A0A5K4F1T1_SCHMA Loading...

Innexin AlphaSync

Structural component of the gap junctions.

AlphaFold DB , UniProt , Accession A0A5K4F1T1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene inx, Length 609 aa.

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

 

Download Structure   AlphaSync Parameters   PDB   PAE   Table  
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
1M44.9Very low57.6Low212 Ų212115.9 Ų115.9100%1.04461%0.612SS**  0113.20-73.6-176.4178.200106.8T3 F6M1-T3 PolarHBondContact O-N 3.32Å; M1-F6 HydrophobicContact CB-CE2 4.21Å
2D64.2Low57.1Low125 Ų125117.8 Ų117.867%0.66861%0.612SS**  trans-68.5125.2-163.2-54.8-43.3000111.7H4 F5D2-H4 PolarHBondContact O-N 3.21Å; D2-H4 VanDerWaalsContact O-N 3.07Å; D2-F5 WeakPolarHBondContact O-CB 3.37Å; D2-F5 PolarHBondContact O-N 2.95Å
3T67.1Low56.8Low125 Ų125117.2 Ų117.277%0.76760%0.601SS**Hα-helixtrans-54.5-27.1175.3480000112.1M1 F6 A7M1-T3 PolarHBondContact O-N 3.32Å; T3-F6 PolarHBondContact O-N 3.44Å; T3-A7 VanDerWaalsContact O-CB 3.3Å; T3-A7 WeakPolarHBondContact O-CB 3.17Å; T3-A7 PolarHBondContact O-N 3.42Å
4H65.1Low56Low162 Ų162117.6 Ų117.675%0.7560%0.604SS**Hα-helixtrans-67.7-31.4176-142.5-87.7000113.6D2 G8D2-H4 PolarHBondContact O-N 3.21Å; D2-H4 VanDerWaalsContact O-N 3.07Å; H4-G8 PolarHBondContact O-N 3.41Å
5F68Low55.4Low136 Ų136116.4 Ų116.460%0.59660%0.6SS**Hα-helixtrans-71.8-45.3176-180-102.9000111.2D2 G8 L9D2-F5 WeakPolarHBondContact O-CB 3.37Å; D2-F5 PolarHBondContact O-N 2.95Å; F5-G8 PolarHBondContact O-N 3.37Å; F5-L9 HydrophobicContact CD1-CD1 3.75Å; F5-L9 HydrophobicContact CE1-CD1 3.23Å; F5-L9 HydrophobicContact CE2-CD1 4.3Å; F5-L9 HydrophobicContact CG-CD1 4.47Å; F5-L9 HydrophobicContact CZ-CD1 3.55Å; F5-L9 PolarHBondContact O-N 3.26Å
6F61.5Low54.9Low117 Ų117111.2 Ų111.251%0.51358%0.579SS.*Hα-helixtrans-64.9-39.4175.2-77.4-77.7000112.1M1 T3 G8 L9 T10M1-F6 HydrophobicContact CB-CE2 4.21Å; T3-F6 PolarHBondContact O-N 3.44Å; F6-G8 VanDerWaalsContact C-N 3.34Å; F6-L9 PolarHBondContact O-N 3.33Å; F6-T10 WeakPolarHBondContact O-CG2 3.15Å; F6-T10 PolarHBondContact O-N 2.98Å; F6-T10 PolarHBondContact O-OG1 3.12Å
7A52.7Low54.2Low51 Ų51107.9 Ų107.942%0.42158%0.579SS.*Hα-helixtrans-63.6-37.8173.700000112.5T3 T10 K11T3-A7 VanDerWaalsContact O-CB 3.3Å; T3-A7 WeakPolarHBondContact O-CB 3.17Å; T3-A7 PolarHBondContact O-N 3.42Å; A7-T10 WeakPolarHBondContact CA-OG1 3.38Å; A7-T10 PolarHBondContact O-OG1 3.06Å; A7-T10 VanDerWaalsContact O-OG1 3.1Å; A7-K11 WeakPolarHBondContact O-CB 3.42Å; A7-K11 PolarHBondContact O-N 3.24Å
8G50.9Low54Low42 Ų42110.4 Ų110.443%0.43358%0.583SS.*Hα-helixtrans-64.5-43.7173.400000112.5H4 F5 F6 F12H4-G8 PolarHBondContact O-N 3.41Å; F5-G8 PolarHBondContact O-N 3.37Å; F6-G8 VanDerWaalsContact C-N 3.34Å; G8-F12 VanDerWaalsContact O-CB 3.27Å; G8-F12 WeakPolarHBondContact O-CB 3.03Å; G8-F12 PolarHBondContact O-N 3Å
9L53Low54.1Low83 Ų83110.2 Ų110.244%0.43558%0.582SS.*Hα-helixtrans-65.1-43175.8-95.6154.7000112.6F5 F6 K13F5-L9 HydrophobicContact CD1-CD1 3.75Å; F5-L9 HydrophobicContact CE1-CD1 3.23Å; F5-L9 HydrophobicContact CE2-CD1 4.3Å; F5-L9 HydrophobicContact CG-CD1 4.47Å; F5-L9 HydrophobicContact CZ-CD1 3.55Å; F5-L9 PolarHBondContact O-N 3.26Å; F6-L9 PolarHBondContact O-N 3.33Å; L9-K13 WeakPolarHBondContact O-CB 3.21Å; L9-K13 PolarHBondContact O-N 3.07Å
10T53.6Low54.5Low79 Ų79109.5 Ų109.549%0.48557%0.571SS.*Hα-helixtrans-70.3-38.9177.150.70000111.5F6 A7 K13 L14F6-T10 WeakPolarHBondContact O-CG2 3.15Å; F6-T10 PolarHBondContact O-N 2.98Å; F6-T10 PolarHBondContact O-OG1 3.12Å; A7-T10 WeakPolarHBondContact CA-OG1 3.38Å; A7-T10 PolarHBondContact O-OG1 3.06Å; A7-T10 VanDerWaalsContact O-OG1 3.1Å; T10-K13 CarbonylContact O-C 3.5Å; T10-K13 PolarHBondContact O-N 3.37Å; T10-L14 VanDerWaalsContact O-CB 3.23Å; T10-L14 WeakPolarHBondContact O-CB 3.41Å; T10-L14 WeakPolarHBondContact O-CD1 3.45Å; T10-L14 VanDerWaalsContact O-CG 3.28Å; T10-L14 WeakPolarHBondContact O-CG 3.28Å; T10-L14 PolarHBondContact O-N 3.16Å
11K52.9Low55.1Low143 Ų143109.8 Ų109.862%0.62257%0.565SS**Hα-helixtrans-64.4-43.4174.1-171.4177.7-179.8177.50111.8A7 K13 L14 D15A7-K11 WeakPolarHBondContact O-CB 3.42Å; A7-K11 PolarHBondContact O-N 3.24Å; K11-K13 VanDerWaalsContact C-N 3.31Å; K11-K13 PolarHBondContact O-N 2.94Å; K11-L14 PolarHBondContact O-N 3.16Å; K11-D15 PolarHBondContact O-N 3.48Å
12F50.8Low56.4Low139 Ų13999.8 Ų99.861%0.6152%0.516SS*.Hα-helixtrans-62.8-38.5174.4-172.6-99.4000111.9G8 A16G8-F12 VanDerWaalsContact O-CB 3.27Å; G8-F12 WeakPolarHBondContact O-CB 3.03Å; G8-F12 PolarHBondContact O-N 3Å; F12-A16 VanDerWaalsContact O-CB 3.25Å; F12-A16 WeakPolarHBondContact O-CB 3.43Å; F12-A16 PolarHBondContact O-N 3.28Å
13K53.1Low57Low109 Ų10994.3 Ų94.347%0.47449%0.486SS..Hα-helixtrans-71.4-33.9172.9-104-169.1170.8-173.30113.8L9 T10 K11 A16 G17 I39L9-K13 WeakPolarHBondContact O-CB 3.21Å; L9-K13 PolarHBondContact O-N 3.07Å; T10-K13 CarbonylContact O-C 3.5Å; T10-K13 PolarHBondContact O-N 3.37Å; K11-K13 VanDerWaalsContact C-N 3.31Å; K11-K13 PolarHBondContact O-N 2.94Å; K13-A16 CarbonylContact O-C 3.59Å; K13-A16 PolarHBondContact O-N 3.41Å; K13-G17 WeakPolarHBondContact O-CA 3.41Å; K13-G17 PolarHBondContact O-N 3.47Å; K13-I39 VanDerWaalsContact NZ-CD1 3.27Å
14L46.3Very low57.7Low123 Ų12390.1 Ų90.164%0.64446%0.459SS*.Hα-helixtrans-73.9-38.1178.8-82.5161.6000110.9T10 K11 A16 G17 K18T10-L14 VanDerWaalsContact O-CB 3.23Å; T10-L14 WeakPolarHBondContact O-CB 3.41Å; T10-L14 WeakPolarHBondContact O-CD1 3.45Å; T10-L14 VanDerWaalsContact O-CG 3.28Å; T10-L14 WeakPolarHBondContact O-CG 3.28Å; T10-L14 PolarHBondContact O-N 3.16Å; K11-L14 PolarHBondContact O-N 3.16Å; L14-A16 VanDerWaalsContact C-N 3.34Å; L14-G17 CarbonylContact O-C 3.59Å; L14-G17 WeakPolarHBondContact O-CA 3.48Å; L14-G17 PolarHBondContact O-N 3.37Å; L14-G17 VanDerWaalsContact O-N 3.07Å; L14-K18 PolarHBondContact O-N 3.36Å
15D47.4Very low58.8Low100 Ų10088.6 Ų88.654%0.53545%0.45SS..Hα-helixtrans-71.4-29.6170.7-82.4-31.1000112.2K11 G17K11-D15 PolarHBondContact O-N 3.48Å; D15-G17 VanDerWaalsContact C-N 3.29Å
16A47.6Very low59.8Low33 Ų3382.3 Ų82.327%0.27342%0.423SS..Hα-helixtrans-74.1-20.7166.500000113.1F12 K13 L14F12-A16 VanDerWaalsContact O-CB 3.25Å; F12-A16 WeakPolarHBondContact O-CB 3.43Å; F12-A16 PolarHBondContact O-N 3.28Å; K13-A16 CarbonylContact O-C 3.59Å; K13-A16 PolarHBondContact O-N 3.41Å; L14-A16 VanDerWaalsContact C-N 3.34Å
17G42.1Very low61.1Low55 Ų5576.8 Ų76.857%0.56740%0.399SS*.Hα-helixtrans-94.5-16.6-175.100000114.4K13 L14 D15 L19K13-G17 WeakPolarHBondContact O-CA 3.41Å; K13-G17 PolarHBondContact O-N 3.47Å; L14-G17 CarbonylContact O-C 3.59Å; L14-G17 WeakPolarHBondContact O-CA 3.48Å; L14-G17 PolarHBondContact O-N 3.37Å; L14-G17 VanDerWaalsContact O-N 3.07Å; D15-G17 VanDerWaalsContact C-N 3.29Å; G17-L19 VanDerWaalsContact C-N 3.28Å; G17-L19 PolarHBondContact O-N 3.25Å
18K51.3Low62.9Low153 Ų15376.8 Ų76.867%0.66539%0.388SS*.SBendtrans-57.2104.5151.9-92.8-174.3176.8-177.80105.2L14 R20L14-K18 PolarHBondContact O-N 3.36Å; K18-R20 PolarHBondContact O-N 3.35Å
19L55Low64.8Low107 Ų10775.7 Ų75.756%0.5637%0.372SS*.  trans-55.881.4-175-169.181.1000109.3G17 R21G17-L19 VanDerWaalsContact C-N 3.28Å; G17-L19 PolarHBondContact O-N 3.25Å; L19-R21 VanDerWaalsContact O-CG 3.25Å; L19-R21 WeakPolarHBondContact O-CG 3.25Å; L19-R21 PolarHBondContact O-N 3.02Å
20R62Low66.7Low95 Ų9571.8 Ų71.836%0.35835%0.351SS..  trans-62.9118.2179.4-76179.163.2114.6-11.1106K18 D22 S138K18-R20 PolarHBondContact O-N 3.35Å; R20-D22 VanDerWaalsContact CB-OD1 3.23Å; R20-D22 WeakPolarHBondContact CB-OD1 3.23Å; R20-D22 IonicContact NE-OD1 3.05Å; R20-D22 IonicContact NH2-OD2 2.98Å; R20-D22 PolarHBondContact O-N 3.43Å; R20-D22 VanDerWaalsContact O-N 3.16Å; R20-S138 VanDerWaalsContact CZ-CB 3.42Å; R20-S138 PolarHBondContact NH2-OG 3.44Å
21R67.6Low68.4Low117 Ų11768.5 Ų68.544%0.44233%0.331SS..THydrogen-bonded Turntrans-85.125.8-171.1-57.9-174176.6136.1-6.8111.8L19 C145 N368L19-R21 VanDerWaalsContact O-CG 3.25Å; L19-R21 WeakPolarHBondContact O-CG 3.25Å; L19-R21 PolarHBondContact O-N 3.02Å; R21-C145 WeakPolarHBondContact CD-SG 3.45Å; R21-C145 VanDerWaalsContact NH1-CB 3.32Å; R21-N368 HydrophobicContact CB-CB 4.41Å; R21-N368 PolarHBondContact O-ND2 3.48Å; R21-N368 VanDerWaalsContact O-ND2 3.16Å; R21-N368 PolarHBondContact O-OD1 3.35Å
22D71.9Confident70.2Confident2 Ų264.7 Ų64.71%0.01132%0.319CS..THydrogen-bonded Turntrans-93.1-10.3170.959.9-40000113.1R20 W126 L137 M141 L364R20-D22 VanDerWaalsContact CB-OD1 3.23Å; R20-D22 WeakPolarHBondContact CB-OD1 3.23Å; R20-D22 IonicContact NE-OD1 3.05Å; R20-D22 IonicContact NH2-OD2 2.98Å; R20-D22 PolarHBondContact O-N 3.43Å; R20-D22 VanDerWaalsContact O-N 3.16Å; D22-W126 PolarHBondContact OD2-NE1 3.49Å; D22-W126 VanDerWaalsContact OD2-NE1 3.1Å; D22-L137 HydrophobicContact CB-CD2 4.32Å; D22-M141 HydrophobicContact CB-CG 4.41Å; D22-L364 HydrophobicContact CB-CD2 4.48Å
23D76.4Confident72.1Confident10 Ų1062.6 Ų62.65%0.05331%0.31CS..SBendtrans-93.8138.1-178.7-66.5-27.4000112.8D27 R28 H31D23-D27 HydrophobicContact CB-CB 4.24Å; D23-R28 HydrophobicContact CB-CG 3.95Å; D23-R28 PolarHBondContact O-NE 2.97Å; D23-R28 PolarHBondContact O-NH2 3.13Å; D23-H31 IonicContact OD2-CE1 2.84Å; D23-H31 PolarHBondContact OD2-CE1 2.84Å; D23-H31 IonicContact OD2-NE2 2.84Å
24D83.3Confident74.1Confident36 Ų3657.4 Ų57.419%0.19329%0.287CS..  trans-75.1160.6171.2-178.525.5000110.6S26 D27 R28 Y209 K213 S310 W314D24-S26 VanDerWaalsContact C-N 3.25Å; D24-S26 PolarHBondContact O-N 3.35Å; D24-S26 PolarHBondContact OD2-OG 3.21Å; D24-D27 WeakPolarHBondContact CB-OD2 3.37Å; D24-D27 PolarHBondContact N-OD2 3.04Å; D24-D27 WeakPolarHBondContact O-CB 3.34Å; D24-D27 PolarHBondContact O-N 3.02Å; D24-R28 PolarHBondContact O-N 3.23Å; D24-Y209 WeakPolarHBondContact CB-OH 3.17Å; D24-K213 IonicContact OD2-NZ 3.87Å; D24-K213 PolarHBondContact OD2-NZ 3.26Å; D24-S310 PolarHBondContact OD2-OG 2.88Å; D24-W314 PolarHBondContact OD2-NE1 3.45Å; D24-W314 VanDerWaalsContact OD2-NE1 3.17Å
25F86.7Confident76.4Confident130 Ų13051.7 Ų51.757%0.5726%0.258SS*.Hα-helixtrans-55-42.3-179.2174.6-99000112.3D27 R28 F29 F33F25-D27 VanDerWaalsContact C-N 3.32Å; F25-D27 PolarHBondContact O-N 2.87Å; F25-R28 PolarHBondContact O-N 3.21Å; F25-F29 HydrophobicContact CE1-CD2 4.42Å; F25-F29 HydrophobicContact CZ-CD2 4.27Å; F25-F29 WeakPolarHBondContact O-CB 3.46Å; F25-F29 PolarHBondContact O-N 3.02Å; F25-F33 HydrophobicContact CE2-CE2 4.35Å
26S89.2Confident78.5Confident4 Ų451 Ų513%0.02825%0.253CS..Hα-helixtrans-60.1-38.2176.953.90000113.5D24 F29 S30 K213 N307 S310D24-S26 VanDerWaalsContact C-N 3.25Å; D24-S26 PolarHBondContact O-N 3.35Å; D24-S26 PolarHBondContact OD2-OG 3.21Å; S26-F29 PolarHBondContact O-N 2.93Å; S26-S30 PolarHBondContact O-N 3.39Å; S26-S30 PolarHBondContact O-OG 3.34Å; S26-K213 PolarHBondContact OG-NZ 3.4Å; S26-N307 PolarHBondContact O-OD1 2.99Å; S26-S310 WeakPolarHBondContact OG-CB 3.17Å; S26-S310 PolarHBondContact OG-OG 3.46Å
27D89.3Confident80.8Confident2 Ų250.8 Ų50.81%0.01125%0.248CC..Hα-helixtrans-67.3-45178.9-58.1-37.5000109.7D23 D24 F25 S30 H31 Y209 K213 Y216D23-D27 HydrophobicContact CB-CB 4.24Å; D24-D27 WeakPolarHBondContact CB-OD2 3.37Å; D24-D27 PolarHBondContact N-OD2 3.04Å; D24-D27 WeakPolarHBondContact O-CB 3.34Å; D24-D27 PolarHBondContact O-N 3.02Å; F25-D27 VanDerWaalsContact C-N 3.32Å; F25-D27 PolarHBondContact O-N 2.87Å; D27-S30 PolarHBondContact O-N 3.2Å; D27-H31 VanDerWaalsContact C-ND1 3.35Å; D27-H31 PolarHBondContact O-N 2.99Å; D27-H31 PolarHBondContact O-ND1 3.16Å; D27-Y209 PolarHBondContact OD2-OH 2.82Å; D27-K213 WeakPolarHBondContact OD1-CD 3.14Å; D27-K213 VanDerWaalsContact OD1-CE 3.25Å; D27-K213 WeakPolarHBondContact OD1-CE 3.26Å; D27-K213 IonicContact OD1-NZ 3.67Å; D27-K213 PolarHBondContact OD1-NZ 3.38Å; D27-K213 WeakPolarHBondContact OD2-CE 3.44Å; D27-K213 IonicContact OD2-NZ 3.23Å; D27-K213 PolarHBondContact OD2-NZ 3.45Å; D27-Y216 HydrophobicContact CB-CE2 3.99Å; D27-Y216 WeakPolarHBondContact OD1-CE2 3.34Å
28R89.7Confident83.3Confident50 Ų5048.1 Ų48.119%0.18922%0.221CC..Hα-helixtrans-63.9-39.7176.6-60.9-178.2-165.8179.28.9112.1D23 D24 F25 S30 T32 F33D23-R28 HydrophobicContact CB-CG 3.95Å; D23-R28 PolarHBondContact O-NE 2.97Å; D23-R28 PolarHBondContact O-NH2 3.13Å; D24-R28 PolarHBondContact O-N 3.23Å; F25-R28 PolarHBondContact O-N 3.21Å; R28-S30 PolarHBondContact O-N 3.04Å; R28-T32 WeakPolarHBondContact O-CA 3.33Å; R28-T32 WeakPolarHBondContact O-CB 3.45Å; R28-T32 PolarHBondContact O-N 3.03Å; R28-T32 PolarHBondContact O-OG1 3.47Å; R28-F33 PolarHBondContact O-N 3.42Å
29F90.8Very high85.3Confident20 Ų2043.2 Ų43.29%0.08820%0.201CC..Iπ-helixtrans-57-40.8175.3-167.3-98.6000111.5F25 S26 F33 T34 W299 L302 V303 V306F25-F29 HydrophobicContact CE1-CD2 4.42Å; F25-F29 HydrophobicContact CZ-CD2 4.27Å; F25-F29 WeakPolarHBondContact O-CB 3.46Å; F25-F29 PolarHBondContact O-N 3.02Å; S26-F29 PolarHBondContact O-N 2.93Å; F29-F33 HydrophobicContact CB-CD2 4.36Å; F29-F33 AromaticContact CD2-CD2 3.73Å; F29-F33 HydrophobicContact CD2-CD2 3.73Å; F29-F33 HydrophobicContact CD2-CE2 4.39Å; F29-F33 HydrophobicContact CE2-CD2 4.43Å; F29-F33 HydrophobicContact CG-CD2 4.4Å; F29-T34 PolarHBondContact O-N 3.16Å; F29-T34 VanDerWaalsContact O-N 3.11Å; F29-T34 PolarHBondContact O-OG1 3.02Å; F29-W299 HydrophobicContact CE1-CZ2 4.28Å; F29-W299 HydrophobicContact CE2-CH2 4.05Å; F29-W299 HydrophobicContact CE2-CZ2 4.14Å; F29-W299 AromaticContact CZ-CH2 3.81Å; F29-W299 HydrophobicContact CZ-CH2 3.81Å; F29-W299 AromaticContact CZ-CZ2 3.73Å; F29-W299 HydrophobicContact CZ-CZ2 3.73Å; F29-W299 HydrophobicContact CZ-CZ3 4.46Å; F29-L302 HydrophobicContact CE1-CD2 4.45Å; F29-L302 HydrophobicContact CE1-CG 4.26Å; F29-L302 HydrophobicContact CZ-CD2 3.86Å; F29-L302 HydrophobicContact CZ-CG 4.14Å; F29-V303 HydrophobicContact CD1-CB 4.47Å; F29-V303 HydrophobicContact CD1-CG2 3.89Å; F29-V303 HydrophobicContact CE1-CB 4.25Å; F29-V303 HydrophobicContact CE1-CG2 3.48Å; F29-V303 VanDerWaalsContact CE1-CG2 3.48Å; F29-V306 HydrophobicContact CD1-CB 4.45Å; F29-V306 HydrophobicContact CD1-CG1 4.38Å
30S92.6Very high87.2Confident0 Ų041.9 Ų41.90%019%0.194CC..Iπ-helixtrans-75-65177.8-61.80000113.1S26 D27 R28 T34 N307S26-S30 PolarHBondContact O-N 3.39Å; S26-S30 PolarHBondContact O-OG 3.34Å; D27-S30 PolarHBondContact O-N 3.2Å; R28-S30 PolarHBondContact O-N 3.04Å; S30-T34 WeakPolarHBondContact O-CB 3.33Å; S30-N307 PolarHBondContact OG-ND2 3.27Å; S30-N307 PolarHBondContact OG-OD1 3.12Å
31H90.7Very high88.8Confident11 Ų1138.9 Ų38.95%0.05118%0.183CC..Iπ-helixtrans-81.2-27.9-169.979.8-81.9000113.6D23 D27 S35 F119 N120 C123 Y216D23-H31 IonicContact OD2-CE1 2.84Å; D23-H31 PolarHBondContact OD2-CE1 2.84Å; D23-H31 IonicContact OD2-NE2 2.84Å; D27-H31 VanDerWaalsContact C-ND1 3.35Å; D27-H31 PolarHBondContact O-N 2.99Å; D27-H31 PolarHBondContact O-ND1 3.16Å; H31-S35 WeakPolarHBondContact O-CB 3.41Å; H31-S35 PolarHBondContact O-OG 3.18Å; H31-F119 WeakPolarHBondContact CB-O 3.3Å; H31-N120 PolarHBondContact O-OD1 3.26Å; H31-C123 HydrophobicContact CB-CB 4.17Å; H31-Y216 HydrophobicContact CB-CE1 4.05Å; H31-Y216 PolarHBondContact ND1-OH 3.3Å
32T89.2Confident90.1Very high62 Ų6234.1 Ų34.138%0.3817%0.167SC..Iπ-helixtrans-91.2-62.2-178.9-41.20000110.8R28 L36R28-T32 WeakPolarHBondContact O-CA 3.33Å; R28-T32 WeakPolarHBondContact O-CB 3.45Å; R28-T32 PolarHBondContact O-N 3.03Å; R28-T32 PolarHBondContact O-OG1 3.47Å; T32-L36 WeakPolarHBondContact O-CB 3.41Å; T32-L36 PolarHBondContact O-N 3.47Å
33F92Very high91.1Very high95 Ų9539.5 Ų39.542%0.41720%0.196SC..Iπ-helixtrans-71.4-47.1-172.2-59.2-29.3000112.4F25 R28 F29 S35 L36 L37F25-F33 HydrophobicContact CE2-CE2 4.35Å; R28-F33 PolarHBondContact O-N 3.42Å; F29-F33 HydrophobicContact CB-CD2 4.36Å; F29-F33 AromaticContact CD2-CD2 3.73Å; F29-F33 HydrophobicContact CD2-CD2 3.73Å; F29-F33 HydrophobicContact CD2-CE2 4.39Å; F29-F33 HydrophobicContact CE2-CD2 4.43Å; F29-F33 HydrophobicContact CG-CD2 4.4Å; F33-S35 PolarHBondContact O-N 3.46Å; F33-L36 PolarHBondContact O-N 3.19Å; F33-L37 VanDerWaalsContact O-CB 3.28Å; F33-L37 WeakPolarHBondContact O-CB 2.85Å; F33-L37 PolarHBondContact O-N 3.48Å
34T95.2Very high91.9Very high0 Ų042.8 Ų42.80%021%0.212CC..Iπ-helixtrans-65.3-41.6179.2-52.70000111.5F29 S30 L37 L38 F119 W299 F300 V303F29-T34 PolarHBondContact O-N 3.16Å; F29-T34 VanDerWaalsContact O-N 3.11Å; F29-T34 PolarHBondContact O-OG1 3.02Å; S30-T34 WeakPolarHBondContact O-CB 3.33Å; T34-L37 PolarHBondContact O-N 3.4Å; T34-L38 HydrophobicContact CG2-CD1 4.17Å; T34-L38 HydrophobicContact CG2-CG 4.5Å; T34-L38 VanDerWaalsContact O-CG 3.32Å; T34-L38 WeakPolarHBondContact O-CG 3.28Å; T34-L38 PolarHBondContact O-N 2.86Å; T34-F119 HydrophobicContact CG2-CD1 4.2Å; T34-F119 HydrophobicContact CG2-CD2 3.94Å; T34-F119 HydrophobicContact CG2-CE1 3.99Å; T34-F119 HydrophobicContact CG2-CE2 3.68Å; T34-F119 HydrophobicContact CG2-CG 4.19Å; T34-F119 HydrophobicContact CG2-CZ 3.72Å; T34-W299 PolarHBondContact OG1-NE1 3.32Å; T34-F300 HydrophobicContact CG2-CD1 4.43Å; T34-F300 HydrophobicContact CG2-CE1 3.93Å; T34-V303 WeakPolarHBondContact OG1-CG2 3.41Å
35S93.5Very high92.3Very high4 Ų441.2 Ų41.23%0.02820%0.204CC..Hα-helixtrans-65.2-40.3175.5-52.70000112.6H31 F33 L37 L38 I39 A116 F119 N120H31-S35 WeakPolarHBondContact O-CB 3.41Å; H31-S35 PolarHBondContact O-OG 3.18Å; F33-S35 PolarHBondContact O-N 3.46Å; S35-L37 VanDerWaalsContact C-N 3.33Å; S35-L38 PolarHBondContact O-N 2.88Å; S35-I39 WeakPolarHBondContact O-CB 3.47Å; S35-I39 WeakPolarHBondContact O-CD1 3.5Å; S35-I39 WeakPolarHBondContact O-CG1 3.49Å; S35-I39 PolarHBondContact O-N 3.24Å; S35-A116 PolarHBondContact OG-O 3.4Å; S35-F119 WeakPolarHBondContact OG-CB 3.39Å; S35-N120 WeakPolarHBondContact CB-ND2 3.31Å; S35-N120 PolarHBondContact OG-ND2 3.45Å
36L92.8Very high92.5Very high84 Ų8436.2 Ų36.244%0.4419%0.185SC..Hα-helixtrans-61.3-45175.517963.1000110.8T32 F33 I39 I40T32-L36 WeakPolarHBondContact O-CB 3.41Å; T32-L36 PolarHBondContact O-N 3.47Å; F33-L36 PolarHBondContact O-N 3.19Å; L36-I39 PolarHBondContact O-N 3.42Å; L36-I40 HydrophobicContact CD1-CD1 4.34Å; L36-I40 HydrophobicContact CG-CD1 4.03Å; L36-I40 VanDerWaalsContact O-CG1 3.32Å; L36-I40 WeakPolarHBondContact O-CG1 3.25Å; L36-I40 PolarHBondContact O-N 2.92Å
37L94.3Very high92.7Very high29 Ų2938 Ų3815%0.15220%0.2CC..Hα-helixtrans-61.2-45.8177.9-178.9144.3000112F33 T34 S35 I39 I40 F41 F295 L296 W299F33-L37 VanDerWaalsContact O-CB 3.28Å; F33-L37 WeakPolarHBondContact O-CB 2.85Å; F33-L37 PolarHBondContact O-N 3.48Å; T34-L37 PolarHBondContact O-N 3.4Å; S35-L37 VanDerWaalsContact C-N 3.33Å; L37-I39 VanDerWaalsContact C-N 3.33Å; L37-I39 PolarHBondContact O-N 3.12Å; L37-I40 PolarHBondContact O-N 3.32Å; L37-F41 HydrophobicContact CD2-CD2 3.69Å; L37-F41 HydrophobicContact CD2-CE2 3.31Å; L37-F41 HydrophobicContact CD2-CZ 4.05Å; L37-F41 HydrophobicContact CG-CD2 4.42Å; L37-F41 HydrophobicContact CG-CE2 3.99Å; L37-F41 HydrophobicContact CG-CZ 4.26Å; L37-F41 PolarHBondContact O-N 2.92Å; L37-F295 HydrophobicContact CD1-CE1 3.6Å; L37-F295 HydrophobicContact CD1-CZ 3.93Å; L37-F295 HydrophobicContact CD2-CE1 4.01Å; L37-F295 HydrophobicContact CG-CE1 4.31Å; L37-L296 HydrophobicContact CD2-CD2 3.59Å; L37-W299 HydrophobicContact CD1-CD2 4.17Å; L37-W299 HydrophobicContact CD1-CE3 4.3Å; L37-W299 HydrophobicContact CD1-CH2 4.32Å; L37-W299 HydrophobicContact CD1-CZ2 4.19Å; L37-W299 HydrophobicContact CD1-CZ3 4.37Å
38L95.4Very high92.7Very high0 Ų042.5 Ų42.50%022%0.217CC..Hα-helixtrans-62.6-38.3175.3-71.9169.4000112.4T34 S35 F41 T42 L112 Q115 A116 F119 L296 F300T34-L38 HydrophobicContact CG2-CD1 4.17Å; T34-L38 HydrophobicContact CG2-CG 4.5Å; T34-L38 VanDerWaalsContact O-CG 3.32Å; T34-L38 WeakPolarHBondContact O-CG 3.28Å; T34-L38 PolarHBondContact O-N 2.86Å; S35-L38 PolarHBondContact O-N 2.88Å; L38-F41 PolarHBondContact O-N 3.07Å; L38-T42 WeakPolarHBondContact O-CB 3.38Å; L38-T42 PolarHBondContact O-N 3.47Å; L38-T42 PolarHBondContact O-OG1 2.82Å; L38-L112 HydrophobicContact CD2-CD2 3.92Å; L38-Q115 HydrophobicContact CD1-CB 4.01Å; L38-A116 HydrophobicContact CB-CB 3.86Å; L38-A116 HydrophobicContact CD1-CB 4.27Å; L38-F119 HydrophobicContact CD1-CD2 3.5Å; L38-F119 VanDerWaalsContact CD1-CD2 3.5Å; L38-F119 HydrophobicContact CD1-CE2 3.75Å; L38-L296 HydrophobicContact CD2-CD1 3.93Å; L38-L296 HydrophobicContact CD2-CD2 3.69Å; L38-L296 HydrophobicContact CD2-CG 4.5Å; L38-F300 HydrophobicContact CD2-CZ 4.36Å
39I94.5Very high92.7Very high50 Ų5041.4 Ų41.426%0.25621%0.214SC..Hα-helixtrans-65.4-42.3175.3-69.8166.5000110.5K13 S35 L36 L37 T42 L43 A116K13-I39 VanDerWaalsContact NZ-CD1 3.27Å; S35-I39 WeakPolarHBondContact O-CB 3.47Å; S35-I39 WeakPolarHBondContact O-CD1 3.5Å; S35-I39 WeakPolarHBondContact O-CG1 3.49Å; S35-I39 PolarHBondContact O-N 3.24Å; L36-I39 PolarHBondContact O-N 3.42Å; L37-I39 VanDerWaalsContact C-N 3.33Å; L37-I39 PolarHBondContact O-N 3.12Å; I39-T42 WeakPolarHBondContact O-CB 3.45Å; I39-T42 PolarHBondContact O-N 2.88Å; I39-L43 HydrophobicContact CG2-CD1 4.39Å; I39-L43 WeakPolarHBondContact O-CG 3.43Å; I39-L43 PolarHBondContact O-N 3.03Å; I39-A116 HydrophobicContact CG1-CB 4.04Å
40I94.6Very high92.6Very high79 Ų7948.2 Ų48.241%0.40524%0.24SC..Hα-helixtrans-60.6-47.3175.8-69.1164.7000110.5L36 L37 T42 L43 I44L36-I40 HydrophobicContact CD1-CD1 4.34Å; L36-I40 HydrophobicContact CG-CD1 4.03Å; L36-I40 VanDerWaalsContact O-CG1 3.32Å; L36-I40 WeakPolarHBondContact O-CG1 3.25Å; L36-I40 PolarHBondContact O-N 2.92Å; L37-I40 PolarHBondContact O-N 3.32Å; I40-T42 VanDerWaalsContact C-N 3.32Å; I40-T42 PolarHBondContact O-N 3.35Å; I40-L43 WeakPolarHBondContact O-CB 3.02Å; I40-L43 PolarHBondContact O-N 3.44Å; I40-L43 VanDerWaalsContact O-N 3.17Å; I40-I44 HydrophobicContact CG2-CD1 3.83Å; I40-I44 HydrophobicContact CG2-CG1 4.48Å; I40-I44 WeakPolarHBondContact O-CG1 3.45Å; I40-I44 PolarHBondContact O-N 3.12Å
41F94.9Very high92.4Very high32 Ų3255.3 Ų55.314%0.1428%0.277CS..Hα-helixtrans-62.8-38.2175.8-69-26000113L37 L38 L43 I44 I45 L112 I292 F295 L296L37-F41 HydrophobicContact CD2-CD2 3.69Å; L37-F41 HydrophobicContact CD2-CE2 3.31Å; L37-F41 HydrophobicContact CD2-CZ 4.05Å; L37-F41 HydrophobicContact CG-CD2 4.42Å; L37-F41 HydrophobicContact CG-CE2 3.99Å; L37-F41 HydrophobicContact CG-CZ 4.26Å; L37-F41 PolarHBondContact O-N 2.92Å; L38-F41 PolarHBondContact O-N 3.07Å; F41-L43 VanDerWaalsContact C-N 3.31Å; F41-L43 PolarHBondContact O-N 3.47Å; F41-I44 HydrophobicContact CD1-CD1 4.3Å; F41-I44 PolarHBondContact O-N 3.46Å; F41-I45 WeakPolarHBondContact O-CG1 3.31Å; F41-I45 PolarHBondContact O-N 3.25Å; F41-L112 HydrophobicContact CB-CD1 4.13Å; F41-I292 HydrophobicContact CB-CD1 4.47Å; F41-I292 HydrophobicContact CB-CG2 4.18Å; F41-I292 HydrophobicContact CD1-CD1 4.45Å; F41-I292 HydrophobicContact CD1-CG1 4.29Å; F41-I292 HydrophobicContact CD2-CG2 3.67Å; F41-I292 HydrophobicContact CE2-CG2 4.09Å; F41-I292 HydrophobicContact CG-CG1 4.43Å; F41-I292 HydrophobicContact CG-CG2 3.93Å; F41-F295 AromaticContact CE2-CD1 3.6Å; F41-F295 HydrophobicContact CE2-CD1 3.6Å; F41-F295 AromaticContact CE2-CE1 3.96Å; F41-F295 HydrophobicContact CE2-CE1 3.96Å; F41-F295 AromaticContact CZ-CD1 3.56Å; F41-F295 HydrophobicContact CZ-CD1 3.56Å; F41-F295 AromaticContact CZ-CE1 3.84Å; F41-F295 HydrophobicContact CZ-CE1 3.84Å; F41-F295 HydrophobicContact CZ-CG 4.27Å; F41-L296 HydrophobicContact CD2-CD1 4.3Å; F41-L296 HydrophobicContact CD2-CD2 3.95Å; F41-L296 HydrophobicContact CD2-CG 4.15Å; F41-L296 HydrophobicContact CE2-CD2 3.77Å; F41-L296 HydrophobicContact CE2-CG 3.99Å
42T94.5Very high92.2Very high17 Ų1756 Ų5610%0.10429%0.287CS..Hα-helixtrans-58.6-44.5173.5-56.60000110.8L38 I39 I40 S46 P109 L112L38-T42 WeakPolarHBondContact O-CB 3.38Å; L38-T42 PolarHBondContact O-N 3.47Å; L38-T42 PolarHBondContact O-OG1 2.82Å; I39-T42 WeakPolarHBondContact O-CB 3.45Å; I39-T42 PolarHBondContact O-N 2.88Å; I40-T42 VanDerWaalsContact C-N 3.32Å; I40-T42 PolarHBondContact O-N 3.35Å; T42-S46 WeakPolarHBondContact O-CB 3.19Å; T42-S46 PolarHBondContact O-N 3.49Å; T42-S46 PolarHBondContact O-OG 3.48Å; T42-P109 HydrophobicContact CG2-CB 4.27Å; T42-P109 WeakPolarHBondContact CG2-O 3.22Å; T42-L112 WeakPolarHBondContact OG1-CB 3.45Å
43L93.5Very high92.1Very high115 Ų11558.2 Ų58.260%0.60229%0.291SS*.Hα-helixtrans-65.1-42.4177.5-68.5174.7000112.1I39 I40 F41 S46 A47I39-L43 HydrophobicContact CG2-CD1 4.39Å; I39-L43 WeakPolarHBondContact O-CG 3.43Å; I39-L43 PolarHBondContact O-N 3.03Å; I40-L43 WeakPolarHBondContact O-CB 3.02Å; I40-L43 PolarHBondContact O-N 3.44Å; I40-L43 VanDerWaalsContact O-N 3.17Å; F41-L43 VanDerWaalsContact C-N 3.31Å; F41-L43 PolarHBondContact O-N 3.47Å; L43-S46 PolarHBondContact O-N 3.49Å; L43-A47 WeakPolarHBondContact O-CB 3.49Å; L43-A47 PolarHBondContact O-N 2.93Å
44I92.2Very high92.1Very high79 Ų7954.6 Ų54.641%0.40528%0.277SS..Hα-helixtrans-62.5-49.4178.7-68.9167.2000110.9I40 F41 S46 A47 R48I40-I44 HydrophobicContact CG2-CD1 3.83Å; I40-I44 HydrophobicContact CG2-CG1 4.48Å; I40-I44 WeakPolarHBondContact O-CG1 3.45Å; I40-I44 PolarHBondContact O-N 3.12Å; F41-I44 HydrophobicContact CD1-CD1 4.3Å; F41-I44 PolarHBondContact O-N 3.46Å; I44-S46 VanDerWaalsContact C-N 3.35Å; I44-A47 PolarHBondContact O-N 3.41Å; I44-R48 PolarHBondContact O-N 2.97Å; I44-R48 VanDerWaalsContact O-N 3.1Å
45I92.3Very high92Very high2 Ų254.8 Ų54.81%0.0128%0.278CS..Hα-helixtrans-65.1-42.2179.2-62.4172.9000110.2F41 A47 R48 Q49 V108 P109 L112 I285 I292F41-I45 WeakPolarHBondContact O-CG1 3.31Å; F41-I45 PolarHBondContact O-N 3.25Å; I45-A47 PolarHBondContact O-N 3.42Å; I45-R48 PolarHBondContact O-N 3.4Å; I45-R48 VanDerWaalsContact O-N 3.15Å; I45-Q49 WeakPolarHBondContact O-CB 3.32Å; I45-Q49 PolarHBondContact O-N 3.26Å; I45-V108 HydrophobicContact CD1-CG1 3.66Å; I45-P109 HydrophobicContact CG2-CG 3.83Å; I45-L112 HydrophobicContact CD1-CD1 3.58Å; I45-I285 HydrophobicContact CG2-CD1 4.15Å; I45-I285 HydrophobicContact CG2-CG1 4.47Å; I45-I292 HydrophobicContact CD1-CD1 3.62Å; I45-I292 HydrophobicContact CG1-CD1 3.55Å
46S92.2Very high92Very high25 Ų2556.5 Ų56.518%0.17529%0.293CS..Hα-helixtrans-61.9-43177.4-59.90000111.6T42 L43 I44 R48 Q49 Y50T42-S46 WeakPolarHBondContact O-CB 3.19Å; T42-S46 PolarHBondContact O-N 3.49Å; T42-S46 PolarHBondContact O-OG 3.48Å; L43-S46 PolarHBondContact O-N 3.49Å; I44-S46 VanDerWaalsContact C-N 3.35Å; S46-R48 VanDerWaalsContact C-N 3.28Å; S46-R48 PolarHBondContact O-N 2.8Å; S46-Q49 PolarHBondContact O-N 2.98Å; S46-Q49 VanDerWaalsContact O-N 3.11Å; S46-Y50 WeakPolarHBondContact O-CD2 3.32Å; S46-Y50 PolarHBondContact O-N 3.3Å
47A91.4Very high92.2Very high43 Ų4353 Ų5336%0.35528%0.275SS..Hα-helixtrans-58.5-42.4175.100000111L43 I44 I45 Q49 I51 G52L43-A47 WeakPolarHBondContact O-CB 3.49Å; L43-A47 PolarHBondContact O-N 2.93Å; I44-A47 PolarHBondContact O-N 3.41Å; I45-A47 PolarHBondContact O-N 3.42Å; A47-Q49 VanDerWaalsContact C-N 3.32Å; A47-Q49 PolarHBondContact O-N 2.9Å; A47-I51 HydrophobicContact CB-CD1 4.22Å; A47-I51 WeakPolarHBondContact O-CA 3.28Å; A47-I51 VanDerWaalsContact O-CB 3.25Å; A47-I51 WeakPolarHBondContact O-CB 3.19Å; A47-I51 PolarHBondContact O-N 3.45Å; A47-G52 PolarHBondContact O-N 3.5Å
48R90.5Very high92.2Very high96 Ų9661.5 Ų61.536%0.36231%0.305SS..Hα-helixtrans-66.2-33.3176.4-170.861.2-176.8179.63.3113I44 I45 S46 G52 F288I44-R48 PolarHBondContact O-N 2.97Å; I44-R48 VanDerWaalsContact O-N 3.1Å; I45-R48 PolarHBondContact O-N 3.4Å; I45-R48 VanDerWaalsContact O-N 3.15Å; S46-R48 VanDerWaalsContact C-N 3.28Å; S46-R48 PolarHBondContact O-N 2.8Å; R48-G52 CarbonylContact O-C 3.56Å; R48-G52 WeakPolarHBondContact O-CA 3.3Å; R48-G52 PolarHBondContact O-N 2.92Å; R48-F288 HydrophobicContact CG-CD2 4.33Å; R48-F288 HydrophobicContact CG-CE2 4.27Å
49Q89.7Confident92.2Very high27 Ų2762.5 Ų62.513%0.12631%0.311CS..Hα-helixtrans-78.9-35.5-179-176.9171.7-28.700113.7I45 S46 A47 W76 I285I45-Q49 WeakPolarHBondContact O-CB 3.32Å; I45-Q49 PolarHBondContact O-N 3.26Å; S46-Q49 PolarHBondContact O-N 2.98Å; S46-Q49 VanDerWaalsContact O-N 3.11Å; A47-Q49 VanDerWaalsContact C-N 3.32Å; A47-Q49 PolarHBondContact O-N 2.9Å; Q49-W76 HydrophobicContact CG-CZ2 3.98Å; Q49-I285 HydrophobicContact CB-CD1 4.34Å
50Y87.7Confident92.2Very high162 Ų16262.4 Ų62.464%0.63531%0.314SS*.Hα-helixtrans-100-34.1-175.2-68.4-68.6000114.3S46S46-Y50 WeakPolarHBondContact O-CD2 3.32Å; S46-Y50 PolarHBondContact O-N 3.3Å
51I89.3Confident92Very high150 Ų15065 Ų6577%0.76933%0.333SS*.THydrogen-bonded Turntrans-96.8-35.2-178.2-53171.5000110.2A47A47-I51 HydrophobicContact CB-CD1 4.22Å; A47-I51 WeakPolarHBondContact O-CA 3.28Å; A47-I51 VanDerWaalsContact O-CB 3.25Å; A47-I51 WeakPolarHBondContact O-CB 3.19Å; A47-I51 PolarHBondContact O-N 3.45Å
52G85.7Confident92Very high25 Ų2570.3 Ų70.326%0.25836%0.359SS..SBendtrans-90170.1177.200000113.2A47 R48 P54A47-G52 PolarHBondContact O-N 3.5Å; R48-G52 CarbonylContact O-C 3.56Å; R48-G52 WeakPolarHBondContact O-CA 3.3Å; R48-G52 PolarHBondContact O-N 2.92Å; G52-P54 VanDerWaalsContact O-CD 3.3Å; G52-P54 WeakPolarHBondContact O-CD 3.47Å
53K87.6Confident91.9Very high108 Ų10871.8 Ų71.847%0.4736%0.364SS..  trans-79.4111.8163-70.2-167.9167.7-145.40109.3I55 E72K53-I55 VanDerWaalsContact C-N 3.32Å; K53-E72 IonicContact NZ-OE1 3.47Å; K53-E72 PolarHBondContact NZ-OE1 3.08Å; K53-E72 IonicContact NZ-OE2 2.9Å; K53-E72 PolarHBondContact NZ-OE2 3.12Å
54P91.4Very high91.9Very high20 Ų2070 Ų7013%0.1336%0.358CS..SBendtrans-73.6-26.2-179.129.1-34.5000112.8G52 W76 P284G52-P54 VanDerWaalsContact O-CD 3.3Å; G52-P54 WeakPolarHBondContact O-CD 3.47Å; P54-W76 HydrophobicContact CB-CD2 4.22Å; P54-W76 HydrophobicContact CB-CE3 4Å; P54-W76 HydrophobicContact CB-CH2 3.98Å; P54-W76 HydrophobicContact CB-CZ2 4.18Å; P54-W76 HydrophobicContact CB-CZ3 3.88Å; P54-W76 HydrophobicContact CG-CD2 3.91Å; P54-W76 HydrophobicContact CG-CE3 4.09Å; P54-W76 HydrophobicContact CG-CG 4.32Å; P54-W76 HydrophobicContact CG-CZ2 4.45Å; P54-W76 HydrophobicContact CG-CZ3 4.46Å; P54-P284 WeakPolarHBondContact O-CD 3.18Å
55I93.5Very high92Very high4 Ų475.3 Ų75.32%0.02137%0.373CS..  trans-137.5147.6-179.4-168.1168.1000108.7K53 E72 C75 W76 T80 C281 L283K53-I55 VanDerWaalsContact C-N 3.32Å; I55-E72 HydrophobicContact CG2-CB 4.37Å; I55-E72 WeakPolarHBondContact CG2-O 3.06Å; I55-C75 HydrophobicContact CD1-CB 4.04Å; I55-W76 HydrophobicContact CB-CE3 4.32Å; I55-W76 HydrophobicContact CG2-CB 3.92Å; I55-W76 HydrophobicContact CG2-CE3 4.43Å; I55-T80 HydrophobicContact CD1-CG2 3.87Å; I55-C281 HydrophobicContact CD1-CB 3.67Å; I55-C281 HydrophobicContact CG1-CB 3.74Å; I55-L283 HydrophobicContact CB-CD1 3.84Å; I55-L283 HydrophobicContact CD1-CD1 3.73Å; I55-L283 HydrophobicContact CG1-CD1 3.64Å
56A94.7Very high92.1Very high40 Ų4078.5 Ų78.533%0.33140%0.4SS..EExtended strand (participates in β ladder)trans-135.113217000000108.7E72 C281 V282A56-E72 WeakPolarHBondContact CA-OE1 3.3Å; A56-C281 CarbonylContact O-C 3.47Å; A56-C281 VanDerWaalsContact O-CA 3.28Å; A56-C281 WeakPolarHBondContact O-CA 3.42Å; A56-V282 PolarHBondContact N-O 3.17Å; A56-V282 PolarHBondContact O-N 3.39Å
57C96.1Very high92.2Very high10 Ų1081.4 Ų81.47%0.06841%0.41CS..EExtended strand (participates in β ladder)trans-118.9138.4-172.2-62.60000112.1V59 E72 V279 C281C57-V59 HydrophobicContact CB-CG1 4.46Å; C57-V59 PolarHBondContact O-N 3.02Å; C57-E72 HydrophobicContact CB-CG 4.24Å; C57-V279 HydrophobicContact CB-CG2 4.34Å; C57-C281 HydrophobicContact CB-CB 4.11Å; C57-C281 WeakPolarHBondContact CB-SG 3.19Å; C57-C281 WeakPolarHBondContact SG-CB 3.48Å; C57-C281 CovalentContact SG-SG 2.05Å; C57-C281 PolarHBondContact SG-SG 3.23Å
58W95.5Very high92.4Very high207 Ų20782.4 Ų82.478%0.78441%0.408SS*.EExtended strand (participates in β ladder)trans-80.6103.8170-176.3-91.5000109.2Q280W58-Q280 PolarHBondContact N-O 3.32Å
59V94.6Very high92.6Very high21 Ų2182.2 Ų82.213%0.12741%0.411CS..  trans-102.4155.7178.4-61.50000111C57 F63 E68 A71 V279C57-V59 HydrophobicContact CB-CG1 4.46Å; C57-V59 PolarHBondContact O-N 3.02Å; V59-F63 HydrophobicContact CB-CB 4.34Å; V59-F63 HydrophobicContact CB-CD2 4.05Å; V59-F63 HydrophobicContact CB-CG 4.33Å; V59-F63 HydrophobicContact CG1-CD2 4.32Å; V59-F63 HydrophobicContact CG2-CB 3.99Å; V59-F63 HydrophobicContact CG2-CD2 4.46Å; V59-E68 HydrophobicContact CG1-CG 4.47Å; V59-E68 HydrophobicContact CG2-CB 3.94Å; V59-E68 HydrophobicContact CG2-CG 3.83Å; V59-A71 HydrophobicContact CG1-CB 3.99Å; V59-V279 HydrophobicContact CG1-CG1 4.33Å
60P94.2Very high92.8Very high49 Ų4986.9 Ų86.932%0.31843%0.428SS..  trans-57.3149.1174.8-23.934.7000112.6E62 F63P60-E62 WeakPolarHBondContact CB-OE2 3.4Å; P60-E62 PolarHBondContact O-N 2.81Å; P60-F63 HydrophobicContact CB-CD1 4.44Å; P60-F63 HydrophobicContact CG-CE1 4.5Å; P60-F63 WeakPolarHBondContact O-CB 3.48Å; P60-F63 PolarHBondContact O-N 3.09Å
61T91.6Very high93.1Very high132 Ų13279.1 Ų79.181%0.8140%0.398SS*.THydrogen-bonded Turntrans-62-18.2-176.239.20000114.4F63T61-F63 PolarHBondContact O-N 2.96Å
62E93.4Very high93.3Very high145 Ų14572.9 Ų72.968%0.67837%0.365SS*.THydrogen-bonded Turntrans-76.5-13.6177.6-49.973.9-133.400112.6P60P60-E62 WeakPolarHBondContact CB-OE2 3.4Å; P60-E62 PolarHBondContact O-N 2.81Å
