.2136.5-677.1000119.7
801E22Very low25.6Very low174 Ų174144.3 Ų144.381%0.81385%0.846SS**  69100.998.4-69.3-177.9158.800113.9
802T39.4Very low25.7Very low221 Ų221151 Ų151100%1.35686%0.857SS**  -167.10102.539.30000109.1

Retrieved 802 of 802 residues in 730.2 ms (Link to these results)

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