63F92.1Very high93.7Very high47 Ų4774.3 Ų74.321%0.20637%0.371CS..  trans-75.5128.4-179.4-83.736.3000110.3V59 P60 T61 Q67 F266V59-F63 HydrophobicContact CB-CB 4.34Å; V59-F63 HydrophobicContact CB-CD2 4.05Å; V59-F63 HydrophobicContact CB-CG 4.33Å; V59-F63 HydrophobicContact CG1-CD2 4.32Å; V59-F63 HydrophobicContact CG2-CB 3.99Å; V59-F63 HydrophobicContact CG2-CD2 4.46Å; P60-F63 HydrophobicContact CB-CD1 4.44Å; P60-F63 HydrophobicContact CG-CE1 4.5Å; P60-F63 WeakPolarHBondContact O-CB 3.48Å; P60-F63 PolarHBondContact O-N 3.09Å; T61-F63 PolarHBondContact O-N 2.96Å; F63-Q67 HydrophobicContact CB-CB 4.08Å; F63-Q67 HydrophobicContact CD2-CB 3.71Å; F63-Q67 HydrophobicContact CE2-CB 4.39Å; F63-Q67 HydrophobicContact CG-CB 4.04Å; F63-F266 HydrophobicContact CE2-CE2 4.12Å; F63-F266 AromaticContact CE2-CZ 3.77Å; F63-F266 HydrophobicContact CE2-CZ 3.77Å; F63-F266 HydrophobicContact CZ-CE2 4.31Å; F63-F266 HydrophobicContact CZ-CZ 4.09Å
64T94.9Very high94Very high79 Ų7970.4 Ų70.449%0.48536%0.357SS..  trans-66.2156.9167.662.10000110.2A66 Q67 E68T64-A66 PolarHBondContact O-N 3.43Å; T64-A66 VanDerWaalsContact O-N 3.12Å; T64-Q67 WeakPolarHBondContact O-CA 3.22Å; T64-Q67 WeakPolarHBondContact O-CB 3.11Å; T64-Q67 PolarHBondContact O-N 3.03Å; T64-Q67 WeakPolarHBondContact OG1-CG 3.29Å; T64-Q67 PolarHBondContact OG1-N 2.95Å; T64-Q67 PolarHBondContact OG1-OE1 2.94Å; T64-E68 PolarHBondContact O-N 3.05Å
65R94.5Very high94.1Very high189 Ų18969.5 Ų69.571%0.71335%0.351SS*.Hα-helixtrans-52.6-36.4176.3-177.2176.5174.5162.33.4113.6Q67 E68 E69R65-Q67 VanDerWaalsContact C-N 3.33Å; R65-Q67 PolarHBondContact O-N 3.28Å; R65-E68 PolarHBondContact O-N 3.33Å; R65-E69 IonicContact NE-OE1 3.3Å; R65-E69 PolarHBondContact NE-OE1 3.36Å; R65-E69 WeakPolarHBondContact O-CG 3.41Å; R65-E69 PolarHBondContact O-N 3.49Å
66A94.5Very high94.1Very high69 Ų6971.3 Ų71.357%0.5736%0.358SS*.Hα-helixtrans-67.3-33.317600000112.6T64 Y70T64-A66 PolarHBondContact O-N 3.43Å; T64-A66 VanDerWaalsContact O-N 3.12Å; A66-Y70 WeakPolarHBondContact O-CB 3.35Å; A66-Y70 PolarHBondContact O-N 3.2Å
67Q94.1Very high93.9Very high86 Ų8674.3 Ų74.340%0.40237%0.371SS..Hα-helixtrans-74.2-34.6174.8-70.5164.7-38.300111.9F63 T64 R65 Y70 A71F63-Q67 HydrophobicContact CB-CB 4.08Å; F63-Q67 HydrophobicContact CD2-CB 3.71Å; F63-Q67 HydrophobicContact CE2-CB 4.39Å; F63-Q67 HydrophobicContact CG-CB 4.04Å; T64-Q67 WeakPolarHBondContact O-CA 3.22Å; T64-Q67 WeakPolarHBondContact O-CB 3.11Å; T64-Q67 PolarHBondContact O-N 3.03Å; T64-Q67 WeakPolarHBondContact OG1-CG 3.29Å; T64-Q67 PolarHBondContact OG1-N 2.95Å; T64-Q67 PolarHBondContact OG1-OE1 2.94Å; R65-Q67 VanDerWaalsContact C-N 3.33Å; R65-Q67 PolarHBondContact O-N 3.28Å; Q67-Y70 PolarHBondContact O-N 3.33Å; Q67-A71 WeakPolarHBondContact O-CB 3.49Å; Q67-A71 PolarHBondContact O-N 2.63Å
68E94.6Very high93.6Very high64 Ų6476.8 Ų76.830%0.29939%0.386SS..Hα-helixtrans-61.3-51.6170.5-176.1-172.5159.600110.8V59 T64 R65 Y70 A71 E72V59-E68 HydrophobicContact CG1-CG 4.47Å; V59-E68 HydrophobicContact CG2-CB 3.94Å; V59-E68 HydrophobicContact CG2-CG 3.83Å; T64-E68 PolarHBondContact O-N 3.05Å; R65-E68 PolarHBondContact O-N 3.33Å; E68-Y70 VanDerWaalsContact C-N 3.28Å; E68-Y70 PolarHBondContact O-N 3.45Å; E68-A71 PolarHBondContact O-N 2.83Å; E68-A71 VanDerWaalsContact O-N 3.09Å; E68-E72 WeakPolarHBondContact O-CG 3.34Å; E68-E72 PolarHBondContact O-N 3.4Å
69E94.2Very high93.3Very high92 Ų9267.5 Ų67.543%0.4335%0.353SS..Hα-helixtrans-60.6-37.7177.5-71.9174.3-17300111.7R65 S73R65-E69 IonicContact NE-OE1 3.3Å; R65-E69 PolarHBondContact NE-OE1 3.36Å; R65-E69 WeakPolarHBondContact O-CG 3.41Å; R65-E69 PolarHBondContact O-N 3.49Å; E69-S73 WeakPolarHBondContact O-CB 3.39Å; E69-S73 PolarHBondContact O-N 2.86Å; E69-S73 PolarHBondContact O-OG 3.05Å
70Y93.9Very high93.2Very high125 Ų12566.7 Ų66.749%0.4935%0.348SS..Hα-helixtrans-62.1-49.9171.4176.1-102.4000111.7A66 Q67 E68 E72 S73 V74A66-Y70 WeakPolarHBondContact O-CB 3.35Å; A66-Y70 PolarHBondContact O-N 3.2Å; Q67-Y70 PolarHBondContact O-N 3.33Å; E68-Y70 VanDerWaalsContact C-N 3.28Å; E68-Y70 PolarHBondContact O-N 3.45Å; Y70-E72 PolarHBondContact O-N 3.41Å; Y70-S73 PolarHBondContact O-N 3.11Å; Y70-S73 PolarHBondContact O-OG 2.92Å; Y70-V74 HydrophobicContact CD1-CG2 4.22Å; Y70-V74 HydrophobicContact CD2-CG2 4.08Å; Y70-V74 HydrophobicContact CE1-CG2 3.8Å; Y70-V74 HydrophobicContact CE2-CG2 3.64Å; Y70-V74 HydrophobicContact CG-CG2 4.36Å; Y70-V74 VanDerWaalsContact CZ-CG2 3.49Å; Y70-V74 WeakPolarHBondContact O-CG2 3.32Å; Y70-V74 PolarHBondContact O-N 3.3Å
71A94.5Very high93.1Very high0 Ų064.5 Ų64.50%033%0.334CS..Hα-helixtrans-60-45.7178.900000111.6V59 Q67 E68 S73 V74 C75 F266V59-A71 HydrophobicContact CG1-CB 3.99Å; Q67-A71 WeakPolarHBondContact O-CB 3.49Å; Q67-A71 PolarHBondContact O-N 2.63Å; E68-A71 PolarHBondContact O-N 2.83Å; E68-A71 VanDerWaalsContact O-N 3.09Å; A71-S73 VanDerWaalsContact C-N 3.34Å; A71-S73 PolarHBondContact O-N 3.33Å; A71-V74 PolarHBondContact O-N 3.46Å; A71-C75 VanDerWaalsContact O-CB 3.27Å; A71-C75 WeakPolarHBondContact O-CB 3.28Å; A71-C75 PolarHBondContact O-N 2.87Å; A71-C75 PolarHBondContact O-SG 3.23Å; A71-F266 HydrophobicContact CB-CE1 4.02Å; A71-F266 HydrophobicContact CB-CZ 4Å
72E94.3Very high93Very high18 Ų1859.2 Ų59.28%0.08430%0.299CS..Hα-helixtrans-56.1-47.2173.9-71.6-176154.800111.2K53 I55 A56 C57 E68 Y70 W76K53-E72 IonicContact NZ-OE1 3.47Å; K53-E72 PolarHBondContact NZ-OE1 3.08Å; K53-E72 IonicContact NZ-OE2 2.9Å; K53-E72 PolarHBondContact NZ-OE2 3.12Å; I55-E72 HydrophobicContact CG2-CB 4.37Å; I55-E72 WeakPolarHBondContact CG2-O 3.06Å; A56-E72 WeakPolarHBondContact CA-OE1 3.3Å; C57-E72 HydrophobicContact CB-CG 4.24Å; E68-E72 WeakPolarHBondContact O-CG 3.34Å; E68-E72 PolarHBondContact O-N 3.4Å; Y70-E72 PolarHBondContact O-N 3.41Å; E72-W76 WeakPolarHBondContact O-CB 3.41Å; E72-W76 PolarHBondContact O-N 2.98Å
73S93.1Very high92.7Very high55 Ų5553.5 Ų53.539%0.38527%0.273SS..Hα-helixtrans-66.4-41.3-179.375.60000113.1E69 Y70 A71 W76 V77E69-S73 WeakPolarHBondContact O-CB 3.39Å; E69-S73 PolarHBondContact O-N 2.86Å; E69-S73 PolarHBondContact O-OG 3.05Å; Y70-S73 PolarHBondContact O-N 3.11Å; Y70-S73 PolarHBondContact O-OG 2.92Å; A71-S73 VanDerWaalsContact C-N 3.34Å; A71-S73 PolarHBondContact O-N 3.33Å; S73-W76 PolarHBondContact O-N 3.12Å; S73-V77 WeakPolarHBondContact O-CG2 3.43Å; S73-V77 PolarHBondContact O-N 2.89Å; S73-V77 VanDerWaalsContact O-N 3.15Å
74V94Very high92.4Very high27 Ų2752.6 Ų52.616%0.16427%0.272CS..Hα-helixtrans-65.6-49.1177.8171.30000109.4Y70 A71 W76 V77 T78 F266Y70-V74 HydrophobicContact CD1-CG2 4.22Å; Y70-V74 HydrophobicContact CD2-CG2 4.08Å; Y70-V74 HydrophobicContact CE1-CG2 3.8Å; Y70-V74 HydrophobicContact CE2-CG2 3.64Å; Y70-V74 HydrophobicContact CG-CG2 4.36Å; Y70-V74 VanDerWaalsContact CZ-CG2 3.49Å; Y70-V74 WeakPolarHBondContact O-CG2 3.32Å; Y70-V74 PolarHBondContact O-N 3.3Å; A71-V74 PolarHBondContact O-N 3.46Å; V74-W76 VanDerWaalsContact C-N 3.27Å; V74-W76 PolarHBondContact O-N 3.08Å; V74-V77 PolarHBondContact O-N 3.48Å; V74-T78 HydrophobicContact CG1-CG2 3.92Å; V74-T78 PolarHBondContact O-N 3.41Å; V74-T78 PolarHBondContact O-OG1 2.85Å; V74-F266 HydrophobicContact CG1-CB 3.79Å
75C94.1Very high91.7Very high1 Ų153 Ų531%0.00728%0.275CS..Hα-helixtrans-61.5-35.3179-700000113.1I55 A71 V77 S79 C264I55-C75 HydrophobicContact CD1-CB 4.04Å; A71-C75 VanDerWaalsContact O-CB 3.27Å; A71-C75 WeakPolarHBondContact O-CB 3.28Å; A71-C75 PolarHBondContact O-N 2.87Å; A71-C75 PolarHBondContact O-SG 3.23Å; C75-V77 VanDerWaalsContact C-N 3.34Å; C75-S79 PolarHBondContact O-N 3.33Å; C75-C264 WeakPolarHBondContact CA-SG 3.35Å; C75-C264 HydrophobicContact CB-CB 3.72Å; C75-C264 WeakPolarHBondContact CB-SG 3.31Å; C75-C264 WeakPolarHBondContact SG-CB 3.35Å; C75-C264 CovalentContact SG-SG 2.02Å; C75-C264 PolarHBondContact SG-SG 3.04Å
76W92.6Very high91Very high42 Ų4250.6 Ų50.616%0.15927%0.271CS..Hα-helixtrans-62.2-42.4172-179.8-114.9000111.7Q49 P54 I55 E72 S73 V74 Q106 L283 I285Q49-W76 HydrophobicContact CG-CZ2 3.98Å; P54-W76 HydrophobicContact CB-CD2 4.22Å; P54-W76 HydrophobicContact CB-CE3 4Å; P54-W76 HydrophobicContact CB-CH2 3.98Å; P54-W76 HydrophobicContact CB-CZ2 4.18Å; P54-W76 HydrophobicContact CB-CZ3 3.88Å; P54-W76 HydrophobicContact CG-CD2 3.91Å; P54-W76 HydrophobicContact CG-CE3 4.09Å; P54-W76 HydrophobicContact CG-CG 4.32Å; P54-W76 HydrophobicContact CG-CZ2 4.45Å; P54-W76 HydrophobicContact CG-CZ3 4.46Å; I55-W76 HydrophobicContact CB-CE3 4.32Å; I55-W76 HydrophobicContact CG2-CB 3.92Å; I55-W76 HydrophobicContact CG2-CE3 4.43Å; E72-W76 WeakPolarHBondContact O-CB 3.41Å; E72-W76 PolarHBondContact O-N 2.98Å; S73-W76 PolarHBondContact O-N 3.12Å; V74-W76 VanDerWaalsContact C-N 3.27Å; V74-W76 PolarHBondContact O-N 3.08Å; W76-Q106 HydrophobicContact CZ2-CG 4.2Å; W76-Q106 PolarHBondContact O-NE2 3.21Å; W76-L283 HydrophobicContact CZ3-CD1 4.36Å; W76-I285 HydrophobicContact CH2-CD1 4.01Å; W76-I285 HydrophobicContact CH2-CG2 4.34Å; W76-I285 HydrophobicContact CZ3-CG2 4.17Å
77V92Very high90.3Very high102 Ų10251.2 Ų51.262%0.61827%0.265SS*.Hα-helixtrans-79.5-43.6-175.9174.90000112.5S73 V74 C75 S79 Q106S73-V77 WeakPolarHBondContact O-CG2 3.43Å; S73-V77 PolarHBondContact O-N 2.89Å; S73-V77 VanDerWaalsContact O-N 3.15Å; V74-V77 PolarHBondContact O-N 3.48Å; C75-V77 VanDerWaalsContact C-N 3.34Å; V77-S79 PolarHBondContact O-N 2.98Å; V77-Q106 PolarHBondContact O-NE2 2.82Å
78T89.6Confident89.6Confident63 Ų6354.5 Ų54.539%0.38728%0.284SS..Hα-helixtrans-76.7-5.2-176.255.90000113.9V74V74-T78 HydrophobicContact CG1-CG2 3.92Å; V74-T78 PolarHBondContact O-N 3.41Å; V74-T78 PolarHBondContact O-OG1 2.85Å
79S88.4Confident89.1Confident12 Ų1257.9 Ų57.98%0.08430%0.304CS..  trans64.8155-173.3-50.80000113C75 V77 H103C75-S79 PolarHBondContact O-N 3.33Å; V77-S79 PolarHBondContact O-N 2.98Å; S79-H103 VanDerWaalsContact CB-ND1 3.29Å; S79-H103 WeakPolarHBondContact CB-ND1 3.18Å; S79-H103 PolarHBondContact OG-ND1 2.87Å
80T92.5Very high88.7Confident4 Ų457 Ų573%0.02530%0.301CS..EExtended strand (participates in β ladder)trans-109.2163.3-178.261.10000110.3I55 K101 I102 T262 L263 C264I55-T80 HydrophobicContact CD1-CG2 3.87Å; T80-K101 CarbonylContact O-C 3.59Å; T80-K101 WeakPolarHBondContact O-CA 3.31Å; T80-I102 PolarHBondContact O-N 2.94Å; T80-T262 WeakPolarHBondContact CB-OG1 3.41Å; T80-T262 VanDerWaalsContact OG1-CB 3.25Å; T80-T262 WeakPolarHBondContact OG1-CB 3.35Å; T80-T262 PolarHBondContact OG1-OG1 3.1Å; T80-L263 WeakPolarHBondContact CA-O 3.43Å; T80-L263 WeakPolarHBondContact CB-O 3.29Å; T80-C264 HydrophobicContact CG2-CB 4.17Å
81Y91.9Very high88.4Confident3 Ų352 Ų521%0.01229%0.285CS..EExtended strand (participates in β ladder)trans-122.8154.6175.466.7-89.4000110.5I83 R97 R100 T262 L263 D265Y81-I83 HydrophobicContact CD2-CD1 4.41Å; Y81-I83 HydrophobicContact CD2-CG1 4.01Å; Y81-I83 HydrophobicContact CE2-CD1 3.72Å; Y81-I83 HydrophobicContact CE2-CG1 3.78Å; Y81-R97 HydrophobicContact CD1-CB 4.47Å; Y81-R97 HydrophobicContact CE1-CB 4.42Å; Y81-R97 PolarHBondContact OH-NE 3.02Å; Y81-R97 PolarHBondContact OH-NH2 3.35Å; Y81-R100 WeakPolarHBondContact CA-O 3.25Å; Y81-R100 WeakPolarHBondContact CB-O 3.28Å; Y81-T262 WeakPolarHBondContact O-CB 3.46Å; Y81-L263 HydrophobicContact CD1-CB 4.49Å; Y81-L263 WeakPolarHBondContact CD1-O 3.38Å; Y81-L263 HydrophobicContact CD2-CB 4.28Å; Y81-L263 HydrophobicContact CE1-CB 3.86Å; Y81-L263 HydrophobicContact CE2-CB 3.6Å; Y81-L263 HydrophobicContact CE2-CD1 3.78Å; Y81-L263 HydrophobicContact CE2-CG 4.31Å; Y81-L263 PolarHBondContact N-O 2.86Å; Y81-L263 PolarHBondContact O-N 2.93Å; Y81-L263 VanDerWaalsContact OH-CB 3.28Å; Y81-L263 WeakPolarHBondContact OH-CB 3.44Å; Y81-D265 WeakPolarHBondContact CE1-OD2 3.32Å
82F89.6Confident87.8Confident20 Ų2060.9 Ų60.99%0.08833%0.326CS..  trans-107.3138.5-179.5172.4-108.2000111.1P84 I102 W252 G256 P259F82-P84 HydrophobicContact CE1-CB 4.4Å; F82-P84 HydrophobicContact CE1-CG 4.01Å; F82-P84 HydrophobicContact CZ-CB 4.48Å; F82-I102 HydrophobicContact CB-CD1 3.85Å; F82-W252 HydrophobicContact CE2-CE3 4.05Å; F82-W252 AromaticContact CE2-CZ3 3.82Å; F82-W252 HydrophobicContact CE2-CZ3 3.82Å; F82-G256 VanDerWaalsContact CE1-CA 3.46Å; F82-P259 HydrophobicContact CB-CB 4.02Å; F82-P259 HydrophobicContact CB-CG 3.88Å; F82-P259 HydrophobicContact CD1-CB 4.5Å; F82-P259 HydrophobicContact CD2-CB 3.35Å; F82-P259 HydrophobicContact CD2-CG 4.17Å; F82-P259 HydrophobicContact CE2-CB 3.91Å; F82-P259 HydrophobicContact CG-CB 3.69Å; F82-P259 HydrophobicContact CG-CG 4.02Å
83I87.9Confident87.6Confident25 Ų2564.7 Ų64.713%0.12835%0.347CS..  trans-122.1126.7169.3-63-173.4000107Y81 D87 I90 L263Y81-I83 HydrophobicContact CD2-CD1 4.41Å; Y81-I83 HydrophobicContact CD2-CG1 4.01Å; Y81-I83 HydrophobicContact CE2-CD1 3.72Å; Y81-I83 HydrophobicContact CE2-CG1 3.78Å; I83-D87 HydrophobicContact CG2-CB 3.68Å; I83-I90 HydrophobicContact CD1-CB 4.23Å; I83-I90 HydrophobicContact CD1-CG1 4.11Å; I83-I90 HydrophobicContact CD1-CG2 4.08Å; I83-L263 HydrophobicContact CB-CD1 4.4Å; I83-L263 HydrophobicContact CD1-CD1 3.67Å; I83-L263 HydrophobicContact CG1-CD1 4.05Å
84P85Confident87.3Confident29 Ų2966.2 Ų66.219%0.18835%0.35CS..  trans-56144.5173.1-22.733.4000111.5F82 Q86 D87F82-P84 HydrophobicContact CE1-CB 4.4Å; F82-P84 HydrophobicContact CE1-CG 4.01Å; F82-P84 HydrophobicContact CZ-CB 4.48Å; P84-Q86 PolarHBondContact O-N 3.2Å; P84-D87 PolarHBondContact O-N 3.12Å
85T80Confident87Confident87 Ų8767.6 Ų67.653%0.53436%0.361SS..THydrogen-bonded Turntrans-64.5-16-177.947.80000114D87 Q253T85-D87 VanDerWaalsContact C-N 3.32Å; T85-Q253 HydrophobicContact CG2-CB 4.21Å; T85-Q253 HydrophobicContact CG2-CG 3.97Å
86Q79.2Confident86.7Confident138 Ų13870.9 Ų70.965%0.64538%0.376SS*.THydrogen-bonded Turntrans-72.8-27.4175.8-58.4176.78.200111.7P84 I88P84-Q86 PolarHBondContact O-N 3.2Å; Q86-I88 PolarHBondContact O-N 3.41Å
87D81.4Confident86.6Confident82 Ų8269.3 Ų69.344%0.43937%0.37SS..  trans-90.197.6179.1-66.9-23.9000109.4I83 P84 T85 N89I83-D87 HydrophobicContact CG2-CB 3.68Å; P84-D87 PolarHBondContact O-N 3.12Å; T85-D87 VanDerWaalsContact C-N 3.32Å; D87-N89 VanDerWaalsContact C-N 3.3Å; D87-N89 PolarHBondContact O-N 2.99Å
88I79.9Confident86.3Confident155 Ų15569.3 Ų69.380%0.79536%0.363SS*.  trans-67.9-33-179.1-59.3172000111.4Q86Q86-I88 PolarHBondContact O-N 3.41Å
89N83.6Confident86.2Confident136 Ų13673 Ų7373%0.72738%0.381SS*.SBendtrans-92.7126-172.8-63.9-29.5000111.1D87 P91D87-N89 VanDerWaalsContact C-N 3.3Å; D87-N89 PolarHBondContact O-N 2.99Å; N89-P91 WeakPolarHBondContact O-CD 3.08Å
90I85.3Confident86.1Confident72 Ų7276.9 Ų76.937%0.36939%0.394SS..PPolyproline II helixtrans-70.7124.4169.5-58.7170.7000107.6I83 E92 L263 T278I83-I90 HydrophobicContact CD1-CB 4.23Å; I83-I90 HydrophobicContact CD1-CG1 4.11Å; I83-I90 HydrophobicContact CD1-CG2 4.08Å; I90-E92 PolarHBondContact O-N 3.01Å; I90-L263 HydrophobicContact CD1-CD1 4.18Å; I90-L263 HydrophobicContact CG1-CD1 4.12Å; I90-T278 HydrophobicContact CD1-CG2 4.14Å
91P86.9Confident85.9Confident22 Ų2279.8 Ų79.814%0.14341%0.406CS..PPolyproline II helixtrans-52.8126.2179.7-27.934.2000111.7N89 N93 E96 R97N89-P91 WeakPolarHBondContact O-CD 3.08Å; P91-N93 PolarHBondContact O-N 3.43Å; P91-E96 HydrophobicContact CB-CB 4.21Å; P91-E96 HydrophobicContact CB-CG 4.38Å; P91-E96 WeakPolarHBondContact CB-OE2 3.3Å; P91-E96 HydrophobicContact CG-CG 4.45Å; P91-R97 HydrophobicContact CB-CG 4.41Å; P91-R97 WeakPolarHBondContact O-CD 3.37Å
92E83.6Confident85.6Confident185 Ų18580.9 Ų80.986%0.86441%0.412SS*.SBendtrans-65.2-34.5178-64.3-171.5166.200110.9I90 I94I90-E92 PolarHBondContact O-N 3.01Å; E92-I94 PolarHBondContact O-N 3.22Å
93N88.4Confident85.4Confident98 Ų9884.3 Ų84.352%0.52443%0.428SS..  trans-70.1117.6-179.8-166.5-4.8000111.4P91 S95 E96P91-N93 PolarHBondContact O-N 3.43Å; N93-S95 VanDerWaalsContact C-N 3.28Å; N93-S95 VanDerWaalsContact CG-OG 3.29Å; N93-S95 PolarHBondContact ND2-OG 2.98Å; N93-S95 PolarHBondContact O-N 3.42Å; N93-S95 PolarHBondContact OD1-N 2.94Å; N93-S95 PolarHBondContact OD1-OG 3.35Å; N93-E96 PolarHBondContact O-N 3.25Å
94I86.8Confident85.3Confident88 Ų8885 Ų8545%0.45143%0.429SS..Hα-helixtrans-61.6-39.2-177.1-50.7-174.3000110.7E92 E96 R97 E98E92-I94 PolarHBondContact O-N 3.22Å; I94-E96 PolarHBondContact O-N 3.21Å; I94-R97 WeakPolarHBondContact O-CB 3.34Å; I94-R97 PolarHBondContact O-N 3.17Å; I94-R97 VanDerWaalsContact O-N 3.1Å; I94-E98 HydrophobicContact CG2-CG 4.3Å; I94-E98 WeakPolarHBondContact O-CG 3.28Å; I94-E98 PolarHBondContact O-N 3.41Å
95S88.7Confident85.3Confident55 Ų5583.9 Ų83.939%0.38542%0.421SS..Hα-helixtrans-61.5-33.8-177.761.50000112.5N93 E98 N99N93-S95 VanDerWaalsContact C-N 3.28Å; N93-S95 VanDerWaalsContact CG-OG 3.29Å; N93-S95 PolarHBondContact ND2-OG 2.98Å; N93-S95 PolarHBondContact O-N 3.42Å; N93-S95 PolarHBondContact OD1-N 2.94Å; N93-S95 PolarHBondContact OD1-OG 3.35Å; S95-E98 PolarHBondContact O-N 3.23Å; S95-N99 PolarHBondContact O-N 3.23Å; S95-N99 PolarHBondContact O-ND2 2.89Å
96E88.4Confident85.7Confident70 Ų7081.7 Ų81.733%0.32741%0.405SS..Hα-helixtrans-68.9-41177.6-166.1-175.8159.200111.5P91 N93 I94 E98 N99 R100P91-E96 HydrophobicContact CB-CB 4.21Å; P91-E96 HydrophobicContact CB-CG 4.38Å; P91-E96 WeakPolarHBondContact CB-OE2 3.3Å; P91-E96 HydrophobicContact CG-CG 4.45Å; N93-E96 PolarHBondContact O-N 3.25Å; I94-E96 PolarHBondContact O-N 3.21Å; E96-E98 VanDerWaalsContact C-N 3.27Å; E96-E98 PolarHBondContact O-N 3.49Å; E96-N99 PolarHBondContact O-N 2.97Å; E96-R100 WeakPolarHBondContact O-CG 3.34Å; E96-R100 PolarHBondContact O-N 3.34Å; E96-R100 IonicContact OE1-CZ 3.18Å; E96-R100 IonicContact OE1-NE 2.61Å; E96-R100 PolarHBondContact OE1-NE 2.65Å; E96-R100 IonicContact OE1-NH2 3.9Å; E96-R100 PolarHBondContact OE1-NH2 3.19Å
97R88.8Confident86.3Confident9 Ų982.3 Ų82.33%0.03440%0.401CS..Hα-helixtrans-62.7-38.3175.1-56.4171.276.9160.53.1110.9Y81 P91 I94 R100 D265 T278Y81-R97 HydrophobicContact CD1-CB 4.47Å; Y81-R97 HydrophobicContact CE1-CB 4.42Å; Y81-R97 PolarHBondContact OH-NE 3.02Å; Y81-R97 PolarHBondContact OH-NH2 3.35Å; P91-R97 HydrophobicContact CB-CG 4.41Å; P91-R97 WeakPolarHBondContact O-CD 3.37Å; I94-R97 WeakPolarHBondContact O-CB 3.34Å; I94-R97 PolarHBondContact O-N 3.17Å; I94-R97 VanDerWaalsContact O-N 3.1Å; R97-R100 PolarHBondContact O-N 2.86Å; R97-D265 VanDerWaalsContact CZ-CG 3.44Å; R97-D265 IonicContact CZ-OD1 2.73Å; R97-D265 IonicContact CZ-OD2 3.45Å; R97-D265 IonicContact NE-OD2 3.75Å; R97-D265 PolarHBondContact NE-OD2 3.25Å; R97-D265 IonicContact NH1-OD1 3Å; R97-D265 IonicContact NH1-OD2 2.77Å; R97-D265 IonicContact NH2-OD1 3.32Å; R97-D265 PolarHBondContact NH2-OD1 3.43Å; R97-D265 IonicContact NH2-OD2 3.2Å; R97-D265 PolarHBondContact NH2-OD2 3.04Å; R97-T278 PolarHBondContact NH2-OG1 2.94Å
98E87.1Confident86.7Confident103 Ų10378.4 Ų78.448%0.48138%0.38SS..Hα-helixtrans-66.8-41.6175.9-64.2-158.5129.500113I94 S95 E96 R100 K101I94-E98 HydrophobicContact CG2-CG 4.3Å; I94-E98 WeakPolarHBondContact O-CG 3.28Å; I94-E98 PolarHBondContact O-N 3.41Å; S95-E98 PolarHBondContact O-N 3.23Å; E96-E98 VanDerWaalsContact C-N 3.27Å; E96-E98 PolarHBondContact O-N 3.49Å; E98-R100 PolarHBondContact O-N 3.36Å; E98-K101 HydrophobicContact CB-CD 4.48Å; E98-K101 VanDerWaalsContact O-CB 3.3Å; E98-K101 WeakPolarHBondContact O-CB 3.46Å; E98-K101 WeakPolarHBondContact O-CG 3.49Å; E98-K101 PolarHBondContact O-N 3.27Å; E98-K101 VanDerWaalsContact O-N 3.12Å; E98-K101 IonicContact OE1-NZ 2.88Å; E98-K101 PolarHBondContact OE1-NZ 3.39Å; E98-K101 VanDerWaalsContact OE1-NZ 3.13Å
99N86.5Confident87.3Confident141 Ų14171.4 Ų71.475%0.75435%0.345SS*.Hα-helixtrans-65.6-24.6177.7-70.3-21.2000113S95 E96S95-N99 PolarHBondContact O-N 3.23Å; S95-N99 PolarHBondContact O-ND2 2.89Å; E96-N99 PolarHBondContact O-N 2.97Å
100R86.2Confident87.8Confident93 Ų9369.2 Ų69.235%0.35133%0.329SS..THydrogen-bonded Turntrans-88.93.1176.6-65.8176-174-104.38.7113.5Y81 E96 R97 E98Y81-R100 WeakPolarHBondContact CA-O 3.25Å; Y81-R100 WeakPolarHBondContact CB-O 3.28Å; E96-R100 WeakPolarHBondContact O-CG 3.34Å; E96-R100 PolarHBondContact O-N 3.34Å; E96-R100 IonicContact OE1-CZ 3.18Å; E96-R100 IonicContact OE1-NE 2.61Å; E96-R100 PolarHBondContact OE1-NE 2.65Å; E96-R100 IonicContact OE1-NH2 3.9Å; E96-R100 PolarHBondContact OE1-NH2 3.19Å; R97-R100 PolarHBondContact O-N 2.86Å; E98-R100 PolarHBondContact O-N 3.36Å
101K87.9Confident88.2Confident64 Ų6467.1 Ų67.128%0.27832%0.319SS..EExtended strand (participates in β ladder)trans-67.3138.9179.2-74.6175179.41700111.6T80 E98 H103T80-K101 CarbonylContact O-C 3.59Å; T80-K101 WeakPolarHBondContact O-CA 3.31Å; E98-K101 HydrophobicContact CB-CD 4.48Å; E98-K101 VanDerWaalsContact O-CB 3.3Å; E98-K101 WeakPolarHBondContact O-CB 3.46Å; E98-K101 WeakPolarHBondContact O-CG 3.49Å; E98-K101 PolarHBondContact O-N 3.27Å; E98-K101 VanDerWaalsContact O-N 3.12Å; E98-K101 IonicContact OE1-NZ 2.88Å; E98-K101 PolarHBondContact OE1-NZ 3.39Å; E98-K101 VanDerWaalsContact OE1-NZ 3.13Å; K101-H103 WeakPolarHBondContact CB-NE2 3.46Å
102I86.4Confident88.5Confident27 Ų2766.1 Ų66.114%0.13831%0.312CS..EExtended strand (participates in β ladder)trans-110.6107.9-176.6-54170.7000109.1T80 F82 Y104 Y105 P259T80-I102 PolarHBondContact O-N 2.94Å; F82-I102 HydrophobicContact CB-CD1 3.85Å; I102-Y104 HydrophobicContact CG2-CD1 3.37Å; I102-Y104 HydrophobicContact CG2-CE1 3.17Å; I102-Y105 HydrophobicContact CB-CE2 3.87Å; I102-Y105 HydrophobicContact CG2-CD2 4.01Å; I102-Y105 HydrophobicContact CG2-CE2 3.28Å; I102-P259 HydrophobicContact CD1-CG 3.36Å
103H84.9Confident89Confident92 Ų9262.5 Ų62.543%0.42630%0.296SS..  trans-99.9-15.8-171.5-63.2-68.5000114.7S79 K101 Y105S79-H103 VanDerWaalsContact CB-ND1 3.29Å; S79-H103 WeakPolarHBondContact CB-ND1 3.18Å; S79-H103 PolarHBondContact OG-ND1 2.87Å; K101-H103 WeakPolarHBondContact CB-NE2 3.46Å; H103-Y105 VanDerWaalsContact C-N 3.33Å; H103-Y105 PolarHBondContact O-N 3.47Å
104Y85.6Confident89.3Confident38 Ų3862.2 Ų62.215%0.14929%0.294CS..G310 helixtrans-69-25.9-164.969-94.1000114.5I102 Q106 W107 V108 F258I102-Y104 HydrophobicContact CG2-CD1 3.37Å; I102-Y104 HydrophobicContact CG2-CE1 3.17Å; Y104-Q106 VanDerWaalsContact C-N 3.31Å; Y104-Q106 PolarHBondContact O-N 3.43Å; Y104-W107 PolarHBondContact O-N 3.42Å; Y104-V108 HydrophobicContact CD2-CG2 3.92Å; Y104-V108 WeakPolarHBondContact O-CG2 3.46Å; Y104-V108 PolarHBondContact O-N 2.86Å; Y104-V108 VanDerWaalsContact O-N 3.16Å; Y104-F258 HydrophobicContact CE2-CD1 4.46Å; Y104-F258 HydrophobicContact CE2-CE1 4.19Å; Y104-F258 WeakPolarHBondContact OH-CD1 3.43Å
105Y86.7Confident89.7Confident6 Ų658 Ų582%0.02427%0.272CS..G310 helixtrans-55.7-42.3-174.1-56.4-56.9000113.8I102 H103 W107 P259 L283 N286I102-Y105 HydrophobicContact CB-CE2 3.87Å; I102-Y105 HydrophobicContact CG2-CD2 4.01Å; I102-Y105 HydrophobicContact CG2-CE2 3.28Å; H103-Y105 VanDerWaalsContact C-N 3.33Å; H103-Y105 PolarHBondContact O-N 3.47Å; Y105-W107 PolarHBondContact O-N 2.9Å; Y105-P259 WeakPolarHBondContact OH-CD 3.37Å; Y105-L283 HydrophobicContact CD2-CD2 3.52Å; Y105-L283 HydrophobicContact CE1-CD2 4.34Å; Y105-L283 HydrophobicContact CE2-CD2 3.3Å; Y105-L283 HydrophobicContact CG-CD2 4.14Å; Y105-N286 HydrophobicContact CE1-CB 3.88Å; Y105-N286 WeakPolarHBondContact CE1-OD1 3.32Å
106Q88.1Confident90Very high42 Ų4255.6 Ų55.620%0.19626%0.256CS..G310 helixtrans-65.3-26.4179.7-61.1172-27.400112.1W76 V77 Y104W76-Q106 HydrophobicContact CZ2-CG 4.2Å; W76-Q106 PolarHBondContact O-NE2 3.21Å; V77-Q106 PolarHBondContact O-NE2 2.82Å; Y104-Q106 VanDerWaalsContact C-N 3.31Å; Y104-Q106 PolarHBondContact O-N 3.43Å
107W90.5Very high90.2Very high150 Ų15058.4 Ų58.457%0.56827%0.267SS*.G310 helixtrans-97.1-14.4-173-63.797.3000113.8Y104 Y105 F110 I111Y104-W107 PolarHBondContact O-N 3.42Å; Y105-W107 PolarHBondContact O-N 2.9Å; W107-F110 HydrophobicContact CE3-CD2 4.14Å; W107-F110 PolarHBondContact O-N 3.12Å; W107-F110 VanDerWaalsContact O-N 3.1Å; W107-I111 HydrophobicContact CB-CD1 3.85Å; W107-I111 HydrophobicContact CB-CG1 4.36Å; W107-I111 WeakPolarHBondContact O-CB 3.45Å; W107-I111 VanDerWaalsContact O-CG1 3.31Å; W107-I111 WeakPolarHBondContact O-CG1 3.17Å; W107-I111 PolarHBondContact O-N 3.48Å
108V91.5Very high90.6Very high0 Ų060.3 Ų60.30%028%0.278CS..Hα-helixtrans-52.1-48.4-175.7178.40000112.9I45 Y104 F110 I111 L112 F293I45-V108 HydrophobicContact CD1-CG1 3.66Å; Y104-V108 HydrophobicContact CD2-CG2 3.92Å; Y104-V108 WeakPolarHBondContact O-CG2 3.46Å; Y104-V108 PolarHBondContact O-N 2.86Å; Y104-V108 VanDerWaalsContact O-N 3.16Å; V108-F110 VanDerWaalsContact C-N 3.34Å; V108-F110 PolarHBondContact O-N 3.01Å; V108-I111 PolarHBondContact O-N 3.45Å; V108-L112 HydrophobicContact CG1-CD1 4.06Å; V108-L112 HydrophobicContact CG1-CG 4.21Å; V108-L112 WeakPolarHBondContact O-CG 3.49Å; V108-L112 PolarHBondContact O-N 3.49Å; V108-F293 HydrophobicContact CG1-CE2 4.09Å; V108-F293 HydrophobicContact CG1-CZ 3.91Å; V108-F293 HydrophobicContact CG2-CE2 4.25Å; V108-F293 HydrophobicContact CG2-CZ 4.36Å
109P92.4Very high90.9Very high8 Ų855.5 Ų55.55%0.05226%0.255CS..Hα-helixtrans-60.5-41.2179.4-23.234000113.3T42 I45 L112 M113T42-P109 HydrophobicContact CG2-CB 4.27Å; T42-P109 WeakPolarHBondContact CG2-O 3.22Å; I45-P109 HydrophobicContact CG2-CG 3.83Å; P109-L112 PolarHBondContact O-N 2.93Å; P109-M113 PolarHBondContact O-N 3.33Å; P109-M113 VanDerWaalsContact O-N 3.08Å
110F93Very high91.2Very high90 Ų9051.6 Ų51.640%0.39523%0.234SC..Hα-helixtrans-68.4-40.6178.9-59-66.5000111.6W107 V108 M113 I114W107-F110 HydrophobicContact CE3-CD2 4.14Å; W107-F110 PolarHBondContact O-N 3.12Å; W107-F110 VanDerWaalsContact O-N 3.1Å; V108-F110 VanDerWaalsContact C-N 3.34Å; V108-F110 PolarHBondContact O-N 3.01Å; F110-M113 HydrophobicContact CD1-CE 4.37Å; F110-M113 PolarHBondContact O-N 2.89Å; F110-I114 VanDerWaalsContact O-CG1 3.31Å; F110-I114 WeakPolarHBondContact O-CG1 3.35Å; F110-I114 PolarHBondContact O-N 2.89Å
111I93.2Very high91.5Very high29 Ų2950.2 Ų50.215%0.14923%0.234CC..Hα-helixtrans-58.9-52.9174.7-72.4166.2000109.8W107 V108 M113 I114 Q115 I230W107-I111 HydrophobicContact CB-CD1 3.85Å; W107-I111 HydrophobicContact CB-CG1 4.36Å; W107-I111 WeakPolarHBondContact O-CB 3.45Å; W107-I111 VanDerWaalsContact O-CG1 3.31Å; W107-I111 WeakPolarHBondContact O-CG1 3.17Å; W107-I111 PolarHBondContact O-N 3.48Å; V108-I111 PolarHBondContact O-N 3.45Å; I111-M113 PolarHBondContact O-N 3.26Å; I111-I114 CarbonylContact O-C 3.57Å; I111-I114 WeakPolarHBondContact O-CA 3.02Å; I111-I114 WeakPolarHBondContact O-CB 3.46Å; I111-I114 PolarHBondContact O-N 2.95Å; I111-Q115 HydrophobicContact CG2-CG 4.28Å; I111-Q115 WeakPolarHBondContact O-CG 3.14Å; I111-Q115 PolarHBondContact O-N 3.33Å; I111-I230 HydrophobicContact CB-CD1 4.48Å; I111-I230 HydrophobicContact CD1-CD1 3.89Å; I111-I230 HydrophobicContact CD1-CG1 4.1Å; I111-I230 HydrophobicContact CD1-CG2 3.97Å; I111-I230 HydrophobicContact CG1-CD1 4.3Å; I111-I230 HydrophobicContact CG2-CD1 3.42Å; I111-I230 VanDerWaalsContact CG2-CD1 3.42Å
112L94.1Very high91.7Very high0 Ų047.3 Ų47.30%022%0.221CC..Hα-helixtrans-59.9-36.2-179.4-68.3179.4000112.1L38 F41 T42 I45 V108 P109 Q115 A116 L296L38-L112 HydrophobicContact CD2-CD2 3.92Å; F41-L112 HydrophobicContact CB-CD1 4.13Å; T42-L112 WeakPolarHBondContact OG1-CB 3.45Å; I45-L112 HydrophobicContact CD1-CD1 3.58Å; V108-L112 HydrophobicContact CG1-CD1 4.06Å; V108-L112 HydrophobicContact CG1-CG 4.21Å; V108-L112 WeakPolarHBondContact O-CG 3.49Å; V108-L112 PolarHBondContact O-N 3.49Å; P109-L112 PolarHBondContact O-N 2.93Å; L112-Q115 PolarHBondContact O-N 3.47Å; L112-A116 WeakPolarHBondContact O-CB 3.37Å; L112-A116 PolarHBondContact O-N 3.38Å; L112-L296 HydrophobicContact CD2-CD1 3.8Å
113M93.9Very high91.9Very high110 Ų11046.1 Ų46.154%0.54222%0.215SC..Hα-helixtrans-64.8-42.3173.4-174175.464.300112.4P109 F110 I111 A116 F117P109-M113 PolarHBondContact O-N 3.33Å; P109-M113 VanDerWaalsContact O-N 3.08Å; F110-M113 HydrophobicContact CD1-CE 4.37Å; F110-M113 PolarHBondContact O-N 2.89Å; I111-M113 PolarHBondContact O-N 3.26Å; M113-A116 PolarHBondContact O-N 3.18Å; M113-F117 PolarHBondContact O-N 3.11Å
114I94.6Very high92.1Very high92 Ų9245.2 Ų45.247%0.47221%0.213SC..Hα-helixtrans-64.2-43174.2-68.1165.7000110.4F110 I111 A116 F117 L118F110-I114 VanDerWaalsContact O-CG1 3.31Å; F110-I114 WeakPolarHBondContact O-CG1 3.35Å; F110-I114 PolarHBondContact O-N 2.89Å; I111-I114 CarbonylContact O-C 3.57Å; I111-I114 WeakPolarHBondContact O-CA 3.02Å; I111-I114 WeakPolarHBondContact O-CB 3.46Å; I111-I114 PolarHBondContact O-N 2.95Å; I114-A116 VanDerWaalsContact C-N 3.33Å; I114-A116 PolarHBondContact O-N 3.22Å; I114-F117 WeakPolarHBondContact O-CB 3.49Å; I114-F117 PolarHBondContact O-N 3.36Å; I114-L118 HydrophobicContact CG2-CD1 3.96Å; I114-L118 HydrophobicContact CG2-CG 4.3Å; I114-L118 VanDerWaalsContact O-CG 3.32Å; I114-L118 WeakPolarHBondContact O-CG 2.89Å; I114-L118 PolarHBondContact O-N 2.94Å
115Q94.9Very high92.3Very high0 Ų045.2 Ų45.20%022%0.215CC..Hα-helixtrans-59.5-45175.6-64.9-169.8-27.800111L38 I111 L112 F117 L118 F119 L226L38-Q115 HydrophobicContact CD1-CB 4.01Å; I111-Q115 HydrophobicContact CG2-CG 4.28Å; I111-Q115 WeakPolarHBondContact O-CG 3.14Å; I111-Q115 PolarHBondContact O-N 3.33Å; L112-Q115 PolarHBondContact O-N 3.47Å; Q115-F117 VanDerWaalsContact C-N 3.31Å; Q115-F117 PolarHBondContact O-N 3.08Å; Q115-L118 PolarHBondContact O-N 2.95Å; Q115-F119 VanDerWaalsContact O-CD2 3.31Å; Q115-F119 WeakPolarHBondContact O-CD2 3.22Å; Q115-F119 PolarHBondContact O-N 3.1Å; Q115-L226 HydrophobicContact CG-CD2 4.08Å
116A95.1Very high92.4Very high4 Ų445.1 Ų45.13%0.03322%0.215CC..Hα-helixtrans-60.3-39.8175.800000112.1S35 L38 I39 L112 M113 I114 N120S35-A116 PolarHBondContact OG-O 3.4Å; L38-A116 HydrophobicContact CB-CB 3.86Å; L38-A116 HydrophobicContact CD1-CB 4.27Å; I39-A116 HydrophobicContact CG1-CB 4.04Å; L112-A116 WeakPolarHBondContact O-CB 3.37Å; L112-A116 PolarHBondContact O-N 3.38Å; M113-A116 PolarHBondContact O-N 3.18Å; I114-A116 VanDerWaalsContact C-N 3.33Å; I114-A116 PolarHBondContact O-N 3.22Å; A116-N120 PolarHBondContact O-N 2.92Å; A116-N120 PolarHBondContact O-ND2 3.46Å
117F93.8Very high92.3Very high129 Ų12946.2 Ų46.257%0.56622%0.217SC*.Hα-helixtrans-63.9-45.8174.2175.3-98.7000112.1M113 I114 Q115 F119 N120 L121M113-F117 PolarHBondContact O-N 3.11Å; I114-F117 WeakPolarHBondContact O-CB 3.49Å; I114-F117 PolarHBondContact O-N 3.36Å; Q115-F117 VanDerWaalsContact C-N 3.31Å; Q115-F117 PolarHBondContact O-N 3.08Å; F117-F119 VanDerWaalsContact C-N 3.32Å; F117-F119 PolarHBondContact O-N 3.09Å; F117-N120 WeakPolarHBondContact O-CA 3.45Å; F117-N120 WeakPolarHBondContact O-CB 3.37Å; F117-N120 PolarHBondContact O-N 3.32Å; F117-L121 PolarHBondContact O-N 3.42Å
118L95.2Very high92.1Very high49 Ų4944 Ų4426%0.25722%0.216SC..Hα-helixtrans-63.9-34.2179.8-70.6172.7000112.6I114 Q115 N120 L121 P122 N219 Q223I114-L118 HydrophobicContact CG2-CD1 3.96Å; I114-L118 HydrophobicContact CG2-CG 4.3Å; I114-L118 VanDerWaalsContact O-CG 3.32Å; I114-L118 WeakPolarHBondContact O-CG 2.89Å; I114-L118 PolarHBondContact O-N 2.94Å; Q115-L118 PolarHBondContact O-N 2.95Å; L118-N120 PolarHBondContact O-N 3.49Å; L118-L121 HydrophobicContact CD2-CD1 4.1Å; L118-L121 VanDerWaalsContact O-CB 3.25Å; L118-L121 WeakPolarHBondContact O-CB 3.04Å; L118-L121 PolarHBondContact O-N 3.02Å; L118-L121 VanDerWaalsContact O-N 3.1Å; L118-P122 WeakPolarHBondContact O-CD 2.83Å; L118-N219 PolarHBondContact O-OD1 3.44Å; L118-Q223 VanDerWaalsContact CD1-NE2 3.3Å
119F94.9Very high91.8Very high1 Ų148 Ų480%0.00423%0.233CC..Hα-helixtrans-62.5-24.4170-86.1-72.5000114.3H31 T34 S35 L38 Q115 F117 N219 V220 Q223 F300 V303H31-F119 WeakPolarHBondContact CB-O 3.3Å; T34-F119 HydrophobicContact CG2-CD1 4.2Å; T34-F119 HydrophobicContact CG2-CD2 3.94Å; T34-F119 HydrophobicContact CG2-CE1 3.99Å; T34-F119 HydrophobicContact CG2-CE2 3.68Å; T34-F119 HydrophobicContact CG2-CG 4.19Å; T34-F119 HydrophobicContact CG2-CZ 3.72Å; S35-F119 WeakPolarHBondContact OG-CB 3.39Å; L38-F119 HydrophobicContact CD1-CD2 3.5Å; L38-F119 VanDerWaalsContact CD1-CD2 3.5Å; L38-F119 HydrophobicContact CD1-CE2 3.75Å; Q115-F119 VanDerWaalsContact O-CD2 3.31Å; Q115-F119 WeakPolarHBondContact O-CD2 3.22Å; Q115-F119 PolarHBondContact O-N 3.1Å; F117-F119 VanDerWaalsContact C-N 3.32Å; F117-F119 PolarHBondContact O-N 3.09Å; F119-N219 WeakPolarHBondContact CA-ND2 3.36Å; F119-N219 WeakPolarHBondContact CD1-ND2 3.42Å; F119-V220 HydrophobicContact CE1-CB 4.32Å; F119-V220 HydrophobicContact CE1-CG2 4.49Å; F119-V220 HydrophobicContact CZ-CG2 4.46Å; F119-Q223 HydrophobicContact CD2-CG 4.18Å; F119-Q223 HydrophobicContact CE1-CG 4.46Å; F119-Q223 HydrophobicContact CE2-CB 4.25Å; F119-Q223 HydrophobicContact CE2-CG 3.55Å; F119-Q223 HydrophobicContact CZ-CB 4.23Å; F119-Q223 HydrophobicContact CZ-CG 3.71Å; F119-F300 HydrophobicContact CE2-CD1 4.28Å; F119-F300 AromaticContact CE2-CE1 3.51Å; F119-F300 HydrophobicContact CE2-CE1 3.51Å; F119-F300 AromaticContact CE2-CZ 3.8Å; F119-F300 HydrophobicContact CE2-CZ 3.8Å; F119-F300 AromaticContact CZ-CD1 3.85Å; F119-F300 HydrophobicContact CZ-CD1 3.85Å; F119-F300 AromaticContact CZ-CE1 3.55Å; F119-F300 HydrophobicContact CZ-CE1 3.55Å; F119-F300 HydrophobicContact CZ-CZ 4.14Å; F119-V303 HydrophobicContact CE1-CG1 4.23Å
120N91.7Very high91.4Very high60 Ų6047.9 Ų47.932%0.32123%0.233SC..Hα-helixtrans-85.4-15174-74.3-73.2000113.6H31 S35 A116 F117 L118 C123 L124H31-N120 PolarHBondContact O-OD1 3.26Å; S35-N120 WeakPolarHBondContact CB-ND2 3.31Å; S35-N120 PolarHBondContact OG-ND2 3.45Å; A116-N120 PolarHBondContact O-N 2.92Å; A116-N120 PolarHBondContact O-ND2 3.46Å; F117-N120 WeakPolarHBondContact O-CA 3.45Å; F117-N120 WeakPolarHBondContact O-CB 3.37Å; F117-N120 PolarHBondContact O-N 3.32Å; L118-N120 PolarHBondContact O-N 3.49Å; N120-C123 WeakPolarHBondContact O-CB 3.33Å; N120-C123 PolarHBondContact O-N 2.92Å; N120-L124 PolarHBondContact O-N 3.42Å
121L92.7Very high90.7Very high64 Ų6452.2 Ų52.234%0.33525%0.246SC..Hα-helixtrans-60.6-44.9-173.8-170.7158.9000113.2F117 L118 C123 L124 I125F117-L121 PolarHBondContact O-N 3.42Å; L118-L121 HydrophobicContact CD2-CD1 4.1Å; L118-L121 VanDerWaalsContact O-CB 3.25Å; L118-L121 WeakPolarHBondContact O-CB 3.04Å; L118-L121 PolarHBondContact O-N 3.02Å; L118-L121 VanDerWaalsContact O-N 3.1Å; L121-C123 VanDerWaalsContact C-N 3.3Å; L121-C123 PolarHBondContact O-N 3.41Å; L121-L124 WeakPolarHBondContact O-CB 3.43Å; L121-L124 PolarHBondContact O-N 3.32Å; L121-L124 VanDerWaalsContact O-N 3.16Å; L121-I125 HydrophobicContact CD2-CD1 3.38Å; L121-I125 HydrophobicContact CD2-CG1 4.04Å; L121-I125 WeakPolarHBondContact O-CG1 3.02Å; L121-I125 PolarHBondContact O-N 2.98Å
122P92.4Very high89.9Confident2 Ų255.9 Ų55.91%0.01326%0.263CS..Hα-helixtrans-61.8-36177.4-23.734.7000113.3L118 I125 W126 T212 L215 Y216 N219L118-P122 WeakPolarHBondContact O-CD 2.83Å; P122-I125 PolarHBondContact O-N 2.98Å; P122-W126 PolarHBondContact O-N 3.4Å; P122-T212 HydrophobicContact CB-CG2 4.44Å; P122-L215 HydrophobicContact CB-CB 4.04Å; P122-L215 HydrophobicContact CG-CB 4.2Å; P122-Y216 HydrophobicContact CB-CD1 3.82Å; P122-Y216 HydrophobicContact CB-CD2 3.95Å; P122-Y216 HydrophobicContact CB-CE1 3.76Å; P122-Y216 HydrophobicContact CB-CE2 3.89Å; P122-Y216 HydrophobicContact CB-CG 3.92Å; P122-Y216 HydrophobicContact CG-CD1 3.8Å; P122-Y216 HydrophobicContact CG-CE1 3.99Å; P122-Y216 HydrophobicContact CG-CG 4.17Å; P122-N219 HydrophobicContact CG-CB 4.26Å
123C89.8Confident88.9Confident3 Ų356.3 Ų56.32%0.0227%0.266CS..Hα-helixtrans-65.6-42.1175.1-172.20000111.2H31 N120 L121 I125 W126 R127 Y216H31-C123 HydrophobicContact CB-CB 4.17Å; N120-C123 WeakPolarHBondContact O-CB 3.33Å; N120-C123 PolarHBondContact O-N 2.92Å; L121-C123 VanDerWaalsContact C-N 3.3Å; L121-C123 PolarHBondContact O-N 3.41Å; C123-I125 VanDerWaalsContact C-N 3.34Å; C123-I125 PolarHBondContact O-N 2.88Å; C123-W126 WeakPolarHBondContact O-CB 3.05Å; C123-W126 PolarHBondContact O-N 3.17Å; C123-R127 VanDerWaalsContact O-CG 3.31Å; C123-R127 WeakPolarHBondContact O-CG 3.23Å; C123-R127 PolarHBondContact O-N 3.04Å; C123-R127 PolarHBondContact SG-NE 3.13Å; C123-R127 PolarHBondContact SG-NH2 3.02Å; C123-R127 VanDerWaalsContact SG-NH2 3.38Å; C123-Y216 WeakPolarHBondContact CB-OH 3.41Å
124L89.4Confident88Confident72 Ų7253.4 Ų53.438%0.37726%0.264SS..Hα-helixtrans-60.6-44.6174.9-178.862.8000111.1N120 L121 W126 R127 L128N120-L124 PolarHBondContact O-N 3.42Å; L121-L124 WeakPolarHBondContact O-CB 3.43Å; L121-L124 PolarHBondContact O-N 3.32Å; L121-L124 VanDerWaalsContact O-N 3.16Å; L124-W126 PolarHBondContact O-N 3.44Å; L124-R127 PolarHBondContact O-N 3.37Å; L124-L128 HydrophobicContact CD1-CD1 4Å; L124-L128 HydrophobicContact CD1-CG 4.06Å; L124-L128 HydrophobicContact CD2-CD1 4.48Å; L124-L128 HydrophobicContact CG-CD1 3.81Å; L124-L128 HydrophobicContact CG-CG 4.3Å; L124-L128 WeakPolarHBondContact O-CB 3.23Å; L124-L128 WeakPolarHBondContact O-CG 3.22Å; L124-L128 PolarHBondContact O-N 3.41Å
125I89.8Confident87.1Confident39 Ų3949 Ų4920%0.224%0.242CC..Hα-helixtrans-58.4-49175.1-70.6177.9000110.5L121 P122 C123 R127 L128 F129 L215L121-I125 HydrophobicContact CD2-CD1 3.38Å; L121-I125 HydrophobicContact CD2-CG1 4.04Å; L121-I125 WeakPolarHBondContact O-CG1 3.02Å; L121-I125 PolarHBondContact O-N 2.98Å; P122-I125 PolarHBondContact O-N 2.98Å; C123-I125 VanDerWaalsContact C-N 3.34Å; C123-I125 PolarHBondContact O-N 2.88Å; I125-R127 PolarHBondContact O-N 3.29Å; I125-L128 PolarHBondContact O-N 3.05Å; I125-F129 HydrophobicContact CB-CD2 4.48Å; I125-F129 HydrophobicContact CG2-CD2 3.66Å; I125-F129 HydrophobicContact CG2-CE2 3.99Å; I125-F129 VanDerWaalsContact O-CD2 3.26Å; I125-F129 WeakPolarHBondContact O-CD2 3.34Å; I125-F129 PolarHBondContact O-N 3.36Å; I125-L215 HydrophobicContact CB-CD1 4.44Å; I125-L215 HydrophobicContact CD1-CD1 3.69Å; I125-L215 HydrophobicContact CG2-CD1 3.91Å
126W89.3Confident86.4Confident3 Ų352.4 Ų52.41%0.01126%0.258CS..Hα-helixtrans-54.3-51.1176.5173.6-111.6000111.8D22 P122 C123 L124 L128 F129 N130 L137 L205 L208 Y209 T212 F360D22-W126 PolarHBondContact OD2-NE1 3.49Å; D22-W126 VanDerWaalsContact OD2-NE1 3.1Å; P122-W126 PolarHBondContact O-N 3.4Å; C123-W126 WeakPolarHBondContact O-CB 3.05Å; C123-W126 PolarHBondContact O-N 3.17Å; L124-W126 PolarHBondContact O-N 3.44Å; W126-L128 PolarHBondContact O-N 3.22Å; W126-F129 PolarHBondContact O-N 3.07Å; W126-N130 HydrophobicContact CD2-CB 4.48Å; W126-N130 WeakPolarHBondContact CZ2-ND2 3.43Å; W126-N130 WeakPolarHBondContact O-CB 3.22Å; W126-N130 PolarHBondContact O-N 3.3Å; W126-L137 HydrophobicContact CH2-CD2 4.27Å; W126-L137 HydrophobicContact CZ2-CD2 3.69Å; W126-L205 HydrophobicContact CH2-CD1 4.25Å; W126-L208 HydrophobicContact CE3-CD2 4.03Å; W126-L208 HydrophobicContact CE3-CG 3.89Å; W126-L208 HydrophobicContact CZ3-CB 4.3Å; W126-L208 HydrophobicContact CZ3-CD2 4Å; W126-L208 HydrophobicContact CZ3-CG 3.91Å; W126-Y209 HydrophobicContact CE3-CD2 4.29Å; W126-Y209 AromaticContact CH2-CD2 3.66Å; W126-Y209 HydrophobicContact CH2-CD2 3.66Å; W126-Y209 HydrophobicContact CH2-CG 4.25Å; W126-Y209 HydrophobicContact CZ2-CD2 4.07Å; W126-Y209 VanDerWaalsContact CZ3-CA 3.48Å; W126-Y209 AromaticContact CZ3-CD2 3.79Å; W126-Y209 HydrophobicContact CZ3-CD2 3.79Å; W126-Y209 HydrophobicContact CZ3-CG 4.22Å; W126-T212 HydrophobicContact CB-CG2 3.89Å; W126-F360 HydrophobicContact CH2-CE1 4.36Å
127R85.2Confident86Confident65 Ų6552.3 Ų52.325%0.24526%0.256CS..Hα-helixtrans-62.3-42.3-178.3-68.9172.9-175.1-175.84.3112.5C123 L124 I125C123-R127 VanDerWaalsContact O-CG 3.31Å; C123-R127 WeakPolarHBondContact O-CG 3.23Å; C123-R127 PolarHBondContact O-N 3.04Å; C123-R127 PolarHBondContact SG-NE 3.13Å; C123-R127 PolarHBondContact SG-NH2 3.02Å; C123-R127 VanDerWaalsContact SG-NH2 3.38Å; L124-R127 PolarHBondContact O-N 3.37Å; I125-R127 PolarHBondContact O-N 3.29Å
128L86.4Confident85.5Confident104 Ų10447.7 Ų47.755%0.54524%0.24SC..Hα-helixtrans-68-42.6-179.4-70.3173.9000112.5L124 I125 W126L124-L128 HydrophobicContact CD1-CD1 4Å; L124-L128 HydrophobicContact CD1-CG 4.06Å; L124-L128 HydrophobicContact CD2-CD1 4.48Å; L124-L128 HydrophobicContact CG-CD1 3.81Å; L124-L128 HydrophobicContact CG-CG 4.3Å; L124-L128 WeakPolarHBondContact O-CB 3.23Å; L124-L128 WeakPolarHBondContact O-CG 3.22Å; L124-L128 PolarHBondContact O-N 3.41Å; I125-L128 PolarHBondContact O-N 3.05Å; W126-L128 PolarHBondContact O-N 3.22Å
129F85.5Confident85Confident83 Ų8347.3 Ų47.336%0.36424%0.242SC..Hα-helixtrans-89.1-20.8-175.8-72.6-73.7000114I125 W126 W131 Q132 Y204 L208I125-F129 HydrophobicContact CB-CD2 4.48Å; I125-F129 HydrophobicContact CG2-CD2 3.66Å; I125-F129 HydrophobicContact CG2-CE2 3.99Å; I125-F129 VanDerWaalsContact O-CD2 3.26Å; I125-F129 WeakPolarHBondContact O-CD2 3.34Å; I125-F129 PolarHBondContact O-N 3.36Å; W126-F129 PolarHBondContact O-N 3.07Å; F129-W131 VanDerWaalsContact C-N 3.34Å; F129-Q132 WeakPolarHBondContact O-CB 3.41Å; F129-Q132 PolarHBondContact O-N 3.34Å; F129-Y204 PolarHBondContact O-OH 2.68Å; F129-L208 HydrophobicContact CB-CD1 3.57Å; F129-L208 HydrophobicContact CB-CD2 3.68Å; F129-L208 HydrophobicContact CB-CG 4.28Å; F129-L208 HydrophobicContact CG-CD1 4.28Å
130N84.2Confident84.7Confident7 Ų747.5 Ų47.54%0.03724%0.243CC..Hα-helixtrans-65.2-39.3175.2-172.6-3.3000110.6W126 Q132 S133 L208W126-N130 HydrophobicContact CD2-CB 4.48Å; W126-N130 WeakPolarHBondContact CZ2-ND2 3.43Å; W126-N130 WeakPolarHBondContact O-CB 3.22Å; W126-N130 PolarHBondContact O-N 3.3Å; N130-Q132 PolarHBondContact O-N 2.85Å; N130-S133 WeakPolarHBondContact O-CB 3.31Å; N130-S133 PolarHBondContact O-N 3Å; N130-S133 PolarHBondContact O-OG 2.94Å; N130-L208 HydrophobicContact CB-CD2 4.39Å
131W78.3Confident84.6Confident180 Ų18044.7 Ų44.768%0.68223%0.228SC*.Hα-helixtrans-56.2-37.4173.1179.3-88.1000112.9F129 S133 G134 H136F129-W131 VanDerWaalsContact C-N 3.34Å; W131-S133 PolarHBondContact O-N 2.86Å; W131-G134 PolarHBondContact O-N 3.41Å; W131-H136 AromaticContact CD2-CE1 3.88Å; W131-H136 AromaticContact CE3-CE1 3.36Å; W131-H136 AromaticContact CE3-ND1 3.51Å; W131-H136 AromaticContact CH2-CE1 3.3Å; W131-H136 WeakPolarHBondContact CH2-CE1 3.26Å; W131-H136 AromaticContact CZ2-CE1 3.82Å; W131-H136 AromaticContact CZ3-CE1 3.06Å; W131-H136 WeakPolarHBondContact CZ3-CE1 3.48Å; W131-H136 AromaticContact CZ3-ND1 3.39Å; W131-H136 WeakPolarHBondContact CZ3-ND1 3.38Å
132Q76.3Confident84.4Confident107 Ų10746.9 Ų46.950%0.524%0.236SC..THydrogen-bonded Turntrans-70.9-9.1179.5-60.9-175.5-3.900114.3F129 N130 G134 K199F129-Q132 WeakPolarHBondContact O-CB 3.41Å; F129-Q132 PolarHBondContact O-N 3.34Å; N130-Q132 PolarHBondContact O-N 2.85Å; Q132-G134 PolarHBondContact O-N 3.44Å; Q132-K199 PolarHBondContact O-NZ 3.45Å
133S74.2Confident84.3Confident8 Ų847.9 Ų47.96%0.05624%0.242CC..THydrogen-bonded Turntrans-69.4-18.6173.673.60000112.5N130 W131 I135 Q174N130-S133 WeakPolarHBondContact O-CB 3.31Å; N130-S133 PolarHBondContact O-N 3Å; N130-S133 PolarHBondContact O-OG 2.94Å; W131-S133 PolarHBondContact O-N 2.86Å; S133-I135 PolarHBondContact O-N 3.09Å; S133-I135 WeakPolarHBondContact OG-CB 3.45Å; S133-I135 PolarHBondContact OG-N 3.43Å; S133-I135 PolarHBondContact OG-O 3.41Å; S133-Q174 PolarHBondContact O-NE2 3.37Å
134G73.8Confident84.4Confident50 Ų5047.8 Ų47.852%0.51524%0.241SC..THydrogen-bonded Turntrans74.1-1.8-168.200000113.3W131 Q132W131-G134 PolarHBondContact O-N 3.41Å; Q132-G134 PolarHBondContact O-N 3.44Å
135I76.8Confident84.4Confident0 Ų044.5 Ų44.50%022%0.224CC..  trans-104.9111.4178.7-47.4-169.1000107.7S133 L137 I140 A170 I361S133-I135 PolarHBondContact O-N 3.09Å; S133-I135 WeakPolarHBondContact OG-CB 3.45Å; S133-I135 PolarHBondContact OG-N 3.43Å; S133-I135 PolarHBondContact OG-O 3.41Å; I135-L137 PolarHBondContact O-N 3.49Å; I135-I140 HydrophobicContact CG2-CD1 3.73Å; I135-A170 HydrophobicContact CB-CB 4.37Å; I135-A170 HydrophobicContact CD1-CB 4.09Å; I135-A170 HydrophobicContact CG1-CB 3.9Å; I135-A170 HydrophobicContact CG2-CB 3.99Å; I135-I361 HydrophobicContact CD1-CD1 4.1Å; I135-I361 HydrophobicContact CG2-CD1 4.17Å
136H80.4Confident84.5Confident71 Ų7147.1 Ų47.133%0.32924%0.236SC..  trans-76.272.6172.3-62.9-58.6000110.6W131 S138 S139 I140W131-H136 AromaticContact CD2-CE1 3.88Å; W131-H136 AromaticContact CE3-CE1 3.36Å; W131-H136 AromaticContact CE3-ND1 3.51Å; W131-H136 AromaticContact CH2-CE1 3.3Å; W131-H136 WeakPolarHBondContact CH2-CE1 3.26Å; W131-H136 AromaticContact CZ2-CE1 3.82Å; W131-H136 AromaticContact CZ3-CE1 3.06Å; W131-H136 WeakPolarHBondContact CZ3-CE1 3.48Å; W131-H136 AromaticContact CZ3-ND1 3.39Å; W131-H136 WeakPolarHBondContact CZ3-ND1 3.38Å; H136-S138 PolarHBondContact O-N 2.98Å; H136-S138 VanDerWaalsContact O-N 3.14Å; H136-S139 PolarHBondContact O-N 2.75Å; H136-I140 PolarHBondContact O-N 2.73Å
137L85.5Confident84.6Confident1 Ų147 Ų471%0.00524%0.235CC..Hα-helixtrans-53.1-38.6-175.3-174.765.4000112.6D22 W126 I135 S139 I140 M141 L205 I361 L364D22-L137 HydrophobicContact CB-CD2 4.32Å; W126-L137 HydrophobicContact CH2-CD2 4.27Å; W126-L137 HydrophobicContact CZ2-CD2 3.69Å; I135-L137 PolarHBondContact O-N 3.49Å; L137-S139 PolarHBondContact O-N 2.96Å; L137-I140 PolarHBondContact O-N 3.14Å; L137-M141 HydrophobicContact CD1-CE 3.95Å; L137-M141 HydrophobicContact CD1-CG 4.44Å; L137-M141 HydrophobicContact CG-CG 4.29Å; L137-M141 WeakPolarHBondContact O-CG 3.48Å; L137-M141 PolarHBondContact O-N 3.28Å; L137-L205 HydrophobicContact CD1-CD2 4.4Å; L137-L205 HydrophobicContact CD2-CD2 4.5Å; L137-I361 HydrophobicContact CD1-CG1 4.01Å; L137-I361 HydrophobicContact CD1-CG2 4.23Å; L137-L364 HydrophobicContact CD1-CD2 4.12Å; L137-L364 HydrophobicContact CD2-CD2 3.65Å; L137-L364 HydrophobicContact CG-CD2 4.1Å
138S84.2Confident84.8Confident32 Ų3249 Ų4922%0.22425%0.247CC..Hα-helixtrans-64.2-37.3179.250.30000113.8R20 H136 M141 E142R20-S138 VanDerWaalsContact CZ-CB 3.42Å; R20-S138 PolarHBondContact NH2-OG 3.44Å; H136-S138 PolarHBondContact O-N 2.98Å; H136-S138 VanDerWaalsContact O-N 3.14Å; S138-M141 PolarHBondContact O-N 3.26Å; S138-E142 VanDerWaalsContact O-CB 3.23Å; S138-E142 WeakPolarHBondContact O-CB 3.31Å; S138-E142 PolarHBondContact O-N 3.14Å
139S85.2Confident84.9Confident42 Ų4250.7 Ų50.729%0.29425%0.254SS..Hα-helixtrans-68.5-39.9176.5178.80000110.5H136 L137 E142 V143H136-S139 PolarHBondContact O-N 2.75Å; L137-S139 PolarHBondContact O-N 2.96Å; S139-E142 PolarHBondContact O-N 2.88Å; S139-V143 WeakPolarHBondContact O-CG2 3.22Å; S139-V143 PolarHBondContact O-N 3.26Å; S139-V143 VanDerWaalsContact O-N 3.08Å
140I88.3Confident85.1Confident4 Ų448.3 Ų48.32%0.02125%0.245CC..Hα-helixtrans-61.3-46.5174.6-58.1175.7000110.4I135 H136 L137 A144 V163 I167 I361I135-I140 HydrophobicContact CG2-CD1 3.73Å; H136-I140 PolarHBondContact O-N 2.73Å; L137-I140 PolarHBondContact O-N 3.14Å; I140-A144 WeakPolarHBondContact O-CB 3.49Å; I140-A144 PolarHBondContact O-N 3.03Å; I140-V163 HydrophobicContact CG2-CG1 4.03Å; I140-I167 HydrophobicContact CD1-CG1 4.21Å; I140-I167 HydrophobicContact CG2-CD1 4.18Å; I140-I167 HydrophobicContact CG2-CG1 4.08Å; I140-I361 HydrophobicContact CG2-CG2 4.41Å
141M89Confident85.3Confident2 Ų258 Ų581%0.0129%0.287CS..Hα-helixtrans-67.8-38.4179.5-66.7-5498.500112.4D22 L137 S138 A144 C145 I361 L364 T365D22-M141 HydrophobicContact CB-CG 4.41Å; L137-M141 HydrophobicContact CD1-CE 3.95Å; L137-M141 HydrophobicContact CD1-CG 4.44Å; L137-M141 HydrophobicContact CG-CG 4.29Å; L137-M141 WeakPolarHBondContact O-CG 3.48Å; L137-M141 PolarHBondContact O-N 3.28Å; S138-M141 PolarHBondContact O-N 3.26Å; M141-A144 PolarHBondContact O-N 2.93Å; M141-C145 WeakPolarHBondContact O-CB 3.47Å; M141-C145 PolarHBondContact O-N 3Å; M141-C145 PolarHBondContact O-SG 3Å; M141-I361 HydrophobicContact CE-CG2 4.07Å; M141-L364 HydrophobicContact CG-CD2 4.24Å; M141-L364 HydrophobicContact SD-CB 4.27Å; M141-L364 HydrophobicContact SD-CD2 3.95Å; M141-L364 HydrophobicContact SD-CG 3.86Å; M141-T365 WeakPolarHBondContact CE-OG1 3.3Å
142E88.8Confident85.9Confident110 Ų11052.8 Ų52.851%0.51427%0.273SS..Hα-helixtrans-60.7-53.9177.8-174.9167.6-15300110.8S138 S139 A144 C145 E146S138-E142 VanDerWaalsContact O-CB 3.23Å; S138-E142 WeakPolarHBondContact O-CB 3.31Å; S138-E142 PolarHBondContact O-N 3.14Å; S139-E142 PolarHBondContact O-N 2.88Å; E142-A144 VanDerWaalsContact C-N 3.32Å; E142-A144 PolarHBondContact O-N 2.84Å; E142-C145 PolarHBondContact O-N 3.08Å; E142-E146 WeakPolarHBondContact O-CG 3.45Å; E142-E146 PolarHBondContact O-N 3.41Å
143V90.7Very high86.7Confident23 Ų2352.2 Ų52.214%0.13928%0.278CS..Hα-helixtrans-63.9-38177-179.30000111.4S139 C145 E146 I147 Y162 V163S139-V143 WeakPolarHBondContact O-CG2 3.22Å; S139-V143 PolarHBondContact O-N 3.26Å; S139-V143 VanDerWaalsContact O-N 3.08Å; V143-C145 PolarHBondContact O-N 2.94Å; V143-E146 PolarHBondContact O-N 3.43Å; V143-I147 HydrophobicContact CG1-CD1 4.47Å; V143-I147 WeakPolarHBondContact O-CG1 3.17Å; V143-I147 PolarHBondContact O-N 3.44Å; V143-Y162 HydrophobicContact CG1-CD1 4.22Å; V143-Y162 HydrophobicContact CG2-CE1 4.34Å; V143-V163 HydrophobicContact CB-CG2 4.04Å; V143-V163 HydrophobicContact CG1-CG2 3.59Å
144A91.5Very high87.5Confident0 Ų058.3 Ų58.30%031%0.305CS..Hα-helixtrans-62.5-41.4176.800000112.8I140 M141 E142 I147 T365 A369I140-A144 WeakPolarHBondContact O-CB 3.49Å; I140-A144 PolarHBondContact O-N 3.03Å; M141-A144 PolarHBondContact O-N 2.93Å; E142-A144 VanDerWaalsContact C-N 3.32Å; E142-A144 PolarHBondContact O-N 2.84Å; A144-I147 WeakPolarHBondContact O-CB 3.41Å; A144-I147 PolarHBondContact O-N 2.53Å; A144-T365 HydrophobicContact CB-CG2 3.86Å; A144-A369 HydrophobicContact CB-CB 4.13Å; A144-A369 WeakPolarHBondContact O-CB 3.47Å
145C89.4Confident88.5Confident3 Ų359 Ų592%0.0230%0.3CS..Hα-helixtrans-71.5-31.6175.4-68.80000112.3R21 M141 E142 V143 I147 E148 N368R21-C145 WeakPolarHBondContact CD-SG 3.45Å; R21-C145 VanDerWaalsContact NH1-CB 3.32Å; M141-C145 WeakPolarHBondContact O-CB 3.47Å; M141-C145 PolarHBondContact O-N 3Å; M141-C145 PolarHBondContact O-SG 3Å; E142-C145 PolarHBondContact O-N 3.08Å; V143-C145 PolarHBondContact O-N 2.94Å; C145-I147 VanDerWaalsContact C-N 3.31Å; C145-E148 WeakPolarHBondContact O-CB 3.48Å; C145-E148 PolarHBondContact O-N 3.5Å; C145-N368 PolarHBondContact SG-O 3.35Å
146E90.8Very high89.3Confident94 Ų9460.9 Ų60.944%0.43931%0.307SS..Hα-helixtrans-64.9-35.6174.2-73.9173.417900112E142 V143 E148 M149 I150E142-E146 WeakPolarHBondContact O-CG 3.45Å; E142-E146 PolarHBondContact O-N 3.41Å; V143-E146 PolarHBondContact O-N 3.43Å; E146-E148 PolarHBondContact O-N 3.44Å; E146-E148 VanDerWaalsContact O-N 3.13Å; E146-M149 PolarHBondContact O-N 3.18Å; E146-I150 WeakPolarHBondContact O-CG1 3.48Å; E146-I150 PolarHBondContact O-N 2.94Å
147I91.9Very high90Very high0 Ų063.7 Ų63.70%032%0.318CS..Hα-helixtrans-55.3-31.3177-73.5163.2000112.4V143 A144 C145 M149 I150 R156 N159 I160 V163 V373V143-I147 HydrophobicContact CG1-CD1 4.47Å; V143-I147 WeakPolarHBondContact O-CG1 3.17Å; V143-I147 PolarHBondContact O-N 3.44Å; A144-I147 WeakPolarHBondContact O-CB 3.41Å; A144-I147 PolarHBondContact O-N 2.53Å; C145-I147 VanDerWaalsContact C-N 3.31Å; I147-M149 VanDerWaalsContact C-N 3.26Å; I147-M149 PolarHBondContact O-N 3.37Å; I147-I150 PolarHBondContact O-N 3.19Å; I147-R156 HydrophobicContact CG2-CG 4Å; I147-R156 PolarHBondContact O-NH1 2.7Å; I147-N159 HydrophobicContact CD1-CB 3.89Å; I147-N159 HydrophobicContact CG1-CB 3.64Å; I147-I160 HydrophobicContact CD1-CG1 3.89Å; I147-I160 HydrophobicContact CG2-CD1 4.21Å; I147-I160 HydrophobicContact CG2-CG1 3.94Å; I147-V163 HydrophobicContact CD1-CG2 3.92Å; I147-V373 HydrophobicContact CB-CG1 4.16Å; I147-V373 HydrophobicContact CG2-CG1 3.8Å; I147-V373 HydrophobicContact CG2-CG2 4.07Å
148E89Confident90.4Very high107 Ų10767.2 Ų67.250%0.534%0.343SS..Hα-helixtrans-62.4-33.6177-167.9180178.500112.5C145 E146 V373C145-E148 WeakPolarHBondContact O-CB 3.48Å; C145-E148 PolarHBondContact O-N 3.5Å; E146-E148 PolarHBondContact O-N 3.44Å; E146-E148 VanDerWaalsContact O-N 3.13Å; E148-V373 HydrophobicContact CB-CG2 4.4Å
149M88.2Confident90.9Very high140 Ų14067.5 Ų67.569%0.6934%0.342SS*.Hα-helixtrans-89-12-174.4-57.8-64.2161.400113.5E146 I147 K151E146-M149 PolarHBondContact O-N 3.18Å; I147-M149 VanDerWaalsContact C-N 3.26Å; I147-M149 PolarHBondContact O-N 3.37Å; M149-K151 PolarHBondContact O-N 2.91Å
150I90.7Very high91.3Very high34 Ų3466.1 Ų66.117%0.17433%0.331CS..  trans-79.4119.1-176.7-63.7174.5000109.8E146 I147 D152 T155 R156 N159E146-I150 WeakPolarHBondContact O-CG1 3.48Å; E146-I150 PolarHBondContact O-N 2.94Å; I147-I150 PolarHBondContact O-N 3.19Å; I150-D152 WeakPolarHBondContact CG2-OD1 3.48Å; I150-T155 HydrophobicContact CD1-CG2 4.33Å; I150-T155 HydrophobicContact CG2-CG2 4.45Å; I150-R156 HydrophobicContact CG2-CB 4.07Å; I150-N159 WeakPolarHBondContact CD1-ND2 3.38Å
151K87.8Confident91.6Very high210 Ų21066.4 Ų66.491%0.91333%0.333SS*.  trans-85.1-30.1179.2-67.5-176.1179.5-179.90113.2M149M149-K151 PolarHBondContact O-N 2.91Å
152D92.2Very high91.9Very high71 Ų7171.9 Ų71.938%0.3835%0.354SS..  trans-82.1131.1-175.271.2-78.5000111.3I150 E154 T155 R156I150-D152 WeakPolarHBondContact CG2-OD1 3.48Å; D152-E154 PolarHBondContact O-N 3.25Å; D152-T155 WeakPolarHBondContact OD2-CA 3.44Å; D152-T155 WeakPolarHBondContact OD2-CB 3.39Å; D152-T155 PolarHBondContact OD2-N 2.81Å; D152-T155 PolarHBondContact OD2-OG1 2.69Å; D152-R156 VanDerWaalsContact O-CB 3.31Å; D152-R156 WeakPolarHBondContact O-CB 3.45Å; D152-R156 PolarHBondContact O-N 3.37Å
153P91.3Very high92.1Very high94 Ų9466.7 Ų66.761%0.6133%0.33SS*.Hα-helixtrans-70.6-31.9-169.425.5-34.1000113.5K157P153-K157 WeakPolarHBondContact O-CB 3.33Å; P153-K157 PolarHBondContact O-N 2.91Å
154E93Very high92.3Very high136 Ų13665.6 Ų65.664%0.63632%0.324SS*.Hα-helixtrans-74.1-44.6-177.1-66.7-55.9136.600112D152 R156 K157 S158D152-E154 PolarHBondContact O-N 3.25Å; E154-R156 VanDerWaalsContact C-N 3.33Å; E154-R156 PolarHBondContact O-N 3.39Å; E154-K157 PolarHBondContact O-N 3.37Å; E154-S158 WeakPolarHBondContact O-CB 3.34Å; E154-S158 PolarHBondContact O-N 2.94Å
155T93.3Very high92.4Very high64 Ų6472 Ų7239%0.39335%0.347SS..Hα-helixtrans-66.3-39.2174.5-52.80000110.5I150 D152 K157 S158 N159I150-T155 HydrophobicContact CD1-CG2 4.33Å; I150-T155 HydrophobicContact CG2-CG2 4.45Å; D152-T155 WeakPolarHBondContact OD2-CA 3.44Å; D152-T155 WeakPolarHBondContact OD2-CB 3.39Å; D152-T155 PolarHBondContact OD2-N 2.81Å; D152-T155 PolarHBondContact OD2-OG1 2.69Å; T155-K157 PolarHBondContact O-N 3.46Å; T155-S158 PolarHBondContact O-N 3.21Å; T155-N159 WeakPolarHBondContact O-CB 3.23Å; T155-N159 PolarHBondContact O-N 3.11Å
156R94.2Very high92.5Very high41 Ų4174.1 Ų74.116%0.15536%0.357CS..Hα-helixtrans-55-51.5174-173.7-177173102.3-10.7111.2I147 I150 D152 E154 S158 N159 I160 E376I147-R156 HydrophobicContact CG2-CG 4Å; I147-R156 PolarHBondContact O-NH1 2.7Å; I150-R156 HydrophobicContact CG2-CB 4.07Å; D152-R156 VanDerWaalsContact O-CB 3.31Å; D152-R156 WeakPolarHBondContact O-CB 3.45Å; D152-R156 PolarHBondContact O-N 3.37Å; E154-R156 VanDerWaalsContact C-N 3.33Å; E154-R156 PolarHBondContact O-N 3.39Å; R156-S158 PolarHBondContact O-N 3.1Å; R156-N159 PolarHBondContact O-N 2.89Å; R156-I160 HydrophobicContact CG-CD1 3.78Å; R156-I160 VanDerWaalsContact O-CD1 3.3Å; R156-I160 WeakPolarHBondContact O-CD1 3.48Å; R156-I160 VanDerWaalsContact O-CG1 3.22Å; R156-I160 WeakPolarHBondContact O-CG1 3.47Å; R156-I160 PolarHBondContact O-N 3.38Å; R156-E376 IonicContact CZ-OE1 3.85Å; R156-E376 IonicContact CZ-OE2 3.54Å; R156-E376 VanDerWaalsContact CZ-OE2 3.32Å; R156-E376 IonicContact NE-OE1 2.7Å; R156-E376 IonicContact NE-OE2 3.22Å; R156-E376 PolarHBondContact NE-OE2 3.16Å; R156-E376 IonicContact NH2-OE1 3.39Å; R156-E376 PolarHBondContact NH2-OE1 3.17Å; R156-E376 IonicContact NH2-OE2 2.82Å; R156-E376 PolarHBondContact NH2-OE2 3.37Å
157K94.5Very high92.6Very high130 Ų13069.6 Ų69.657%0.56534%0.336SS*.Hα-helixtrans-64-37.6179.3-174.3-179.7178.6-175.80112.9P153 E154 T155 T161P153-K157 WeakPolarHBondContact O-CB 3.33Å; P153-K157 PolarHBondContact O-N 2.91Å; E154-K157 PolarHBondContact O-N 3.37Å; T155-K157 PolarHBondContact O-N 3.46Å; K157-T161 WeakPolarHBondContact O-CB 3.46Å; K157-T161 PolarHBondContact O-N 3.29Å; K157-T161 PolarHBondContact O-OG1 3Å
158S94.1Very high92.5Very high75 Ų7571 Ų7152%0.52434%0.342SS..Hα-helixtrans-62.3-49.3174.4-172.40000111.3E154 T155 R156 I160 T161 Y162E154-S158 WeakPolarHBondContact O-CB 3.34Å; E154-S158 PolarHBondContact O-N 2.94Å; T155-S158 PolarHBondContact O-N 3.21Å; R156-S158 PolarHBondContact O-N 3.1Å; S158-I160 PolarHBondContact O-N 2.96Å; S158-T161 CarbonylContact O-C 3.54Å; S158-T161 WeakPolarHBondContact O-CB 3.17Å; S158-T161 PolarHBondContact O-N 3.04Å; S158-T161 VanDerWaalsContact O-N 3.12Å; S158-Y162 PolarHBondContact O-N 3.46Å
159N93.9Very high92.5Very high37 Ų3770.8 Ų70.820%0.19835%0.345CS..Hα-helixtrans-65.3-39.9179.6-72.9-5.5000112.4I147 I150 T155 R156 T161 Y162 V163I147-N159 HydrophobicContact CD1-CB 3.89Å; I147-N159 HydrophobicContact CG1-CB 3.64Å; I150-N159 WeakPolarHBondContact CD1-ND2 3.38Å; T155-N159 WeakPolarHBondContact O-CB 3.23Å; T155-N159 PolarHBondContact O-N 3.11Å; R156-N159 PolarHBondContact O-N 2.89Å; N159-T161 VanDerWaalsContact C-N 3.29Å; N159-T161 PolarHBondContact O-N 2.92Å; N159-Y162 WeakPolarHBondContact O-CB 3.22Å; N159-Y162 PolarHBondContact O-N 3.21Å; N159-V163 WeakPolarHBondContact O-CG2 3.05Å; N159-V163 PolarHBondContact O-N 3.35Å
160I94.9Very high92.4Very high13 Ų1364.6 Ų64.67%0.06732%0.316CS..Hα-helixtrans-61-41.7172.8-69.5158.5000110.7I147 R156 S158 V163 A164 E376 I377 R380I147-I160 HydrophobicContact CD1-CG1 3.89Å; I147-I160 HydrophobicContact CG2-CD1 4.21Å; I147-I160 HydrophobicContact CG2-CG1 3.94Å; R156-I160 HydrophobicContact CG-CD1 3.78Å; R156-I160 VanDerWaalsContact O-CD1 3.3Å; R156-I160 WeakPolarHBondContact O-CD1 3.48Å; R156-I160 VanDerWaalsContact O-CG1 3.22Å; R156-I160 WeakPolarHBondContact O-CG1 3.47Å; R156-I160 PolarHBondContact O-N 3.38Å; S158-I160 PolarHBondContact O-N 2.96Å; I160-V163 PolarHBondContact O-N 3.43Å; I160-A164 VanDerWaalsContact O-CB 3.28Å; I160-A164 WeakPolarHBondContact O-CB 3.14Å; I160-A164 PolarHBondContact O-N 3.33Å; I160-E376 HydrophobicContact CD1-CB 3.94Å; I160-E376 WeakPolarHBondContact CD1-OE2 3.39Å; I160-E376 HydrophobicContact CG2-CB 4.35Å; I160-I377 HydrophobicContact CG2-CG1 4.05Å; I160-R380 HydrophobicContact CG2-CB 4.2Å
161T95.3Very high92.2Very high10 Ų1063.7 Ų63.76%0.06131%0.311CS..Hα-helixtrans-67-38.2176.7-61.30000111.5K157 S158 N159 R165 R380K157-T161 WeakPolarHBondContact O-CB 3.46Å; K157-T161 PolarHBondContact O-N 3.29Å; K157-T161 PolarHBondContact O-OG1 3Å; S158-T161 CarbonylContact O-C 3.54Å; S158-T161 WeakPolarHBondContact O-CB 3.17Å; S158-T161 PolarHBondContact O-N 3.04Å; S158-T161 VanDerWaalsContact O-N 3.12Å; N159-T161 VanDerWaalsContact C-N 3.29Å; N159-T161 PolarHBondContact O-N 2.92Å; T161-R165 HydrophobicContact CG2-CG 4.44Å; T161-R165 WeakPolarHBondContact O-CB 3.27Å; T161-R165 VanDerWaalsContact O-CG 3.31Å; T161-R165 WeakPolarHBondContact O-CG 3.27Å; T161-R165 PolarHBondContact O-N 2.92Å; T161-R380 PolarHBondContact OG1-NE 2.87Å
162Y93.9Very high91.9Very high118 Ų11856.7 Ų56.746%0.46329%0.289SS..Hα-helixtrans-60.2-50.3173.2173.7-95.2000111.2V143 S158 N159 A164 R165 H166V143-Y162 HydrophobicContact CG1-CD1 4.22Å; V143-Y162 HydrophobicContact CG2-CE1 4.34Å; S158-Y162 PolarHBondContact O-N 3.46Å; N159-Y162 WeakPolarHBondContact O-CB 3.22Å; N159-Y162 PolarHBondContact O-N 3.21Å; Y162-A164 PolarHBondContact O-N 2.84Å; Y162-R165 PolarHBondContact O-N 3.14Å; Y162-H166 WeakPolarHBondContact O-CB 3.48Å; Y162-H166 PolarHBondContact O-N 3.01Å
163V94Very high91.3Very high1 Ų157.3 Ų57.31%0.00630%0.299CS..Hα-helixtrans-61-45.3177.5171.50000111.4I140 V143 I147 N159 I160 H166 I167 I377I140-V163 HydrophobicContact CG2-CG1 4.03Å; V143-V163 HydrophobicContact CB-CG2 4.04Å; V143-V163 HydrophobicContact CG1-CG2 3.59Å; I147-V163 HydrophobicContact CD1-CG2 3.92Å; N159-V163 WeakPolarHBondContact O-CG2 3.05Å; N159-V163 PolarHBondContact O-N 3.35Å; I160-V163 PolarHBondContact O-N 3.43Å; V163-H166 PolarHBondContact O-N 3.37Å; V163-I167 HydrophobicContact CG1-CD1 3.86Å; V163-I167 HydrophobicContact CG1-CG1 4.48Å; V163-I167 VanDerWaalsContact O-CG1 3.29Å; V163-I167 WeakPolarHBondContact O-CG1 3.46Å; V163-I167 PolarHBondContact O-N 3.01Å; V163-I377 HydrophobicContact CG1-CD1 3.78Å; V163-I377 HydrophobicContact CG1-CG1 4.25Å; V163-I377 HydrophobicContact CG1-CG2 4.37Å
164A94.8Very high90.4Very high0 Ų054.5 Ų54.50%028%0.277CS..Hα-helixtrans-62.2-45178.400000112.2I160 Y162 I167 E168 R380 L381 M384I160-A164 VanDerWaalsContact O-CB 3.28Å; I160-A164 WeakPolarHBondContact O-CB 3.14Å; I160-A164 PolarHBondContact O-N 3.33Å; Y162-A164 PolarHBondContact O-N 2.84Å; A164-I167 PolarHBondContact O-N 3.2Å; A164-E168 PolarHBondContact O-N 3.42Å; A164-R380 HydrophobicContact CB-CB 4Å; A164-R380 HydrophobicContact CB-CG 3.68Å; A164-L381 HydrophobicContact CB-CD2 4.1Å; A164-L381 HydrophobicContact CB-CG 4.06Å; A164-L381 WeakPolarHBondContact O-CD2 3.23Å; A164-M384 HydrophobicContact CB-SD 4.17Å
165R93.5Very high89.3Confident133 Ų13356.7 Ų56.750%0.50228%0.28SS..Hα-helixtrans-62.2-45.7174.4-76.4176.3-177.7143-1.3111.6T161 Y162 I167 E168 D169 M384T161-R165 HydrophobicContact CG2-CG 4.44Å; T161-R165 WeakPolarHBondContact O-CB 3.27Å; T161-R165 VanDerWaalsContact O-CG 3.31Å; T161-R165 WeakPolarHBondContact O-CG 3.27Å; T161-R165 PolarHBondContact O-N 2.92Å; Y162-R165 PolarHBondContact O-N 3.14Å; R165-I167 VanDerWaalsContact C-N 3.28Å; R165-I167 PolarHBondContact O-N 3.13Å; R165-E168 PolarHBondContact O-N 3.33Å; R165-E168 VanDerWaalsContact O-N 3.09Å; R165-D169 WeakPolarHBondContact O-CB 3.44Å; R165-D169 VanDerWaalsContact O-CG 3.3Å; R165-D169 PolarHBondContact O-N 2.93Å; R165-M384 HydrophobicContact CB-CE 4.48Å; R165-M384 HydrophobicContact CG-CE 3.55Å; R165-M384 HydrophobicContact CG-SD 4.47Å
166H91.6Very high87.6Confident48 Ų4861.2 Ų61.222%0.22230%0.297CS..Hα-helixtrans-62.1-36.5178.5-168.8-63.7000112Y162 V163 A170Y162-H166 WeakPolarHBondContact O-CB 3.48Å; Y162-H166 PolarHBondContact O-N 3.01Å; V163-H166 PolarHBondContact O-N 3.37Å; H166-A170 WeakPolarHBondContact O-CB 3.5Å; H166-A170 PolarHBondContact O-N 3.39Å
167I91.8Very high85.5Confident0 Ų070 Ų700%033%0.331CS..Hα-helixtrans-66.4-45.3172.6-69.7168.4000110.5I140 V163 A164 R165 A170 L171 I361 L362 I377 L381I140-I167 HydrophobicContact CD1-CG1 4.21Å; I140-I167 HydrophobicContact CG2-CD1 4.18Å; I140-I167 HydrophobicContact CG2-CG1 4.08Å; V163-I167 HydrophobicContact CG1-CD1 3.86Å; V163-I167 HydrophobicContact CG1-CG1 4.48Å; V163-I167 VanDerWaalsContact O-CG1 3.29Å; V163-I167 WeakPolarHBondContact O-CG1 3.46Å; V163-I167 PolarHBondContact O-N 3.01Å; A164-I167 PolarHBondContact O-N 3.2Å; R165-I167 VanDerWaalsContact C-N 3.28Å; R165-I167 PolarHBondContact O-N 3.13Å; I167-A170 PolarHBondContact O-N 3.3Å; I167-L171 HydrophobicContact CG2-CD1 3.69Å; I167-L171 HydrophobicContact CG2-CG 4.22Å; I167-L171 WeakPolarHBondContact O-CB 3.36Å; I167-L171 WeakPolarHBondContact O-CG 3.48Å; I167-L171 PolarHBondContact O-N 3.49Å; I167-I361 HydrophobicContact CD1-CG2 4.07Å; I167-I361 HydrophobicContact CG1-CG2 4.25Å; I167-L362 HydrophobicContact CD1-CD2 4.44Å; I167-I377 HydrophobicContact CD1-CG2 4.01Å; I167-L381 HydrophobicContact CG2-CD1 4.29Å; I167-L381 HydrophobicContact CG2-CD2 4.41Å
168E91.4Very high83.4Confident28 Ų2873.1 Ų73.113%0.13134%0.339CS..Hα-helixtrans-62.7-45.9178.1-176.4177-16100112.5A164 R165 A170 L171 S172 Y353 L381 M384 H388A164-E168 PolarHBondContact O-N 3.42Å; R165-E168 PolarHBondContact O-N 3.33Å; R165-E168 VanDerWaalsContact O-N 3.09Å; E168-A170 VanDerWaalsContact C-N 3.31Å; E168-A170 PolarHBondContact O-N 2.95Å; E168-L171 PolarHBondContact O-N 3.28Å; E168-S172 VanDerWaalsContact O-CB 3.28Å; E168-S172 WeakPolarHBondContact O-CB 3.29Å; E168-S172 PolarHBondContact O-N 2.96Å; E168-S172 PolarHBondContact O-OG 2.98Å; E168-Y353 HydrophobicContact CG-CE2 4.45Å; E168-Y353 PolarHBondContact OE1-OH 2.94Å; E168-Y353 PolarHBondContact OE2-OH 3.44Å; E168-L381 HydrophobicContact CB-CD2 4.48Å; E168-M384 WeakPolarHBondContact OE2-CE 3.33Å; E168-H388 IonicContact OE1-CD2 3.55Å; E168-H388 IonicContact OE1-NE2 3.34Å; E168-H388 PolarHBondContact OE1-NE2 3.27Å
169D88.4Confident81.1Confident104 Ų10474.6 Ų74.656%0.55635%0.35SS*.Hα-helixtrans-61.3-42.2176.9-69-24.7000110.8R165 S172 S173R165-D169 WeakPolarHBondContact O-CB 3.44Å; R165-D169 VanDerWaalsContact O-CG 3.3Å; R165-D169 PolarHBondContact O-N 2.93Å; D169-S172 WeakPolarHBondContact CA-OG 3.42Å; D169-S172 PolarHBondContact O-N 3.1Å; D169-S172 PolarHBondContact O-OG 3.26Å; D169-S173 VanDerWaalsContact O-CB 3.25Å; D169-S173 WeakPolarHBondContact O-CB 3.26Å; D169-S173 PolarHBondContact O-N 3.27Å
170A85.9Confident79.3Confident9 Ų974.9 Ų74.97%0.07436%0.362CS..Hα-helixtrans-62.5-4517500000112.6I135 H166 I167 E168 Q174I135-A170 HydrophobicContact CB-CB 4.37Å; I135-A170 HydrophobicContact CD1-CB 4.09Å; I135-A170 HydrophobicContact CG1-CB 3.9Å; I135-A170 HydrophobicContact CG2-CB 3.99Å; H166-A170 WeakPolarHBondContact O-CB 3.5Å; H166-A170 PolarHBondContact O-N 3.39Å; I167-A170 PolarHBondContact O-N 3.3Å; E168-A170 VanDerWaalsContact C-N 3.31Å; E168-A170 PolarHBondContact O-N 2.95Å; A170-Q174 PolarHBondContact O-N 2.82Å
171L86.2Confident77.3Confident15 Ų1579.6 Ų79.68%0.07940%0.395CS..Hα-helixtrans-71.4-35.7179.6-68173.2000112.4I167 E168 Q174 L354 D357I167-L171 HydrophobicContact CG2-CD1 3.69Å; I167-L171 HydrophobicContact CG2-CG 4.22Å; I167-L171 WeakPolarHBondContact O-CB 3.36Å; I167-L171 WeakPolarHBondContact O-CG 3.48Å; I167-L171 PolarHBondContact O-N 3.49Å; E168-L171 PolarHBondContact O-N 3.28Å; L171-Q174 PolarHBondContact O-N 2.96Å; L171-L354 HydrophobicContact CD1-CD2 4.3Å; L171-D357 HydrophobicContact CD2-CB 4.41Å
172S82.6Confident75.6Confident64 Ų6481.9 Ų81.945%0.44842%0.42SS..Hα-helixtrans-72.8-35.7177.6670000112E168 D169 Q174 R175E168-S172 VanDerWaalsContact O-CB 3.28Å; E168-S172 WeakPolarHBondContact O-CB 3.29Å; E168-S172 PolarHBondContact O-N 2.96Å; E168-S172 PolarHBondContact O-OG 2.98Å; D169-S172 WeakPolarHBondContact CA-OG 3.42Å; D169-S172 PolarHBondContact O-N 3.1Å; D169-S172 PolarHBondContact O-OG 3.26Å; S172-Q174 VanDerWaalsContact C-N 3.28Å; S172-Q174 PolarHBondContact O-N 3.05Å; S172-R175 WeakPolarHBondContact O-CB 2.96Å; S172-R175 PolarHBondContact O-N 2.84Å
173S78.3Confident73.9Confident83 Ų8377.7 Ų77.758%0.5841%0.407SS*.Hα-helixtrans-59-38.3172.5179.90000112.1D169 R175D169-S173 VanDerWaalsContact O-CB 3.25Å; D169-S173 WeakPolarHBondContact O-CB 3.26Å; D169-S173 PolarHBondContact O-N 3.27Å; S173-R175 PolarHBondContact O-N 3.09Å; S173-R175 VanDerWaalsContact O-N 3.12Å
174Q72.3Confident72.2Confident35 Ų3587.2 Ų87.216%0.16444%0.443CS..THydrogen-bonded Turntrans-70.9-2.5175.2-68.7-167.6-11.800114.5S133 A170 L171 S172 E176 D357S133-Q174 PolarHBondContact O-NE2 3.37Å; A170-Q174 PolarHBondContact O-N 2.82Å; L171-Q174 PolarHBondContact O-N 2.96Å; S172-Q174 VanDerWaalsContact C-N 3.28Å; S172-Q174 PolarHBondContact O-N 3.05Å; Q174-E176 PolarHBondContact O-N 3.3Å; Q174-D357 PolarHBondContact OE1-OD2 3.44Å
175R69.7Low70.4Confident183 Ų18394.5 Ų94.569%0.69147%0.474SS*.THydrogen-bonded Turntrans-75.82.8-177-166.3167179.2176.7-0.3114.4S172 S173 Y177S172-R175 WeakPolarHBondContact O-CB 2.96Å; S172-R175 PolarHBondContact O-N 2.84Å; S173-R175 PolarHBondContact O-N 3.09Å; S173-R175 VanDerWaalsContact O-N 3.12Å; R175-Y177 PolarHBondContact O-N 3.42Å
176E58.4Low68.7Low159 Ų15995.7 Ų95.774%0.74348%0.483SS*.  trans-25102.5-171.9-85.1-175.616300115.4Q174 R178Q174-E176 PolarHBondContact O-N 3.3Å; E176-R178 VanDerWaalsContact C-N 3.28Å; E176-R178 PolarHBondContact O-N 2.67Å
177Y50Low67.1Low225 Ų22598 Ų9888%0.88249%0.494SS*.  trans-72.777.7174-168.1-91.5000109.2R175R175-Y177 PolarHBondContact O-N 3.42Å
178R50.3Low65.3Low195 Ų195102.2 Ų102.274%0.73652%0.522SS*.  trans-115.284.2172.8-146.6169.9-176.9162.70.6109.9E176 R200E176-R178 VanDerWaalsContact C-N 3.28Å; E176-R178 PolarHBondContact O-N 2.67Å; R178-R200 PolarHBondContact O-NH2 2.84Å
179S46.1Very low63.5Low106 Ų106106.1 Ų106.174%0.74154%0.543SS*.  trans-82.5121.8161.886.10000107.8
180G56.6Low61.9Low44 Ų44103.6 Ų103.645%0.45454%0.537SS..  trans-177.6146.8-178.600000110.6G182 V183G180-G182 VanDerWaalsContact C-N 3.26Å; G180-G182 PolarHBondContact O-N 2.98Å; G180-G182 VanDerWaalsContact O-N 3.12Å; G180-V183 WeakPolarHBondContact O-CB 3.44Å; G180-V183 WeakPolarHBondContact O-CG2 3.25Å; G180-V183 PolarHBondContact O-N 3.42Å
181C51.7Low60.3Low112 Ų112112.1 Ų112.176%0.75757%0.573SS**THydrogen-bonded Turntrans-56.1-33.2-169.8-170.80000114.4V183 R184C181-V183 PolarHBondContact O-N 2.84Å; C181-R184 PolarHBondContact O-N 2.86Å
182G59.4Low58.6Low57 Ų57116.7 Ų116.759%0.58861%0.605SS**Hα-helixtrans-60.8-13.217800000115.1G180 K186G180-G182 VanDerWaalsContact C-N 3.26Å; G180-G182 PolarHBondContact O-N 2.98Å; G180-G182 VanDerWaalsContact O-N 3.12Å; G182-K186 PolarHBondContact O-N 3.26Å
183V59Low56.9Low31 Ų31118.8 Ų118.819%0.18862%0.619CS.*Hα-helixtrans-66.8-39.7173.41650000112.3G180 C181 F185 K186 H187 R200G180-V183 WeakPolarHBondContact O-CB 3.44Å; G180-V183 WeakPolarHBondContact O-CG2 3.25Å; G180-V183 PolarHBondContact O-N 3.42Å; C181-V183 PolarHBondContact O-N 2.84Å; V183-F185 VanDerWaalsContact C-N 3.31Å; V183-F185 PolarHBondContact O-N 3.45Å; V183-K186 PolarHBondContact O-N 3.25Å; V183-H187 WeakPolarHBondContact O-CB 3.38Å; V183-H187 PolarHBondContact O-N 3.39Å; V183-R200 VanDerWaalsContact CG1-NH2 3.3Å
184R58.3Low55.4Low201 Ų201117.9 Ų117.976%0.75861%0.612SS**Hα-helixtrans-63.7-38.1-178.7-79.5-176.4-178.6163.50.3111.7C181 H187 C188C181-R184 PolarHBondContact O-N 2.86Å; R184-H187 CarbonylContact O-C 3.59Å; R184-H187 WeakPolarHBondContact O-CA 3.4Å; R184-H187 WeakPolarHBondContact O-CB 3.44Å; R184-H187 PolarHBondContact O-N 2.91Å; R184-H187 VanDerWaalsContact O-N 3.13Å; R184-C188 PolarHBondContact O-N 3.39Å
185F56.2Low53.9Low153 Ų153124.4 Ų124.467%0.67165%0.647SS**Hα-helixtrans-66.3-44.4178.2-167.1-100.7000111.9V183 H187 C188 L189V183-F185 VanDerWaalsContact C-N 3.31Å; V183-F185 PolarHBondContact O-N 3.45Å; F185-H187 VanDerWaalsContact C-N 3.28Å; F185-H187 PolarHBondContact O-N 3.06Å; F185-C188 WeakPolarHBondContact O-CB 3.31Å; F185-C188 PolarHBondContact O-N 3.13Å; F185-L189 HydrophobicContact CD1-CD1 4.17Å; F185-L189 HydrophobicContact CE1-CD1 3.81Å; F185-L189 PolarHBondContact O-N 2.96Å
186K58.9Low53Low157 Ų157122.3 Ų122.368%0.68364%0.639SS**Hα-helixtrans-62.9-33.1169.5-77.1-171.3172.7-178.70112.6G182 V183 C188 L189 A190G182-K186 PolarHBondContact O-N 3.26Å; V183-K186 PolarHBondContact O-N 3.25Å; K186-C188 VanDerWaalsContact C-N 3.29Å; K186-C188 PolarHBondContact O-N 3.38Å; K186-L189 PolarHBondContact O-N 2.95Å; K186-A190 VanDerWaalsContact O-CB 3.25Å; K186-A190 WeakPolarHBondContact O-CB 3.42Å; K186-A190 PolarHBondContact O-N 3.48Å
187H56.9Low52.7Low97 Ų97119.9 Ų119.945%0.44963%0.626SS.*Hα-helixtrans-65-32.5175.1-134-79.6000112.5V183 R184 F185 K191V183-H187 WeakPolarHBondContact O-CB 3.38Å; V183-H187 PolarHBondContact O-N 3.39Å; R184-H187 CarbonylContact O-C 3.59Å; R184-H187 WeakPolarHBondContact O-CA 3.4Å; R184-H187 WeakPolarHBondContact O-CB 3.44Å; R184-H187 PolarHBondContact O-N 2.91Å; R184-H187 VanDerWaalsContact O-N 3.13Å; F185-H187 VanDerWaalsContact C-N 3.28Å; F185-H187 PolarHBondContact O-N 3.06Å; H187-K191 PolarHBondContact O-N 3.37Å
188C54.6Low52.8Low88 Ų88110.1 Ų110.160%0.59560%0.595SS**Hα-helixtrans-73.4-45.6176-162.70000111.5R184 F185 K186 A190 K191R184-C188 PolarHBondContact O-N 3.39Å; F185-C188 WeakPolarHBondContact O-CB 3.31Å; F185-C188 PolarHBondContact O-N 3.13Å; K186-C188 VanDerWaalsContact C-N 3.29Å; K186-C188 PolarHBondContact O-N 3.38Å; C188-A190 PolarHBondContact O-N 3.45Å; C188-K191 WeakPolarHBondContact O-CB 3.43Å; C188-K191 PolarHBondContact O-N 3.46Å
189L53.7Low52.9Low110 Ų110106.7 Ų106.758%0.57659%0.585SS**Hα-helixtrans-64.9-38.2176-77.5166.2000112.5F185 K186 K191 S192F185-L189 HydrophobicContact CD1-CD1 4.17Å; F185-L189 HydrophobicContact CE1-CD1 3.81Å; F185-L189 PolarHBondContact O-N 2.96Å; K186-L189 PolarHBondContact O-N 2.95Å; L189-K191 VanDerWaalsContact C-N 3.26Å; L189-K191 PolarHBondContact O-N 3.5Å; L189-S192 PolarHBondContact O-N 3.44Å
190A54.5Low53.2Low51 Ų51107.7 Ų107.742%0.42157%0.573SS.*Hα-helixtrans-64.3-28.8174.900000113K186 C188 S192K186-A190 VanDerWaalsContact O-CB 3.25Å; K186-A190 WeakPolarHBondContact O-CB 3.42Å; K186-A190 PolarHBondContact O-N 3.48Å; C188-A190 PolarHBondContact O-N 3.45Å; A190-S192 VanDerWaalsContact C-N 3.3Å; A190-S192 PolarHBondContact O-N 3.06Å
191K52.6Low53.3Low189 Ų189112.6 Ų112.682%0.82258%0.579SS**Hα-helixtrans-72.2-23.9-179.8-151.3179.6-176.5-1730112.9H187 C188 L189H187-K191 PolarHBondContact O-N 3.37Å; C188-K191 WeakPolarHBondContact O-CB 3.43Å; C188-K191 PolarHBondContact O-N 3.46Å; L189-K191 VanDerWaalsContact C-N 3.26Å; L189-K191 PolarHBondContact O-N 3.5Å
192S50.5Low54.3Low110 Ų110107.3 Ų107.377%0.76954%0.543SS*.Hα-helixtrans-101.1-21.8-172.7-163.30000114.8L189 A190L189-S192 PolarHBondContact O-N 3.44Å; A190-S192 VanDerWaalsContact C-N 3.3Å; A190-S192 PolarHBondContact O-N 3.06Å
193C47Very low55.4Low108 Ų108106.5 Ų106.573%0.7353%0.525SS*.Hα-helixtrans-119.5-17.1-166.8-157.50000116.1
194C46Very low56.6Low65 Ų65106.4 Ų106.444%0.43952%0.521SS..  trans-169.2110.4178.9-97.20000111.4W196 F197C194-W196 PolarHBondContact O-N 2.72Å; C194-F197 HydrophobicContact CB-CD2 3.77Å; C194-F197 HydrophobicContact CB-CE2 4.5Å
195L42.3Very low58Low172 Ų17296.8 Ų96.890%0.90149%0.485SS*.THydrogen-bonded Turntrans-59.2-7.2175.9-81.9162.1000114.9
196W50.9Low59.5Low138 Ų13889.7 Ų89.752%0.52345%0.454SS..THydrogen-bonded Turntrans-117.8-18.2-166.9-64.4-7.7000116.3C194 G198 C207 F311C194-W196 PolarHBondContact O-N 2.72Å; W196-G198 PolarHBondContact O-N 3.42Å; W196-C207 PolarHBondContact O-SG 2.83Å; W196-F311 HydrophobicContact CH2-CZ 4.39Å; W196-F311 HydrophobicContact CZ3-CZ 4.47Å
197F51.6Low60.9Low108 Ų10882.6 Ų82.647%0.47442%0.424SS..  trans-98.194.8-173.3-73.2-86.8000113.3C194 I211C194-F197 HydrophobicContact CB-CD2 3.77Å; C194-F197 HydrophobicContact CB-CE2 4.5Å; F197-I211 HydrophobicContact CD1-CD1 3.86Å; F197-I211 HydrophobicContact CD2-CD1 4.15Å; F197-I211 HydrophobicContact CE1-CD1 3.04Å; F197-I211 HydrophobicContact CE1-CG1 4.4Å; F197-I211 HydrophobicContact CE2-CD1 3.4Å; F197-I211 VanDerWaalsContact CE2-CD1 3.4Å; F197-I211 HydrophobicContact CE2-CG1 4.17Å; F197-I211 HydrophobicContact CG-CD1 4.4Å; F197-I211 HydrophobicContact CZ-CD1 2.85Å; F197-I211 HydrophobicContact CZ-CG1 3.86Å; F197-I211 HydrophobicContact CZ-CG2 4.49Å
198G51Low62.5Low21 Ų2178.4 Ų78.422%0.21641%0.405CS..  trans-141.8102.5169.400000112.1W196 R200 Y201W196-G198 PolarHBondContact O-N 3.42Å; G198-R200 PolarHBondContact O-N 2.93Å; G198-Y201 PolarHBondContact O-N 2.77Å; G198-Y201 VanDerWaalsContact O-N 3.11Å
199K52.6Low64.2Low123 Ų12374.3 Ų74.354%0.53538%0.377SS..G310 helixtrans-46.4-27.1165.9-94.6-172.3170.4-176.60112.3Q132 Y201 G202 Y204Q132-K199 PolarHBondContact O-NZ 3.45Å; K199-Y201 VanDerWaalsContact C-N 3.33Å; K199-Y201 PolarHBondContact O-N 3.18Å; K199-G202 PolarHBondContact O-N 3.49Å; K199-Y204 HydrophobicContact CD-CD2 4.33Å; K199-Y204 HydrophobicContact CG-CD2 3.57Å; K199-Y204 HydrophobicContact CG-CE2 4.31Å; K199-Y204 HydrophobicContact CG-CG 3.96Å
200R52.2Low66Low126 Ų12669.7 Ų69.748%0.47535%0.353SS..G310 helixtrans-63.9-25.2-178.7-125.3-172.7-168.888.918.5116.1R178 V183 G198R178-R200 PolarHBondContact O-NH2 2.84Å; V183-R200 VanDerWaalsContact CG1-NH2 3.3Å; G198-R200 PolarHBondContact O-N 2.93Å
201Y59.7Low67.8Low148 Ų14869 Ų6958%0.5834%0.342SS*.G310 helixtrans-94.2-3.9-175.7-69.3-79.5000113.7G198 K199 N203G198-Y201 PolarHBondContact O-N 2.77Å; G198-Y201 VanDerWaalsContact O-N 3.11Å; K199-Y201 VanDerWaalsContact C-N 3.33Å; K199-Y201 PolarHBondContact O-N 3.18Å; Y201-N203 VanDerWaalsContact C-N 3.29Å; Y201-N203 WeakPolarHBondContact CB-ND2 3.23Å; Y201-N203 PolarHBondContact O-OD1 3.38Å; Y201-N203 VanDerWaalsContact O-OD1 3.12Å
202G71.9Confident69.8Low1 Ų160.1 Ų60.11%0.0130%0.304CS..THydrogen-bonded Turntrans65.537-168.600000111.9K199 D357K199-G202 PolarHBondContact O-N 3.49Å; G202-D357 VanDerWaalsContact C-CG 3.44Å; G202-D357 VanDerWaalsContact O-CB 3.32Å; G202-D357 WeakPolarHBondContact O-CB 3.38Å; G202-D357 PolarHBondContact O-N 3.47Å
203N82.1Confident71.8Confident40 Ų4055 Ų5521%0.21427%0.267CS..  trans-124.117.9-178.7-57.7-4.8000111.2Y201 I206 C207 Q356 D357Y201-N203 VanDerWaalsContact C-N 3.29Å; Y201-N203 WeakPolarHBondContact CB-ND2 3.23Å; Y201-N203 PolarHBondContact O-OD1 3.38Å; Y201-N203 VanDerWaalsContact O-OD1 3.12Å; N203-I206 HydrophobicContact CB-CG2 3.89Å; N203-I206 VanDerWaalsContact O-CG2 3.28Å; N203-I206 WeakPolarHBondContact O-CG2 3.3Å; N203-C207 WeakPolarHBondContact O-CB 3.41Å; N203-C207 PolarHBondContact O-N 3.39Å; N203-C207 VanDerWaalsContact O-N 3.09Å; N203-Q356 HydrophobicContact CB-CB 4.47Å; N203-Q356 PolarHBondContact ND2-OE1 2.89Å; N203-Q356 WeakPolarHBondContact OD1-CB 3.41Å; N203-Q356 PolarHBondContact OD1-OE1 3.13Å; N203-Q356 VanDerWaalsContact OD1-OE1 3.08Å; N203-D357 VanDerWaalsContact C-OD1 3.24Å; N203-D357 VanDerWaalsContact CA-OD1 3.3Å; N203-D357 WeakPolarHBondContact CA-OD1 3.41Å; N203-D357 PolarHBondContact N-OD2 3.27Å
204Y84.9Confident74.1Confident28 Ų2850.9 Ų50.911%0.1124%0.24CC..Hα-helixtrans-68.6-48-174.8172.6-94.9000110.7F129 K199 C207 L208 D357F129-Y204 PolarHBondContact O-OH 2.68Å; K199-Y204 HydrophobicContact CD-CD2 4.33Å; K199-Y204 HydrophobicContact CG-CD2 3.57Å; K199-Y204 HydrophobicContact CG-CE2 4.31Å; K199-Y204 HydrophobicContact CG-CG 3.96Å; Y204-C207 PolarHBondContact O-N 3.17Å; Y204-L208 HydrophobicContact CE1-CD2 4.3Å; Y204-L208 WeakPolarHBondContact O-CB 3.25Å; Y204-L208 PolarHBondContact O-N 2.89Å; Y204-D357 PolarHBondContact N-OD1 2.89Å; Y204-D357 PolarHBondContact N-OD2 3.37Å
205L87.4Confident76.5Confident0 Ų050.1 Ų50.10%023%0.231CC..Hα-helixtrans-66.1-45.6-174.8-169.774.9000110.6W126 L137 L208 Y209 D357 F360 I361W126-L205 HydrophobicContact CH2-CD1 4.25Å; L137-L205 HydrophobicContact CD1-CD2 4.4Å; L137-L205 HydrophobicContact CD2-CD2 4.5Å; L205-L208 PolarHBondContact O-N 3.24Å; L205-Y209 WeakPolarHBondContact O-CB 3.25Å; L205-Y209 PolarHBondContact O-N 2.99Å; L205-D357 HydrophobicContact CB-CB 4.19Å; L205-D357 WeakPolarHBondContact CB-OD1 3.36Å; L205-D357 PolarHBondContact N-OD1 2.82Å; L205-D357 VanDerWaalsContact N-OD1 3.1Å; L205-D357 PolarHBondContact N-OD2 3.43Å; L205-D357 VanDerWaalsContact N-OD2 3.12Å; L205-F360 HydrophobicContact CB-CD1 4.49Å; L205-F360 HydrophobicContact CD2-CD1 3.66Å; L205-F360 HydrophobicContact CD2-CE1 3.84Å; L205-F360 HydrophobicContact CG-CD1 3.95Å; L205-F360 HydrophobicContact CG-CE1 3.88Å; L205-I361 HydrophobicContact CD2-CD1 4Å; L205-I361 HydrophobicContact CD2-CG1 3.6Å
206I88.8Confident79Confident4 Ų442 Ų422%0.02119%0.189CC..Hα-helixtrans-66-39.5177.7-175.556.6000112.6N203 Y209 L210 S318 Q356 D357 F360N203-I206 HydrophobicContact CB-CG2 3.89Å; N203-I206 VanDerWaalsContact O-CG2 3.28Å; N203-I206 WeakPolarHBondContact O-CG2 3.3Å; I206-Y209 PolarHBondContact O-N 2.93Å; I206-L210 HydrophobicContact CD1-CG 4.44Å; I206-L210 WeakPolarHBondContact O-CG 3.12Å; I206-L210 PolarHBondContact O-N 3.14Å; I206-S318 WeakPolarHBondContact CD1-OG 3.33Å; I206-S318 WeakPolarHBondContact CG1-OG 3.47Å; I206-Q356 HydrophobicContact CG2-CB 4.35Å; I206-Q356 HydrophobicContact CG2-CG 3.87Å; I206-D357 WeakPolarHBondContact CG2-OD1 3.46Å; I206-D357 PolarHBondContact N-OD1 2.79Å; I206-F360 HydrophobicContact CB-CB 4.28Å; I206-F360 HydrophobicContact CB-CG 4.27Å; I206-F360 HydrophobicContact CD1-CB 4.21Å; I206-F360 HydrophobicContact CD1-CD2 3.43Å; I206-F360 VanDerWaalsContact CD1-CD2 3.43Å; I206-F360 HydrophobicContact CD1-CE2 3.9Å; I206-F360 HydrophobicContact CD1-CG 3.82Å
207C88Confident81.2Confident7 Ų737 Ų375%0.04717%0.172CC..Hα-helixtrans-62.5-52.21771790000109.3W196 N203 Y204 Y209 L210 I211W196-C207 PolarHBondContact O-SG 2.83Å; N203-C207 WeakPolarHBondContact O-CB 3.41Å; N203-C207 PolarHBondContact O-N 3.39Å; N203-C207 VanDerWaalsContact O-N 3.09Å; Y204-C207 PolarHBondContact O-N 3.17Å; C207-Y209 PolarHBondContact O-N 3.45Å; C207-L210 PolarHBondContact O-N 3.33Å; C207-I211 WeakPolarHBondContact O-CD1 3.47Å; C207-I211 WeakPolarHBondContact O-CG1 3.46Å; C207-I211 PolarHBondContact O-N 2.98Å; C207-I211 WeakPolarHBondContact SG-CD1 3.27Å
208L89.3Confident83.3Confident9 Ų938.8 Ų38.85%0.04718%0.179CC..Hα-helixtrans-52.1-43.6177.1179.265000111.3W126 F129 N130 Y204 L205 I211 T212W126-L208 HydrophobicContact CE3-CD2 4.03Å; W126-L208 HydrophobicContact CE3-CG 3.89Å; W126-L208 HydrophobicContact CZ3-CB 4.3Å; W126-L208 HydrophobicContact CZ3-CD2 4Å; W126-L208 HydrophobicContact CZ3-CG 3.91Å; F129-L208 HydrophobicContact CB-CD1 3.57Å; F129-L208 HydrophobicContact CB-CD2 3.68Å; F129-L208 HydrophobicContact CB-CG 4.28Å; F129-L208 HydrophobicContact CG-CD1 4.28Å; N130-L208 HydrophobicContact CB-CD2 4.39Å; Y204-L208 HydrophobicContact CE1-CD2 4.3Å; Y204-L208 WeakPolarHBondContact O-CB 3.25Å; Y204-L208 PolarHBondContact O-N 2.89Å; L205-L208 PolarHBondContact O-N 3.24Å; L208-I211 PolarHBondContact O-N 2.97Å; L208-T212 PolarHBondContact O-N 3.34Å; L208-T212 PolarHBondContact O-OG1 2.93Å
209Y90.8Very high85.5Confident3 Ų338.8 Ų38.81%0.01218%0.175CC..Hα-helixtrans-62.6-46.8177.9-173.2-105000112.4D24 D27 W126 L205 I206 C207 I211 T212 K213 W314 F360D24-Y209 WeakPolarHBondContact CB-OH 3.17Å; D27-Y209 PolarHBondContact OD2-OH 2.82Å; W126-Y209 HydrophobicContact CE3-CD2 4.29Å; W126-Y209 AromaticContact CH2-CD2 3.66Å; W126-Y209 HydrophobicContact CH2-CD2 3.66Å; W126-Y209 HydrophobicContact CH2-CG 4.25Å; W126-Y209 HydrophobicContact CZ2-CD2 4.07Å; W126-Y209 VanDerWaalsContact CZ3-CA 3.48Å; W126-Y209 AromaticContact CZ3-CD2 3.79Å; W126-Y209 HydrophobicContact CZ3-CD2 3.79Å; W126-Y209 HydrophobicContact CZ3-CG 4.22Å; L205-Y209 WeakPolarHBondContact O-CB 3.25Å; L205-Y209 PolarHBondContact O-N 2.99Å; I206-Y209 PolarHBondContact O-N 2.93Å; C207-Y209 PolarHBondContact O-N 3.45Å; Y209-I211 VanDerWaalsContact C-N 3.28Å; Y209-I211 PolarHBondContact O-N 3.47Å; Y209-T212 PolarHBondContact O-N 3.05Å; Y209-K213 HydrophobicContact CD1-CG 4.32Å; Y209-K213 HydrophobicContact CE1-CD 4.48Å; Y209-K213 HydrophobicContact CE1-CG 4.08Å; Y209-K213 WeakPolarHBondContact O-CG 3.49Å; Y209-K213 PolarHBondContact O-N 3.16Å; Y209-K213 WeakPolarHBondContact OH-CE 3.39Å; Y209-K213 PolarHBondContact OH-NZ 3.21Å; Y209-W314 HydrophobicContact CD1-CD2 4.46Å; Y209-W314 HydrophobicContact CE1-CB 4.35Å; Y209-W314 AromaticContact CE1-CD1 3.94Å; Y209-W314 AromaticContact CE1-CD2 3.59Å; Y209-W314 HydrophobicContact CE1-CD2 3.59Å; Y209-W314 AromaticContact CE1-CE2 3.7Å; Y209-W314 HydrophobicContact CE1-CE3 4.03Å; Y209-W314 AromaticContact CE1-CG 3.74Å; Y209-W314 HydrophobicContact CE1-CG 3.74Å; Y209-W314 HydrophobicContact CE1-CZ2 4.18Å; Y209-W314 AromaticContact CE1-NE1 3.94Å; Y209-W314 PolarHBondContact OH-NE1 3.35Å; Y209-F360 AromaticContact CD1-CE2 3.61Å; Y209-F360 HydrophobicContact CD1-CE2 3.61Å; Y209-F360 AromaticContact CD1-CZ 3.73Å; Y209-F360 HydrophobicContact CD1-CZ 3.73Å; Y209-F360 HydrophobicContact CD2-CE2 4.41Å; Y209-F360 AromaticContact CD2-CZ 3.73Å; Y209-F360 HydrophobicContact CD2-CZ 3.73Å; Y209-F360 AromaticContact CE1-CE2 3.98Å; Y209-F360 HydrophobicContact CE1-CE2 3.98Å; Y209-F360 HydrophobicContact CE1-CZ 4.24Å; Y209-F360 HydrophobicContact CE2-CZ 4.25Å; Y209-F360 HydrophobicContact CG-CE1 4.39Å; Y209-F360 AromaticContact CG-CE2 3.84Å; Y209-F360 HydrophobicContact CG-CE2 3.84Å; Y209-F360 AromaticContact CG-CZ 3.43Å; Y209-F360 HydrophobicContact CG-CZ 3.43Å; Y209-F360 VanDerWaalsContact CG-CZ 3.43Å
210L92.7Very high87.5Confident12 Ų1233.1 Ų33.16%0.06315%0.15CC..Hα-helixtrans-62.4-35.5176.5-69.7178.2000112.3I206 C207 K213 S214 W314I206-L210 HydrophobicContact CD1-CG 4.44Å; I206-L210 WeakPolarHBondContact O-CG 3.12Å; I206-L210 PolarHBondContact O-N 3.14Å; C207-L210 PolarHBondContact O-N 3.33Å; L210-K213 WeakPolarHBondContact O-CB 3.38Å; L210-K213 PolarHBondContact O-N 3.22Å; L210-S214 PolarHBondContact O-N 3.41Å; L210-S214 PolarHBondContact O-OG 3.38Å; L210-S214 VanDerWaalsContact O-OG 3.06Å; L210-W314 HydrophobicContact CD2-CB 4.06Å
211I92.5Very high89.5Confident36 Ų3630.2 Ų30.219%0.18515%0.146CC..Hα-helixtrans-69.9-43.2175.8-68.5145.5000111.2F197 C207 L208 Y209 K213 S214 L215F197-I211 HydrophobicContact CD1-CD1 3.86Å; F197-I211 HydrophobicContact CD2-CD1 4.15Å; F197-I211 HydrophobicContact CE1-CD1 3.04Å; F197-I211 HydrophobicContact CE1-CG1 4.4Å; F197-I211 HydrophobicContact CE2-CD1 3.4Å; F197-I211 VanDerWaalsContact CE2-CD1 3.4Å; F197-I211 HydrophobicContact CE2-CG1 4.17Å; F197-I211 HydrophobicContact CG-CD1 4.4Å; F197-I211 HydrophobicContact CZ-CD1 2.85Å; F197-I211 HydrophobicContact CZ-CG1 3.86Å; F197-I211 HydrophobicContact CZ-CG2 4.49Å; C207-I211 WeakPolarHBondContact O-CD1 3.47Å; C207-I211 WeakPolarHBondContact O-CG1 3.46Å; C207-I211 PolarHBondContact O-N 2.98Å; C207-I211 WeakPolarHBondContact SG-CD1 3.27Å; L208-I211 PolarHBondContact O-N 2.97Å; Y209-I211 VanDerWaalsContact C-N 3.28Å; Y209-I211 PolarHBondContact O-N 3.47Å; I211-K213 VanDerWaalsContact C-N 3.25Å; I211-K213 PolarHBondContact O-N 3.36Å; I211-S214 CarbonylContact O-C 3.53Å; I211-S214 WeakPolarHBondContact O-CB 3.42Å; I211-S214 PolarHBondContact O-N 3.16Å; I211-S214 VanDerWaalsContact O-N 3.13Å; I211-L215 HydrophobicContact CG2-CD1 3.99Å; I211-L215 HydrophobicContact CG2-CG 4.29Å; I211-L215 WeakPolarHBondContact O-CB 3.29Å; I211-L215 VanDerWaalsContact O-CG 3.27Å; I211-L215 WeakPolarHBondContact O-CG 3.4Å; I211-L215 PolarHBondContact O-N 3.39Å
212T92.9Very high91.1Very high4 Ų424.9 Ų24.93%0.02514%0.136CC..Hα-helixtrans-56-44172-67.20000110.7P122 W126 L208 Y209 L215 Y216P122-T212 HydrophobicContact CB-CG2 4.44Å; W126-T212 HydrophobicContact CB-CG2 3.89Å; L208-T212 PolarHBondContact O-N 3.34Å; L208-T212 PolarHBondContact O-OG1 2.93Å; Y209-T212 PolarHBondContact O-N 3.05Å; T212-L215 WeakPolarHBondContact O-CB 3.25Å; T212-L215 PolarHBondContact O-N 3.16Å; T212-Y216 HydrophobicContact CG2-CD2 4.07Å; T212-Y216 HydrophobicContact CG2-CE2 3.72Å; T212-Y216 VanDerWaalsContact O-CD2 3.26Å; T212-Y216 WeakPolarHBondContact O-CD2 3.16Å; T212-Y216 PolarHBondContact O-N 3.22Å
213K94.1Very high92.2Very high2 Ų225 Ų251%0.00914%0.136CC..Hα-helixtrans-61-44174.2-69.3-74.3-176.6-174.90112.4D24 S26 D27 Y209 L210 I211 L215 Y216 I217 S310 F311D24-K213 IonicContact OD2-NZ 3.87Å; D24-K213 PolarHBondContact OD2-NZ 3.26Å; S26-K213 PolarHBondContact OG-NZ 3.4Å; D27-K213 WeakPolarHBondContact OD1-CD 3.14Å; D27-K213 VanDerWaalsContact OD1-CE 3.25Å; D27-K213 WeakPolarHBondContact OD1-CE 3.26Å; D27-K213 IonicContact OD1-NZ 3.67Å; D27-K213 PolarHBondContact OD1-NZ 3.38Å; D27-K213 WeakPolarHBondContact OD2-CE 3.44Å; D27-K213 IonicContact OD2-NZ 3.23Å; D27-K213 PolarHBondContact OD2-NZ 3.45Å; Y209-K213 HydrophobicContact CD1-CG 4.32Å; Y209-K213 HydrophobicContact CE1-CD 4.48Å; Y209-K213 HydrophobicContact CE1-CG 4.08Å; Y209-K213 WeakPolarHBondContact O-CG 3.49Å; Y209-K213 PolarHBondContact O-N 3.16Å; Y209-K213 WeakPolarHBondContact OH-CE 3.39Å; Y209-K213 PolarHBondContact OH-NZ 3.21Å; L210-K213 WeakPolarHBondContact O-CB 3.38Å; L210-K213 PolarHBondContact O-N 3.22Å; I211-K213 VanDerWaalsContact C-N 3.25Å; I211-K213 PolarHBondContact O-N 3.36Å; K213-L215 VanDerWaalsContact C-N 3.32Å; K213-L215 PolarHBondContact O-N 3.06Å; K213-Y216 PolarHBondContact O-N 3.03Å; K213-I217 PolarHBondContact O-N 3.26Å; K213-S310 PolarHBondContact NZ-OG 2.93Å; K213-F311 HydrophobicContact CB-CB 4.3Å; K213-F311 HydrophobicContact CB-CD2 3.69Å; K213-F311 HydrophobicContact CB-CG 4.48Å
214S94.5Very high92.6Very high22 Ų2224.7 Ų24.715%0.15413%0.134CC..Hα-helixtrans-62-39.1173.4-57.90000112L210 I211 Y216 I217 F218 F311L210-S214 PolarHBondContact O-N 3.41Å; L210-S214 PolarHBondContact O-OG 3.38Å; L210-S214 VanDerWaalsContact O-OG 3.06Å; I211-S214 CarbonylContact O-C 3.53Å; I211-S214 WeakPolarHBondContact O-CB 3.42Å; I211-S214 PolarHBondContact O-N 3.16Å; I211-S214 VanDerWaalsContact O-N 3.13Å; S214-Y216 VanDerWaalsContact C-N 3.32Å; S214-Y216 PolarHBondContact O-N 3.22Å; S214-I217 WeakPolarHBondContact O-CB 3.47Å; S214-I217 PolarHBondContact O-N 3.01Å; S214-I217 VanDerWaalsContact O-N 3.12Å; S214-F218 WeakPolarHBondContact O-CD2 3.43Å; S214-F218 PolarHBondContact O-N 3.44Å; S214-F311 WeakPolarHBondContact OG-CE2 3.32Å
215L95.8Very high92.8Very high49 Ų4929.1 Ų29.126%0.25715%0.154SC..Hα-helixtrans-64.6-34.3177-72.8168.4000112.2P122 I125 I211 T212 K213 I217 N219P122-L215 HydrophobicContact CB-CB 4.04Å; P122-L215 HydrophobicContact CG-CB 4.2Å; I125-L215 HydrophobicContact CB-CD1 4.44Å; I125-L215 HydrophobicContact CD1-CD1 3.69Å; I125-L215 HydrophobicContact CG2-CD1 3.91Å; I211-L215 HydrophobicContact CG2-CD1 3.99Å; I211-L215 HydrophobicContact CG2-CG 4.29Å; I211-L215 WeakPolarHBondContact O-CB 3.29Å; I211-L215 VanDerWaalsContact O-CG 3.27Å; I211-L215 WeakPolarHBondContact O-CG 3.4Å; I211-L215 PolarHBondContact O-N 3.39Å; T212-L215 WeakPolarHBondContact O-CB 3.25Å; T212-L215 PolarHBondContact O-N 3.16Å; K213-L215 VanDerWaalsContact C-N 3.32Å; K213-L215 PolarHBondContact O-N 3.06Å; L215-I217 VanDerWaalsContact C-N 3.34Å; L215-N219 WeakPolarHBondContact O-CB 3.47Å; L215-N219 PolarHBondContact O-N 2.89Å
216Y95.8Very high92.9Very high2 Ų232 Ų321%0.00817%0.168CC..Hα-helixtrans-61.7-41.4170.4-81.3-65.9000112.3D27 H31 P122 C123 T212 K213 S214 N219 V220D27-Y216 HydrophobicContact CB-CE2 3.99Å; D27-Y216 WeakPolarHBondContact OD1-CE2 3.34Å; H31-Y216 HydrophobicContact CB-CE1 4.05Å; H31-Y216 PolarHBondContact ND1-OH 3.3Å; P122-Y216 HydrophobicContact CB-CD1 3.82Å; P122-Y216 HydrophobicContact CB-CD2 3.95Å; P122-Y216 HydrophobicContact CB-CE1 3.76Å; P122-Y216 HydrophobicContact CB-CE2 3.89Å; P122-Y216 HydrophobicContact CB-CG 3.92Å; P122-Y216 HydrophobicContact CG-CD1 3.8Å; P122-Y216 HydrophobicContact CG-CE1 3.99Å; P122-Y216 HydrophobicContact CG-CG 4.17Å; C123-Y216 WeakPolarHBondContact CB-OH 3.41Å; T212-Y216 HydrophobicContact CG2-CD2 4.07Å; T212-Y216 HydrophobicContact CG2-CE2 3.72Å; T212-Y216 VanDerWaalsContact O-CD2 3.26Å; T212-Y216 WeakPolarHBondContact O-CD2 3.16Å; T212-Y216 PolarHBondContact O-N 3.22Å; K213-Y216 PolarHBondContact O-N 3.03Å; S214-Y216 VanDerWaalsContact C-N 3.32Å; S214-Y216 PolarHBondContact O-N 3.22Å; Y216-N219 PolarHBondContact O-N 2.86Å; Y216-V220 PolarHBondContact O-N 2.96Å
217I96.2Very high92.9Very high33 Ų3331.8 Ų31.817%0.16917%0.168CC..Hα-helixtrans-66.6-49.1176.2-61.5170.6000110.7K213 S214 L215 N219 V220 V221 N307 F311K213-I217 PolarHBondContact O-N 3.26Å; S214-I217 WeakPolarHBondContact O-CB 3.47Å; S214-I217 PolarHBondContact O-N 3.01Å; S214-I217 VanDerWaalsContact O-N 3.12Å; L215-I217 VanDerWaalsContact C-N 3.34Å; I217-N219 VanDerWaalsContact C-N 3.26Å; I217-N219 PolarHBondContact O-N 3.23Å; I217-V220 WeakPolarHBondContact O-CG1 3.28Å; I217-V220 PolarHBondContact O-N 2.99Å; I217-V221 HydrophobicContact CG2-CG2 4.42Å; I217-V221 WeakPolarHBondContact O-CB 3.49Å; I217-V221 VanDerWaalsContact O-CG2 3.28Å; I217-V221 WeakPolarHBondContact O-CG2 3.33Å; I217-V221 PolarHBondContact O-N 2.95Å; I217-N307 HydrophobicContact CG1-CB 4Å; I217-F311 HydrophobicContact CD1-CB 3.61Å; I217-F311 HydrophobicContact CD1-CD1 4.03Å; I217-F311 HydrophobicContact CD1-CG 3.83Å
218F96.1Very high92.7Very high144 Ų14432 Ų3263%0.63217%0.168SC*.Hα-helixtrans-62.1-36.6177.4-72.1-57.5000112.1S214 G222S214-F218 WeakPolarHBondContact O-CD2 3.43Å; S214-F218 PolarHBondContact O-N 3.44Å; F218-G222 PolarHBondContact O-N 2.63Å
219N96.7Very high92.5Very high22 Ų2239.9 Ų39.912%0.11820%0.202CC..Hα-helixtrans-63.2-53.9175.5177.154.8000110.7L118 F119 P122 L215 Y216 I217 V221 G222 Q223L118-N219 PolarHBondContact O-OD1 3.44Å; F119-N219 WeakPolarHBondContact CA-ND2 3.36Å; F119-N219 WeakPolarHBondContact CD1-ND2 3.42Å; P122-N219 HydrophobicContact CG-CB 4.26Å; L215-N219 WeakPolarHBondContact O-CB 3.47Å; L215-N219 PolarHBondContact O-N 2.89Å; Y216-N219 PolarHBondContact O-N 2.86Å; I217-N219 VanDerWaalsContact C-N 3.26Å; I217-N219 PolarHBondContact O-N 3.23Å; N219-V221 VanDerWaalsContact C-N 3.29Å; N219-V221 PolarHBondContact O-N 2.92Å; N219-G222 CarbonylContact O-C 3.59Å; N219-G222 WeakPolarHBondContact O-CA 3.45Å; N219-G222 PolarHBondContact O-N 3.46Å; N219-Q223 VanDerWaalsContact O-CG 3.29Å; N219-Q223 WeakPolarHBondContact O-CG 3.46Å; N219-Q223 PolarHBondContact O-N 2.82Å; N219-Q223 PolarHBondContact OD1-NE2 2.89Å
220V95.7Very high92.2Very high3 Ų341.2 Ų41.22%0.01821%0.209CC..Hα-helixtrans-61.5-37.5-179.165.90000112.5F119 Y216 I217 Q223 F224 F300 V303 A304F119-V220 HydrophobicContact CE1-CB 4.32Å; F119-V220 HydrophobicContact CE1-CG2 4.49Å; F119-V220 HydrophobicContact CZ-CG2 4.46Å; Y216-V220 PolarHBondContact O-N 2.96Å; I217-V220 WeakPolarHBondContact O-CG1 3.28Å; I217-V220 PolarHBondContact O-N 2.99Å; V220-Q223 PolarHBondContact O-N 2.84Å; V220-F224 WeakPolarHBondContact O-CB 3.39Å; V220-F224 PolarHBondContact O-N 3.25Å; V220-F300 HydrophobicContact CG2-CB 4.11Å; V220-F300 WeakPolarHBondContact CG2-O 3.23Å; V220-V303 HydrophobicContact CB-CG1 4.35Å; V220-V303 HydrophobicContact CG2-CB 4.22Å; V220-V303 HydrophobicContact CG2-CG1 4.02Å; V220-A304 HydrophobicContact CG1-CB 3.84Å; V220-A304 HydrophobicContact CG2-CB 4.14Å
221V93.6Very high91.5Very high65 Ų6541.5 Ų41.539%0.39421%0.21SC..Hα-helixtrans-63.2-44.3172.91720000110.9I217 N219 Q223 F224 F225I217-V221 HydrophobicContact CG2-CG2 4.42Å; I217-V221 WeakPolarHBondContact O-CB 3.49Å; I217-V221 VanDerWaalsContact O-CG2 3.28Å; I217-V221 WeakPolarHBondContact O-CG2 3.33Å; I217-V221 PolarHBondContact O-N 2.95Å; N219-V221 VanDerWaalsContact C-N 3.29Å; N219-V221 PolarHBondContact O-N 2.92Å; V221-Q223 PolarHBondContact O-N 2.87Å; V221-F224 WeakPolarHBondContact O-CB 3.3Å; V221-F224 PolarHBondContact O-N 3.42Å; V221-F225 HydrophobicContact CG1-CD2 3.77Å; V221-F225 HydrophobicContact CG1-CE2 3.47Å; V221-F225 VanDerWaalsContact CG1-CE2 3.47Å; V221-F225 WeakPolarHBondContact O-CD2 3.24Å; V221-F225 PolarHBondContact O-N 3.31Å
222G93.6Very high90.4Very high36 Ų3642.6 Ų42.637%0.37123%0.231SC..Hα-helixtrans-61.8-39.5174.800000113.2F218 N219 F224 F225 L226F218-G222 PolarHBondContact O-N 2.63Å; N219-G222 CarbonylContact O-C 3.59Å; N219-G222 WeakPolarHBondContact O-CA 3.45Å; N219-G222 PolarHBondContact O-N 3.46Å; G222-F224 VanDerWaalsContact C-N 3.33Å; G222-F225 PolarHBondContact O-N 3.35Å; G222-L226 WeakPolarHBondContact O-CB 3.16Å; G222-L226 PolarHBondContact O-N 3.49Å
223Q93.9Very high89.2Confident3 Ų343.2 Ų43.21%0.01423%0.234CC..Hα-helixtrans-63.4-40.4174.5-63.6-54.7-26.500111.8L118 F119 N219 V220 V221 L226 M227 F300L118-Q223 VanDerWaalsContact CD1-NE2 3.3Å; F119-Q223 HydrophobicContact CD2-CG 4.18Å; F119-Q223 HydrophobicContact CE1-CG 4.46Å; F119-Q223 HydrophobicContact CE2-CB 4.25Å; F119-Q223 HydrophobicContact CE2-CG 3.55Å; F119-Q223 HydrophobicContact CZ-CB 4.23Å; F119-Q223 HydrophobicContact CZ-CG 3.71Å; N219-Q223 VanDerWaalsContact O-CG 3.29Å; N219-Q223 WeakPolarHBondContact O-CG 3.46Å; N219-Q223 PolarHBondContact O-N 2.82Å; N219-Q223 PolarHBondContact OD1-NE2 2.89Å; V220-Q223 PolarHBondContact O-N 2.84Å; V221-Q223 PolarHBondContact O-N 2.87Å; Q223-L226 PolarHBondContact O-N 3.45Å; Q223-M227 WeakPolarHBondContact O-CB 3.47Å; Q223-M227 PolarHBondContact O-N 3.29Å; Q223-F300 HydrophobicContact CB-CD2 4.38Å; Q223-F300 HydrophobicContact CB-CE2 4.06Å; Q223-F300 HydrophobicContact CB-CZ 4.43Å
224F90.5Very high87.7Confident35 Ų3550.6 Ų50.615%0.15427%0.274CS..Hα-helixtrans-62.2-46.3176.6-166.9-95.1000111.5V220 V221 G222 M227 N228 T236 W297V220-F224 WeakPolarHBondContact O-CB 3.39Å; V220-F224 PolarHBondContact O-N 3.25Å; V221-F224 WeakPolarHBondContact O-CB 3.3Å; V221-F224 PolarHBondContact O-N 3.42Å; G222-F224 VanDerWaalsContact C-N 3.33Å; F224-M227 HydrophobicContact CD2-CE 4.46Å; F224-M227 PolarHBondContact O-N 2.99Å; F224-N228 WeakPolarHBondContact CD1-ND2 3.28Å; F224-N228 VanDerWaalsContact CE1-ND2 3.32Å; F224-N228 WeakPolarHBondContact CE1-ND2 3.4Å; F224-N228 PolarHBondContact O-N 3.12Å; F224-N228 PolarHBondContact O-ND2 3.39Å; F224-T236 WeakPolarHBondContact CE1-O 3.21Å; F224-T236 WeakPolarHBondContact CZ-O 3.38Å; F224-W297 AromaticContact CE2-CD1 3.62Å; F224-W297 HydrophobicContact CE2-CD2 4.45Å; F224-W297 AromaticContact CE2-CE2 3.88Å; F224-W297 HydrophobicContact CE2-CG 4.28Å; F224-W297 HydrophobicContact CE2-CZ2 4.5Å; F224-W297 AromaticContact CE2-NE1 3.32Å; F224-W297 VanDerWaalsContact CE2-NE1 3.32Å; F224-W297 AromaticContact CZ-CE2 3.93Å; F224-W297 HydrophobicContact CZ-CZ2 4.28Å; F224-W297 AromaticContact CZ-NE1 3.3Å; F224-W297 VanDerWaalsContact CZ-NE1 3.3Å
225F89.4Confident86.3Confident121 Ų12156.7 Ų56.753%0.53130%0.295SS..Hα-helixtrans-64.4-40.4174.4-76.4-64.1000113.1V221 G222 M227 N228 K229V221-F225 HydrophobicContact CG1-CD2 3.77Å; V221-F225 HydrophobicContact CG1-CE2 3.47Å; V221-F225 VanDerWaalsContact CG1-CE2 3.47Å; V221-F225 WeakPolarHBondContact O-CD2 3.24Å; V221-F225 PolarHBondContact O-N 3.31Å; G222-F225 PolarHBondContact O-N 3.35Å; F225-M227 VanDerWaalsContact C-N 3.33Å; F225-M227 PolarHBondContact O-N 3.02Å; F225-N228 PolarHBondContact O-N 3.32Å; F225-K229 WeakPolarHBondContact O-CB 3.5Å; F225-K229 PolarHBondContact O-N 3.05Å
226L90.2Very high84.9Confident59 Ų5957.5 Ų57.531%0.30930%0.302SS..Hα-helixtrans-59.8-46.3176.3177.660.7000110.6Q115 G222 Q223 K229 I230Q115-L226 HydrophobicContact CG-CD2 4.08Å; G222-L226 WeakPolarHBondContact O-CB 3.16Å; G222-L226 PolarHBondContact O-N 3.49Å; Q223-L226 PolarHBondContact O-N 3.45Å; L226-K229 PolarHBondContact O-N 2.85Å; L226-I230 HydrophobicContact CD1-CD1 3.88Å; L226-I230 HydrophobicContact CD1-CG1 4.35Å; L226-I230 HydrophobicContact CG-CD1 3.76Å; L226-I230 VanDerWaalsContact O-CD1 3.27Å; L226-I230 WeakPolarHBondContact O-CD1 3.43Å; L226-I230 VanDerWaalsContact O-CG1 3.25Å; L226-I230 WeakPolarHBondContact O-CG1 3.33Å; L226-I230 PolarHBondContact O-N 3.38Å
227M87.7Confident83.8Confident1 Ų163.2 Ų63.21%0.00533%0.327CS..Hα-helixtrans-60.5-50.1178.4-170.8179.370.300111.7Q223 F224 F225 K229 I230 L231 F293 L296 W297 F300Q223-M227 WeakPolarHBondContact O-CB 3.47Å; Q223-M227 PolarHBondContact O-N 3.29Å; F224-M227 HydrophobicContact CD2-CE 4.46Å; F224-M227 PolarHBondContact O-N 2.99Å; F225-M227 VanDerWaalsContact C-N 3.33Å; F225-M227 PolarHBondContact O-N 3.02Å; M227-K229 VanDerWaalsContact C-N 3.28Å; M227-K229 PolarHBondContact O-N 3.03Å; M227-I230 PolarHBondContact O-N 2.85Å; M227-I230 VanDerWaalsContact O-N 3.1Å; M227-L231 HydrophobicContact CG-CD1 3.77Å; M227-L231 WeakPolarHBondContact O-CD1 3.29Å; M227-L231 PolarHBondContact O-N 2.83Å; M227-F293 HydrophobicContact CG-CD1 3.96Å; M227-F293 HydrophobicContact CG-CE1 4.25Å; M227-F293 HydrophobicContact SD-CD1 4Å; M227-L296 HydrophobicContact SD-CB 4.39Å; M227-W297 HydrophobicContact CE-CB 3.91Å; M227-W297 HydrophobicContact CE-CG 4.08Å; M227-F300 HydrophobicContact SD-CD2 4.41Å; M227-F300 HydrophobicContact SD-CE2 4.25Å
228N84.9Confident82.7Confident11 Ų1162 Ų626%0.05932%0.32CS..Hα-helixtrans-58.6-39.8177.8-69.4-20.1000112F224 F225 I230 L231 G232 T236F224-N228 WeakPolarHBondContact CD1-ND2 3.28Å; F224-N228 VanDerWaalsContact CE1-ND2 3.32Å; F224-N228 WeakPolarHBondContact CE1-ND2 3.4Å; F224-N228 PolarHBondContact O-N 3.12Å; F224-N228 PolarHBondContact O-ND2 3.39Å; F225-N228 PolarHBondContact O-N 3.32Å; N228-I230 PolarHBondContact O-N 2.87Å; N228-L231 PolarHBondContact O-N 3.23Å; N228-G232 PolarHBondContact O-N 2.92Å; N228-T236 PolarHBondContact ND2-O 2.7Å
229K85.3Confident81.8Confident174 Ų17455.1 Ų55.176%0.75729%0.29SS*.Hα-helixtrans-64.8-37.8176.4-174175.3-179.6177.20112.8F225 L226 M227 G232F225-K229 WeakPolarHBondContact O-CB 3.5Å; F225-K229 PolarHBondContact O-N 3.05Å; L226-K229 PolarHBondContact O-N 2.85Å; M227-K229 VanDerWaalsContact C-N 3.28Å; M227-K229 PolarHBondContact O-N 3.03Å; K229-G232 PolarHBondContact O-N 3.1Å
230I83.3Confident81Confident31 Ų3158.2 Ų58.216%0.15931%0.306CS..Hα-helixtrans-70.2-38.2179.7-69155.6000111.5I111 L226 M227 N228 G232I111-I230 HydrophobicContact CB-CD1 4.48Å; I111-I230 HydrophobicContact CD1-CD1 3.89Å; I111-I230 HydrophobicContact CD1-CG1 4.1Å; I111-I230 HydrophobicContact CD1-CG2 3.97Å; I111-I230 HydrophobicContact CG1-CD1 4.3Å; I111-I230 HydrophobicContact CG2-CD1 3.42Å; I111-I230 VanDerWaalsContact CG2-CD1 3.42Å; L226-I230 HydrophobicContact CD1-CD1 3.88Å; L226-I230 HydrophobicContact CD1-CG1 4.35Å; L226-I230 HydrophobicContact CG-CD1 3.76Å; L226-I230 VanDerWaalsContact O-CD1 3.27Å; L226-I230 WeakPolarHBondContact O-CD1 3.43Å; L226-I230 VanDerWaalsContact O-CG1 3.25Å; L226-I230 WeakPolarHBondContact O-CG1 3.33Å; L226-I230 PolarHBondContact O-N 3.38Å; M227-I230 PolarHBondContact O-N 2.85Å; M227-I230 VanDerWaalsContact O-N 3.1Å; N228-I230 PolarHBondContact O-N 2.87Å; I230-G232 PolarHBondContact O-N 3.28Å
231L78Confident80.1Confident18 Ų1860.8 Ų60.89%0.09432%0.32CS..Hα-helixtrans-68.5-17.3177.3-74.9148.8000112.5M227 N228 T233 Y238 F258M227-L231 HydrophobicContact CG-CD1 3.77Å; M227-L231 WeakPolarHBondContact O-CD1 3.29Å; M227-L231 PolarHBondContact O-N 2.83Å; N228-L231 PolarHBondContact O-N 3.23Å; L231-T233 HydrophobicContact CB-CG2 4.06Å; L231-T233 PolarHBondContact O-N 3.3Å; L231-Y238 HydrophobicContact CD1-CD1 3.92Å; L231-Y238 HydrophobicContact CD1-CE1 4.09Å; L231-Y238 HydrophobicContact CD2-CD1 4.48Å; L231-Y238 HydrophobicContact CD2-CE1 3.86Å; L231-F258 HydrophobicContact CD2-CE1 3.76Å; L231-F258 HydrophobicContact CD2-CE2 3.81Å; L231-F258 HydrophobicContact CD2-CZ 3.19Å
232G70.6Confident79.3Confident59 Ų5958.2 Ų58.261%0.60830%0.304SS*.THydrogen-bonded Turntrans7016.1-177.300000113.1N228 K229 I230N228-G232 PolarHBondContact O-N 2.92Å; K229-G232 PolarHBondContact O-N 3.1Å; I230-G232 PolarHBondContact O-N 3.28Å
233T67.7Low78.6Confident17 Ų1760 Ų6010%0.10431%0.305CS..  trans-90.3132.1-177.656.10000109.5L231 Y235 Y238L231-T233 HydrophobicContact CB-CG2 4.06Å; L231-T233 PolarHBondContact O-N 3.3Å; T233-Y235 PolarHBondContact O-N 2.97Å; T233-Y238 HydrophobicContact CG2-CD2 3.51Å; T233-Y238 HydrophobicContact CG2-CE2 3.64Å; T233-Y238 HydrophobicContact CG2-CG 4.23Å
234N62.6Low78Confident158 Ų15867 Ų6785%0.84533%0.331SS*.SBendtrans-75.8-6.7176.3-69-51.2000112.7
235Y65.8Low77.3Confident150 Ų15067.4 Ų67.459%0.58834%0.335SS*.  trans-99123.3-174.6-52-69.5000110.7T233 F237 Y238 D241T233-Y235 PolarHBondContact O-N 2.97Å; Y235-F237 PolarHBondContact O-N 3.48Å; Y235-Y238 PolarHBondContact O-N 3.2Å; Y235-D241 WeakPolarHBondContact CB-OD2 3.37Å
236T65.4Low76.8Confident66 Ų6665.2 Ų65.241%0.40533%0.328SS..THydrogen-bonded Turntrans-65.8-27.4175.151.70000112.3F224 N228 Y238F224-T236 WeakPolarHBondContact CE1-O 3.21Å; F224-T236 WeakPolarHBondContact CZ-O 3.38Å; N228-T236 PolarHBondContact ND2-O 2.7Å; T236-Y238 VanDerWaalsContact C-N 3.34Å
237F72.4Confident76.4Confident121 Ų12167 Ų6753%0.53135%0.345SS..THydrogen-bonded Turntrans-99.933.7-178.4-63.2-75.2000112.8Y235 G239 L240 D241 W297Y235-F237 PolarHBondContact O-N 3.48Å; F237-G239 PolarHBondContact O-N 2.9Å; F237-L240 HydrophobicContact CB-CD1 4.44Å; F237-L240 HydrophobicContact CD1-CD1 4.25Å; F237-L240 PolarHBondContact O-N 2.73Å; F237-D241 PolarHBondContact O-N 3.39Å; F237-D241 VanDerWaalsContact O-N 3.1Å; F237-W297 HydrophobicContact CD1-CZ2 4.16Å
238Y73.2Confident76.2Confident8 Ų871.6 Ų71.63%0.03137%0.367CS..Hα-helixtrans-45-40.4179.1175.6-109000114.5L231 T233 Y235 T236 L240 D241 L242 N257 F258L231-Y238 HydrophobicContact CD1-CD1 3.92Å; L231-Y238 HydrophobicContact CD1-CE1 4.09Å; L231-Y238 HydrophobicContact CD2-CD1 4.48Å; L231-Y238 HydrophobicContact CD2-CE1 3.86Å; T233-Y238 HydrophobicContact CG2-CD2 3.51Å; T233-Y238 HydrophobicContact CG2-CE2 3.64Å; T233-Y238 HydrophobicContact CG2-CG 4.23Å; Y235-Y238 PolarHBondContact O-N 3.2Å; T236-Y238 VanDerWaalsContact C-N 3.34Å; Y238-L240 PolarHBondContact O-N 3.3Å; Y238-D241 PolarHBondContact O-N 3.24Å; Y238-L242 HydrophobicContact CE1-CB 4.43Å; Y238-L242 HydrophobicContact CE1-CD2 3.69Å; Y238-L242 HydrophobicContact CE2-CB 4.24Å; Y238-L242 HydrophobicContact CE2-CD2 4.47Å; Y238-L242 WeakPolarHBondContact O-CB 3.31Å; Y238-L242 PolarHBondContact O-N 3.38Å; Y238-L242 WeakPolarHBondContact OH-CD2 3.36Å; Y238-N257 HydrophobicContact CE2-CB 4.42Å; Y238-F258 AromaticContact CE1-CE2 3.89Å; Y238-F258 HydrophobicContact CE1-CE2 3.89Å; Y238-F258 AromaticContact CZ-CE2 3.74Å; Y238-F258 WeakPolarHBondContact OH-CD2 3.18Å; Y238-F258 WeakPolarHBondContact OH-CE2 3.4Å
239G77Confident75.7Confident0 Ų073.6 Ų73.60%039%0.39CS..Hα-helixtrans-67.2-32.5179.800000114.4F237 L243F237-G239 PolarHBondContact O-N 2.9Å; G239-L243 WeakPolarHBondContact O-CB 3.31Å; G239-L243 WeakPolarHBondContact O-CG 3.46Å; G239-L243 PolarHBondContact O-N 3.24Å; G239-L243 VanDerWaalsContact O-N 3.12Å
240L79.5Confident75Confident86 Ų8671 Ų7145%0.4538%0.376SS..Hα-helixtrans-75.5-43.4173.8-64178.4000110.9F237 Y238 L242 L243 R244 W297F237-L240 HydrophobicContact CB-CD1 4.44Å; F237-L240 HydrophobicContact CD1-CD1 4.25Å; F237-L240 PolarHBondContact O-N 2.73Å; Y238-L240 PolarHBondContact O-N 3.3Å; L240-L242 VanDerWaalsContact C-N 3.34Å; L240-L243 PolarHBondContact O-N 3.18Å; L240-R244 WeakPolarHBondContact O-CB 3.45Å; L240-R244 PolarHBondContact O-N 2.96Å; L240-W297 HydrophobicContact CD1-CH2 4.11Å; L240-W297 HydrophobicContact CD2-CH2 3.8Å; L240-W297 HydrophobicContact CD2-CZ3 3.98Å; L240-W297 HydrophobicContact CG-CH2 3.46Å; L240-W297 VanDerWaalsContact CG-CH2 3.46Å; L240-W297 HydrophobicContact CG-CZ2 4.11Å; L240-W297 HydrophobicContact CG-CZ3 4.1Å
241D77.7Confident74.5Confident58 Ų5872.6 Ų72.631%0.3139%0.387SS..Hα-helixtrans-63.4-44.3179.4-60.1-35000110Y235 F237 Y238 L243 R244 D245Y235-D241 WeakPolarHBondContact CB-OD2 3.37Å; F237-D241 PolarHBondContact O-N 3.39Å; F237-D241 VanDerWaalsContact O-N 3.1Å; Y238-D241 PolarHBondContact O-N 3.24Å; D241-L243 PolarHBondContact O-N 2.92Å; D241-R244 CarbonylContact O-C 3.28Å; D241-R244 WeakPolarHBondContact O-CB 3.49Å; D241-R244 PolarHBondContact O-N 3.25Å; D241-R244 VanDerWaalsContact O-N 3.15Å; D241-D245 WeakPolarHBondContact O-CB 3.31Å; D241-D245 PolarHBondContact O-N 3.41Å
242L76.3Confident74.2Confident11 Ų1173.4 Ų73.46%0.05839%0.389CS..Hα-helixtrans-64.6-39175.3-177.764.7000112.5Y238 L240 R244 D245 I246 F258 I294Y238-L242 HydrophobicContact CE1-CB 4.43Å; Y238-L242 HydrophobicContact CE1-CD2 3.69Å; Y238-L242 HydrophobicContact CE2-CB 4.24Å; Y238-L242 HydrophobicContact CE2-CD2 4.47Å; Y238-L242 WeakPolarHBondContact O-CB 3.31Å; Y238-L242 PolarHBondContact O-N 3.38Å; Y238-L242 WeakPolarHBondContact OH-CD2 3.36Å; L240-L242 VanDerWaalsContact C-N 3.34Å; L242-R244 VanDerWaalsContact C-N 3.31Å; L242-D245 PolarHBondContact O-N 3.07Å; L242-I246 HydrophobicContact CD1-CD1 4.16Å; L242-I246 HydrophobicContact CD1-CG1 4.4Å; L242-I246 HydrophobicContact CG-CD1 3.9Å; L242-I246 WeakPolarHBondContact O-CB 3.41Å; L242-I246 WeakPolarHBondContact O-CD1 3.41Å; L242-I246 WeakPolarHBondContact O-CG1 3.19Å; L242-I246 PolarHBondContact O-N 3.04Å; L242-F258 HydrophobicContact CD2-CE2 4.28Å; L242-I294 HydrophobicContact CD2-CD1 3.6Å; L242-I294 HydrophobicContact CD2-CG1 3.35Å; L242-I294 HydrophobicContact CG-CD1 4.3Å; L242-I294 HydrophobicContact CG-CG1 4.34Å
243L78.4Confident74Confident74 Ų7473.8 Ų73.839%0.38738%0.375SS..Hα-helixtrans-64.9-39173.5-85.6-169.7000111.7G239 L240 D241 I246 S247 F298G239-L243 WeakPolarHBondContact O-CB 3.31Å; G239-L243 WeakPolarHBondContact O-CG 3.46Å; G239-L243 PolarHBondContact O-N 3.24Å; G239-L243 VanDerWaalsContact O-N 3.12Å; L240-L243 PolarHBondContact O-N 3.18Å; D241-L243 PolarHBondContact O-N 2.92Å; L243-I246 PolarHBondContact O-N 3.32Å; L243-S247 VanDerWaalsContact O-CB 3.31Å; L243-S247 WeakPolarHBondContact O-CB 3.2Å; L243-S247 PolarHBondContact O-N 3.26Å; L243-S247 PolarHBondContact O-OG 2.85Å; L243-F298 HydrophobicContact CD1-CE1 4.21Å; L243-F298 HydrophobicContact CD1-CE2 3.65Å; L243-F298 HydrophobicContact CD1-CZ 3.21Å; L243-F298 HydrophobicContact CG-CE2 4.1Å; L243-F298 HydrophobicContact CG-CZ 4.03Å
244R81.3Confident73.9Confident148 Ų14878.2 Ų78.256%0.55839%0.394SS*.Hα-helixtrans-63.1-49.4176-177.7179.6179.6178.5-2.1110.3L240 D241 L242 I246 S247 E248L240-R244 WeakPolarHBondContact O-CB 3.45Å; L240-R244 PolarHBondContact O-N 2.96Å; D241-R244 CarbonylContact O-C 3.28Å; D241-R244 WeakPolarHBondContact O-CB 3.49Å; D241-R244 PolarHBondContact O-N 3.25Å; D241-R244 VanDerWaalsContact O-N 3.15Å; L242-R244 VanDerWaalsContact C-N 3.31Å; R244-I246 VanDerWaalsContact C-N 3.31Å; R244-I246 PolarHBondContact O-N 2.83Å; R244-S247 WeakPolarHBondContact CA-OG 3.14Å; R244-S247 CarbonylContact O-C 3.46Å; R244-S247 WeakPolarHBondContact O-CA 3.34Å; R244-S247 PolarHBondContact O-N 3.03Å; R244-S247 PolarHBondContact O-OG 3.2Å; R244-E248 HydrophobicContact CG-CG 4.35Å; R244-E248 WeakPolarHBondContact CG-OE1 3.5Å; R244-E248 IonicContact CZ-OE1 3.2Å; R244-E248 IonicContact NE-OE1 3.35Å; R244-E248 PolarHBondContact NE-OE1 2.72Å; R244-E248 IonicContact NE-OE2 2.75Å; R244-E248 IonicContact NH2-OE1 2.74Å; R244-E248 PolarHBondContact NH2-OE1 3.29Å; R244-E248 WeakPolarHBondContact O-CB 3.45Å; R244-E248 WeakPolarHBondContact O-CG 3.06Å; R244-E248 PolarHBondContact O-N 2.88Å
245D76.9Confident74.4Confident44 Ų4472.7 Ų72.724%0.23537%0.369CS..Hα-helixtrans-56.6-46176.6-67.6-9.4000111.1D241 L242 S247 E248 G249 Y250D241-D245 WeakPolarHBondContact O-CB 3.31Å; D241-D245 PolarHBondContact O-N 3.41Å; L242-D245 PolarHBondContact O-N 3.07Å; D245-S247 VanDerWaalsContact C-N 3.32Å; D245-S247 PolarHBondContact O-N 2.87Å; D245-E248 PolarHBondContact O-N 2.92Å; D245-G249 PolarHBondContact O-N 2.76Å; D245-Y250 PolarHBondContact O-N 2.97Å
246I77.9Confident74.7Confident76 Ų7666.9 Ų66.939%0.3935%0.354SS..Hα-helixtrans-63.7-38.1176.2-69.3166.3000111.3L242 L243 R244 G249 I294L242-I246 HydrophobicContact CD1-CD1 4.16Å; L242-I246 HydrophobicContact CD1-CG1 4.4Å; L242-I246 HydrophobicContact CG-CD1 3.9Å; L242-I246 WeakPolarHBondContact O-CB 3.41Å; L242-I246 WeakPolarHBondContact O-CD1 3.41Å; L242-I246 WeakPolarHBondContact O-CG1 3.19Å; L242-I246 PolarHBondContact O-N 3.04Å; L243-I246 PolarHBondContact O-N 3.32Å; R244-I246 VanDerWaalsContact C-N 3.31Å; R244-I246 PolarHBondContact O-N 2.83Å; I246-G249 PolarHBondContact O-N 2.93Å; I246-I294 HydrophobicContact CD1-CD1 3.97Å
247S82.4Confident75.1Confident97 Ų9766 Ų6668%0.67835%0.346SS*.Hα-helixtrans-73.2-33.1179.674.70000113.4L243 R244 D245L243-S247 VanDerWaalsContact O-CB 3.31Å; L243-S247 WeakPolarHBondContact O-CB 3.2Å; L243-S247 PolarHBondContact O-N 3.26Å; L243-S247 PolarHBondContact O-OG 2.85Å; R244-S247 WeakPolarHBondContact CA-OG 3.14Å; R244-S247 CarbonylContact O-C 3.46Å; R244-S247 WeakPolarHBondContact O-CA 3.34Å; R244-S247 PolarHBondContact O-N 3.03Å; R244-S247 PolarHBondContact O-OG 3.2Å; D245-S247 VanDerWaalsContact C-N 3.32Å; D245-S247 PolarHBondContact O-N 2.87Å
248E83.2Confident75.4Confident96 Ų9660.4 Ų60.445%0.44932%0.322SS..Hα-helixtrans-81.4-8.1176.6-69.5175.5176.200111.3R244 D245 Y250R244-E248 HydrophobicContact CG-CG 4.35Å; R244-E248 WeakPolarHBondContact CG-OE1 3.5Å; R244-E248 IonicContact CZ-OE1 3.2Å; R244-E248 IonicContact NE-OE1 3.35Å; R244-E248 PolarHBondContact NE-OE1 2.72Å; R244-E248 IonicContact NE-OE2 2.75Å; R244-E248 IonicContact NH2-OE1 2.74Å; R244-E248 PolarHBondContact NH2-OE1 3.29Å; R244-E248 WeakPolarHBondContact O-CB 3.45Å; R244-E248 WeakPolarHBondContact O-CG 3.06Å; R244-E248 PolarHBondContact O-N 2.88Å; D245-E248 PolarHBondContact O-N 2.92Å; E248-Y250 HydrophobicContact CB-CD2 3.63Å; E248-Y250 HydrophobicContact CB-CE2 3.69Å; E248-Y250 VanDerWaalsContact OE2-CE2 3.24Å; E248-Y250 WeakPolarHBondContact OE2-CE2 3.44Å
249G75.6Confident76.2Confident53 Ų5360.1 Ų60.155%0.54632%0.321SS..THydrogen-bonded Turntrans84.710.9176.800000114D245 I246 V251D245-G249 PolarHBondContact O-N 2.76Å; I246-G249 PolarHBondContact O-N 2.93Å; G249-V251 PolarHBondContact O-N 3.07Å
250Y70.1Confident76.8Confident119 Ų11964 Ų6447%0.46734%0.336SS..  trans-66117.7175.2-69.4-66000110.2D245 E248 E254D245-Y250 PolarHBondContact O-N 2.97Å; E248-Y250 HydrophobicContact CB-CD2 3.63Å; E248-Y250 HydrophobicContact CB-CE2 3.69Å; E248-Y250 VanDerWaalsContact OE2-CE2 3.24Å; E248-Y250 WeakPolarHBondContact OE2-CE2 3.44Å; Y250-E254 VanDerWaalsContact CD1-OE2 3.24Å; Y250-E254 WeakPolarHBondContact CD1-OE2 3.27Å
251V72Confident77.3Confident65 Ų6562.8 Ų62.839%0.39433%0.329SS..  trans-83.4150.3179.9-172.80000108.9G249 Q253 E254G249-V251 PolarHBondContact O-N 3.07Å; V251-Q253 HydrophobicContact CB-CB 4.49Å; V251-Q253 HydrophobicContact CG1-CB 4.41Å; V251-Q253 HydrophobicContact CG1-CG 3.97Å; V251-Q253 PolarHBondContact O-N 3.1Å; V251-E254 PolarHBondContact O-N 2.93Å
252W72.1Confident78Confident35 Ų3560.1 Ų60.113%0.13332%0.315CS..Hα-helixtrans-47.3-18.3174.457.1-91.3000115F82 E254 G256 P259 R260 I261F82-W252 HydrophobicContact CE2-CE3 4.05Å; F82-W252 AromaticContact CE2-CZ3 3.82Å; F82-W252 HydrophobicContact CE2-CZ3 3.82Å; W252-E254 PolarHBondContact O-N 3.5Å; W252-G256 PolarHBondContact O-N 2.71Å; W252-P259 HydrophobicContact CE3-CB 4.12Å; W252-P259 HydrophobicContact CZ3-CB 4.43Å; W252-R260 HydrophobicContact CD2-CB 4.39Å; W252-R260 HydrophobicContact CD2-CG 4.4Å; W252-R260 HydrophobicContact CG-CG 4.46Å; W252-R260 HydrophobicContact CZ2-CB 4.08Å; W252-I261 HydrophobicContact CH2-CB 3.66Å; W252-I261 HydrophobicContact CH2-CD1 3.84Å; W252-I261 HydrophobicContact CH2-CG1 3.62Å; W252-I261 HydrophobicContact CZ2-CD1 4.22Å; W252-I261 HydrophobicContact CZ2-CG1 4.11Å; W252-I261 HydrophobicContact CZ3-CB 4.15Å
253Q67Low78.8Confident68 Ų6861 Ų6132%0.31832%0.32SS..Hα-helixtrans-59.9-29.6175-68.4166.7-29.500112.9T85 V251T85-Q253 HydrophobicContact CG2-CB 4.21Å; T85-Q253 HydrophobicContact CG2-CG 3.97Å; V251-Q253 HydrophobicContact CB-CB 4.49Å; V251-Q253 HydrophobicContact CG1-CB 4.41Å; V251-Q253 HydrophobicContact CG1-CG 3.97Å; V251-Q253 PolarHBondContact O-N 3.1Å
254E66.3Low79.6Confident109 Ų10957.5 Ų57.551%0.50930%0.301SS..Hα-helixtrans-101.9-41.2-178.2-60.6-170.9170.700112.2Y250 V251 W252 G256Y250-E254 VanDerWaalsContact CD1-OE2 3.24Å; Y250-E254 WeakPolarHBondContact CD1-OE2 3.27Å; V251-E254 PolarHBondContact O-N 2.93Å; W252-E254 PolarHBondContact O-N 3.5Å; E254-G256 VanDerWaalsContact C-N 3.29Å; E254-G256 PolarHBondContact O-N 2.97Å
255S71.2Confident80.2Confident43 Ų4352.3 Ų52.330%0.30128%0.284SS..Hα-helixtrans-73.5-22.1-177.667.10000113.2N257S255-N257 PolarHBondContact O-N 2.87Å; S255-N257 PolarHBondContact OG-N 3.39Å
256G73.3Confident80.9Confident27 Ų2750.5 Ų50.528%0.27828%0.275SS..  trans65.3-3-173.900000114.5F82 W252 E254F82-G256 VanDerWaalsContact CE1-CA 3.46Å; W252-G256 PolarHBondContact O-N 2.71Å; E254-G256 VanDerWaalsContact C-N 3.29Å; E254-G256 PolarHBondContact O-N 2.97Å
257N72.6Confident81.5Confident47 Ų4751.6 Ų51.625%0.25128%0.278SS..SBendtrans-83.4131.2176.1-66.9-37.7000108.9Y238 S255Y238-N257 HydrophobicContact CE2-CB 4.42Å; S255-N257 PolarHBondContact O-N 2.87Å; S255-N257 PolarHBondContact OG-N 3.39Å
258F80.6Confident81.9Confident5 Ų549 Ų492%0.02226%0.258CS..SBendtrans50.962.3-178-60.7-61.1000113.9Y104 L231 Y238 L242 R260 N286 N289 E290 F293Y104-F258 HydrophobicContact CE2-CD1 4.46Å; Y104-F258 HydrophobicContact CE2-CE1 4.19Å; Y104-F258 WeakPolarHBondContact OH-CD1 3.43Å; L231-F258 HydrophobicContact CD2-CE1 3.76Å; L231-F258 HydrophobicContact CD2-CE2 3.81Å; L231-F258 HydrophobicContact CD2-CZ 3.19Å; Y238-F258 AromaticContact CE1-CE2 3.89Å; Y238-F258 HydrophobicContact CE1-CE2 3.89Å; Y238-F258 AromaticContact CZ-CE2 3.74Å; Y238-F258 WeakPolarHBondContact OH-CD2 3.18Å; Y238-F258 WeakPolarHBondContact OH-CE2 3.4Å; L242-F258 HydrophobicContact CD2-CE2 4.28Å; F258-R260 PolarHBondContact O-N 3.48Å; F258-N286 WeakPolarHBondContact CA-ND2 3.25Å; F258-N286 WeakPolarHBondContact CB-ND2 3.29Å; F258-N286 WeakPolarHBondContact CD1-OD1 3.49Å; F258-N286 PolarHBondContact O-ND2 3.33Å; F258-N289 HydrophobicContact CE1-CB 4.31Å; F258-E290 HydrophobicContact CB-CB 4.36Å; F258-E290 HydrophobicContact CB-CG 4.45Å; F258-E290 HydrophobicContact CD1-CB 4.5Å; F258-E290 HydrophobicContact CD2-CB 3.97Å; F258-E290 HydrophobicContact CD2-CG 3.79Å; F258-E290 HydrophobicContact CE2-CB 4.23Å; F258-E290 HydrophobicContact CE2-CG 4.19Å; F258-E290 HydrophobicContact CG-CB 4.08Å; F258-E290 HydrophobicContact CG-CG 4.27Å; F258-F293 HydrophobicContact CE1-CD2 4.01Å; F258-F293 HydrophobicContact CZ-CB 4.04Å; F258-F293 AromaticContact CZ-CD2 3.83Å; F258-F293 HydrophobicContact CZ-CD2 3.83Å; F258-F293 HydrophobicContact CZ-CG 4.31Å
259P88.4Confident82.2Confident1 Ų153.3 Ų53.31%0.00627%0.27CS..  trans-66.4134.3174.828.7-35.1000112.7F82 I102 Y105 W252 T262 N286F82-P259 HydrophobicContact CB-CB 4.02Å; F82-P259 HydrophobicContact CB-CG 3.88Å; F82-P259 HydrophobicContact CD1-CB 4.5Å; F82-P259 HydrophobicContact CD2-CB 3.35Å; F82-P259 HydrophobicContact CD2-CG 4.17Å; F82-P259 HydrophobicContact CE2-CB 3.91Å; F82-P259 HydrophobicContact CG-CB 3.69Å; F82-P259 HydrophobicContact CG-CG 4.02Å; I102-P259 HydrophobicContact CD1-CG 3.36Å; Y105-P259 WeakPolarHBondContact OH-CD 3.37Å; W252-P259 HydrophobicContact CE3-CB 4.12Å; W252-P259 HydrophobicContact CZ3-CB 4.43Å; P259-T262 HydrophobicContact CB-CG2 4.12Å; P259-T262 HydrophobicContact CG-CG2 3.97Å; P259-N286 VanDerWaalsContact C-ND2 3.34Å; P259-N286 PolarHBondContact O-ND2 2.98Å
260R89.2Confident82.7Confident81 Ų8157.5 Ų57.531%0.30627%0.273SS..SBendtrans-93.3-17.7178-60.2-177.8-173.7168.45112.7W252 F258 V282 L283 E290W252-R260 HydrophobicContact CD2-CB 4.39Å; W252-R260 HydrophobicContact CD2-CG 4.4Å; W252-R260 HydrophobicContact CG-CG 4.46Å; W252-R260 HydrophobicContact CZ2-CB 4.08Å; F258-R260 PolarHBondContact O-N 3.48Å; R260-V282 WeakPolarHBondContact O-CA 3.27Å; R260-L283 PolarHBondContact O-N 2.8Å; R260-E290 IonicContact CZ-OE2 3.65Å; R260-E290 IonicContact NE-OE2 3.65Å; R260-E290 IonicContact NH2-OE1 3.65Å; R260-E290 IonicContact NH2-OE2 2.78Å; R260-E290 PolarHBondContact NH2-OE2 3.36Å
261I91.1Very high83.5Confident61 Ų6159 Ų5931%0.31329%0.294SS..EExtended strand (participates in β ladder)trans-122.9127.9175.8-57.5-179.4000106.9W252 Q280 C281W252-I261 HydrophobicContact CH2-CB 3.66Å; W252-I261 HydrophobicContact CH2-CD1 3.84Å; W252-I261 HydrophobicContact CH2-CG1 3.62Å; W252-I261 HydrophobicContact CZ2-CD1 4.22Å; W252-I261 HydrophobicContact CZ2-CG1 4.11Å; W252-I261 HydrophobicContact CZ3-CB 4.15Å; I261-Q280 HydrophobicContact CG2-CG 3.6Å; I261-Q280 VanDerWaalsContact CG2-NE2 3.25Å; I261-C281 WeakPolarHBondContact CA-O 3.44Å
262T92.5Very high84.1Confident2 Ų260.6 Ų60.61%0.01231%0.314CS..EExtended strand (participates in β ladder)trans-136.6159.5-178.956.80000109.6T80 Y81 P259 C281T80-T262 WeakPolarHBondContact CB-OG1 3.41Å; T80-T262 VanDerWaalsContact OG1-CB 3.25Å; T80-T262 WeakPolarHBondContact OG1-CB 3.35Å; T80-T262 PolarHBondContact OG1-OG1 3.1Å; Y81-T262 WeakPolarHBondContact O-CB 3.46Å; P259-T262 HydrophobicContact CB-CG2 4.12Å; P259-T262 HydrophobicContact CG-CG2 3.97Å; T262-C281 PolarHBondContact N-O 2.77Å; T262-C281 PolarHBondContact O-N 3.18Å
263L93.7Very high84.9Confident31 Ų3163.8 Ų63.816%0.16233%0.334CS..EExtended strand (participates in β ladder)trans-102.9146.1175.2-65.6169000109.6T80 Y81 I83 I90 T278 Q280T80-L263 WeakPolarHBondContact CA-O 3.43Å; T80-L263 WeakPolarHBondContact CB-O 3.29Å; Y81-L263 HydrophobicContact CD1-CB 4.49Å; Y81-L263 WeakPolarHBondContact CD1-O 3.38Å; Y81-L263 HydrophobicContact CD2-CB 4.28Å; Y81-L263 HydrophobicContact CE1-CB 3.86Å; Y81-L263 HydrophobicContact CE2-CB 3.6Å; Y81-L263 HydrophobicContact CE2-CD1 3.78Å; Y81-L263 HydrophobicContact CE2-CG 4.31Å; Y81-L263 PolarHBondContact N-O 2.86Å; Y81-L263 PolarHBondContact O-N 2.93Å; Y81-L263 VanDerWaalsContact OH-CB 3.28Å; Y81-L263 WeakPolarHBondContact OH-CB 3.44Å; I83-L263 HydrophobicContact CB-CD1 4.4Å; I83-L263 HydrophobicContact CD1-CD1 3.67Å; I83-L263 HydrophobicContact CG1-CD1 4.05Å; I90-L263 HydrophobicContact CD1-CD1 4.18Å; I90-L263 HydrophobicContact CG1-CD1 4.12Å; L263-T278 HydrophobicContact CD2-CG2 4.42Å; L263-Q280 HydrophobicContact CD2-CB 4.17Å
264C94.5Very high85.9Confident0 Ų066.9 Ų66.90%035%0.347CS..EExtended strand (participates in β ladder)trans-127.5136.6177.9174.60000110C75 T80 T278 V279C75-C264 WeakPolarHBondContact CA-SG 3.35Å; C75-C264 HydrophobicContact CB-CB 3.72Å; C75-C264 WeakPolarHBondContact CB-SG 3.31Å; C75-C264 WeakPolarHBondContact SG-CB 3.35Å; C75-C264 CovalentContact SG-SG 2.02Å; C75-C264 PolarHBondContact SG-SG 3.04Å; T80-C264 HydrophobicContact CG2-CB 4.17Å; C264-T278 CarbonylContact O-C 3.49Å; C264-T278 VanDerWaalsContact O-CA 3.3Å; C264-T278 WeakPolarHBondContact O-CA 3.21Å; C264-V279 HydrophobicContact CB-CG2 3.95Å; C264-V279 PolarHBondContact N-O 2.86Å; C264-V279 PolarHBondContact O-N 3.29Å
265D93.3Very high86.9Confident38 Ų3865.4 Ų65.420%0.20334%0.339CS..EExtended strand (participates in β ladder)trans-107.1128.9167.3-67.9-43.4000110.8Y81 R97 R276 H277 T278Y81-D265 WeakPolarHBondContact CE1-OD2 3.32Å; R97-D265 VanDerWaalsContact CZ-CG 3.44Å; R97-D265 IonicContact CZ-OD1 2.73Å; R97-D265 IonicContact CZ-OD2 3.45Å; R97-D265 IonicContact NE-OD2 3.75Å; R97-D265 PolarHBondContact NE-OD2 3.25Å; R97-D265 IonicContact NH1-OD1 3Å; R97-D265 IonicContact NH1-OD2 2.77Å; R97-D265 IonicContact NH2-OD1 3.32Å; R97-D265 PolarHBondContact NH2-OD1 3.43Å; R97-D265 IonicContact NH2-OD2 3.2Å; R97-D265 PolarHBondContact NH2-OD2 3.04Å; D265-R276 HydrophobicContact CB-CG 4.46Å; D265-H277 WeakPolarHBondContact CA-O 3.5Å; D265-T278 WeakPolarHBondContact OD1-CB 3.41Å; D265-T278 PolarHBondContact OD1-OG1 2.94Å
266F91.7Very high87.8Confident7 Ų768 Ų683%0.03134%0.343CS..EExtended strand (participates in β ladder)trans-133.4148.8167.966.2-86.6000110.6F63 A71 V74 V268 R276 H277 V279F63-F266 HydrophobicContact CE2-CE2 4.12Å; F63-F266 AromaticContact CE2-CZ 3.77Å; F63-F266 HydrophobicContact CE2-CZ 3.77Å; F63-F266 HydrophobicContact CZ-CE2 4.31Å; F63-F266 HydrophobicContact CZ-CZ 4.09Å; A71-F266 HydrophobicContact CB-CE1 4.02Å; A71-F266 HydrophobicContact CB-CZ 4Å; V74-F266 HydrophobicContact CG1-CB 3.79Å; F266-V268 HydrophobicContact CD2-CG2 3.9Å; F266-V268 HydrophobicContact CE2-CG2 3.75Å; F266-R276 WeakPolarHBondContact O-CA 3.43Å; F266-H277 HydrophobicContact CD1-CB 4.3Å; F266-H277 HydrophobicContact CD2-CB 4.37Å; F266-H277 HydrophobicContact CE1-CB 3.76Å; F266-H277 HydrophobicContact CE2-CB 3.83Å; F266-H277 AromaticContact CE2-CD2 3.99Å; F266-H277 HydrophobicContact CZ-CB 3.49Å; F266-H277 VanDerWaalsContact CZ-CB 3.49Å; F266-H277 PolarHBondContact N-O 3.31Å; F266-H277 PolarHBondContact O-N 3.45Å; F266-V279 HydrophobicContact CD1-CG2 4.15Å; F266-V279 HydrophobicContact CE1-CB 4.38Å; F266-V279 HydrophobicContact CE1-CG1 3.7Å; F266-V279 HydrophobicContact CE1-CG2 3.75Å; F266-V279 HydrophobicContact CZ-CG1 4.34Å
267E90.9Very high88.7Confident98 Ų9869.5 Ų69.546%0.45834%0.342SS..EExtended strand (participates in β ladder)trans-110123.4-179.8-64-177173.500110.1H275 R276E267-H275 WeakPolarHBondContact CA-O 3.32Å; E267-R276 HydrophobicContact CG-CB 4.33Å; E267-R276 HydrophobicContact CG-CG 4.42Å
268V90.2Very high89.7Confident42 Ų4269.8 Ų69.826%0.25535%0.346SS..EExtended strand (participates in β ladder)trans-98.5124.3171.1-177.60000108.6F266 H275F266-V268 HydrophobicContact CD2-CG2 3.9Å; F266-V268 HydrophobicContact CE2-CG2 3.75Å; V268-H275 PolarHBondContact N-O 3.01Å; V268-H275 PolarHBondContact O-N 2.99Å
269R89.8Confident90.3Very high188 Ų18869.9 Ų69.971%0.70935%0.347SS*.EExtended strand (participates in β ladder)trans-88.9113.3176.3-61.9-174.7-178.5167.51.4109.3K274R269-K274 HydrophobicContact CG-CG 4.37Å
270K87.1Confident90.6Very high141 Ų14174.6 Ų74.661%0.61337%0.369SS*.EExtended strand (participates in β ladder)trans-102.1158.8162.8-66.1-176.9-179.7177.50107.8A272 N273K270-A272 PolarHBondContact O-N 3.33Å; K270-A272 VanDerWaalsContact O-N 3.16Å; K270-N273 PolarHBondContact N-O 2.76Å; K270-N273 PolarHBondContact O-N 2.92Å; K270-N273 VanDerWaalsContact O-N 3.09Å
271V87.2Confident90.9Very high150 Ų15070.7 Ų70.791%0.90935%0.354SS*.THydrogen-bonded Turntrans-53.2127.5178.1-179.60000108.6N273V271-N273 VanDerWaalsContact C-N 3.34Å; V271-N273 PolarHBondContact O-N 2.97Å
272A84Confident91Very high98 Ų9871.2 Ų71.281%0.8136%0.36SS*.THydrogen-bonded Turntrans73-16.4-17600000118.9K270K270-A272 PolarHBondContact O-N 3.33Å; K270-A272 VanDerWaalsContact O-N 3.16Å
273N88.4Confident91Very high102 Ų10271.2 Ų71.255%0.54536%0.359SS..EExtended strand (participates in β ladder)trans-138.2141.3-175.6-76.5-39.5000114.2K270 V271K270-N273 PolarHBondContact N-O 2.76Å; K270-N273 PolarHBondContact O-N 2.92Å; K270-N273 VanDerWaalsContact O-N 3.09Å; V271-N273 VanDerWaalsContact C-N 3.34Å; V271-N273 PolarHBondContact O-N 2.97Å
274K87.8Confident90.8Very high134 Ų13471.4 Ų71.458%0.58336%0.363SS*.EExtended strand (participates in β ladder)trans-98.4117.1168.4-63.2-175.4-178.4178.10108.9R269R269-K274 HydrophobicContact CG-CG 4.37Å
275H88.1Confident90.6Very high77 Ų7771.4 Ų71.436%0.35636%0.363SS..EExtended strand (participates in β ladder)trans-100114.4175.1-64.2-78.1000109.2E267 V268E267-H275 WeakPolarHBondContact CA-O 3.32Å; V268-H275 PolarHBondContact N-O 3.01Å; V268-H275 PolarHBondContact O-N 2.99Å
276R89.5Confident90.4Very high98 Ų9869.6 Ų69.637%0.3735%0.353SS..EExtended strand (participates in β ladder)trans-85.5122.2173.1-173.9172.673172.4-2.9109.2D265 F266 E267D265-R276 HydrophobicContact CB-CG 4.46Å; F266-R276 WeakPolarHBondContact O-CA 3.43Å; E267-R276 HydrophobicContact CG-CB 4.33Å; E267-R276 HydrophobicContact CG-CG 4.42Å
277H91.9Very high90.2Very high58 Ų5873.3 Ų73.327%0.26937%0.372SS..EExtended strand (participates in β ladder)trans-105.9135.2171.8-67.8-80.5000109.1D265 F266D265-H277 WeakPolarHBondContact CA-O 3.5Å; F266-H277 HydrophobicContact CD1-CB 4.3Å; F266-H277 HydrophobicContact CD2-CB 4.37Å; F266-H277 HydrophobicContact CE1-CB 3.76Å; F266-H277 HydrophobicContact CE2-CB 3.83Å; F266-H277 AromaticContact CE2-CD2 3.99Å; F266-H277 HydrophobicContact CZ-CB 3.49Å; F266-H277 VanDerWaalsContact CZ-CB 3.49Å; F266-H277 PolarHBondContact N-O 3.31Å; F266-H277 PolarHBondContact O-N 3.45Å
278T93.3Very high90Very high54 Ų5472.2 Ų72.233%0.33137%0.365SS..EExtended strand (participates in β ladder)trans-109.5121.5170.6-57.10000108.2I90 R97 L263 C264 D265I90-T278 HydrophobicContact CD1-CG2 4.14Å; R97-T278 PolarHBondContact NH2-OG1 2.94Å; L263-T278 HydrophobicContact CD2-CG2 4.42Å; C264-T278 CarbonylContact O-C 3.49Å; C264-T278 VanDerWaalsContact O-CA 3.3Å; C264-T278 WeakPolarHBondContact O-CA 3.21Å; D265-T278 WeakPolarHBondContact OD1-CB 3.41Å; D265-T278 PolarHBondContact OD1-OG1 2.94Å
279V94Very high90Very high6 Ų670.2 Ų70.24%0.03635%0.353CS..EExtended strand (participates in β ladder)trans-123.6149.6-178.5-65.90000110.8C57 V59 C264 F266C57-V279 HydrophobicContact CB-CG2 4.34Å; V59-V279 HydrophobicContact CG1-CG1 4.33Å; C264-V279 HydrophobicContact CB-CG2 3.95Å; C264-V279 PolarHBondContact N-O 2.86Å; C264-V279 PolarHBondContact O-N 3.29Å; F266-V279 HydrophobicContact CD1-CG2 4.15Å; F266-V279 HydrophobicContact CE1-CB 4.38Å; F266-V279 HydrophobicContact CE1-CG1 3.7Å; F266-V279 HydrophobicContact CE1-CG2 3.75Å; F266-V279 HydrophobicContact CZ-CG1 4.34Å
280Q94.5Very high89.9Confident100 Ų10061.8 Ų61.847%0.46732%0.322SS..EExtended strand (participates in β ladder)trans-92124.5176.6-178175.1-22.400109.7W58 I261 L263W58-Q280 PolarHBondContact N-O 3.32Å; I261-Q280 HydrophobicContact CG2-CG 3.6Å; I261-Q280 VanDerWaalsContact CG2-NE2 3.25Å; L263-Q280 HydrophobicContact CD2-CB 4.17Å
281C95.1Very high89.9Confident0 Ų060.2 Ų60.20%032%0.315CS..EExtended strand (participates in β ladder)trans-119.4133.9-177.9-56.50000111.6I55 A56 C57 I261 T262I55-C281 HydrophobicContact CD1-CB 3.67Å; I55-C281 HydrophobicContact CG1-CB 3.74Å; A56-C281 CarbonylContact O-C 3.47Å; A56-C281 VanDerWaalsContact O-CA 3.28Å; A56-C281 WeakPolarHBondContact O-CA 3.42Å; C57-C281 HydrophobicContact CB-CB 4.11Å; C57-C281 WeakPolarHBondContact CB-SG 3.19Å; C57-C281 WeakPolarHBondContact SG-CB 3.48Å; C57-C281 CovalentContact SG-SG 2.05Å; C57-C281 PolarHBondContact SG-SG 3.23Å; I261-C281 WeakPolarHBondContact CA-O 3.44Å; T262-C281 PolarHBondContact N-O 2.77Å; T262-C281 PolarHBondContact O-N 3.18Å
282V93.8Very high90.1Very high71 Ų7153.7 Ų53.743%0.4328%0.275SS..EExtended strand (participates in β ladder)trans-87.5138169.7-177.10000108.3A56 R260 P284A56-V282 PolarHBondContact N-O 3.17Å; A56-V282 PolarHBondContact O-N 3.39Å; R260-V282 WeakPolarHBondContact O-CA 3.27Å; V282-P284 VanDerWaalsContact C-CD 3.47Å; V282-P284 HydrophobicContact CG1-CG 4.39Å; V282-P284 VanDerWaalsContact O-CD 3.23Å; V282-P284 WeakPolarHBondContact O-CD 3.28Å
283L91.3Very high90.4Very high2 Ų249.1 Ų49.11%0.0124%0.237CC..  trans-119.174.6-173.9-147.666.7000111.4I55 W76 Y105 R260 I285 N286I55-L283 HydrophobicContact CB-CD1 3.84Å; I55-L283 HydrophobicContact CD1-CD1 3.73Å; I55-L283 HydrophobicContact CG1-CD1 3.64Å; W76-L283 HydrophobicContact CZ3-CD1 4.36Å; Y105-L283 HydrophobicContact CD2-CD2 3.52Å; Y105-L283 HydrophobicContact CE1-CD2 4.34Å; Y105-L283 HydrophobicContact CE2-CD2 3.3Å; Y105-L283 HydrophobicContact CG-CD2 4.14Å; R260-L283 PolarHBondContact O-N 2.8Å; L283-I285 HydrophobicContact CG-CG2 3.99Å; L283-I285 PolarHBondContact O-N 3.43Å; L283-N286 HydrophobicContact CB-CB 4.46Å; L283-N286 HydrophobicContact CD2-CB 4.41Å; L283-N286 WeakPolarHBondContact O-CB 3.32Å; L283-N286 PolarHBondContact O-N 3.38Å
284P90.5Very high90.4Very high35 Ų3545.2 Ų45.223%0.22722%0.216CC..Hα-helixtrans-58.3-31-176.5-25.533.9000114.3P54 V282 N286 M287 F288P54-P284 WeakPolarHBondContact O-CD 3.18Å; V282-P284 VanDerWaalsContact C-CD 3.47Å; V282-P284 HydrophobicContact CG1-CG 4.39Å; V282-P284 VanDerWaalsContact O-CD 3.23Å; V282-P284 WeakPolarHBondContact O-CD 3.28Å; P284-N286 PolarHBondContact O-N 3.18Å; P284-M287 WeakPolarHBondContact O-CB 3.13Å; P284-M287 PolarHBondContact O-N 2.89Å; P284-F288 WeakPolarHBondContact O-CD2 3.32Å
285I89.9Confident90.6Very high0 Ų043.1 Ų43.10%021%0.207CC..Hα-helixtrans-57.5-30.4177.8-168.9168.4000112I45 Q49 W76 L283 M287 F288 N289I45-I285 HydrophobicContact CG2-CD1 4.15Å; I45-I285 HydrophobicContact CG2-CG1 4.47Å; Q49-I285 HydrophobicContact CB-CD1 4.34Å; W76-I285 HydrophobicContact CH2-CD1 4.01Å; W76-I285 HydrophobicContact CH2-CG2 4.34Å; W76-I285 HydrophobicContact CZ3-CG2 4.17Å; L283-I285 HydrophobicContact CG-CG2 3.99Å; L283-I285 PolarHBondContact O-N 3.43Å; I285-M287 VanDerWaalsContact C-N 3.35Å; I285-M287 PolarHBondContact O-N 3.37Å; I285-F288 WeakPolarHBondContact O-CB 3.35Å; I285-F288 PolarHBondContact O-N 2.82Å; I285-N289 PolarHBondContact O-N 2.87Å; I285-N289 VanDerWaalsContact O-N 3.1Å
286N88.7Confident90.9Very high0 Ų039.4 Ų39.40%019%0.19CC..Hα-helixtrans-72.8-29.7-176.9-173.138.3000113Y105 F258 P259 L283 P284 F288 N289 E290Y105-N286 HydrophobicContact CE1-CB 3.88Å; Y105-N286 WeakPolarHBondContact CE1-OD1 3.32Å; F258-N286 WeakPolarHBondContact CA-ND2 3.25Å; F258-N286 WeakPolarHBondContact CB-ND2 3.29Å; F258-N286 WeakPolarHBondContact CD1-OD1 3.49Å; F258-N286 PolarHBondContact O-ND2 3.33Å; P259-N286 VanDerWaalsContact C-ND2 3.34Å; P259-N286 PolarHBondContact O-ND2 2.98Å; L283-N286 HydrophobicContact CB-CB 4.46Å; L283-N286 HydrophobicContact CD2-CB 4.41Å; L283-N286 WeakPolarHBondContact O-CB 3.32Å; L283-N286 PolarHBondContact O-N 3.38Å; P284-N286 PolarHBondContact O-N 3.18Å; N286-F288 PolarHBondContact O-N 3.45Å; N286-N289 PolarHBondContact O-N 3.06Å; N286-E290 WeakPolarHBondContact O-CB 3.43Å; N286-E290 PolarHBondContact O-N 3Å
287M87.4Confident91Very high86 Ų8635.1 Ų35.142%0.42417%0.173SC..Hα-helixtrans-59.9-37.8170.9-172.8-176.275.600111.4P284 I285 K291P284-M287 WeakPolarHBondContact O-CB 3.13Å; P284-M287 PolarHBondContact O-N 2.89Å; I285-M287 VanDerWaalsContact C-N 3.35Å; I285-M287 PolarHBondContact O-N 3.37Å; M287-K291 WeakPolarHBondContact O-CG 3.13Å; M287-K291 PolarHBondContact O-N 3.39Å
288F88.7Confident91Very high74 Ų7436.4 Ų36.433%0.32518%0.178SC..Hα-helixtrans-70.8-43.9175.7-69.1-86.7000111.7R48 P284 I285 N286 E290 K291 I292R48-F288 HydrophobicContact CG-CD2 4.33Å; R48-F288 HydrophobicContact CG-CE2 4.27Å; P284-F288 WeakPolarHBondContact O-CD2 3.32Å; I285-F288 WeakPolarHBondContact O-CB 3.35Å; I285-F288 PolarHBondContact O-N 2.82Å; N286-F288 PolarHBondContact O-N 3.45Å; F288-E290 PolarHBondContact O-N 3.31Å; F288-K291 PolarHBondContact O-N 2.96Å; F288-I292 WeakPolarHBondContact O-CB 3.36Å; F288-I292 WeakPolarHBondContact O-CG1 3.42Å; F288-I292 PolarHBondContact O-N 3.11Å
289N89.6Confident91.1Very high0 Ų036.2 Ų36.20%017%0.172CC..Hα-helixtrans-59.4-45.7178.7-71.9-19.7000111.7F258 I285 N286 K291 I292 F293F258-N289 HydrophobicContact CE1-CB 4.31Å; I285-N289 PolarHBondContact O-N 2.87Å; I285-N289 VanDerWaalsContact O-N 3.1Å; N286-N289 PolarHBondContact O-N 3.06Å; N289-K291 VanDerWaalsContact C-N 3.32Å; N289-K291 PolarHBondContact O-N 2.91Å; N289-I292 PolarHBondContact O-N 3.37Å; N289-F293 HydrophobicContact CB-CD2 4.14Å; N289-F293 HydrophobicContact CB-CE2 4.18Å; N289-F293 WeakPolarHBondContact O-CB 3.29Å; N289-F293 WeakPolarHBondContact O-CD2 3.36Å; N289-F293 PolarHBondContact O-N 2.96Å
290E86.6Confident91.1Very high11 Ų1136 Ų365%0.05117%0.17CC..Hα-helixtrans-51.1-51.5175.8-174-159.7127.300111F258 R260 N286 F288 I294F258-E290 HydrophobicContact CB-CB 4.36Å; F258-E290 HydrophobicContact CB-CG 4.45Å; F258-E290 HydrophobicContact CD1-CB 4.5Å; F258-E290 HydrophobicContact CD2-CB 3.97Å; F258-E290 HydrophobicContact CD2-CG 3.79Å; F258-E290 HydrophobicContact CE2-CB 4.23Å; F258-E290 HydrophobicContact CE2-CG 4.19Å; F258-E290 HydrophobicContact CG-CB 4.08Å; F258-E290 HydrophobicContact CG-CG 4.27Å; R260-E290 IonicContact CZ-OE2 3.65Å; R260-E290 IonicContact NE-OE2 3.65Å; R260-E290 IonicContact NH2-OE1 3.65Å; R260-E290 IonicContact NH2-OE2 2.78Å; R260-E290 PolarHBondContact NH2-OE2 3.36Å; N286-E290 WeakPolarHBondContact O-CB 3.43Å; N286-E290 PolarHBondContact O-N 3Å; F288-E290 PolarHBondContact O-N 3.31Å; E290-I294 HydrophobicContact CG-CD1 4.13Å; E290-I294 WeakPolarHBondContact O-CD1 3.43Å; E290-I294 VanDerWaalsContact O-CG1 3.22Å; E290-I294 WeakPolarHBondContact O-CG1 3.43Å; E290-I294 PolarHBondContact O-N 2.94Å
291K88.3Confident91Very high108 Ų10834.9 Ų34.947%0.4717%0.167SC..Hα-helixtrans-68.1-40.2-178.6-58.5-44.4-179.4-164.20112.9M287 F288 N289 F295M287-K291 WeakPolarHBondContact O-CG 3.13Å; M287-K291 PolarHBondContact O-N 3.39Å; F288-K291 PolarHBondContact O-N 2.96Å; N289-K291 VanDerWaalsContact C-N 3.32Å; N289-K291 PolarHBondContact O-N 2.91Å; K291-F295 WeakPolarHBondContact O-CB 3.37Å; K291-F295 PolarHBondContact O-N 3.32Å; K291-F295 VanDerWaalsContact O-N 3.08Å
292I91.7Very high91Very high13 Ų1338.9 Ų38.97%0.06719%0.188CC..Hα-helixtrans-65.5-45.9178.9-70.7169000110.6F41 I45 F288 N289 F295 L296F41-I292 HydrophobicContact CB-CD1 4.47Å; F41-I292 HydrophobicContact CB-CG2 4.18Å; F41-I292 HydrophobicContact CD1-CD1 4.45Å; F41-I292 HydrophobicContact CD1-CG1 4.29Å; F41-I292 HydrophobicContact CD2-CG2 3.67Å; F41-I292 HydrophobicContact CE2-CG2 4.09Å; F41-I292 HydrophobicContact CG-CG1 4.43Å; F41-I292 HydrophobicContact CG-CG2 3.93Å; I45-I292 HydrophobicContact CD1-CD1 3.62Å; I45-I292 HydrophobicContact CG1-CD1 3.55Å; F288-I292 WeakPolarHBondContact O-CB 3.36Å; F288-I292 WeakPolarHBondContact O-CG1 3.42Å; F288-I292 PolarHBondContact O-N 3.11Å; N289-I292 PolarHBondContact O-N 3.37Å; I292-F295 PolarHBondContact O-N 2.63Å; I292-L296 HydrophobicContact CG2-CD1 3.84Å; I292-L296 HydrophobicContact CG2-CG 4.26Å; I292-L296 WeakPolarHBondContact O-CB 3.39Å; I292-L296 VanDerWaalsContact O-CG 3.3Å; I292-L296 WeakPolarHBondContact O-CG 3.3Å; I292-L296 PolarHBondContact O-N 3.49Å
293F89.7Confident91.1Very high2 Ų235.5 Ų35.51%0.00917%0.167CC..Hα-helixtrans-69.6-36.7-179.2-76.8-61.4000112.9V108 M227 F258 N289 F295 L296 W297V108-F293 HydrophobicContact CG1-CE2 4.09Å; V108-F293 HydrophobicContact CG1-CZ 3.91Å; V108-F293 HydrophobicContact CG2-CE2 4.25Å; V108-F293 HydrophobicContact CG2-CZ 4.36Å; M227-F293 HydrophobicContact CG-CD1 3.96Å; M227-F293 HydrophobicContact CG-CE1 4.25Å; M227-F293 HydrophobicContact SD-CD1 4Å; F258-F293 HydrophobicContact CE1-CD2 4.01Å; F258-F293 HydrophobicContact CZ-CB 4.04Å; F258-F293 AromaticContact CZ-CD2 3.83Å; F258-F293 HydrophobicContact CZ-CD2 3.83Å; F258-F293 HydrophobicContact CZ-CG 4.31Å; N289-F293 HydrophobicContact CB-CD2 4.14Å; N289-F293 HydrophobicContact CB-CE2 4.18Å; N289-F293 WeakPolarHBondContact O-CB 3.29Å; N289-F293 WeakPolarHBondContact O-CD2 3.36Å; N289-F293 PolarHBondContact O-N 2.96Å; F293-F295 VanDerWaalsContact C-N 3.35Å; F293-L296 HydrophobicContact CD1-CD1 4.41Å; F293-L296 PolarHBondContact O-N 3.39Å; F293-W297 WeakPolarHBondContact O-CB 3.35Å; F293-W297 PolarHBondContact O-N 3.31Å
294I88Confident91.3Very high21 Ų2136.7 Ų36.711%0.10818%0.177CC..Hα-helixtrans-57-51.7169.9-70.8163.3000109.8L242 I246 E290 L296 W297 F298L242-I294 HydrophobicContact CD2-CD1 3.6Å; L242-I294 HydrophobicContact CD2-CG1 3.35Å; L242-I294 HydrophobicContact CG-CD1 4.3Å; L242-I294 HydrophobicContact CG-CG1 4.34Å; I246-I294 HydrophobicContact CD1-CD1 3.97Å; E290-I294 HydrophobicContact CG-CD1 4.13Å; E290-I294 WeakPolarHBondContact O-CD1 3.43Å; E290-I294 VanDerWaalsContact O-CG1 3.22Å; E290-I294 WeakPolarHBondContact O-CG1 3.43Å; E290-I294 PolarHBondContact O-N 2.94Å; I294-L296 PolarHBondContact O-N 3.04Å; I294-W297 WeakPolarHBondContact O-CB 3.17Å; I294-W297 PolarHBondContact O-N 3.49Å; I294-F298 HydrophobicContact CG2-CD2 4.19Å; I294-F298 HydrophobicContact CG2-CE2 4Å; I294-F298 VanDerWaalsContact O-CD2 3.25Å; I294-F298 WeakPolarHBondContact O-CD2 3.2Å; I294-F298 PolarHBondContact O-N 3.34Å
295F92.6Very high91.6Very high89 Ų8937.5 Ų37.539%0.3919%0.187SC..Hα-helixtrans-59.8-46.2-179.7175.4-84.4000111.7L37 F41 K291 I292 F293 W297 F298 W299L37-F295 HydrophobicContact CD1-CE1 3.6Å; L37-F295 HydrophobicContact CD1-CZ 3.93Å; L37-F295 HydrophobicContact CD2-CE1 4.01Å; L37-F295 HydrophobicContact CG-CE1 4.31Å; F41-F295 AromaticContact CE2-CD1 3.6Å; F41-F295 HydrophobicContact CE2-CD1 3.6Å; F41-F295 AromaticContact CE2-CE1 3.96Å; F41-F295 HydrophobicContact CE2-CE1 3.96Å; F41-F295 AromaticContact CZ-CD1 3.56Å; F41-F295 HydrophobicContact CZ-CD1 3.56Å; F41-F295 AromaticContact CZ-CE1 3.84Å; F41-F295 HydrophobicContact CZ-CE1 3.84Å; F41-F295 HydrophobicContact CZ-CG 4.27Å; K291-F295 WeakPolarHBondContact O-CB 3.37Å; K291-F295 PolarHBondContact O-N 3.32Å; K291-F295 VanDerWaalsContact O-N 3.08Å; I292-F295 PolarHBondContact O-N 2.63Å; F293-F295 VanDerWaalsContact C-N 3.35Å; F295-W297 VanDerWaalsContact C-N 3.27Å; F295-W297 PolarHBondContact O-N 3.38Å; F295-F298 PolarHBondContact O-N 3.45Å; F295-W299 HydrophobicContact CD1-CB 4.47Å; F295-W299 HydrophobicContact CE1-CB 4.09Å; F295-W299 HydrophobicContact CE1-CD2 4.27Å; F295-W299 HydrophobicContact CE1-CE3 4.09Å; F295-W299 HydrophobicContact CE1-CG 4.28Å; F295-W299 HydrophobicContact CZ-CD2 4.39Å; F295-W299 AromaticContact CZ-CE3 3.76Å; F295-W299 HydrophobicContact CZ-CE3 3.76Å; F295-W299 HydrophobicContact CZ-CZ3 4.36Å; F295-W299 WeakPolarHBondContact O-CB 3.33Å; F295-W299 PolarHBondContact O-N 3.01Å
296L93.3Very high91.9Very high0 Ų039.3 Ų39.30%020%0.198CC..Hα-helixtrans-62.5-34179.2-74.7177.1000112.5L37 L38 F41 L112 M227 I292 F293 I294 W299 F300L37-L296 HydrophobicContact CD2-CD2 3.59Å; L38-L296 HydrophobicContact CD2-CD1 3.93Å; L38-L296 HydrophobicContact CD2-CD2 3.69Å; L38-L296 HydrophobicContact CD2-CG 4.5Å; F41-L296 HydrophobicContact CD2-CD1 4.3Å; F41-L296 HydrophobicContact CD2-CD2 3.95Å; F41-L296 HydrophobicContact CD2-CG 4.15Å; F41-L296 HydrophobicContact CE2-CD2 3.77Å; F41-L296 HydrophobicContact CE2-CG 3.99Å; L112-L296 HydrophobicContact CD2-CD1 3.8Å; M227-L296 HydrophobicContact SD-CB 4.39Å; I292-L296 HydrophobicContact CG2-CD1 3.84Å; I292-L296 HydrophobicContact CG2-CG 4.26Å; I292-L296 WeakPolarHBondContact O-CB 3.39Å; I292-L296 VanDerWaalsContact O-CG 3.3Å; I292-L296 WeakPolarHBondContact O-CG 3.3Å; I292-L296 PolarHBondContact O-N 3.49Å; F293-L296 HydrophobicContact CD1-CD1 4.41Å; F293-L296 PolarHBondContact O-N 3.39Å; I294-L296 PolarHBondContact O-N 3.04Å; L296-W299 PolarHBondContact O-N 3.06Å; L296-F300 HydrophobicContact CD2-CE1 4.25Å; L296-F300 HydrophobicContact CD2-CZ 4.31Å; L296-F300 WeakPolarHBondContact O-CB 3.49Å; L296-F300 VanDerWaalsContact O-CG 3.27Å; L296-F300 WeakPolarHBondContact O-CG 3.43Å; L296-F300 PolarHBondContact O-N 3.42Å
297W91.5Very high92.3Very high7 Ų739.4 Ų39.43%0.02720%0.198CC..Hα-helixtrans-60.8-50.4176.6-171.696.9000111.6F224 M227 F237 L240 F293 I294 F295 F300 I301F224-W297 AromaticContact CE2-CD1 3.62Å; F224-W297 HydrophobicContact CE2-CD2 4.45Å; F224-W297 AromaticContact CE2-CE2 3.88Å; F224-W297 HydrophobicContact CE2-CG 4.28Å; F224-W297 HydrophobicContact CE2-CZ2 4.5Å; F224-W297 AromaticContact CE2-NE1 3.32Å; F224-W297 VanDerWaalsContact CE2-NE1 3.32Å; F224-W297 AromaticContact CZ-CE2 3.93Å; F224-W297 HydrophobicContact CZ-CZ2 4.28Å; F224-W297 AromaticContact CZ-NE1 3.3Å; F224-W297 VanDerWaalsContact CZ-NE1 3.3Å; M227-W297 HydrophobicContact CE-CB 3.91Å; M227-W297 HydrophobicContact CE-CG 4.08Å; F237-W297 HydrophobicContact CD1-CZ2 4.16Å; L240-W297 HydrophobicContact CD1-CH2 4.11Å; L240-W297 HydrophobicContact CD2-CH2 3.8Å; L240-W297 HydrophobicContact CD2-CZ3 3.98Å; L240-W297 HydrophobicContact CG-CH2 3.46Å; L240-W297 VanDerWaalsContact CG-CH2 3.46Å; L240-W297 HydrophobicContact CG-CZ2 4.11Å; L240-W297 HydrophobicContact CG-CZ3 4.1Å; F293-W297 WeakPolarHBondContact O-CB 3.35Å; F293-W297 PolarHBondContact O-N 3.31Å; I294-W297 WeakPolarHBondContact O-CB 3.17Å; I294-W297 PolarHBondContact O-N 3.49Å; F295-W297 VanDerWaalsContact C-N 3.27Å; F295-W297 PolarHBondContact O-N 3.38Å; W297-F300 PolarHBondContact O-N 2.9Å; W297-I301 HydrophobicContact CD2-CD1 4.03Å; W297-I301 HydrophobicContact CE3-CD1 3.67Å; W297-I301 HydrophobicContact CH2-CD1 3.17Å; W297-I301 HydrophobicContact CZ2-CD1 3.62Å; W297-I301 HydrophobicContact CZ3-CD1 3.23Å; W297-I301 PolarHBondContact O-N 3.45Å
298F92.4Very high92.7Very high85 Ų8537.9 Ų37.937%0.37319%0.194SC..Hα-helixtrans-64.5-40.3174.9-72.7-73.5000112.2L243 I294 F295 F300 I301 L302L243-F298 HydrophobicContact CD1-CE1 4.21Å; L243-F298 HydrophobicContact CD1-CE2 3.65Å; L243-F298 HydrophobicContact CD1-CZ 3.21Å; L243-F298 HydrophobicContact CG-CE2 4.1Å; L243-F298 HydrophobicContact CG-CZ 4.03Å; I294-F298 HydrophobicContact CG2-CD2 4.19Å; I294-F298 HydrophobicContact CG2-CE2 4Å; I294-F298 VanDerWaalsContact O-CD2 3.25Å; I294-F298 WeakPolarHBondContact O-CD2 3.2Å; I294-F298 PolarHBondContact O-N 3.34Å; F295-F298 PolarHBondContact O-N 3.45Å; F298-F300 PolarHBondContact O-N 3.45Å; F298-I301 PolarHBondContact O-N 2.9Å; F298-L302 PolarHBondContact O-N 3.26Å; F298-L302 VanDerWaalsContact O-N 3.09Å
299W94.7Very high93Very high50 Ų5038 Ų3819%0.18920%0.204CC..Hα-helixtrans-61-45178.4-173.4-93.8000112F29 T34 L37 F295 L296 I301 L302 V303F29-W299 HydrophobicContact CE1-CZ2 4.28Å; F29-W299 HydrophobicContact CE2-CH2 4.05Å; F29-W299 HydrophobicContact CE2-CZ2 4.14Å; F29-W299 AromaticContact CZ-CH2 3.81Å; F29-W299 HydrophobicContact CZ-CH2 3.81Å; F29-W299 AromaticContact CZ-CZ2 3.73Å; F29-W299 HydrophobicContact CZ-CZ2 3.73Å; F29-W299 HydrophobicContact CZ-CZ3 4.46Å; T34-W299 PolarHBondContact OG1-NE1 3.32Å; L37-W299 HydrophobicContact CD1-CD2 4.17Å; L37-W299 HydrophobicContact CD1-CE3 4.3Å; L37-W299 HydrophobicContact CD1-CH2 4.32Å; L37-W299 HydrophobicContact CD1-CZ2 4.19Å; L37-W299 HydrophobicContact CD1-CZ3 4.37Å; F295-W299 HydrophobicContact CD1-CB 4.47Å; F295-W299 HydrophobicContact CE1-CB 4.09Å; F295-W299 HydrophobicContact CE1-CD2 4.27Å; F295-W299 HydrophobicContact CE1-CE3 4.09Å; F295-W299 HydrophobicContact CE1-CG 4.28Å; F295-W299 HydrophobicContact CZ-CD2 4.39Å; F295-W299 AromaticContact CZ-CE3 3.76Å; F295-W299 HydrophobicContact CZ-CE3 3.76Å; F295-W299 HydrophobicContact CZ-CZ3 4.36Å; F295-W299 WeakPolarHBondContact O-CB 3.33Å; F295-W299 PolarHBondContact O-N 3.01Å; L296-W299 PolarHBondContact O-N 3.06Å; W299-I301 VanDerWaalsContact C-N 3.32Å; W299-I301 PolarHBondContact O-N 3.26Å; W299-L302 WeakPolarHBondContact O-CB 3.49Å; W299-L302 PolarHBondContact O-N 3.43Å; W299-V303 HydrophobicContact CG-CG2 4.49Å; W299-V303 VanDerWaalsContact O-CG2 3.29Å; W299-V303 WeakPolarHBondContact O-CG2 3.36Å; W299-V303 PolarHBondContact O-N 3.29Å
300F94Very high93.3Very high3 Ų338.5 Ų38.51%0.01321%0.207CC..Hα-helixtrans-66.6-32.5179.2-69.4-13.7000112.9T34 L38 F119 V220 Q223 M227 L296 W297 F298 V303 A304T34-F300 HydrophobicContact CG2-CD1 4.43Å; T34-F300 HydrophobicContact CG2-CE1 3.93Å; L38-F300 HydrophobicContact CD2-CZ 4.36Å; F119-F300 HydrophobicContact CE2-CD1 4.28Å; F119-F300 AromaticContact CE2-CE1 3.51Å; F119-F300 HydrophobicContact CE2-CE1 3.51Å; F119-F300 AromaticContact CE2-CZ 3.8Å; F119-F300 HydrophobicContact CE2-CZ 3.8Å; F119-F300 AromaticContact CZ-CD1 3.85Å; F119-F300 HydrophobicContact CZ-CD1 3.85Å; F119-F300 AromaticContact CZ-CE1 3.55Å; F119-F300 HydrophobicContact CZ-CE1 3.55Å; F119-F300 HydrophobicContact CZ-CZ 4.14Å; V220-F300 HydrophobicContact CG2-CB 4.11Å; V220-F300 WeakPolarHBondContact CG2-O 3.23Å; Q223-F300 HydrophobicContact CB-CD2 4.38Å; Q223-F300 HydrophobicContact CB-CE2 4.06Å; Q223-F300 HydrophobicContact CB-CZ 4.43Å; M227-F300 HydrophobicContact SD-CD2 4.41Å; M227-F300 HydrophobicContact SD-CE2 4.25Å; L296-F300 HydrophobicContact CD2-CE1 4.25Å; L296-F300 HydrophobicContact CD2-CZ 4.31Å; L296-F300 WeakPolarHBondContact O-CB 3.49Å; L296-F300 VanDerWaalsContact O-CG 3.27Å; L296-F300 WeakPolarHBondContact O-CG 3.43Å; L296-F300 PolarHBondContact O-N 3.42Å; W297-F300 PolarHBondContact O-N 2.9Å; F298-F300 PolarHBondContact O-N 3.45Å; F300-V303 PolarHBondContact O-N 2.86Å; F300-A304 VanDerWaalsContact O-CB 3.29Å; F300-A304 WeakPolarHBondContact O-CB 3.05Å; F300-A304 PolarHBondContact O-N 2.97Å
301I93.4Very high93.7Very high75 Ų7539.6 Ų39.639%0.38521%0.212SC..Hα-helixtrans-63.7-45.2171.3-69.2173.1000110.7W297 F298 W299 A304 A305W297-I301 HydrophobicContact CD2-CD1 4.03Å; W297-I301 HydrophobicContact CE3-CD1 3.67Å; W297-I301 HydrophobicContact CH2-CD1 3.17Å; W297-I301 HydrophobicContact CZ2-CD1 3.62Å; W297-I301 HydrophobicContact CZ3-CD1 3.23Å; W297-I301 PolarHBondContact O-N 3.45Å; F298-I301 PolarHBondContact O-N 2.9Å; W299-I301 VanDerWaalsContact C-N 3.32Å; W299-I301 PolarHBondContact O-N 3.26Å; I301-A304 PolarHBondContact O-N 3.09Å; I301-A305 WeakPolarHBondContact O-CB 3.44Å; I301-A305 PolarHBondContact O-N 2.89Å
302L95.1Very high94Very high85 Ų8539.5 Ų39.545%0.44522%0.216SC..Hα-helixtrans-60.6-46.9176.3179.463.8000111.4F29 F298 W299 A304 A305 V306F29-L302 HydrophobicContact CE1-CD2 4.45Å; F29-L302 HydrophobicContact CE1-CG 4.26Å; F29-L302 HydrophobicContact CZ-CD2 3.86Å; F29-L302 HydrophobicContact CZ-CG 4.14Å; F298-L302 PolarHBondContact O-N 3.26Å; F298-L302 VanDerWaalsContact O-N 3.09Å; W299-L302 WeakPolarHBondContact O-CB 3.49Å; W299-L302 PolarHBondContact O-N 3.43Å; L302-A304 VanDerWaalsContact C-N 3.32Å; L302-A304 PolarHBondContact O-N 3.18Å; L302-A305 PolarHBondContact O-N 3.4Å; L302-V306 HydrophobicContact CD1-CG2 4.37Å; L302-V306 WeakPolarHBondContact O-CG2 3.3Å; L302-V306 PolarHBondContact O-N 2.9Å
303V96.3Very high94Very high0 Ų043.8 Ų43.80%023%0.232CC..Hα-helixtrans-59.1-43.4175.8174.20000111F29 T34 F119 V220 W299 F300 V306 N307F29-V303 HydrophobicContact CD1-CB 4.47Å; F29-V303 HydrophobicContact CD1-CG2 3.89Å; F29-V303 HydrophobicContact CE1-CB 4.25Å; F29-V303 HydrophobicContact CE1-CG2 3.48Å; F29-V303 VanDerWaalsContact CE1-CG2 3.48Å; T34-V303 WeakPolarHBondContact OG1-CG2 3.41Å; F119-V303 HydrophobicContact CE1-CG1 4.23Å; V220-V303 HydrophobicContact CB-CG1 4.35Å; V220-V303 HydrophobicContact CG2-CB 4.22Å; V220-V303 HydrophobicContact CG2-CG1 4.02Å; W299-V303 HydrophobicContact CG-CG2 4.49Å; W299-V303 VanDerWaalsContact O-CG2 3.29Å; W299-V303 WeakPolarHBondContact O-CG2 3.36Å; W299-V303 PolarHBondContact O-N 3.29Å; F300-V303 PolarHBondContact O-N 2.86Å; V303-V306 PolarHBondContact O-N 3.27Å; V303-N307 WeakPolarHBondContact CG1-ND2 3.12Å; V303-N307 WeakPolarHBondContact O-CB 3.41Å; V303-N307 VanDerWaalsContact O-CG 3.3Å; V303-N307 PolarHBondContact O-N 3.1Å; V303-N307 PolarHBondContact O-ND2 3.03Å
304A95.6Very high94.2Very high27 Ų2743.8 Ų43.822%0.22323%0.232CC..Hα-helixtrans-62.9-43177.200000112.3V220 F300 I301 L302 T308V220-A304 HydrophobicContact CG1-CB 3.84Å; V220-A304 HydrophobicContact CG2-CB 4.14Å; F300-A304 VanDerWaalsContact O-CB 3.29Å; F300-A304 WeakPolarHBondContact O-CB 3.05Å; F300-A304 PolarHBondContact O-N 2.97Å; I301-A304 PolarHBondContact O-N 3.09Å; L302-A304 VanDerWaalsContact C-N 3.32Å; L302-A304 PolarHBondContact O-N 3.18Å; A304-T308 VanDerWaalsContact O-CB 3.24Å; A304-T308 WeakPolarHBondContact O-CB 3.22Å; A304-T308 PolarHBondContact O-N 3.04Å; A304-T308 PolarHBondContact O-OG1 2.73Å
305A96.3Very high94.3Very high51 Ų5143.6 Ų43.642%0.42123%0.232SC..Hα-helixtrans-63.7-45.2177.100000112.1I301 L302 S309I301-A305 WeakPolarHBondContact O-CB 3.44Å; I301-A305 PolarHBondContact O-N 2.89Å; L302-A305 PolarHBondContact O-N 3.4Å; A305-S309 VanDerWaalsContact O-CB 3.31Å; A305-S309 WeakPolarHBondContact O-CB 3.25Å; A305-S309 PolarHBondContact O-N 2.99Å; A305-S309 PolarHBondContact O-OG 3.25Å
306V96.3Very high94.2Very high38 Ų3845.9 Ų45.923%0.2324%0.239CC..Hα-helixtrans-63.4-46.5178.3171.30000111.2F29 L302 V303 S309 S310F29-V306 HydrophobicContact CD1-CB 4.45Å; F29-V306 HydrophobicContact CD1-CG1 4.38Å; L302-V306 HydrophobicContact CD1-CG2 4.37Å; L302-V306 WeakPolarHBondContact O-CG2 3.3Å; L302-V306 PolarHBondContact O-N 2.9Å; V303-V306 PolarHBondContact O-N 3.27Å; V306-S309 PolarHBondContact O-N 3.43Å; V306-S310 PolarHBondContact O-N 3.43Å
307N95.9Very high94Very high2 Ų248.6 Ų48.61%0.01125%0.251CS..Hα-helixtrans-66-42.4178.9-73.9-30.1000112.6S26 S30 I217 V303 S310 F311S26-N307 PolarHBondContact O-OD1 2.99Å; S30-N307 PolarHBondContact OG-ND2 3.27Å; S30-N307 PolarHBondContact OG-OD1 3.12Å; I217-N307 HydrophobicContact CG1-CB 4Å; V303-N307 WeakPolarHBondContact CG1-ND2 3.12Å; V303-N307 WeakPolarHBondContact O-CB 3.41Å; V303-N307 VanDerWaalsContact O-CG 3.3Å; V303-N307 PolarHBondContact O-N 3.1Å; V303-N307 PolarHBondContact O-ND2 3.03Å; N307-S310 PolarHBondContact O-N 2.93Å; N307-F311 WeakPolarHBondContact O-CB 3.5Å; N307-F311 PolarHBondContact O-N 3.48Å
308T96.2Very high93.8Very high54 Ų5448.6 Ų48.633%0.33125%0.252SS..Hα-helixtrans-63.7-44.3177.8-56.90000110.6A304 S310 F311 L312A304-T308 VanDerWaalsContact O-CB 3.24Å; A304-T308 WeakPolarHBondContact O-CB 3.22Å; A304-T308 PolarHBondContact O-N 3.04Å; A304-T308 PolarHBondContact O-OG1 2.73Å; T308-S310 PolarHBondContact O-N 3.34Å; T308-F311 PolarHBondContact O-N 3.08Å; T308-L312 HydrophobicContact CG2-CD1 4.06Å; T308-L312 HydrophobicContact CG2-CG 4.39Å; T308-L312 WeakPolarHBondContact O-CB 3.43Å; T308-L312 VanDerWaalsContact O-CG 3.29Å; T308-L312 WeakPolarHBondContact O-CG 3.42Å; T308-L312 PolarHBondContact O-N 2.91Å
309S95.8Very high93.4Very high77 Ų7748.4 Ų48.454%0.53826%0.261SS..Hα-helixtrans-61.1-44.3176.9-59.10000111.8A305 V306 Y313A305-S309 VanDerWaalsContact O-CB 3.31Å; A305-S309 WeakPolarHBondContact O-CB 3.25Å; A305-S309 PolarHBondContact O-N 2.99Å; A305-S309 PolarHBondContact O-OG 3.25Å; V306-S309 PolarHBondContact O-N 3.43Å; S309-Y313 VanDerWaalsContact O-CB 3.26Å; S309-Y313 WeakPolarHBondContact O-CB 3.22Å; S309-Y313 PolarHBondContact O-N 3.35Å
310S94.7Very high93Very high10 Ų1051.2 Ų51.27%0.0728%0.275CS..Hα-helixtrans-64.4-45.9175.7179.80000111.9D24 S26 K213 V306 N307 T308 L312 Y313 W314D24-S310 PolarHBondContact OD2-OG 2.88Å; S26-S310 WeakPolarHBondContact OG-CB 3.17Å; S26-S310 PolarHBondContact OG-OG 3.46Å; K213-S310 PolarHBondContact NZ-OG 2.93Å; V306-S310 PolarHBondContact O-N 3.43Å; N307-S310 PolarHBondContact O-N 2.93Å; T308-S310 PolarHBondContact O-N 3.34Å; S310-L312 PolarHBondContact O-N 2.92Å; S310-Y313 WeakPolarHBondContact O-CB 3.33Å; S310-Y313 PolarHBondContact O-N 2.95Å; S310-W314 WeakPolarHBondContact O-CB 3.37Å; S310-W314 PolarHBondContact O-N 3.34Å; S310-W314 VanDerWaalsContact OG-CD1 3.3Å
311F95.1Very high92.7Very high34 Ų3457.5 Ų57.515%0.14930%0.299CS..Hα-helixtrans-58.6-46.3177.4174.5-103.1000112W196 K213 S214 I217 N307 T308 W314 S315W196-F311 HydrophobicContact CH2-CZ 4.39Å; W196-F311 HydrophobicContact CZ3-CZ 4.47Å; K213-F311 HydrophobicContact CB-CB 4.3Å; K213-F311 HydrophobicContact CB-CD2 3.69Å; K213-F311 HydrophobicContact CB-CG 4.48Å; S214-F311 WeakPolarHBondContact OG-CE2 3.32Å; I217-F311 HydrophobicContact CD1-CB 3.61Å; I217-F311 HydrophobicContact CD1-CD1 4.03Å; I217-F311 HydrophobicContact CD1-CG 3.83Å; N307-F311 WeakPolarHBondContact O-CB 3.5Å; N307-F311 PolarHBondContact O-N 3.48Å; T308-F311 PolarHBondContact O-N 3.08Å; F311-W314 PolarHBondContact O-N 3.35Å; F311-S315 WeakPolarHBondContact O-CB 3.47Å; F311-S315 PolarHBondContact O-N 3.46Å; F311-S315 PolarHBondContact O-OG 3.38Å
312L94.8Very high92.5Very high106 Ų10655.9 Ų55.956%0.55530%0.301SS*.Hα-helixtrans-64.1-42.8177.7-69.2175.6000111.4T308 S310 S315 Y316T308-L312 HydrophobicContact CG2-CD1 4.06Å; T308-L312 HydrophobicContact CG2-CG 4.39Å; T308-L312 WeakPolarHBondContact O-CB 3.43Å; T308-L312 VanDerWaalsContact O-CG 3.29Å; T308-L312 WeakPolarHBondContact O-CG 3.42Å; T308-L312 PolarHBondContact O-N 2.91Å; S310-L312 PolarHBondContact O-N 2.92Å; L312-S315 PolarHBondContact O-N 3.4Å; L312-Y316 VanDerWaalsContact O-CB 3.27Å; L312-Y316 WeakPolarHBondContact O-CB 3.37Å; L312-Y316 PolarHBondContact O-N 3.31Å
313Y93.4Very high92.3Very high103 Ų10352.8 Ų52.840%0.40429%0.286SS..Hα-helixtrans-59.6-49.7176.4172.5-97.1000112.4S309 S310 K317S309-Y313 VanDerWaalsContact O-CB 3.26Å; S309-Y313 WeakPolarHBondContact O-CB 3.22Å; S309-Y313 PolarHBondContact O-N 3.35Å; S310-Y313 WeakPolarHBondContact O-CB 3.33Å; S310-Y313 PolarHBondContact O-N 2.95Å; Y313-K317 HydrophobicContact CD1-CD 4.3Å; Y313-K317 HydrophobicContact CE1-CD 3.71Å; Y313-K317 HydrophobicContact CE2-CD 4.06Å; Y313-K317 WeakPolarHBondContact O-CB 3.25Å; Y313-K317 WeakPolarHBondContact O-CG 3.35Å; Y313-K317 PolarHBondContact O-N 3.32Å; Y313-K317 VanDerWaalsContact OH-CE 3.29Å; Y313-K317 WeakPolarHBondContact OH-CE 3.5Å; Y313-K317 PolarHBondContact OH-NZ 3.32Å
314W92.1Very high92.1Very high3 Ų354 Ų541%0.01129%0.29CS..Hα-helixtrans-68.7-38.2178.6-79107.7000112.2D24 Y209 L210 S310 F311 K317 S318 F360D24-W314 PolarHBondContact OD2-NE1 3.45Å; D24-W314 VanDerWaalsContact OD2-NE1 3.17Å; Y209-W314 HydrophobicContact CD1-CD2 4.46Å; Y209-W314 HydrophobicContact CE1-CB 4.35Å; Y209-W314 AromaticContact CE1-CD1 3.94Å; Y209-W314 AromaticContact CE1-CD2 3.59Å; Y209-W314 HydrophobicContact CE1-CD2 3.59Å; Y209-W314 AromaticContact CE1-CE2 3.7Å; Y209-W314 HydrophobicContact CE1-CE3 4.03Å; Y209-W314 AromaticContact CE1-CG 3.74Å; Y209-W314 HydrophobicContact CE1-CG 3.74Å; Y209-W314 HydrophobicContact CE1-CZ2 4.18Å; Y209-W314 AromaticContact CE1-NE1 3.94Å; Y209-W314 PolarHBondContact OH-NE1 3.35Å; L210-W314 HydrophobicContact CD2-CB 4.06Å; S310-W314 WeakPolarHBondContact O-CB 3.37Å; S310-W314 PolarHBondContact O-N 3.34Å; S310-W314 VanDerWaalsContact OG-CD1 3.3Å; F311-W314 PolarHBondContact O-N 3.35Å; W314-K317 PolarHBondContact O-N 3.44Å; W314-S318 WeakPolarHBondContact O-CB 3.37Å; W314-S318 PolarHBondContact O-N 3.46Å; W314-F360 HydrophobicContact CE3-CD2 4.35Å; W314-F360 HydrophobicContact CE3-CE2 4.09Å; W314-F360 HydrophobicContact CH2-CE2 4.09Å; W314-F360 AromaticContact CZ3-CD2 3.8Å; W314-F360 HydrophobicContact CZ3-CD2 3.8Å; W314-F360 AromaticContact CZ3-CE2 3.62Å; W314-F360 HydrophobicContact CZ3-CE2 3.62Å
315S91.4Very high91.9Very high16 Ų1653.8 Ų53.811%0.11229%0.285CS..Hα-helixtrans-63-46.3175.2-64.20000111.4F311 L312 S318 S319F311-S315 WeakPolarHBondContact O-CB 3.47Å; F311-S315 PolarHBondContact O-N 3.46Å; F311-S315 PolarHBondContact O-OG 3.38Å; L312-S315 PolarHBondContact O-N 3.4Å; S315-S318 PolarHBondContact O-N 2.95Å; S315-S319 VanDerWaalsContact O-CB 3.23Å; S315-S319 WeakPolarHBondContact O-CB 3.39Å; S315-S319 PolarHBondContact O-N 3.36Å; S315-S319 PolarHBondContact O-OG 3.44Å
316Y91.2Very high91.8Very high137 Ų13757.8 Ų57.854%0.53730%0.295SS..Hα-helixtrans-59.4-54.2174.3173.6-96.9000110.6L312 S318 S319 F320 T323L312-Y316 VanDerWaalsContact O-CB 3.27Å; L312-Y316 WeakPolarHBondContact O-CB 3.37Å; L312-Y316 PolarHBondContact O-N 3.31Å; Y316-S318 VanDerWaalsContact C-N 3.26Å; Y316-S318 PolarHBondContact O-N 3.24Å; Y316-S319 PolarHBondContact O-N 3.4Å; Y316-F320 AromaticContact CD2-CD2 3.57Å; Y316-F320 HydrophobicContact CD2-CD2 3.57Å; Y316-F320 AromaticContact CD2-CE2 3.29Å; Y316-F320 HydrophobicContact CD2-CE2 3.29Å; Y316-F320 HydrophobicContact CD2-CZ 4.43Å; Y316-F320 AromaticContact CE2-CD2 3.56Å; Y316-F320 HydrophobicContact CE2-CD2 3.56Å; Y316-F320 AromaticContact CE2-CE2 3.44Å; Y316-F320 HydrophobicContact CE2-CE2 3.44Å; Y316-F320 VanDerWaalsContact CE2-CE2 3.44Å; Y316-F320 HydrophobicContact CE2-CZ 4.38Å; Y316-F320 HydrophobicContact CG-CD2 4.18Å; Y316-F320 HydrophobicContact CG-CE2 4.23Å; Y316-F320 VanDerWaalsContact O-CD2 3.22Å; Y316-F320 WeakPolarHBondContact O-CD2 3.45Å; Y316-F320 PolarHBondContact O-N 3.49Å; Y316-T323 HydrophobicContact CE1-CG2 4.2Å
317K88.9Confident91.6Very high57 Ų5757.6 Ų57.625%0.24829%0.291CS..Hα-helixtrans-58.6-39.1179.8-82.7-166.8168.6-168.90112.1Y313 W314 T323 R363Y313-K317 HydrophobicContact CD1-CD 4.3Å; Y313-K317 HydrophobicContact CE1-CD 3.71Å; Y313-K317 HydrophobicContact CE2-CD 4.06Å; Y313-K317 WeakPolarHBondContact O-CB 3.25Å; Y313-K317 WeakPolarHBondContact O-CG 3.35Å; Y313-K317 PolarHBondContact O-N 3.32Å; Y313-K317 VanDerWaalsContact OH-CE 3.29Å; Y313-K317 WeakPolarHBondContact OH-CE 3.5Å; Y313-K317 PolarHBondContact OH-NZ 3.32Å; W314-K317 PolarHBondContact O-N 3.44Å; K317-T323 PolarHBondContact O-OG1 3.06Å; K317-R363 PolarHBondContact O-NH1 3.48Å; K317-R363 PolarHBondContact O-NH2 3.1Å
318S85.8Confident91.6Very high7 Ų757.5 Ų57.55%0.04929%0.29CS..Hα-helixtrans-75.4-42.5-176.8-177.30000113.2I206 W314 S315 Y316 Q356I206-S318 WeakPolarHBondContact CD1-OG 3.33Å; I206-S318 WeakPolarHBondContact CG1-OG 3.47Å; W314-S318 WeakPolarHBondContact O-CB 3.37Å; W314-S318 PolarHBondContact O-N 3.46Å; S315-S318 PolarHBondContact O-N 2.95Å; Y316-S318 VanDerWaalsContact C-N 3.26Å; Y316-S318 PolarHBondContact O-N 3.24Å; S318-Q356 PolarHBondContact O-NE2 3.44Å; S318-Q356 PolarHBondContact OG-NE2 3.15Å
319S83.8Confident91.4Very high81 Ų8157 Ų5757%0.56628%0.283SS*.Hα-helixtrans-71.8-37.6-169.6-58.90000113.2S315 Y316 R321S315-S319 VanDerWaalsContact O-CB 3.23Å; S315-S319 WeakPolarHBondContact O-CB 3.39Å; S315-S319 PolarHBondContact O-N 3.36Å; S315-S319 PolarHBondContact O-OG 3.44Å; Y316-S319 PolarHBondContact O-N 3.4Å; S319-R321 PolarHBondContact O-N 2.86Å
320F86.6Confident91.3Very high109 Ų10958 Ų5848%0.47828%0.277SS..  trans-83.8112.7-175.2-67.4-72.4000112Y316 G322 T323 R324Y316-F320 AromaticContact CD2-CD2 3.57Å; Y316-F320 HydrophobicContact CD2-CD2 3.57Å; Y316-F320 AromaticContact CD2-CE2 3.29Å; Y316-F320 HydrophobicContact CD2-CE2 3.29Å; Y316-F320 HydrophobicContact CD2-CZ 4.43Å; Y316-F320 AromaticContact CE2-CD2 3.56Å; Y316-F320 HydrophobicContact CE2-CD2 3.56Å; Y316-F320 AromaticContact CE2-CE2 3.44Å; Y316-F320 HydrophobicContact CE2-CE2 3.44Å; Y316-F320 VanDerWaalsContact CE2-CE2 3.44Å; Y316-F320 HydrophobicContact CE2-CZ 4.38Å; Y316-F320 HydrophobicContact CG-CD2 4.18Å; Y316-F320 HydrophobicContact CG-CE2 4.23Å; Y316-F320 VanDerWaalsContact O-CD2 3.22Å; Y316-F320 WeakPolarHBondContact O-CD2 3.45Å; Y316-F320 PolarHBondContact O-N 3.49Å; F320-G322 PolarHBondContact O-N 2.95Å; F320-T323 HydrophobicContact CB-CG2 3.8Å; F320-T323 PolarHBondContact O-N 3.3Å; F320-T323 VanDerWaalsContact O-N 3.11Å; F320-T323 PolarHBondContact O-OG1 3.24Å; F320-R324 PolarHBondContact O-N 2.68Å
321R88.3Confident91.3Very high135 Ų13557.6 Ų57.651%0.50927%0.274SS..Hα-helixtrans-53.7-36172.1-174.6177.2175.6-164-1.9112.4S319 T323 R324 I325 D351S319-R321 PolarHBondContact O-N 2.86Å; R321-T323 PolarHBondContact O-N 2.85Å; R321-R324 PolarHBondContact O-N 3.34Å; R321-I325 HydrophobicContact CG-CD1 3.81Å; R321-I325 HydrophobicContact CG-CG1 4.47Å; R321-I325 WeakPolarHBondContact O-CG1 3.39Å; R321-I325 PolarHBondContact O-N 2.94Å; R321-I325 VanDerWaalsContact O-N 3.08Å; R321-D351 IonicContact CZ-OD2 3.1Å; R321-D351 IonicContact NE-OD1 3.4Å; R321-D351 PolarHBondContact NE-OD1 3.34Å; R321-D351 IonicContact NE-OD2 2.83Å; R321-D351 PolarHBondContact NE-OD2 3.37Å; R321-D351 IonicContact NH2-OD2 2.63Å; R321-D351 PolarHBondContact NH2-OD2 2.85Å
322G89.4Confident91.2Very high41 Ų4156 Ų5642%0.42327%0.267SS..Hα-helixtrans-57.9-45.7176.500000113.2F320 R324 I325 Q326F320-G322 PolarHBondContact O-N 2.95Å; G322-R324 VanDerWaalsContact C-N 3.35Å; G322-R324 PolarHBondContact O-N 2.98Å; G322-I325 PolarHBondContact O-N 3.29Å; G322-Q326 WeakPolarHBondContact O-CB 3.13Å; G322-Q326 WeakPolarHBondContact O-CG 3.38Å; G322-Q326 PolarHBondContact O-N 3.22Å
323T90.8Very high91.1Very high21 Ų2157.3 Ų57.313%0.12927%0.268CS..Hα-helixtrans-70.1-33.1-178.771.40000111.8Y316 K317 F320 R321 F327 R363Y316-T323 HydrophobicContact CE1-CG2 4.2Å; K317-T323 PolarHBondContact O-OG1 3.06Å; F320-T323 HydrophobicContact CB-CG2 3.8Å; F320-T323 PolarHBondContact O-N 3.3Å; F320-T323 VanDerWaalsContact O-N 3.11Å; F320-T323 PolarHBondContact O-OG1 3.24Å; R321-T323 PolarHBondContact O-N 2.85Å; T323-F327 VanDerWaalsContact O-CB 3.23Å; T323-F327 WeakPolarHBondContact O-CB 2.98Å; T323-F327 PolarHBondContact O-N 3.26Å; T323-R363 PolarHBondContact O-NH2 3.16Å; T323-R363 VanDerWaalsContact O-NH2 3.1Å; T323-R363 PolarHBondContact OG1-NH2 3.36Å
324R91.6Very high91Very high25 Ų2558 Ų589%0.09428%0.278CS..Hα-helixtrans-62.5-49.8174.1-72.217444.4-143.2-18.3110.9F320 R321 G322 F327 I328 V350 D351 V359F320-R324 PolarHBondContact O-N 2.68Å; R321-R324 PolarHBondContact O-N 3.34Å; G322-R324 VanDerWaalsContact C-N 3.35Å; G322-R324 PolarHBondContact O-N 2.98Å; R324-F327 PolarHBondContact O-N 3.42Å; R324-I328 PolarHBondContact O-N 3.26Å; R324-V350 HydrophobicContact CB-CG1 4.44Å; R324-V350 PolarHBondContact NH2-O 2.96Å; R324-D351 IonicContact CZ-OD1 3.97Å; R324-D351 IonicContact NH2-OD1 2.84Å; R324-D351 PolarHBondContact NH2-OD1 2.8Å; R324-V359 HydrophobicContact CB-CG1 4.11Å; R324-V359 HydrophobicContact CG-CG1 4.03Å
325I92.1Very high91Very high23 Ų2362.9 Ų62.912%0.11830%0.297CS..Hα-helixtrans-65.5-44.4179.6-65.8165.9000110.6R321 G322 F327 I328 R329 L347 V350R321-I325 HydrophobicContact CG-CD1 3.81Å; R321-I325 HydrophobicContact CG-CG1 4.47Å; R321-I325 WeakPolarHBondContact O-CG1 3.39Å; R321-I325 PolarHBondContact O-N 2.94Å; R321-I325 VanDerWaalsContact O-N 3.08Å; G322-I325 PolarHBondContact O-N 3.29Å; I325-F327 VanDerWaalsContact C-N 3.34Å; I325-F327 PolarHBondContact O-N 3.43Å; I325-I328 PolarHBondContact O-N 2.97Å; I325-R329 HydrophobicContact CG2-CG 4.15Å; I325-R329 VanDerWaalsContact O-CB 3.28Å; I325-R329 WeakPolarHBondContact O-CB 2.81Å; I325-R329 VanDerWaalsContact O-CG 3.25Å; I325-R329 WeakPolarHBondContact O-CG 3.43Å; I325-R329 PolarHBondContact O-N 3.46Å; I325-L347 HydrophobicContact CD1-CD1 4.44Å; I325-L347 HydrophobicContact CD1-CD2 4.48Å; I325-L347 HydrophobicContact CD1-CG 4Å; I325-L347 HydrophobicContact CG2-CD1 4.4Å; I325-V350 HydrophobicContact CG1-CB 4.28Å; I325-V350 HydrophobicContact CG1-CG1 3.86Å
326Q92.8Very high90.9Very high135 Ų13565.3 Ų65.363%0.63132%0.324SS*.Hα-helixtrans-60.9-41.8177.8-76.1173.2-6.900112.1G322 R329 K330G322-Q326 WeakPolarHBondContact O-CB 3.13Å; G322-Q326 WeakPolarHBondContact O-CG 3.38Å; G322-Q326 PolarHBondContact O-N 3.22Å; Q326-R329 PolarHBondContact O-N 3.43Å; Q326-K330 WeakPolarHBondContact O-CB 3.36Å; Q326-K330 PolarHBondContact O-N 2.67Å
327F93.7Very high90.7Very high33 Ų3359.5 Ų59.515%0.14531%0.305CS..Hα-helixtrans-58.2-52.3177.1174.5-96.4000112T323 R324 I325 K330 F331 V359 L362 R363 A366 I378T323-F327 VanDerWaalsContact O-CB 3.23Å; T323-F327 WeakPolarHBondContact O-CB 2.98Å; T323-F327 PolarHBondContact O-N 3.26Å; R324-F327 PolarHBondContact O-N 3.42Å; I325-F327 VanDerWaalsContact C-N 3.34Å; I325-F327 PolarHBondContact O-N 3.43Å; F327-K330 WeakPolarHBondContact O-CB 3.34Å; F327-K330 PolarHBondContact O-N 3.11Å; F327-F331 AromaticContact CD2-CE2 3.93Å; F327-F331 HydrophobicContact CD2-CE2 3.93Å; F327-F331 HydrophobicContact CE1-CD2 4.25Å; F327-F331 HydrophobicContact CE1-CE2 4.1Å; F327-F331 HydrophobicContact CE2-CD2 4.29Å; F327-F331 AromaticContact CE2-CE2 3.44Å; F327-F331 HydrophobicContact CE2-CE2 3.44Å; F327-F331 VanDerWaalsContact CE2-CE2 3.44Å; F327-F331 HydrophobicContact CE2-CZ 4.32Å; F327-F331 HydrophobicContact CG-CE2 4.47Å; F327-F331 HydrophobicContact CZ-CD2 4.11Å; F327-F331 AromaticContact CZ-CE2 3.5Å; F327-F331 HydrophobicContact CZ-CE2 3.5Å; F327-F331 VanDerWaalsContact O-CD2 3.31Å; F327-F331 WeakPolarHBondContact O-CD2 3.39Å; F327-F331 PolarHBondContact O-N 2.89Å; F327-V359 HydrophobicContact CD1-CG1 4.3Å; F327-L362 HydrophobicContact CE1-CB 4.27Å; F327-R363 HydrophobicContact CD1-CG 3.88Å; F327-R363 HydrophobicContact CD2-CG 4.05Å; F327-R363 HydrophobicContact CE1-CG 3.5Å; F327-R363 HydrophobicContact CE2-CG 3.63Å; F327-R363 HydrophobicContact CG-CG 4.15Å; F327-R363 HydrophobicContact CZ-CB 4.16Å; F327-R363 HydrophobicContact CZ-CG 3.37Å; F327-A366 HydrophobicContact CZ-CB 4.16Å; F327-I378 HydrophobicContact CE1-CD1 4.35Å
328I94.6Very high90.6Very high0 Ų058.4 Ų58.40%030%0.301CS..Hα-helixtrans-66.8-41.1179.4-61.1-61.7000111.3R324 I325 K330 F331 L332 F349 V350 L354 V359 L362 I378R324-I328 PolarHBondContact O-N 3.26Å; I325-I328 PolarHBondContact O-N 2.97Å; I328-K330 VanDerWaalsContact C-N 3.32Å; I328-K330 PolarHBondContact O-N 3.37Å; I328-F331 PolarHBondContact O-N 2.84Å; I328-L332 HydrophobicContact CG2-CD1 3.84Å; I328-L332 HydrophobicContact CG2-CG 4.31Å; I328-L332 WeakPolarHBondContact O-CG 3.41Å; I328-L332 PolarHBondContact O-N 3.36Å; I328-F349 HydrophobicContact CG2-CD1 4.15Å; I328-F349 HydrophobicContact CG2-CE1 3.87Å; I328-V350 HydrophobicContact CB-CG2 3.86Å; I328-V350 HydrophobicContact CG1-CG2 4.03Å; I328-V350 HydrophobicContact CG2-CG2 3.9Å; I328-L354 HydrophobicContact CD1-CD1 3.97Å; I328-L354 HydrophobicContact CG1-CD1 4.21Å; I328-L354 HydrophobicContact CG2-CD1 4.49Å; I328-V359 HydrophobicContact CD1-CG2 4.39Å; I328-V359 HydrophobicContact CG1-CG2 4.13Å; I328-L362 HydrophobicContact CD1-CD1 3.79Å; I328-I378 HydrophobicContact CD1-CD1 4.05Å; I328-I378 HydrophobicContact CD1-CG1 4.34Å; I328-I378 HydrophobicContact CG2-CG2 4.25Å
329R93.2Very high90.4Very high44 Ų4462.6 Ų62.617%0.16632%0.32CS..Hα-helixtrans-63.9-34.5177-74.8178.472.674.81.3112.7I325 Q326 K333 T346I325-R329 HydrophobicContact CG2-CG 4.15Å; I325-R329 VanDerWaalsContact O-CB 3.28Å; I325-R329 WeakPolarHBondContact O-CB 2.81Å; I325-R329 VanDerWaalsContact O-CG 3.25Å; I325-R329 WeakPolarHBondContact O-CG 3.43Å; I325-R329 PolarHBondContact O-N 3.46Å; Q326-R329 PolarHBondContact O-N 3.43Å; R329-K333 VanDerWaalsContact O-CB 3.31Å; R329-K333 WeakPolarHBondContact O-CB 3.34Å; R329-K333 WeakPolarHBondContact O-CG 3.32Å; R329-K333 PolarHBondContact O-N 2.92Å; R329-T346 HydrophobicContact CG-CG2 3.62Å; R329-T346 PolarHBondContact NH1-OG1 2.95Å
330K93.3Very high89.9Confident98 Ų9865.5 Ų65.543%0.42634%0.337SS..Hα-helixtrans-56.4-54.6174.6179.4-168.6166.2-160.10109.1Q326 F327 I328 K333 L334 E371Q326-K330 WeakPolarHBondContact O-CB 3.36Å; Q326-K330 PolarHBondContact O-N 2.67Å; F327-K330 WeakPolarHBondContact O-CB 3.34Å; F327-K330 PolarHBondContact O-N 3.11Å; I328-K330 VanDerWaalsContact C-N 3.32Å; I328-K330 PolarHBondContact O-N 3.37Å; K330-K333 PolarHBondContact O-N 2.89Å; K330-L334 HydrophobicContact CD-CD1 4.45Å; K330-L334 HydrophobicContact CG-CD1 3.75Å; K330-L334 VanDerWaalsContact O-CD1 3.3Å; K330-L334 WeakPolarHBondContact O-CD1 3.1Å; K330-L334 WeakPolarHBondContact O-CG 3.4Å; K330-L334 PolarHBondContact O-N 3.17Å; K330-E371 IonicContact NZ-OE1 3.13Å; K330-E371 PolarHBondContact NZ-OE1 3.29Å; K330-E371 IonicContact NZ-OE2 3.4Å; K330-E371 PolarHBondContact NZ-OE2 3.09Å
331F94.5Very high89.5Confident2 Ų263.4 Ų63.41%0.00935%0.346CS..Hα-helixtrans-66.4-41.3-178.4-71.7-62.8000114.3F327 I328 K333 L334 R335 E371 I378F327-F331 AromaticContact CD2-CE2 3.93Å; F327-F331 HydrophobicContact CD2-CE2 3.93Å; F327-F331 HydrophobicContact CE1-CD2 4.25Å; F327-F331 HydrophobicContact CE1-CE2 4.1Å; F327-F331 HydrophobicContact CE2-CD2 4.29Å; F327-F331 AromaticContact CE2-CE2 3.44Å; F327-F331 HydrophobicContact CE2-CE2 3.44Å; F327-F331 VanDerWaalsContact CE2-CE2 3.44Å; F327-F331 HydrophobicContact CE2-CZ 4.32Å; F327-F331 HydrophobicContact CG-CE2 4.47Å; F327-F331 HydrophobicContact CZ-CD2 4.11Å; F327-F331 AromaticContact CZ-CE2 3.5Å; F327-F331 HydrophobicContact CZ-CE2 3.5Å; F327-F331 VanDerWaalsContact O-CD2 3.31Å; F327-F331 WeakPolarHBondContact O-CD2 3.39Å; F327-F331 PolarHBondContact O-N 2.89Å; I328-F331 PolarHBondContact O-N 2.84Å; F331-K333 VanDerWaalsContact C-N 3.3Å; F331-K333 PolarHBondContact O-N 3.2Å; F331-L334 HydrophobicContact CD1-CD1 4.18Å; F331-L334 PolarHBondContact O-N 3.02Å; F331-R335 PolarHBondContact O-N 3.29Å; F331-R335 VanDerWaalsContact O-N 3.13Å; F331-E371 HydrophobicContact CE1-CB 3.89Å; F331-E371 HydrophobicContact CE1-CG 4.24Å; F331-E371 WeakPolarHBondContact CE1-O 3.44Å; F331-E371 HydrophobicContact CZ-CB 4.12Å; F331-E371 HydrophobicContact CZ-CG 3.99Å; F331-I378 HydrophobicContact CB-CD1 3.74Å; F331-I378 HydrophobicContact CB-CG2 4.31Å; F331-I378 HydrophobicContact CD2-CD1 3.5Å; F331-I378 HydrophobicContact CE2-CD1 4.34Å; F331-I378 HydrophobicContact CG-CD1 3.77Å
332L93.5Very high89.3Confident1 Ų157.2 Ų57.21%0.00532%0.323CS..Hα-helixtrans-65.1-34.2176.6-69.6175.2000112.7I328 G336 A337 T346 I378 W382I328-L332 HydrophobicContact CG2-CD1 3.84Å; I328-L332 HydrophobicContact CG2-CG 4.31Å; I328-L332 WeakPolarHBondContact O-CG 3.41Å; I328-L332 PolarHBondContact O-N 3.36Å; L332-G336 PolarHBondContact O-N 3.1Å; L332-A337 HydrophobicContact CD2-CB 4.28Å; L332-A337 PolarHBondContact O-N 3.38Å; L332-T346 HydrophobicContact CD1-CG2 4.23Å; L332-I378 HydrophobicContact CD2-CG2 3.7Å; L332-I378 HydrophobicContact CG-CG2 3.87Å; L332-W382 HydrophobicContact CD1-CD2 4.09Å; L332-W382 HydrophobicContact CD1-CE3 4.05Å; L332-W382 HydrophobicContact CD1-CG 4.38Å; L332-W382 HydrophobicContact CD2-CB 3.68Å; L332-W382 HydrophobicContact CD2-CD2 4.35Å; L332-W382 HydrophobicContact CD2-CG 3.79Å
333K91.8Very high89.1Confident132 Ų13262.2 Ų62.257%0.57433%0.333SS*.Hα-helixtrans-68.9-43.9173.4-76.1176.4174.6-166.70112.1R329 K330 F331 R335 G336 L338R329-K333 VanDerWaalsContact O-CB 3.31Å; R329-K333 WeakPolarHBondContact O-CB 3.34Å; R329-K333 WeakPolarHBondContact O-CG 3.32Å; R329-K333 PolarHBondContact O-N 2.92Å; K330-K333 PolarHBondContact O-N 2.89Å; F331-K333 VanDerWaalsContact C-N 3.3Å; F331-K333 PolarHBondContact O-N 3.2Å; K333-R335 PolarHBondContact O-N 3.47Å; K333-G336 PolarHBondContact O-N 3Å; K333-L338 HydrophobicContact CG-CD2 3.96Å
334L91.3Very high89Confident117 Ų11769.5 Ų69.561%0.61336%0.363SS*.Hα-helixtrans-57.2-36.1177.3-81.9148.6000112.3K330 F331K330-L334 HydrophobicContact CD-CD1 4.45Å; K330-L334 HydrophobicContact CG-CD1 3.75Å; K330-L334 VanDerWaalsContact O-CD1 3.3Å; K330-L334 WeakPolarHBondContact O-CD1 3.1Å; K330-L334 WeakPolarHBondContact O-CG 3.4Å; K330-L334 PolarHBondContact O-N 3.17Å; F331-L334 HydrophobicContact CD1-CD1 4.18Å; F331-L334 PolarHBondContact O-N 3.02Å
335R92.3Very high88.9Confident107 Ų10772.5 Ų72.540%0.40438%0.377SS..THydrogen-bonded Turntrans-87.91.3178.4-64.4-66.7-64.7178.3-1114.3F331 K333 A337 E379F331-R335 PolarHBondContact O-N 3.29Å; F331-R335 VanDerWaalsContact O-N 3.13Å; K333-R335 PolarHBondContact O-N 3.47Å; R335-A337 PolarHBondContact O-N 2.97Å; R335-E379 IonicContact CZ-OE2 3.68Å; R335-E379 IonicContact NE-OE2 2.84Å; R335-E379 PolarHBondContact NE-OE2 3.47Å; R335-E379 IonicContact NH2-OE2 3.63Å; R335-E379 PolarHBondContact NH2-OE2 2.84Å
336G89.2Confident88.8Confident66 Ų6671.4 Ų71.468%0.6837%0.371SS*.THydrogen-bonded Turntrans66.715.4-178.800000114.9L332 K333 L338L332-G336 PolarHBondContact O-N 3.1Å; K333-G336 PolarHBondContact O-N 3Å; G336-L338 VanDerWaalsContact C-N 3.31Å; G336-L338 PolarHBondContact O-N 3.29Å
337A87.2Confident88.8Confident16 Ų1668 Ų6813%0.13236%0.357CS..  trans-84.4-1.2-173.500000114.3L332 R335 E379 W382L332-A337 HydrophobicContact CD2-CB 4.28Å; L332-A337 PolarHBondContact O-N 3.38Å; R335-A337 PolarHBondContact O-N 2.97Å; A337-E379 HydrophobicContact CB-CG 4.31Å; A337-W382 PolarHBondContact O-NE1 3.01Å; A337-W382 VanDerWaalsContact O-NE1 3.17Å
338L86.4Confident88.7Confident34 Ų3469 Ų6918%0.17837%0.366CS..  trans-110.9115.8-173-170.472.1000111.6K333 G336 D342 T346 W382K333-L338 HydrophobicContact CG-CD2 3.96Å; G336-L338 VanDerWaalsContact C-N 3.31Å; G336-L338 PolarHBondContact O-N 3.29Å; L338-D342 HydrophobicContact CD1-CB 3.57Å; L338-D342 HydrophobicContact CG-CB 4.42Å; L338-T346 VanDerWaalsContact CD1-OG1 3.28Å; L338-T346 WeakPolarHBondContact CD1-OG1 2.95Å; L338-W382 HydrophobicContact CD1-CZ2 4.43Å
339E82.1Confident88.6Confident95 Ų9569 Ų6944%0.44437%0.366SS..  trans-78.7151.2174.9-65164.1-159.100110.8G341 D342 R386E339-G341 PolarHBondContact O-N 3.17Å; E339-D342 PolarHBondContact N-OD2 3.34Å; E339-D342 PolarHBondContact O-N 3.29Å; E339-D342 VanDerWaalsContact O-N 3.12Å; E339-R386 IonicContact OE1-CZ 3.72Å; E339-R386 IonicContact OE1-NH1 3.58Å; E339-R386 IonicContact OE1-NH2 2.97Å; E339-R386 PolarHBondContact OE1-NH2 2.87Å
340P73.3Confident88.5Confident141 Ų14167 Ų6792%0.91636%0.359SS*.THydrogen-bonded Turntrans-61.5-3.1-173.118.7-29.4000116.9
341G78.4Confident88.3Confident66 Ų6664.1 Ų64.168%0.6835%0.348SS*.THydrogen-bonded Turntrans-107.8-4.9175.200000116E339 K343E339-G341 PolarHBondContact O-N 3.17Å; G341-K343 VanDerWaalsContact C-N 3.26Å; G341-K343 PolarHBondContact O-N 3.41Å
342D83.3Confident87.9Confident5 Ų567.5 Ų67.53%0.02737%0.372CS..THydrogen-bonded Turntrans-82.114.6-161.8-79.9-24.5000116L338 E339 K344 K345 T346L338-D342 HydrophobicContact CD1-CB 3.57Å; L338-D342 HydrophobicContact CG-CB 4.42Å; E339-D342 PolarHBondContact N-OD2 3.34Å; E339-D342 PolarHBondContact O-N 3.29Å; E339-D342 VanDerWaalsContact O-N 3.12Å; D342-K344 VanDerWaalsContact C-N 3.33Å; D342-K344 PolarHBondContact O-N 2.8Å; D342-K345 HydrophobicContact CB-CB 4.48Å; D342-K345 PolarHBondContact O-N 2.81Å; D342-K345 VanDerWaalsContact O-N 3.12Å; D342-K345 WeakPolarHBondContact OD1-CD 3.13Å; D342-K345 WeakPolarHBondContact OD1-CE 3.43Å; D342-K345 IonicContact OD1-NZ 2.82Å; D342-K345 PolarHBondContact OD1-NZ 3.3Å; D342-T346 PolarHBondContact O-N 3.08Å; D342-T346 PolarHBondContact O-OG1 3.12Å
343K86.4Confident87.7Confident145 Ų14569.4 Ų69.463%0.6338%0.38SS*.Hα-helixtrans-52.2-47.6-177.7-68.4-178.9-176.7174.50112.6G341 T346 L347G341-K343 VanDerWaalsContact C-N 3.26Å; G341-K343 PolarHBondContact O-N 3.41Å; K343-T346 PolarHBondContact O-N 3.06Å; K343-L347 WeakPolarHBondContact O-CD1 3.39Å; K343-L347 PolarHBondContact O-N 3.39Å; K343-L347 VanDerWaalsContact O-N 3.08Å
344K88.3Confident87.7Confident174 Ų17463.1 Ų63.176%0.75735%0.352SS*.Hα-helixtrans-68.4-39.2-179.6-170.4177.8179.9-178.60112.3D342 L347 T348D342-K344 VanDerWaalsContact C-N 3.33Å; D342-K344 PolarHBondContact O-N 2.8Å; K344-L347 PolarHBondContact O-N 3.13Å; K344-T348 PolarHBondContact O-N 2.86Å; K344-T348 PolarHBondContact O-OG1 3.1Å
345K89.8Confident87.5Confident88 Ų8860.3 Ų60.338%0.38333%0.333SS..Hα-helixtrans-65.4-42.7176.5-63-169.9-161.8143.20111.1D342 T348 F349 W382D342-K345 HydrophobicContact CB-CB 4.48Å; D342-K345 PolarHBondContact O-N 2.81Å; D342-K345 VanDerWaalsContact O-N 3.12Å; D342-K345 WeakPolarHBondContact OD1-CD 3.13Å; D342-K345 WeakPolarHBondContact OD1-CE 3.43Å; D342-K345 IonicContact OD1-NZ 2.82Å; D342-K345 PolarHBondContact OD1-NZ 3.3Å; K345-T348 PolarHBondContact O-N 3.26Å; K345-F349 WeakPolarHBondContact O-CB 3.42Å; K345-F349 PolarHBondContact O-N 3.45Å; K345-W382 HydrophobicContact CB-CH2 3.99Å
346T90.6Very high87.3Confident0 Ų056.8 Ų56.80%032%0.321CS..Hα-helixtrans-64.7-40.2176.6-43.10000112.3R329 L332 L338 D342 K343 T348 F349 V350R329-T346 HydrophobicContact CG-CG2 3.62Å; R329-T346 PolarHBondContact NH1-OG1 2.95Å; L332-T346 HydrophobicContact CD1-CG2 4.23Å; L338-T346 VanDerWaalsContact CD1-OG1 3.28Å; L338-T346 WeakPolarHBondContact CD1-OG1 2.95Å; D342-T346 PolarHBondContact O-N 3.08Å; D342-T346 PolarHBondContact O-OG1 3.12Å; K343-T346 PolarHBondContact O-N 3.06Å; T346-T348 VanDerWaalsContact C-N 3.31Å; T346-T348 PolarHBondContact O-N 3.25Å; T346-F349 PolarHBondContact O-N 3.26Å; T346-V350 HydrophobicContact CG2-CG2 4.32Å; T346-V350 VanDerWaalsContact O-CG2 3.32Å; T346-V350 WeakPolarHBondContact O-CG2 3.19Å; T346-V350 PolarHBondContact O-N 2.96Å
347L91.9Very high87.3Confident64 Ų6453.7 Ų53.734%0.33529%0.289SS..Hα-helixtrans-59.4-45.4174-99.483.4000111.2I325 K343 K344 F349 V350 D351I325-L347 HydrophobicContact CD1-CD1 4.44Å; I325-L347 HydrophobicContact CD1-CD2 4.48Å; I325-L347 HydrophobicContact CD1-CG 4Å; I325-L347 HydrophobicContact CG2-CD1 4.4Å; K343-L347 WeakPolarHBondContact O-CD1 3.39Å; K343-L347 PolarHBondContact O-N 3.39Å; K343-L347 VanDerWaalsContact O-N 3.08Å; K344-L347 PolarHBondContact O-N 3.13Å; L347-F349 VanDerWaalsContact C-N 3.34Å; L347-F349 PolarHBondContact O-N 3.28Å; L347-V350 PolarHBondContact O-N 3.36Å; L347-D351 WeakPolarHBondContact O-CB 3.35Å; L347-D351 PolarHBondContact O-N 2.9Å
348T90.9Very high87.5Confident55 Ų5552.9 Ų52.934%0.33728%0.283SS..Hα-helixtrans-64-40.5179.4-51.30000111.4K344 K345 T346 S352 Y353 Y385K344-T348 PolarHBondContact O-N 2.86Å; K344-T348 PolarHBondContact O-OG1 3.1Å; K345-T348 PolarHBondContact O-N 3.26Å; T346-T348 VanDerWaalsContact C-N 3.31Å; T346-T348 PolarHBondContact O-N 3.25Å; T348-S352 WeakPolarHBondContact O-CA 3.47Å; T348-S352 VanDerWaalsContact O-CB 3.23Å; T348-S352 WeakPolarHBondContact O-CB 3.46Å; T348-S352 PolarHBondContact O-N 3.34Å; T348-Y353 PolarHBondContact O-N 3Å; T348-Y385 WeakPolarHBondContact CB-OH 3.43Å; T348-Y385 WeakPolarHBondContact CG2-OH 3.25Å
349F92.6Very high87.9Confident0 Ų051.3 Ų51.30%028%0.275CS..Iπ-helixtrans-60.9-47.7173.5174.5-111.6000112.5I328 K345 T346 L347 Y353 L354 L381 W382 Y385I328-F349 HydrophobicContact CG2-CD1 4.15Å; I328-F349 HydrophobicContact CG2-CE1 3.87Å; K345-F349 WeakPolarHBondContact O-CB 3.42Å; K345-F349 PolarHBondContact O-N 3.45Å; T346-F349 PolarHBondContact O-N 3.26Å; L347-F349 VanDerWaalsContact C-N 3.34Å; L347-F349 PolarHBondContact O-N 3.28Å; F349-Y353 AromaticContact CD2-CD1 3.48Å; F349-Y353 HydrophobicContact CD2-CD1 3.48Å; F349-Y353 VanDerWaalsContact CD2-CD1 3.48Å; F349-Y353 HydrophobicContact CD2-CE1 4.16Å; F349-Y353 AromaticContact CD2-CG 4Å; F349-Y353 HydrophobicContact CD2-CG 4Å; F349-Y353 AromaticContact CE2-CD1 3.29Å; F349-Y353 HydrophobicContact CE2-CD1 3.29Å; F349-Y353 AromaticContact CE2-CE1 3.56Å; F349-Y353 HydrophobicContact CE2-CE1 3.56Å; F349-Y353 HydrophobicContact CE2-CG 4.23Å; F349-Y353 HydrophobicContact CZ-CD1 4.31Å; F349-Y353 WeakPolarHBondContact O-CB 3.39Å; F349-Y353 PolarHBondContact O-N 3.15Å; F349-L354 HydrophobicContact CD1-CD1 3.94Å; F349-L354 HydrophobicContact CD1-CG 4.42Å; F349-L354 HydrophobicContact CE1-CD1 3.37Å; F349-L354 HydrophobicContact CE1-CG 3.99Å; F349-L354 HydrophobicContact CE2-CD1 4.42Å; F349-L354 HydrophobicContact CE2-CG 4.17Å; F349-L354 HydrophobicContact CZ-CD1 3.66Å; F349-L354 HydrophobicContact CZ-CD2 4.19Å; F349-L354 HydrophobicContact CZ-CG 3.86Å; F349-L354 PolarHBondContact O-N 3.41Å; F349-L381 HydrophobicContact CE2-CB 4.5Å; F349-L381 HydrophobicContact CZ-CB 4.12Å; F349-W382 HydrophobicContact CB-CE3 3.98Å; F349-W382 HydrophobicContact CB-CZ3 3.56Å; F349-W382 AromaticContact CD1-CE3 3.62Å; F349-W382 HydrophobicContact CD1-CE3 3.62Å; F349-W382 AromaticContact CD1-CZ3 3.94Å; F349-W382 HydrophobicContact CD1-CZ3 3.94Å; F349-W382 AromaticContact CD2-CE3 3.9Å; F349-W382 HydrophobicContact CD2-CE3 3.9Å; F349-W382 HydrophobicContact CD2-CZ3 4.33Å; F349-W382 AromaticContact CE1-CE3 3.97Å; F349-W382 HydrophobicContact CE1-CE3 3.97Å; F349-W382 HydrophobicContact CE2-CE3 4.22Å; F349-W382 AromaticContact CG-CE3 3.58Å; F349-W382 HydrophobicContact CG-CE3 3.58Å; F349-W382 AromaticContact CG-CZ3 3.71Å; F349-W382 HydrophobicContact CG-CZ3 3.71Å; F349-W382 HydrophobicContact CZ-CB 4.21Å; F349-W382 HydrophobicContact CZ-CE3 4.25Å; F349-Y385 HydrophobicContact CB-CD1 4.1Å; F349-Y385 HydrophobicContact CB-CE1 3.85Å; F349-Y385 HydrophobicContact CB-CE2 4.47Å; F349-Y385 HydrophobicContact CB-CG 4.5Å; F349-Y385 AromaticContact CD2-CD1 3.73Å; F349-Y385 HydrophobicContact CD2-CD1 3.73Å; F349-Y385 AromaticContact CD2-CD2 3.93Å; F349-Y385 HydrophobicContact CD2-CD2 3.93Å; F349-Y385 HydrophobicContact CD2-CE1 4.32Å; F349-Y385 HydrophobicContact CD2-CE2 4.48Å; F349-Y385 AromaticContact CD2-CG 3.49Å; F349-Y385 HydrophobicContact CD2-CG 3.49Å; F349-Y385 VanDerWaalsContact CD2-CG 3.49Å; F349-Y385 HydrophobicContact CE2-CG 4.14Å; F349-Y385 HydrophobicContact CG-CD1 4.27Å; F349-Y385 HydrophobicContact CG-CG 4.42Å
350V92.2Very high88.3Confident0 Ų047.1 Ų47.10%026%0.255CS..Iπ-helixtrans-69.1-39.9-178.4174.20000112.1R324 I325 I328 T346 L347 R355 V359R324-V350 HydrophobicContact CB-CG1 4.44Å; R324-V350 PolarHBondContact NH2-O 2.96Å; I325-V350 HydrophobicContact CG1-CB 4.28Å; I325-V350 HydrophobicContact CG1-CG1 3.86Å; I328-V350 HydrophobicContact CB-CG2 3.86Å; I328-V350 HydrophobicContact CG1-CG2 4.03Å; I328-V350 HydrophobicContact CG2-CG2 3.9Å; T346-V350 HydrophobicContact CG2-CG2 4.32Å; T346-V350 VanDerWaalsContact O-CG2 3.32Å; T346-V350 WeakPolarHBondContact O-CG2 3.19Å; T346-V350 PolarHBondContact O-N 2.96Å; L347-V350 PolarHBondContact O-N 3.36Å; V350-R355 PolarHBondContact O-N 3.1Å; V350-R355 VanDerWaalsContact O-N 3.1Å; V350-V359 HydrophobicContact CG1-CG2 4.12Å
351D87.9Confident89.2Confident38 Ų3840.4 Ų40.420%0.20321%0.211CC..Iπ-helixtrans-91.5-34.5-173-68.8-44.6000114.1R321 R324 L347R321-D351 IonicContact CZ-OD2 3.1Å; R321-D351 IonicContact NE-OD1 3.4Å; R321-D351 PolarHBondContact NE-OD1 3.34Å; R321-D351 IonicContact NE-OD2 2.83Å; R321-D351 PolarHBondContact NE-OD2 3.37Å; R321-D351 IonicContact NH2-OD2 2.63Å; R321-D351 PolarHBondContact NH2-OD2 2.85Å; R324-D351 IonicContact CZ-OD1 3.97Å; R324-D351 IonicContact NH2-OD1 2.84Å; R324-D351 PolarHBondContact NH2-OD1 2.8Å; L347-D351 WeakPolarHBondContact O-CB 3.35Å; L347-D351 PolarHBondContact O-N 2.9Å
352S85.8Confident90Very high74 Ų7437.2 Ų37.252%0.51718%0.179SC..Iπ-helixtrans-101-40.4-176-55.90000113.3T348T348-S352 WeakPolarHBondContact O-CA 3.47Å; T348-S352 VanDerWaalsContact O-CB 3.23Å; T348-S352 WeakPolarHBondContact O-CB 3.46Å; T348-S352 PolarHBondContact O-N 3.34Å
353Y90.6Very high90.5Very high41 Ų4137.8 Ų37.816%0.16118%0.181CC..Iπ-helixtrans-86.6-60-176.3-177.3-94.7000111.8E168 T348 F349 L381 Y385E168-Y353 HydrophobicContact CG-CE2 4.45Å; E168-Y353 PolarHBondContact OE1-OH 2.94Å; E168-Y353 PolarHBondContact OE2-OH 3.44Å; T348-Y353 PolarHBondContact O-N 3Å; F349-Y353 AromaticContact CD2-CD1 3.48Å; F349-Y353 HydrophobicContact CD2-CD1 3.48Å; F349-Y353 VanDerWaalsContact CD2-CD1 3.48Å; F349-Y353 HydrophobicContact CD2-CE1 4.16Å; F349-Y353 AromaticContact CD2-CG 4Å; F349-Y353 HydrophobicContact CD2-CG 4Å; F349-Y353 AromaticContact CE2-CD1 3.29Å; F349-Y353 HydrophobicContact CE2-CD1 3.29Å; F349-Y353 AromaticContact CE2-CE1 3.56Å; F349-Y353 HydrophobicContact CE2-CE1 3.56Å; F349-Y353 HydrophobicContact CE2-CG 4.23Å; F349-Y353 HydrophobicContact CZ-CD1 4.31Å; F349-Y353 WeakPolarHBondContact O-CB 3.39Å; F349-Y353 PolarHBondContact O-N 3.15Å; Y353-L381 HydrophobicContact CE1-CD2 4.48Å; Y353-Y385 HydrophobicContact CD1-CD2 4.34Å; Y353-Y385 AromaticContact CD2-CD2 3.63Å; Y353-Y385 HydrophobicContact CD2-CD2 3.63Å; Y353-Y385 HydrophobicContact CD2-CE2 4.43Å; Y353-Y385 HydrophobicContact CD2-CG 4.48Å; Y353-Y385 HydrophobicContact CE2-CD2 4.21Å; Y353-Y385 AromaticContact CG-CD2 3.68Å; Y353-Y385 HydrophobicContact CG-CD2 3.68Å; Y353-Y385 HydrophobicContact CG-CE2 4.36Å; Y353-Y385 HydrophobicContact CG-CG 4.4Å
354L91.1Very high90.7Very high0 Ų030.9 Ų30.90%015%0.151CC..Iπ-helixtrans-76-35178.8-69.3177.5000113.4L171 I328 F349 G358 V359 L362 L381L171-L354 HydrophobicContact CD1-CD2 4.3Å; I328-L354 HydrophobicContact CD1-CD1 3.97Å; I328-L354 HydrophobicContact CG1-CD1 4.21Å; I328-L354 HydrophobicContact CG2-CD1 4.49Å; F349-L354 HydrophobicContact CD1-CD1 3.94Å; F349-L354 HydrophobicContact CD1-CG 4.42Å; F349-L354 HydrophobicContact CE1-CD1 3.37Å; F349-L354 HydrophobicContact CE1-CG 3.99Å; F349-L354 HydrophobicContact CE2-CD1 4.42Å; F349-L354 HydrophobicContact CE2-CG 4.17Å; F349-L354 HydrophobicContact CZ-CD1 3.66Å; F349-L354 HydrophobicContact CZ-CD2 4.19Å; F349-L354 HydrophobicContact CZ-CG 3.86Å; F349-L354 PolarHBondContact O-N 3.41Å; L354-G358 WeakPolarHBondContact O-CA 2.96Å; L354-G358 PolarHBondContact O-N 3.15Å; L354-V359 HydrophobicContact CB-CG2 4.19Å; L354-V359 HydrophobicContact CD1-CG2 4.34Å; L354-L362 HydrophobicContact CD1-CD1 3.89Å; L354-L362 HydrophobicContact CD2-CD1 3.99Å; L354-L381 HydrophobicContact CD2-CD1 4.09Å
355R88.1Confident90.9Very high57 Ų5722.6 Ų22.622%0.21511%0.114CC..Hα-helixtrans56-161.9-172.7-54.2-177.1177.3-158.2-2.3112V350 V359V350-R355 PolarHBondContact O-N 3.1Å; V350-R355 VanDerWaalsContact O-N 3.1Å; R355-V359 VanDerWaalsContact O-CG2 3.3Å; R355-V359 WeakPolarHBondContact O-CG2 3.35Å
356Q87.8Confident91Very high33 Ų3319 Ų1915%0.15410%0.101CC..Hα-helixtrans-78.1-42.9-179.6-160.2170-10.300111.6N203 I206 S318 G358 V359 F360N203-Q356 HydrophobicContact CB-CB 4.47Å; N203-Q356 PolarHBondContact ND2-OE1 2.89Å; N203-Q356 WeakPolarHBondContact OD1-CB 3.41Å; N203-Q356 PolarHBondContact OD1-OE1 3.13Å; N203-Q356 VanDerWaalsContact OD1-OE1 3.08Å; I206-Q356 HydrophobicContact CG2-CB 4.35Å; I206-Q356 HydrophobicContact CG2-CG 3.87Å; S318-Q356 PolarHBondContact O-NE2 3.44Å; S318-Q356 PolarHBondContact OG-NE2 3.15Å; Q356-G358 PolarHBondContact O-N 2.95Å; Q356-V359 PolarHBondContact O-N 3.4Å; Q356-F360 WeakPolarHBondContact O-CB 3.27Å; Q356-F360 PolarHBondContact O-N 3.4Å
357D89.1Confident90.9Very high1 Ų122.7 Ų22.71%0.00512%0.119CC..Hα-helixtrans-63.2-41-179.5-73.8-17.3000112L171 Q174 G202 N203 Y204 L205 I206 V359 F360 I361L171-D357 HydrophobicContact CD2-CB 4.41Å; Q174-D357 PolarHBondContact OE1-OD2 3.44Å; G202-D357 VanDerWaalsContact C-CG 3.44Å; G202-D357 VanDerWaalsContact O-CB 3.32Å; G202-D357 WeakPolarHBondContact O-CB 3.38Å; G202-D357 PolarHBondContact O-N 3.47Å; N203-D357 VanDerWaalsContact C-OD1 3.24Å; N203-D357 VanDerWaalsContact CA-OD1 3.3Å; N203-D357 WeakPolarHBondContact CA-OD1 3.41Å; N203-D357 PolarHBondContact N-OD2 3.27Å; Y204-D357 PolarHBondContact N-OD1 2.89Å; Y204-D357 PolarHBondContact N-OD2 3.37Å; L205-D357 HydrophobicContact CB-CB 4.19Å; L205-D357 WeakPolarHBondContact CB-OD1 3.36Å; L205-D357 PolarHBondContact N-OD1 2.82Å; L205-D357 VanDerWaalsContact N-OD1 3.1Å; L205-D357 PolarHBondContact N-OD2 3.43Å; L205-D357 VanDerWaalsContact N-OD2 3.12Å; I206-D357 WeakPolarHBondContact CG2-OD1 3.46Å; I206-D357 PolarHBondContact N-OD1 2.79Å; D357-V359 PolarHBondContact O-N 3.26Å; D357-F360 WeakPolarHBondContact O-CB 3.48Å; D357-F360 PolarHBondContact O-N 3.31Å; D357-F360 VanDerWaalsContact O-N 3.17Å; D357-I361 WeakPolarHBondContact O-CG1 3.48Å; D357-I361 PolarHBondContact O-N 3.34Å
358G91.6Very high90.7Very high0 Ų021.3 Ų21.30%011%0.111CC..Hα-helixtrans-64.9-41.1176.400000112.8L354 Q356 F360 I361 L362L354-G358 WeakPolarHBondContact O-CA 2.96Å; L354-G358 PolarHBondContact O-N 3.15Å; Q356-G358 PolarHBondContact O-N 2.95Å; G358-F360 VanDerWaalsContact C-N 3.29Å; G358-F360 PolarHBondContact O-N 3.24Å; G358-I361 PolarHBondContact O-N 2.99Å; G358-L362 WeakPolarHBondContact O-CD1 3.46Å; G358-L362 VanDerWaalsContact O-CG 3.22Å; G358-L362 WeakPolarHBondContact O-CG 3.48Å; G358-L362 PolarHBondContact O-N 3.42Å
359V93.2Very high90.6Very high1 Ų118.8 Ų18.81%0.00610%0.096CC..Hα-helixtrans-65.7-34.7173.9177.70000111.3R324 F327 I328 V350 L354 R355 Q356 D357 R363R324-V359 HydrophobicContact CB-CG1 4.11Å; R324-V359 HydrophobicContact CG-CG1 4.03Å; F327-V359 HydrophobicContact CD1-CG1 4.3Å; I328-V359 HydrophobicContact CD1-CG2 4.39Å; I328-V359 HydrophobicContact CG1-CG2 4.13Å; V350-V359 HydrophobicContact CG1-CG2 4.12Å; L354-V359 HydrophobicContact CB-CG2 4.19Å; L354-V359 HydrophobicContact CD1-CG2 4.34Å; R355-V359 VanDerWaalsContact O-CG2 3.3Å; R355-V359 WeakPolarHBondContact O-CG2 3.35Å; Q356-V359 PolarHBondContact O-N 3.4Å; D357-V359 PolarHBondContact O-N 3.26Å; V359-R363 WeakPolarHBondContact O-CB 3.24Å; V359-R363 VanDerWaalsContact O-CG 3.31Å; V359-R363 WeakPolarHBondContact O-CG 3.45Å; V359-R363 PolarHBondContact O-N 3.47Å
360F92.2Very high90.6Very high6 Ų620.1 Ų20.13%0.02611%0.11CC..Hα-helixtrans-65.7-47.6174.8171.4-109.8000112W126 L205 I206 Y209 W314 Q356 D357 G358 L362 R363 L364W126-F360 HydrophobicContact CH2-CE1 4.36Å; L205-F360 HydrophobicContact CB-CD1 4.49Å; L205-F360 HydrophobicContact CD2-CD1 3.66Å; L205-F360 HydrophobicContact CD2-CE1 3.84Å; L205-F360 HydrophobicContact CG-CD1 3.95Å; L205-F360 HydrophobicContact CG-CE1 3.88Å; I206-F360 HydrophobicContact CB-CB 4.28Å; I206-F360 HydrophobicContact CB-CG 4.27Å; I206-F360 HydrophobicContact CD1-CB 4.21Å; I206-F360 HydrophobicContact CD1-CD2 3.43Å; I206-F360 VanDerWaalsContact CD1-CD2 3.43Å; I206-F360 HydrophobicContact CD1-CE2 3.9Å; I206-F360 HydrophobicContact CD1-CG 3.82Å; Y209-F360 AromaticContact CD1-CE2 3.61Å; Y209-F360 HydrophobicContact CD1-CE2 3.61Å; Y209-F360 AromaticContact CD1-CZ 3.73Å; Y209-F360 HydrophobicContact CD1-CZ 3.73Å; Y209-F360 HydrophobicContact CD2-CE2 4.41Å; Y209-F360 AromaticContact CD2-CZ 3.73Å; Y209-F360 HydrophobicContact CD2-CZ 3.73Å; Y209-F360 AromaticContact CE1-CE2 3.98Å; Y209-F360 HydrophobicContact CE1-CE2 3.98Å; Y209-F360 HydrophobicContact CE1-CZ 4.24Å; Y209-F360 HydrophobicContact CE2-CZ 4.25Å; Y209-F360 HydrophobicContact CG-CE1 4.39Å; Y209-F360 AromaticContact CG-CE2 3.84Å; Y209-F360 HydrophobicContact CG-CE2 3.84Å; Y209-F360 AromaticContact CG-CZ 3.43Å; Y209-F360 HydrophobicContact CG-CZ 3.43Å; Y209-F360 VanDerWaalsContact CG-CZ 3.43Å; W314-F360 HydrophobicContact CE3-CD2 4.35Å; W314-F360 HydrophobicContact CE3-CE2 4.09Å; W314-F360 HydrophobicContact CH2-CE2 4.09Å; W314-F360 AromaticContact CZ3-CD2 3.8Å; W314-F360 HydrophobicContact CZ3-CD2 3.8Å; W314-F360 AromaticContact CZ3-CE2 3.62Å; W314-F360 HydrophobicContact CZ3-CE2 3.62Å; Q356-F360 WeakPolarHBondContact O-CB 3.27Å; Q356-F360 PolarHBondContact O-N 3.4Å; D357-F360 WeakPolarHBondContact O-CB 3.48Å; D357-F360 PolarHBondContact O-N 3.31Å; D357-F360 VanDerWaalsContact O-N 3.17Å; G358-F360 VanDerWaalsContact C-N 3.29Å; G358-F360 PolarHBondContact O-N 3.24Å; F360-L362 VanDerWaalsContact C-N 3.3Å; F360-L362 PolarHBondContact O-N 2.97Å; F360-R363 WeakPolarHBondContact O-CB 3.3Å; F360-R363 PolarHBondContact O-N 3.25Å; F360-R363 VanDerWaalsContact O-N 3.13Å; F360-L364 PolarHBondContact O-N 2.88Å
361I92.2Very high90.6Very high0 Ų025.2 Ų25.20%013%0.134CC..Hα-helixtrans-56.1-47.3175.6-65.6166.1000110.1I135 L137 I140 M141 I167 L205 D357 G358 R363 L364 T365I135-I361 HydrophobicContact CD1-CD1 4.1Å; I135-I361 HydrophobicContact CG2-CD1 4.17Å; L137-I361 HydrophobicContact CD1-CG1 4.01Å; L137-I361 HydrophobicContact CD1-CG2 4.23Å; I140-I361 HydrophobicContact CG2-CG2 4.41Å; M141-I361 HydrophobicContact CE-CG2 4.07Å; I167-I361 HydrophobicContact CD1-CG2 4.07Å; I167-I361 HydrophobicContact CG1-CG2 4.25Å; L205-I361 HydrophobicContact CD2-CD1 4Å; L205-I361 HydrophobicContact CD2-CG1 3.6Å; D357-I361 WeakPolarHBondContact O-CG1 3.48Å; D357-I361 PolarHBondContact O-N 3.34Å; G358-I361 PolarHBondContact O-N 2.99Å; I361-R363 VanDerWaalsContact C-N 3.32Å; I361-R363 PolarHBondContact O-N 3.12Å; I361-L364 WeakPolarHBondContact O-CB 3.47Å; I361-L364 PolarHBondContact O-N 2.93Å; I361-L364 VanDerWaalsContact O-N 3.14Å; I361-T365 PolarHBondContact O-N 3.1Å; I361-T365 PolarHBondContact O-OG1 3.28Å; I361-T365 VanDerWaalsContact O-OG1 3.05Å
362L94Very high90.9Very high0 Ų028.3 Ų28.30%015%0.15CC..Hα-helixtrans-64.2-34.3179.5-68.5168.6000113.2I167 F327 I328 L354 G358 F360 A366 I377 I378 L381I167-L362 HydrophobicContact CD1-CD2 4.44Å; F327-L362 HydrophobicContact CE1-CB 4.27Å; I328-L362 HydrophobicContact CD1-CD1 3.79Å; L354-L362 HydrophobicContact CD1-CD1 3.89Å; L354-L362 HydrophobicContact CD2-CD1 3.99Å; G358-L362 WeakPolarHBondContact O-CD1 3.46Å; G358-L362 VanDerWaalsContact O-CG 3.22Å; G358-L362 WeakPolarHBondContact O-CG 3.48Å; G358-L362 PolarHBondContact O-N 3.42Å; F360-L362 VanDerWaalsContact C-N 3.3Å; F360-L362 PolarHBondContact O-N 2.97Å; L362-A366 WeakPolarHBondContact O-CB 3.37Å; L362-A366 PolarHBondContact O-N 2.94Å; L362-I377 HydrophobicContact CD2-CG2 3.82Å; L362-I378 HydrophobicContact CD1-CG1 3.91Å; L362-I378 HydrophobicContact CD2-CG1 3.87Å; L362-I378 HydrophobicContact CG-CG1 4.33Å; L362-L381 HydrophobicContact CD1-CD1 4.22Å; L362-L381 HydrophobicContact CD2-CD1 3.92Å
363R93.3Very high91.3Very high16 Ų1625 Ų256%0.0613%0.126CC..Hα-helixtrans-68.3-40.1173-78.5173.6173-177.7-3.1111.9K317 T323 F327 V359 F360 I361 A366 Q367K317-R363 PolarHBondContact O-NH1 3.48Å; K317-R363 PolarHBondContact O-NH2 3.1Å; T323-R363 PolarHBondContact O-NH2 3.16Å; T323-R363 VanDerWaalsContact O-NH2 3.1Å; T323-R363 PolarHBondContact OG1-NH2 3.36Å; F327-R363 HydrophobicContact CD1-CG 3.88Å; F327-R363 HydrophobicContact CD2-CG 4.05Å; F327-R363 HydrophobicContact CE1-CG 3.5Å; F327-R363 HydrophobicContact CE2-CG 3.63Å; F327-R363 HydrophobicContact CG-CG 4.15Å; F327-R363 HydrophobicContact CZ-CB 4.16Å; F327-R363 HydrophobicContact CZ-CG 3.37Å; V359-R363 WeakPolarHBondContact O-CB 3.24Å; V359-R363 VanDerWaalsContact O-CG 3.31Å; V359-R363 WeakPolarHBondContact O-CG 3.45Å; V359-R363 PolarHBondContact O-N 3.47Å; F360-R363 WeakPolarHBondContact O-CB 3.3Å; F360-R363 PolarHBondContact O-N 3.25Å; F360-R363 VanDerWaalsContact O-N 3.13Å; I361-R363 VanDerWaalsContact C-N 3.32Å; I361-R363 PolarHBondContact O-N 3.12Å; R363-A366 PolarHBondContact O-N 2.93Å; R363-Q367 PolarHBondContact O-N 2.84Å; R363-Q367 VanDerWaalsContact O-N 3.14Å
364L91Very high91.5Very high0 Ų023 Ų230%012%0.119CC..Hα-helixtrans-66.5-40.5176.3-169.367000111.1D22 L137 M141 F360 I361 Q367 N368D22-L364 HydrophobicContact CB-CD2 4.48Å; L137-L364 HydrophobicContact CD1-CD2 4.12Å; L137-L364 HydrophobicContact CD2-CD2 3.65Å; L137-L364 HydrophobicContact CG-CD2 4.1Å; M141-L364 HydrophobicContact CG-CD2 4.24Å; M141-L364 HydrophobicContact SD-CB 4.27Å; M141-L364 HydrophobicContact SD-CD2 3.95Å; M141-L364 HydrophobicContact SD-CG 3.86Å; F360-L364 PolarHBondContact O-N 2.88Å; I361-L364 WeakPolarHBondContact O-CB 3.47Å; I361-L364 PolarHBondContact O-N 2.93Å; I361-L364 VanDerWaalsContact O-N 3.14Å; L364-Q367 PolarHBondContact O-N 3.48Å; L364-N368 WeakPolarHBondContact CD1-ND2 3.37Å; L364-N368 PolarHBondContact O-N 2.88Å; L364-N368 PolarHBondContact O-ND2 3.17Å
365T92Very high91.7Very high0 Ų023.4 Ų23.40%012%0.121CC..Hα-helixtrans-59.7-45.5171.9-56.20000111.3M141 A144 I361 Q367 N368 A369 A374 I377M141-T365 WeakPolarHBondContact CE-OG1 3.3Å; A144-T365 HydrophobicContact CB-CG2 3.86Å; I361-T365 PolarHBondContact O-N 3.1Å; I361-T365 PolarHBondContact O-OG1 3.28Å; I361-T365 VanDerWaalsContact O-OG1 3.05Å; T365-Q367 PolarHBondContact O-N 3.05Å; T365-N368 PolarHBondContact O-N 2.89Å; T365-A369 HydrophobicContact CG2-CB 4.17Å; T365-A369 WeakPolarHBondContact O-CB 3.48Å; T365-A369 PolarHBondContact O-N 2.78Å; T365-A374 HydrophobicContact CG2-CB 4.35Å; T365-I377 HydrophobicContact CG2-CD1 3.82Å
366A93Very high92Very high13 Ų1322 Ų2211%0.10712%0.118CC..Hα-helixtrans-61.6-31.9178.900000113.1F327 L362 R363 G370 A374F327-A366 HydrophobicContact CZ-CB 4.16Å; L362-A366 WeakPolarHBondContact O-CB 3.37Å; L362-A366 PolarHBondContact O-N 2.94Å; R363-A366 PolarHBondContact O-N 2.93Å; A366-G370 CarbonylContact O-C 3.57Å; A366-G370 VanDerWaalsContact O-C 3.28Å; A366-G370 VanDerWaalsContact O-CA 3.3Å; A366-G370 WeakPolarHBondContact O-CA 3.43Å; A366-G370 PolarHBondContact O-N 3.5Å; A366-A374 HydrophobicContact CB-CB 3.64Å
367Q88.7Confident92.4Very high78 Ų7820.5 Ų20.536%0.36411%0.11SC..Hα-helixtrans-79.8-33.6177.3-74.5175.8-27.900113.5R363 L364 T365R363-Q367 PolarHBondContact O-N 2.84Å; R363-Q367 VanDerWaalsContact O-N 3.14Å; L364-Q367 PolarHBondContact O-N 3.48Å; T365-Q367 PolarHBondContact O-N 3.05Å
368N87.1Confident92.7Very high34 Ų3420.5 Ų20.518%0.18211%0.11CC..Hα-helixtrans-98.5-30.7-173.9-71.7-74.4000114.7R21 C145 L364 T365R21-N368 HydrophobicContact CB-CB 4.41Å; R21-N368 PolarHBondContact O-ND2 3.48Å; R21-N368 VanDerWaalsContact O-ND2 3.16Å; R21-N368 PolarHBondContact O-OD1 3.35Å; C145-N368 PolarHBondContact SG-O 3.35Å; L364-N368 WeakPolarHBondContact CD1-ND2 3.37Å; L364-N368 PolarHBondContact O-N 2.88Å; L364-N368 PolarHBondContact O-ND2 3.17Å; T365-N368 PolarHBondContact O-N 2.89Å
369A89.8Confident92.9Very high2 Ų222.7 Ų22.72%0.01712%0.121CC..SBendtrans-113.31.7179.700000113.1A144 T365 V373A144-A369 HydrophobicContact CB-CB 4.13Å; A144-A369 WeakPolarHBondContact O-CB 3.47Å; T365-A369 HydrophobicContact CG2-CB 4.17Å; T365-A369 WeakPolarHBondContact O-CB 3.48Å; T365-A369 PolarHBondContact O-N 2.78Å; A369-V373 HydrophobicContact CB-CB 4.25Å; A369-V373 HydrophobicContact CB-CG1 4.2Å; A369-V373 WeakPolarHBondContact O-CG2 3.28Å
370G91.4Very high93Very high29 Ų2926.6 Ų26.630%0.29914%0.135SC..Hα-helixtrans87.5161.3179.800000115.2A366 L372 A374A366-G370 CarbonylContact O-C 3.57Å; A366-G370 VanDerWaalsContact O-C 3.28Å; A366-G370 VanDerWaalsContact O-CA 3.3Å; A366-G370 WeakPolarHBondContact O-CA 3.43Å; A366-G370 PolarHBondContact O-N 3.5Å; G370-L372 VanDerWaalsContact C-N 3.33Å; G370-L372 PolarHBondContact O-N 3Å; G370-A374 PolarHBondContact O-N 2.95Å
371E93.3Very high93.2Very high106 Ų10626.3 Ų26.350%0.49513%0.134SC..Hα-helixtrans-65.2-32.8-176.8-74.8-155168.900112.9K330 F331 S375K330-E371 IonicContact NZ-OE1 3.13Å; K330-E371 PolarHBondContact NZ-OE1 3.29Å; K330-E371 IonicContact NZ-OE2 3.4Å; K330-E371 PolarHBondContact NZ-OE2 3.09Å; F331-E371 HydrophobicContact CE1-CB 3.89Å; F331-E371 HydrophobicContact CE1-CG 4.24Å; F331-E371 WeakPolarHBondContact CE1-O 3.44Å; F331-E371 HydrophobicContact CZ-CB 4.12Å; F331-E371 HydrophobicContact CZ-CG 3.99Å; E371-S375 WeakPolarHBondContact O-CB 3.31Å; E371-S375 PolarHBondContact O-N 3.18Å
372L93.2Very high93.3Very high104 Ų10426.3 Ų26.355%0.54513%0.134SC..Hα-helixtrans-65.4-52.7-178.9-177.863.6000111.5G370 A374 S375 E376G370-L372 VanDerWaalsContact C-N 3.33Å; G370-L372 PolarHBondContact O-N 3Å; L372-A374 VanDerWaalsContact C-N 3.32Å; L372-A374 PolarHBondContact O-N 2.88Å; L372-S375 WeakPolarHBondContact O-CB 3.45Å; L372-S375 PolarHBondContact O-N 2.9Å; L372-S375 VanDerWaalsContact O-N 3.09Å; L372-S375 PolarHBondContact O-OG 3.45Å; L372-E376 PolarHBondContact O-N 3.17Å; L372-E376 VanDerWaalsContact O-N 3.14Å
373V93.8Very high93.3Very high3 Ų329.2 Ų29.22%0.01815%0.15CC..Hα-helixtrans-60.1-44.5179.2178.10000110.5I147 E148 A369 S375 E376 I377I147-V373 HydrophobicContact CB-CG1 4.16Å; I147-V373 HydrophobicContact CG2-CG1 3.8Å; I147-V373 HydrophobicContact CG2-CG2 4.07Å; E148-V373 HydrophobicContact CB-CG2 4.4Å; A369-V373 HydrophobicContact CB-CB 4.25Å; A369-V373 HydrophobicContact CB-CG1 4.2Å; A369-V373 WeakPolarHBondContact O-CG2 3.28Å; V373-S375 VanDerWaalsContact C-N 3.3Å; V373-S375 PolarHBondContact O-N 2.93Å; V373-E376 PolarHBondContact O-N 3.04Å; V373-I377 HydrophobicContact CG1-CD1 3.89Å; V373-I377 WeakPolarHBondContact O-CG1 3.3Å; V373-I377 PolarHBondContact O-N 2.88Å; V373-I377 VanDerWaalsContact O-N 3.09Å
374A95.3Very high93.3Very high0 Ų029.7 Ų29.70%015%0.153CC..Hα-helixtrans-60.5-39.2175.700000112.5T365 A366 G370 L372 E376 I377 I378T365-A374 HydrophobicContact CG2-CB 4.35Å; A366-A374 HydrophobicContact CB-CB 3.64Å; G370-A374 PolarHBondContact O-N 2.95Å; L372-A374 VanDerWaalsContact C-N 3.32Å; L372-A374 PolarHBondContact O-N 2.88Å; A374-E376 PolarHBondContact O-N 2.02Å; A374-I377 PolarHBondContact O-N 2.75Å; A374-I378 WeakPolarHBondContact O-CB 3.5Å; A374-I378 WeakPolarHBondContact O-CD1 3.42Å; A374-I378 WeakPolarHBondContact O-CG1 3.41Å; A374-I378 PolarHBondContact O-N 3.43Å
375S95.6Very high93.4Very high8 Ų830.3 Ų30.36%0.05616%0.155CC..Hα-helixtrans-63.9-38.9178.380.30000113E371 L372 V373 I378 E379E371-S375 WeakPolarHBondContact O-CB 3.31Å; E371-S375 PolarHBondContact O-N 3.18Å; L372-S375 WeakPolarHBondContact O-CB 3.45Å; L372-S375 PolarHBondContact O-N 2.9Å; L372-S375 VanDerWaalsContact O-N 3.09Å; L372-S375 PolarHBondContact O-OG 3.45Å; V373-S375 VanDerWaalsContact C-N 3.3Å; V373-S375 PolarHBondContact O-N 2.93Å; S375-I378 PolarHBondContact O-N 3.19Å; S375-E379 WeakPolarHBondContact O-CB 3.12Å; S375-E379 PolarHBondContact O-N 2.99Å
376E94.9Very high93.3Very high29 Ų2933.9 Ų33.914%0.13617%0.169CC..Hα-helixtrans-69.8-39.7178-67.9171.1-160.300111.4R156 I160 L372 V373 A374 E379 R380R156-E376 IonicContact CZ-OE1 3.85Å; R156-E376 IonicContact CZ-OE2 3.54Å; R156-E376 VanDerWaalsContact CZ-OE2 3.32Å; R156-E376 IonicContact NE-OE1 2.7Å; R156-E376 IonicContact NE-OE2 3.22Å; R156-E376 PolarHBondContact NE-OE2 3.16Å; R156-E376 IonicContact NH2-OE1 3.39Å; R156-E376 PolarHBondContact NH2-OE1 3.17Å; R156-E376 IonicContact NH2-OE2 2.82Å; R156-E376 PolarHBondContact NH2-OE2 3.37Å; I160-E376 HydrophobicContact CD1-CB 3.94Å; I160-E376 WeakPolarHBondContact CD1-OE2 3.39Å; I160-E376 HydrophobicContact CG2-CB 4.35Å; L372-E376 PolarHBondContact O-N 3.17Å; L372-E376 VanDerWaalsContact O-N 3.14Å; V373-E376 PolarHBondContact O-N 3.04Å; A374-E376 PolarHBondContact O-N 2.02Å; E376-E379 PolarHBondContact O-N 3.19Å; E376-R380 WeakPolarHBondContact O-CB 3.5Å; E376-R380 PolarHBondContact O-N 3.09Å
377I95.8Very high93.2Very high0 Ų035.8 Ų35.80%018%0.184CC..Hα-helixtrans-64-43.5173.7-64.6163.9000110.6I160 V163 I167 L362 T365 V373 A374 R380 L381I160-I377 HydrophobicContact CG2-CG1 4.05Å; V163-I377 HydrophobicContact CG1-CD1 3.78Å; V163-I377 HydrophobicContact CG1-CG1 4.25Å; V163-I377 HydrophobicContact CG1-CG2 4.37Å; I167-I377 HydrophobicContact CD1-CG2 4.01Å; L362-I377 HydrophobicContact CD2-CG2 3.82Å; T365-I377 HydrophobicContact CG2-CD1 3.82Å; V373-I377 HydrophobicContact CG1-CD1 3.89Å; V373-I377 WeakPolarHBondContact O-CG1 3.3Å; V373-I377 PolarHBondContact O-N 2.88Å; V373-I377 VanDerWaalsContact O-N 3.09Å; A374-I377 PolarHBondContact O-N 2.75Å; I377-R380 PolarHBondContact O-N 3.39Å; I377-L381 HydrophobicContact CG2-CD1 3.95Å; I377-L381 HydrophobicContact CG2-CG 4.46Å; I377-L381 WeakPolarHBondContact O-CB 3.12Å; I377-L381 WeakPolarHBondContact O-CG 3.28Å; I377-L381 PolarHBondContact O-N 3Å
378I96.1Very high93.1Very high1 Ų137 Ų371%0.00519%0.19CC..Hα-helixtrans-61.7-44.4177.5-71.2166.5000111.2F327 I328 F331 L332 L362 A374 S375 R380 L381 W382F327-I378 HydrophobicContact CE1-CD1 4.35Å; I328-I378 HydrophobicContact CD1-CD1 4.05Å; I328-I378 HydrophobicContact CD1-CG1 4.34Å; I328-I378 HydrophobicContact CG2-CG2 4.25Å; F331-I378 HydrophobicContact CB-CD1 3.74Å; F331-I378 HydrophobicContact CB-CG2 4.31Å; F331-I378 HydrophobicContact CD2-CD1 3.5Å; F331-I378 HydrophobicContact CE2-CD1 4.34Å; F331-I378 HydrophobicContact CG-CD1 3.77Å; L332-I378 HydrophobicContact CD2-CG2 3.7Å; L332-I378 HydrophobicContact CG-CG2 3.87Å; L362-I378 HydrophobicContact CD1-CG1 3.91Å; L362-I378 HydrophobicContact CD2-CG1 3.87Å; L362-I378 HydrophobicContact CG-CG1 4.33Å; A374-I378 WeakPolarHBondContact O-CB 3.5Å; A374-I378 WeakPolarHBondContact O-CD1 3.42Å; A374-I378 WeakPolarHBondContact O-CG1 3.41Å; A374-I378 PolarHBondContact O-N 3.43Å; S375-I378 PolarHBondContact O-N 3.19Å; I378-R380 VanDerWaalsContact C-N 3.34Å; I378-L381 PolarHBondContact O-N 3.2Å; I378-W382 WeakPolarHBondContact O-CB 3.38Å; I378-W382 PolarHBondContact O-N 2.74Å
379E95.4Very high93Very high47 Ų4738.6 Ų38.622%0.2220%0.196CC..Hα-helixtrans-60.7-44.7175.9-173.5-167.2162.200111.1R335 A337 S375 E376 L381 W382 N383R335-E379 IonicContact CZ-OE2 3.68Å; R335-E379 IonicContact NE-OE2 2.84Å; R335-E379 PolarHBondContact NE-OE2 3.47Å; R335-E379 IonicContact NH2-OE2 3.63Å; R335-E379 PolarHBondContact NH2-OE2 2.84Å; A337-E379 HydrophobicContact CB-CG 4.31Å; S375-E379 WeakPolarHBondContact O-CB 3.12Å; S375-E379 PolarHBondContact O-N 2.99Å; E376-E379 PolarHBondContact O-N 3.19Å; E379-L381 PolarHBondContact O-N 2.77Å; E379-W382 WeakPolarHBondContact O-CB 3.43Å; E379-W382 PolarHBondContact O-N 3.39Å; E379-N383 PolarHBondContact O-N 3.37Å; E379-N383 PolarHBondContact O-ND2 3.39Å
380R95.4Very high92.5Very high82 Ų8243.4 Ų43.431%0.30922%0.222SC..Hα-helixtrans-62.1-45.9178.7-171.155.9168.6152.61.7111.8I160 T161 A164 E376 I377 I378 W382 N383 M384I160-R380 HydrophobicContact CG2-CB 4.2Å; T161-R380 PolarHBondContact OG1-NE 2.87Å; A164-R380 HydrophobicContact CB-CB 4Å; A164-R380 HydrophobicContact CB-CG 3.68Å; E376-R380 WeakPolarHBondContact O-CB 3.5Å; E376-R380 PolarHBondContact O-N 3.09Å; I377-R380 PolarHBondContact O-N 3.39Å; I378-R380 VanDerWaalsContact C-N 3.34Å; R380-W382 VanDerWaalsContact C-N 3.31Å; R380-W382 PolarHBondContact O-N 3.49Å; R380-N383 PolarHBondContact O-N 2.7Å; R380-M384 HydrophobicContact CG-SD 4.24Å; R380-M384 VanDerWaalsContact O-CG 3.28Å; R380-M384 WeakPolarHBondContact O-CG 3.34Å; R380-M384 PolarHBondContact O-N 3.41Å
381L95.6Very high91.8Very high0 Ų047 Ų470%024%0.238CC..Hα-helixtrans-60.6-38.3175.1-74.2167.7000112.3A164 I167 E168 F349 Y353 L354 L362 I377 I378 E379 M384 Y385A164-L381 HydrophobicContact CB-CD2 4.1Å; A164-L381 HydrophobicContact CB-CG 4.06Å; A164-L381 WeakPolarHBondContact O-CD2 3.23Å; I167-L381 HydrophobicContact CG2-CD1 4.29Å; I167-L381 HydrophobicContact CG2-CD2 4.41Å; E168-L381 HydrophobicContact CB-CD2 4.48Å; F349-L381 HydrophobicContact CE2-CB 4.5Å; F349-L381 HydrophobicContact CZ-CB 4.12Å; Y353-L381 HydrophobicContact CE1-CD2 4.48Å; L354-L381 HydrophobicContact CD2-CD1 4.09Å; L362-L381 HydrophobicContact CD1-CD1 4.22Å; L362-L381 HydrophobicContact CD2-CD1 3.92Å; I377-L381 HydrophobicContact CG2-CD1 3.95Å; I377-L381 HydrophobicContact CG2-CG 4.46Å; I377-L381 WeakPolarHBondContact O-CB 3.12Å; I377-L381 WeakPolarHBondContact O-CG 3.28Å; I377-L381 PolarHBondContact O-N 3Å; I378-L381 PolarHBondContact O-N 3.2Å; E379-L381 PolarHBondContact O-N 2.77Å; L381-M384 PolarHBondContact O-N 3.2Å; L381-Y385 WeakPolarHBondContact O-CB 3.37Å; L381-Y385 PolarHBondContact O-N 3.2Å
382W94.9Very high90.3Very high1 Ų145.8 Ų45.80%0.00424%0.241CC..Hα-helixtrans-65.7-43176.2175.6-108.7000112.4L332 A337 L338 K345 F349 I378 E379 R380 M384 Y385 R386L332-W382 HydrophobicContact CD1-CD2 4.09Å; L332-W382 HydrophobicContact CD1-CE3 4.05Å; L332-W382 HydrophobicContact CD1-CG 4.38Å; L332-W382 HydrophobicContact CD2-CB 3.68Å; L332-W382 HydrophobicContact CD2-CD2 4.35Å; L332-W382 HydrophobicContact CD2-CG 3.79Å; A337-W382 PolarHBondContact O-NE1 3.01Å; A337-W382 VanDerWaalsContact O-NE1 3.17Å; L338-W382 HydrophobicContact CD1-CZ2 4.43Å; K345-W382 HydrophobicContact CB-CH2 3.99Å; F349-W382 HydrophobicContact CB-CE3 3.98Å; F349-W382 HydrophobicContact CB-CZ3 3.56Å; F349-W382 AromaticContact CD1-CE3 3.62Å; F349-W382 HydrophobicContact CD1-CE3 3.62Å; F349-W382 AromaticContact CD1-CZ3 3.94Å; F349-W382 HydrophobicContact CD1-CZ3 3.94Å; F349-W382 AromaticContact CD2-CE3 3.9Å; F349-W382 HydrophobicContact CD2-CE3 3.9Å; F349-W382 HydrophobicContact CD2-CZ3 4.33Å; F349-W382 AromaticContact CE1-CE3 3.97Å; F349-W382 HydrophobicContact CE1-CE3 3.97Å; F349-W382 HydrophobicContact CE2-CE3 4.22Å; F349-W382 AromaticContact CG-CE3 3.58Å; F349-W382 HydrophobicContact CG-CE3 3.58Å; F349-W382 AromaticContact CG-CZ3 3.71Å; F349-W382 HydrophobicContact CG-CZ3 3.71Å; F349-W382 HydrophobicContact CZ-CB 4.21Å; F349-W382 HydrophobicContact CZ-CE3 4.25Å; I378-W382 WeakPolarHBondContact O-CB 3.38Å; I378-W382 PolarHBondContact O-N 2.74Å; E379-W382 WeakPolarHBondContact O-CB 3.43Å; E379-W382 PolarHBondContact O-N 3.39Å; R380-W382 VanDerWaalsContact C-N 3.31Å; R380-W382 PolarHBondContact O-N 3.49Å; W382-M384 VanDerWaalsContact C-N 3.34Å; W382-M384 PolarHBondContact O-N 2.83Å; W382-Y385 HydrophobicContact CE3-CD1 4.08Å; W382-Y385 HydrophobicContact CZ3-CD1 4.01Å; W382-Y385 HydrophobicContact CZ3-CE1 4.07Å; W382-Y385 WeakPolarHBondContact O-CB 3.41Å; W382-Y385 PolarHBondContact O-N 3.18Å; W382-R386 WeakPolarHBondContact O-CG 3.42Å; W382-R386 PolarHBondContact O-N 3.36Å
383N93.8Very high88.8Confident61 Ų6145.5 Ų45.533%0.32624%0.244SC..Hα-helixtrans-64.6-39.1176.8-71.2-25.3000111.9E379 R380 R386 A387E379-N383 PolarHBondContact O-N 3.37Å; E379-N383 PolarHBondContact O-ND2 3.39Å; R380-N383 PolarHBondContact O-N 2.7Å; N383-R386 PolarHBondContact O-N 2.96Å; N383-A387 PolarHBondContact O-N 3.47Å
384M92.8Very high87.2Confident25 Ų2550.2 Ų50.212%0.12327%0.272CS..Hα-helixtrans-63-46.2173.5-67.117178.500111.1A164 R165 E168 R380 L381 W382 R386 A387 H388A164-M384 HydrophobicContact CB-SD 4.17Å; R165-M384 HydrophobicContact CB-CE 4.48Å; R165-M384 HydrophobicContact CG-CE 3.55Å; R165-M384 HydrophobicContact CG-SD 4.47Å; E168-M384 WeakPolarHBondContact OE2-CE 3.33Å; R380-M384 HydrophobicContact CG-SD 4.24Å; R380-M384 VanDerWaalsContact O-CG 3.28Å; R380-M384 WeakPolarHBondContact O-CG 3.34Å; R380-M384 PolarHBondContact O-N 3.41Å; L381-M384 PolarHBondContact O-N 3.2Å; W382-M384 VanDerWaalsContact C-N 3.34Å; W382-M384 PolarHBondContact O-N 2.83Å; M384-R386 PolarHBondContact O-N 3.43Å; M384-A387 WeakPolarHBondContact O-CB 3.39Å; M384-A387 PolarHBondContact O-N 3.06Å; M384-A387 VanDerWaalsContact O-N 3.16Å; M384-H388 PolarHBondContact O-CD2 2.68Å; M384-H388 PolarHBondContact O-N 2.88Å
385Y92.7Very high85.2Confident14 Ų1454.6 Ų54.66%0.05530%0.303CS..Hα-helixtrans-57.8-45.9174.3170.6-103.2000113T348 F349 Y353 L381 W382 A387 H388 Q389T348-Y385 WeakPolarHBondContact CB-OH 3.43Å; T348-Y385 WeakPolarHBondContact CG2-OH 3.25Å; F349-Y385 HydrophobicContact CB-CD1 4.1Å; F349-Y385 HydrophobicContact CB-CE1 3.85Å; F349-Y385 HydrophobicContact CB-CE2 4.47Å; F349-Y385 HydrophobicContact CB-CG 4.5Å; F349-Y385 AromaticContact CD2-CD1 3.73Å; F349-Y385 HydrophobicContact CD2-CD1 3.73Å; F349-Y385 AromaticContact CD2-CD2 3.93Å; F349-Y385 HydrophobicContact CD2-CD2 3.93Å; F349-Y385 HydrophobicContact CD2-CE1 4.32Å; F349-Y385 HydrophobicContact CD2-CE2 4.48Å; F349-Y385 AromaticContact CD2-CG 3.49Å; F349-Y385 HydrophobicContact CD2-CG 3.49Å; F349-Y385 VanDerWaalsContact CD2-CG 3.49Å; F349-Y385 HydrophobicContact CE2-CG 4.14Å; F349-Y385 HydrophobicContact CG-CD1 4.27Å; F349-Y385 HydrophobicContact CG-CG 4.42Å; Y353-Y385 HydrophobicContact CD1-CD2 4.34Å; Y353-Y385 AromaticContact CD2-CD2 3.63Å; Y353-Y385 HydrophobicContact CD2-CD2 3.63Å; Y353-Y385 HydrophobicContact CD2-CE2 4.43Å; Y353-Y385 HydrophobicContact CD2-CG 4.48Å; Y353-Y385 HydrophobicContact CE2-CD2 4.21Å; Y353-Y385 AromaticContact CG-CD2 3.68Å; Y353-Y385 HydrophobicContact CG-CD2 3.68Å; Y353-Y385 HydrophobicContact CG-CE2 4.36Å; Y353-Y385 HydrophobicContact CG-CG 4.4Å; L381-Y385 WeakPolarHBondContact O-CB 3.37Å; L381-Y385 PolarHBondContact O-N 3.2Å; W382-Y385 HydrophobicContact CE3-CD1 4.08Å; W382-Y385 HydrophobicContact CZ3-CD1 4.01Å; W382-Y385 HydrophobicContact CZ3-CE1 4.07Å; W382-Y385 WeakPolarHBondContact O-CB 3.41Å; W382-Y385 PolarHBondContact O-N 3.18Å; Y385-A387 VanDerWaalsContact C-N 3.31Å; Y385-A387 PolarHBondContact O-N 2.81Å; Y385-H388 PolarHBondContact O-N 2.96Å; Y385-Q389 HydrophobicContact CD1-CG 4.49Å; Y385-Q389 HydrophobicContact CD2-CG 4.49Å; Y385-Q389 HydrophobicContact CE1-CG 4.13Å; Y385-Q389 HydrophobicContact CE2-CG 4.14Å; Y385-Q389 VanDerWaalsContact CZ-CD 3.41Å; Y385-Q389 VanDerWaalsContact CZ-NE2 3.27Å; Y385-Q389 WeakPolarHBondContact O-CG 3.42Å; Y385-Q389 PolarHBondContact O-N 2.84Å; Y385-Q389 PolarHBondContact OH-NE2 2.93Å
386R90.6Very high83Confident74 Ų7460.1 Ų60.128%0.27934%0.337SS..Hα-helixtrans-59.3-42.1175.7-74-178.273.1168.411.3111.6E339 W382 N383 M384 H388 Q389 N390E339-R386 IonicContact OE1-CZ 3.72Å; E339-R386 IonicContact OE1-NH1 3.58Å; E339-R386 IonicContact OE1-NH2 2.97Å; E339-R386 PolarHBondContact OE1-NH2 2.87Å; W382-R386 WeakPolarHBondContact O-CG 3.42Å; W382-R386 PolarHBondContact O-N 3.36Å; N383-R386 PolarHBondContact O-N 2.96Å; M384-R386 PolarHBondContact O-N 3.43Å; R386-H388 VanDerWaalsContact C-N 3.35Å; R386-H388 PolarHBondContact O-N 2.61Å; R386-Q389 PolarHBondContact O-N 2.78Å; R386-N390 VanDerWaalsContact O-CG 3.3Å; R386-N390 PolarHBondContact O-N 2.81Å
387A90.9Very high80.6Confident53 Ų5362.9 Ų62.944%0.43836%0.359SS..Hα-helixtrans-60.2-43.6176.600000111.7N383 M384 Y385 Q389 N390 V391N383-A387 PolarHBondContact O-N 3.47Å; M384-A387 WeakPolarHBondContact O-CB 3.39Å; M384-A387 PolarHBondContact O-N 3.06Å; M384-A387 VanDerWaalsContact O-N 3.16Å; Y385-A387 VanDerWaalsContact C-N 3.31Å; Y385-A387 PolarHBondContact O-N 2.81Å; A387-Q389 PolarHBondContact O-N 2.58Å; A387-N390 PolarHBondContact O-N 2.88Å; A387-V391 WeakPolarHBondContact O-CG2 3.24Å; A387-V391 PolarHBondContact O-N 2.87Å
388H87.4Confident77.8Confident105 Ų10573.7 Ų73.749%0.48640%0.4SS..Hα-helixtrans-63.8-35.9175.5-77.1-69.7000113.6E168 M384 Y385 R386 S392E168-H388 IonicContact OE1-CD2 3.55Å; E168-H388 IonicContact OE1-NE2 3.34Å; E168-H388 PolarHBondContact OE1-NE2 3.27Å; M384-H388 PolarHBondContact O-CD2 2.68Å; M384-H388 PolarHBondContact O-N 2.88Å; Y385-H388 PolarHBondContact O-N 2.96Å; R386-H388 VanDerWaalsContact C-N 3.35Å; R386-H388 PolarHBondContact O-N 2.61Å; H388-S392 PolarHBondContact O-N 2.05Å; H388-S392 PolarHBondContact O-OG 3.33Å
389Q83.5Confident75.3Confident66 Ų6678.8 Ų78.831%0.30843%0.433SS..Hα-helixtrans-69.5-39.1176.1-65.2-153.2-50.600112.7Y385 R386 A387 V391 S392 T393Y385-Q389 HydrophobicContact CD1-CG 4.49Å; Y385-Q389 HydrophobicContact CD2-CG 4.49Å; Y385-Q389 HydrophobicContact CE1-CG 4.13Å; Y385-Q389 HydrophobicContact CE2-CG 4.14Å; Y385-Q389 VanDerWaalsContact CZ-CD 3.41Å; Y385-Q389 VanDerWaalsContact CZ-NE2 3.27Å; Y385-Q389 WeakPolarHBondContact O-CG 3.42Å; Y385-Q389 PolarHBondContact O-N 2.84Å; Y385-Q389 PolarHBondContact OH-NE2 2.93Å; R386-Q389 PolarHBondContact O-N 2.78Å; A387-Q389 PolarHBondContact O-N 2.58Å; Q389-V391 PolarHBondContact O-N 2.87Å; Q389-S392 PolarHBondContact O-N 2.93Å; Q389-T393 PolarHBondContact O-N 3.47Å; Q389-T393 PolarHBondContact O-OG1 2.85Å
390N80Confident72.5Confident103 Ų10383.7 Ų83.755%0.55146%0.46SS*.Hα-helixtrans-65-39.8-180-69.5-12.8000111.7R386 A387 S392 T393 T394R386-N390 VanDerWaalsContact O-CG 3.3Å; R386-N390 PolarHBondContact O-N 2.81Å; A387-N390 PolarHBondContact O-N 2.88Å; N390-S392 VanDerWaalsContact C-N 3.29Å; N390-S392 PolarHBondContact O-N 2.78Å; N390-T393 PolarHBondContact O-N 3.47Å; N390-T393 VanDerWaalsContact O-N 3.16Å; N390-T394 PolarHBondContact O-N 3.49Å; N390-T394 PolarHBondContact O-OG1 2.98Å
391V76.7Confident69.9Low105 Ų10584.4 Ų84.464%0.63648%0.478SS*.Hα-helixtrans-62.2-37.1176.8176.10000111.9A387 Q389 T393A387-V391 WeakPolarHBondContact O-CG2 3.24Å; A387-V391 PolarHBondContact O-N 2.87Å; Q389-V391 PolarHBondContact O-N 2.87Å; V391-T393 VanDerWaalsContact C-N 3.25Å; V391-T393 PolarHBondContact O-N 3.45Å
392S62.8Low67.3Low80 Ų8094.4 Ų94.456%0.55952%0.517SS*.Hα-helixtrans-69.9-21.9178.9-560000113.2H388 Q389 N390 S395H388-S392 PolarHBondContact O-N 2.05Å; H388-S392 PolarHBondContact O-OG 3.33Å; Q389-S392 PolarHBondContact O-N 2.93Å; N390-S392 VanDerWaalsContact C-N 3.29Å; N390-S392 PolarHBondContact O-N 2.78Å; S392-S395 PolarHBondContact O-OG 3.05Å
393T61.4Low64.8Low99 Ų99100.4 Ų100.461%0.60755%0.554SS**Hα-helixtrans-87.9-31.1-177.4-44.70000111.7Q389 N390 V391Q389-T393 PolarHBondContact O-N 3.47Å; Q389-T393 PolarHBondContact O-OG1 2.85Å; N390-T393 PolarHBondContact O-N 3.47Å; N390-T393 VanDerWaalsContact O-N 3.16Å; V391-T393 VanDerWaalsContact C-N 3.25Å; V391-T393 PolarHBondContact O-N 3.45Å
394T59.5Low62.4Low101 Ų101105.4 Ų105.462%0.6258%0.58SS**Hα-helixtrans-75.9-23.1-179.6-50.20000113.7N390N390-T394 PolarHBondContact O-N 3.49Å; N390-T394 PolarHBondContact O-OG1 2.98Å
395S54.2Low60.2Low92 Ų92110.1 Ų110.164%0.64361%0.612SS**THydrogen-bonded Turntrans-82.5-12.7-178.152.60000114.9S392S392-S395 PolarHBondContact O-OG 3.05Å
396T49.3Very low58Low125 Ų125118.4 Ų118.477%0.76765%0.652SS**SBendtrans-97.4-8.7-177.7-52.60000113.3
397S44.8Very low55.5Low87 Ų87123.8 Ų123.861%0.60868%0.68SS**SBendtrans-108.218.4-172.855.20000115.7P399S397-P399 WeakPolarHBondContact O-CD 3.04Å
398R36.5Very low53.5Low226 Ų226127.1 Ų127.185%0.85370%0.697SS**  trans-103.9105.2168-82.7-174.3174179.4-1.7111L400R398-L400 PolarHBondContact O-N 2.99Å
399P42.2Very low51.3Low109 Ų109131.4 Ų131.471%0.70872%0.717SS**  trans-62.5127.7159.2-11.826.3000108.8S397 S401S397-P399 WeakPolarHBondContact O-CD 3.04Å; P399-S401 VanDerWaalsContact C-N 3.29Å; P399-S401 PolarHBondContact O-N 3.36Å
400L37.5Very low49.2Very low150 Ų150136.1 Ų136.179%0.78574%0.744SS**  trans-65.289.5164.7-91.5151000108.6R398 Y402R398-L400 PolarHBondContact O-N 2.99Å; L400-Y402 HydrophobicContact CD2-CD2 4.33Å; L400-Y402 HydrophobicContact CD2-CE2 3.71Å
401S41.7Very low47.4Very low97 Ų97136.9 Ų136.968%0.67875%0.754SS**  trans-102.192.7163.2-61.20000108.2P399 T403P399-S401 VanDerWaalsContact C-N 3.29Å; P399-S401 PolarHBondContact O-N 3.36Å; S401-T403 PolarHBondContact O-N 2.98Å
402Y40.7Very low45.3Very low210 Ų210140.9 Ų140.982%0.82477%0.766SS**  trans-58.7115.2160.6-75.4-91.6000108.2L400L400-Y402 HydrophobicContact CD2-CD2 4.33Å; L400-Y402 HydrophobicContact CD2-CE2 3.71Å
403T42.9Very low44.3Very low126 Ų126145.7 Ų145.777%0.77378%0.779SS**  trans-136.2113.1161-30.90000107.1S401S401-T403 PolarHBondContact O-N 2.98Å
404L41.6Very low43.2Very low166 Ų166149 Ų14987%0.86979%0.788SS**  trans-59.5135171.7-94.2115.9000109.6Q406L404-Q406 PolarHBondContact O-N 2.9Å
405P47.2Very low42.3Very low125 Ų125149.9 Ų149.981%0.81279%0.793SS**  trans-74.3115.3170.9-8.424.5000110.1
406Q46.2Very low41.3Very low188 Ų188149.7 Ų149.788%0.87979%0.792SS**PPolyproline II helixtrans-71.2139.4161-90173.3-2500110L404L404-Q406 PolarHBondContact O-N 2.9Å
407Q38.8Very low41Very low187 Ų187152.9 Ų152.987%0.87480%0.798SS**PPolyproline II helixtrans-58.9137.7-178.5-76.9167.3-48.200113.1
408P47.9Very low40.7Very low123 Ų123159.9 Ų159.980%0.79981%0.811SS**PPolyproline II helixtrans-78.3131.7166.6-8.925.8000111.4
409Q42.1Very low40.9Very low195 Ų195153.9 Ų153.991%0.91180%0.803SS**PPolyproline II helixtrans-69.3135.6167.6-69.7-171.5-18.700110.7
410L39.8Very low40.8Very low164 Ų164153 Ų15386%0.85980%0.799SS**PPolyproline II helixtrans-86.7138.9-178.7-119.8126.9000111.2
411P40.7Very low41.2Very low120 Ų120152.9 Ų152.978%0.77979%0.794SS**PPolyproline II helixtrans-75.8138.4174.7-8.825.2000112.2
412Q33.6Very low41.5Very low188 Ų188155 Ų15588%0.87979%0.793SS**PPolyproline II helixtrans-69.8126.6172.9-71.7175.9-26.800111.4
413H41.5Very low41.8Very low182 Ų182151.4 Ų151.484%0.84378%0.784SS**  trans-148.696.4147-113.8-45.4000111.6
414Q39.1Very low42Very low168 Ų168152.3 Ų152.379%0.78578%0.779SS**  trans29.5125.4130.9-110.7-177.3-12.500121.8
415V39.9Very low42.2Very low119 Ų119150.8 Ų150.872%0.72177%0.767SS**  trans119.7106.1135.2-167.80000116.1
416S33.4Very low42.2Very low89 Ų89152.7 Ų152.762%0.62277%0.765SS**  trans-9.5142.2156.457.30000119.8
417H43.1Very low41.7Very low192 Ų192154.7 Ų154.789%0.88977%0.765SS**  -158.6158.9112.7-100.2-76000111.1
418R37.9Very low42.1Very low234 Ų234150.5 Ų150.588%0.88375%0.754SS**  trans-91.5150-146.4-163.5175.4-174.8-176.60.4113.7
419S40.4Very low41.6Very low100 Ų100149.5 Ų149.570%0.69975%0.749SS**  trans-19151.7158.3-151.60000115.9
420S41.5Very low41.6Very low89 Ų89147 Ų14762%0.62275%0.748SS**  178.2159.453.9-250000113.9
421H46.1Very low41.7Very low148 Ų148143.5 Ų143.569%0.68574%0.742SS**  trans77.5114.5141.4-70.6-59.1000122.5
422H47Very low41.8Very low142 Ų142143.3 Ų143.366%0.65774%0.744SS**  88.8141.5114.4-80-39.4000114.5
423H47.7Very low42.4Very low135 Ų135139.3 Ų139.363%0.62574%0.737SS**  cis-164.4153.320.5-107.9-52.6000109.5
424H46.8Very low42.5Very low144 Ų144136.3 Ų136.367%0.66773%0.731SS**  trans39.4151.8136-75.2-46.1000122.7
425H46Very low42.7Very low135 Ų135135.4 Ų135.463%0.62573%0.732SS**  cis-175.9160.524.8-121.5-58.9000110.4
426H45.9Very low42.7Very low165 Ų165141.2 Ų141.276%0.76474%0.741SS**  trans84.6124.7143.4-75.2-60.7000125.7
427R36.9Very low43Very low230 Ų230148.5 Ų148.587%0.86875%0.754SS**  trans-89.2176.9149.8-134-170.8171.3177.1-2108.1
428P45.7Very low42.9Very low99 Ų99144 Ų14464%0.64375%0.75SS**  cis-149.1179.413.440.4-15.8000119.7
429S38.7Very low42.9Very low101 Ų101138.4 Ų138.471%0.70675%0.747SS**  trans37.6125.2145.8590000124.7
430T42.5Very low42.9Very low144 Ų144146 Ų14688%0.88376%0.761SS**  trans-177.8118.714040.30000108.3
431A41.8Very low42.8Very low89 Ų89147 Ų14774%0.73677%0.768SS**  91.2120.576.800000115.7
432S43.3Very low42.7Very low117 Ų117148.5 Ų148.582%0.81878%0.78SS**  trans89.5136.7143.377.10000123.4
433S45.8Very low42.5Very low104 Ų104147.3 Ų147.373%0.72778%0.783SS**  trans81.4130.2150.1-150.70000117.3
434T43.2Very low42.4Very low119 Ų119147.1 Ų147.173%0.7379%0.794SS**  cis-169.6137.513.9-0.80000110.9
435N42.4Very low42.5Very low148 Ų148146.8 Ų146.879%0.79180%0.802SS**  trans11.5129.6149.5-72.7-32.1000122.1
436R40.4Very low42.3Very low241 Ų241145.7 Ų145.791%0.90981%0.809SS**  -179.8123.3105.8-98.2175.6-176.7-165.12.4114.8
437R40.5Very low42.3Very low242 Ų242143.9 Ų143.991%0.91381%0.812SS**  trans68.9109.8140.3-93.8177.5-175.5-1720.5123.1
438A41.5Very low42.4Very low97 Ų97138.6 Ų138.680%0.80281%0.81SS**  81.794.312100000119.7
439S37Very low41.9Very low118 Ų118141.3 Ų141.383%0.82582%0.819SS**  trans-82.6144.9170.3-43.90000113.5
440R39.9Very low41.9Very low258 Ų258141.8 Ų141.897%0.97482%0.822SS**  trans-154.6100139.4-98.5-174.8-176.4-1761108.2
441S39.7Very low41.7Very low110 Ų110139.7 Ų139.777%0.76981%0.814SS**  trans-133.6127.7162.660.90000108.9
442L44Very low41.5Very low180 Ų180144.9 Ų144.994%0.94282%0.823SS**PPolyproline II helixtrans-93121.7172.2-85.4151.2000108
443T43.3Very low41.5Very low117 Ų117146.4 Ų146.472%0.71882%0.82SS**PPolyproline II helixtrans-81.3147.6172.546.10000111.8
444P45.8Very low41Very low132 Ų132153 Ų15386%0.85783%0.829SS**PPolyproline II helixtrans-100.2132.515724.1-8.7000111.5
445V47.7Very low41Very low137 Ų137158.9 Ų158.983%0.8384%0.838SS**PPolyproline II helixtrans-95.7139.7178170.30000110.3
446S42.8Very low41Very low112 Ų112161.1 Ų161.178%0.78384%0.841SS**PPolyproline II helixtrans-72.9147.8174.5-1240000112.6
447P44.9Very low41.9Very low127 Ų127155.1 Ų155.183%0.82583%0.833SS**PPolyproline II helixtrans-95.8141.3177.635.7-28.4000112.4
448S39.7Very low42.8Very low118 Ų118149.2 Ų149.283%0.82583%0.826SS**  trans-123.5145.4166.751.50000110.2
449D35.6Very low43.2Very low157 Ų157150.1 Ų150.184%0.8482%0.824SS**  trans-20.6142.7178.1-79.9-48.8000118.9
450S38.3Very low43.5Very low110 Ų110150 Ų15077%0.76982%0.823SS**  167.1127.6118-70.70000112.8
451S39Very low43.9Very low101 Ų101148.2 Ų148.271%0.70682%0.818SS**  trans49.3103.414264.40000120.6I453S451-I453 PolarHBondContact O-N 3.3Å
452E36.2Very low44.4Very low198 Ų198147.8 Ų147.893%0.92581%0.812SS**  19.194.8126.1-157.1169.7-170.300118.4
453I43.3Very low44.3Very low149 Ų149143.1 Ų143.176%0.76480%0.8SS**  trans-135.5113.6155-61.6-177.5000110.1S451 R455S451-I453 PolarHBondContact O-N 3.3Å; I453-R455 PolarHBondContact O-N 3Å
454R36.5Very low44.3Very low243 Ų243147.9 Ų147.992%0.91781%0.806SS**  trans-43.8114.9169.3-167.5176.1-155.5-168.25.1112.7
455R42.1Very low44.3Very low241 Ų241150.4 Ų150.491%0.90981%0.806SS**  trans-107.1124167.2-71.5-169.9-170-176.14.2111.6I453I453-R455 PolarHBondContact O-N 3Å
456K42.8Very low44.2Very low195 Ų195152.1 Ų152.185%0.84881%0.81SS**PPolyproline II helixtrans-59.5152173.9-75.4172.3172.7176.30112
457P58.4Low44.2Very low115 Ų115157.8 Ų157.875%0.74781%0.814SS**PPolyproline II helixtrans-71.6155170.730.9-32.1000111.4
458P59.2Low44.7Very low119 Ų119156.9 Ų156.977%0.77381%0.808SS**PPolyproline II helixtrans-70.1154.9179.230-33.6000111.8
459P50.8Low45.6Very low116 Ų116156.9 Ų156.975%0.75381%0.805SS**PPolyproline II helixtrans-71.1139.7-17628.9-32.3000111.9
460S43.4Very low46.7Very low116 Ų116155 Ų15581%0.81180%0.801SS**PPolyproline II helixtrans-68126.3170.847.70000111.2
461Y47.3Very low47Very low219 Ų219154.7 Ų154.786%0.85981%0.806SS**PPolyproline II helixtrans-73.6139164.9-76.2-88000110.1
462P52Low47.3Very low101 Ų101155.1 Ų155.166%0.65681%0.809SS**PPolyproline II helixtrans-71.2135177.929.2-32.6000110.6Y464P462-Y464 PolarHBondContact O-N 3.46Å
463A41.9Very low47.5Very low82 Ų82151.5 Ų151.568%0.67880%0.802SS**PPolyproline II helixtrans-68.5121.5172.800000109.9H465A463-H465 PolarHBondContact O-N 3.39Å
464Y42.4Very low47.5Very low218 Ų218149.4 Ų149.486%0.85581%0.807SS**  trans-75.3107.7165.2-75.8-80.8000108.8P462 L466P462-Y464 PolarHBondContact O-N 3.46Å; Y464-L466 PolarHBondContact O-N 3.05Å
465H45Very low47.7Very low184 Ų184141.5 Ų141.585%0.85280%0.801SS**  trans-65107.3168.1-76.6-88.4000109.6A463 R467A463-H465 PolarHBondContact O-N 3.39Å; H465-R467 PolarHBondContact O-N 3.23Å
466L45.9Very low47.6Very low173 Ų173135.1 Ų135.191%0.90679%0.794SS**  trans-76.7111.1160.2-93.9141.1000108.1Y464Y464-L466 PolarHBondContact O-N 3.05Å
467R43Very low47.4Very low232 Ų232135.4 Ų135.488%0.87580%0.798SS**PPolyproline II helixtrans-60.4133.7177.6-156.1-179.9-149.4-171.64.7110H465H465-R467 PolarHBondContact O-N 3.23Å
468P54.8Low46.8Very low108 Ų108137.4 Ų137.470%0.70180%0.801SS**PPolyproline II helixtrans-72.8146.5168.331-31.5000109.5
469P60.5Low46.8Very low117 Ų117137 Ų13776%0.7680%0.799SS**PPolyproline II helixtrans-69.6147170.829.3-30.8000110.1
470P56.7Low47.3Very low118 Ų118137 Ų13777%0.76680%0.799SS**PPolyproline II helixtrans-72.6141.9-177.829.3-32.1000111.5
471A45Very low47.7Very low104 Ų104137.5 Ų137.586%0.8680%0.799SS**PPolyproline II helixtrans-62.3137.1165.700000110.1
472S45.1Very low47.8Very low110 Ų110134.9 Ų134.977%0.76980%0.8SS**  trans-132.4148.9164.3-75.60000109.4
473P42.1Very low47.9Very low122 Ų122135.3 Ų135.379%0.79280%0.802SS**  trans-92.7159.9-148.235.9-33.5000113.7
474A42.8Very low48.4Very low104 Ų104137.3 Ų137.386%0.8681%0.808SS**  trans17.8128.3149.500000120.1
475G39.9Very low48.3Very low77 Ų77132.2 Ų132.279%0.79481%0.805SS**  trans11385.7137.100000116.4
476S40.5Very low48Very low108 Ų108131.9 Ų131.976%0.75581%0.808SS**  trans171.6121.7134.153.10000108.8L478S476-L478 PolarHBondContact O-N 3.41Å
477Q39.5Very low47.6Very low200 Ų200134.5 Ų134.594%0.93581%0.806SS**  trans-61.2128.2176-64.4-177.54.100110.3
478L45.4Very low47.5Very low157 Ų157129 Ų12982%0.82280%0.801SS**  trans-122131.7163.8-129.484.2000107.5S476S476-L478 PolarHBondContact O-N 3.41Å
479P59.1Low46.9Very low112 Ų112129.4 Ų129.473%0.72781%0.806SS**PPolyproline II helixtrans-71.2160.3-178.930.3-33.3000111.5
480P60.8Low46.3Very low115 Ų115127.9 Ų127.975%0.74780%0.803SS**PPolyproline II helixtrans-65.1155.7-176.228-34.5000112.1
481P53.1Low46.3Very low126 Ų126127.8 Ų127.882%0.81880%0.802SS**PPolyproline II helixtrans-69.4139-17628.9-33000111.4
482L47.6Very low47Very low165 Ų165128 Ų12886%0.86480%0.795SS**PPolyproline II helixtrans-59.2147.1171.5-83.4100.8000111.5
483P55.7Low47.6Very low109 Ų109128.8 Ų128.871%0.70880%0.798SS**PPolyproline II helixtrans-65.6154.8171.528.6-32.3000110.9S485P483-S485 PolarHBondContact O-N 2.79Å
484P50.8Low48.4Very low125 Ų125130.8 Ų130.881%0.81280%0.801SS**PPolyproline II helixtrans-63.3128.1-177.425.5-31000110.4L486P484-L486 PolarHBondContact O-N 3.07Å
485S40.2Very low49.4Very low111 Ų111131 Ų13178%0.77679%0.793SS**  trans-43.9127.7170.345.90000112.3P483 R487P483-S485 PolarHBondContact O-N 2.79Å; S485-R487 PolarHBondContact O-N 3.03Å
486L39.3Very low50.3Low176 Ų176133.4 Ų133.492%0.92180%0.795SS**  trans-44.9107.9166.7-82.6134.8000110.9P484P484-L486 PolarHBondContact O-N 3.07Å
487R36.9Very low50.7Low228 Ų228134.9 Ų134.986%0.8680%0.8SS**PPolyproline II helixtrans-72.4132.1161.3-155178-141.1-151.33.8107.1S485 S489S485-R487 PolarHBondContact O-N 3.03Å; R487-S489 PolarHBondContact O-N 3.33Å; R487-S489 VanDerWaalsContact O-N 3.12Å
488P41.3Very low51Low118 Ų118133.8 Ų133.877%0.76680%0.799SS**PPolyproline II helixtrans-61.1120.3172.2-14.427.3000108.3A490P488-A490 PolarHBondContact O-N 3.46Å
489S42.7Very low50.8Low115 Ų115129.2 Ų129.280%0.80479%0.79SS**PPolyproline II helixtrans-55125.5167.339.50000109.3R487R487-S489 PolarHBondContact O-N 3.33Å; R487-S489 VanDerWaalsContact O-N 3.12Å
490A48.6Very low49.6Very low86 Ų86134.1 Ų134.171%0.71180%0.8SS**PPolyproline II helixtrans-56.8143.4169.700000110P488P488-A490 PolarHBondContact O-N 3.46Å
491P56.8Low48.6Very low115 Ų115134.8 Ų134.875%0.74780%0.802SS**PPolyproline II helixtrans-63.5149.9175.626.8-32.7000110.8
492P59.3Low47.9Very low109 Ų109134.5 Ų134.571%0.70880%0.798SS**PPolyproline II helixtrans-62.7149175.726.8-33000111
493P57.6Low47.2Very low127 Ų127132 Ų13283%0.82580%0.795SS**PPolyproline II helixtrans-69.3137.6179.328.1-31.3000110.9
494L58.8Low46.5Very low164 Ų164134.8 Ų134.886%0.85980%0.802SS**PPolyproline II helixtrans-59.4144.5173.2-80.9148.2000111.3
495P64.4Low45.7Very low107 Ų107133.6 Ų133.670%0.69580%0.796SS**PPolyproline II helixtrans-67.1149.817427.8-32.6000111.4
496P57.4Low45.8Very low128 Ų128136.3 Ų136.383%0.83180%0.801SS**PPolyproline II helixtrans-70.2134.3-178.128-32.4000111.5L498P496-L498 PolarHBondContact O-N 3.12Å
497T48.8Very low45.7Very low140 Ų140135.3 Ų135.386%0.85980%0.797SS**PPolyproline II helixtrans-65.2122.917245.90000110.6G499T497-G499 PolarHBondContact O-N 3.39Å
498L47.5Very low45.8Very low176 Ų176127.6 Ų127.692%0.92179%0.788SS**PPolyproline II helixtrans-60.5128.2176.5-157.676.2000110.4P496P496-L498 PolarHBondContact O-N 3.12Å
499G39.9Very low45.7Very low61 Ų61128 Ų12863%0.62979%0.789SS**PPolyproline II helixtrans-66.7147-176.900000113.8T497T497-G499 PolarHBondContact O-N 3.39Å
500K33.4Very low45.6Very low216 Ų216127.3 Ų127.394%0.93978%0.784SS**PPolyproline II helixtrans-59.6128.1169.6-69.4172.8174.6177.40110.5
501T40.1Very low45.2Very low128 Ų128128.7 Ų128.779%0.78579%0.788SS**  trans-110.5106.6162.4-22.30000108.5
502T38.5Very low44.1Very low120 Ų120128.3 Ų128.374%0.73679%0.788SS**  trans39.1112145.247.30000120.1
503S32.7Very low43.2Very low114 Ų114132.5 Ų132.580%0.79780%0.801SS**  trans-50.6129.1151.349.80000113.5
504I41.1Very low42.1Very low167 Ų167133.2 Ų133.286%0.85680%0.803SS**  trans-136.9118.8140.6-62.3-175.8000107.3
505S35Very low41.1Very low99 Ų99130.8 Ų130.869%0.69280%0.8SS**  trans-70.7144.8176.832.40000113
506L41.3Very low39.8Very low169 Ų169134.5 Ų134.589%0.88581%0.808SS**  trans-160.6140.7141-105.9146.1000110
507D38.8Very low38.7Very low155 Ų155133 Ų13383%0.82980%0.801SS**  trans-73.3165.4-158.7-61.2-68000115.3
508G38.7Very low38.1Very low66 Ų66135.2 Ų135.268%0.6880%0.801SS**  trans161.948164.200000118.4
509T39.3Very low37.5Very low126 Ų126132.3 Ų132.377%0.77379%0.793SS**  trans47.9121.9138.1-9.90000121.7
510S39.8Very low37.3Very low101 Ų101134.4 Ų134.471%0.70680%0.798SS**  trans67.2136.1134.547.30000119
511S40.5Very low37.2Very low114 Ų114130.2 Ų130.280%0.79779%0.79SS**  cis-169.5146.29.317.70000108.7
512S34.2Very low37.1Very low107 Ų107129.7 Ų129.775%0.74879%0.787SS**  trans-54.2147.1172.952.20000115.1
513M40.5Very low36.9Very low198 Ų198130.1 Ų130.198%0.97579%0.785SS**  -153.3125129.2-82.9-153.7160.900111.5
514T33.5Very low37.1Very low141 Ų141131.4 Ų131.487%0.86578%0.778SS**  trans-91.5138.9171.429.30000111.5
515S38.5Very low36.8Very low113 Ų113129.5 Ų129.579%0.7977%0.77SS**  trans-167.5107.8149460000108.7
516Q35.8Very low36.9Very low185 Ų185131.1 Ų131.186%0.86478%0.775SS**  62.4106.791.2-83.9-170.4-0.700116.3
517S35.4Very low36.4Very low98 Ų98130.1 Ų130.169%0.68577%0.771SS**  59.7116.5128.170.40000120.3
518Q35.4Very low36.3Very low186 Ų186131.8 Ų131.887%0.86977%0.774SS**  168.6160.790.6-94.5-162.6-1500111.2
519P35.7Very low35.9Very low114 Ų114137.7 Ų137.774%0.7478%0.781SS**  trans-105.8153.8-167.638.3-28.6000113.6
520S34.4Very low35.8Very low105 Ų105138.2 Ų138.273%0.73478%0.784SS**  trans-175.2115.6151.343.80000112.3
521T33Very low35.3Very low128 Ų128142.9 Ų142.979%0.78579%0.786SS**  trans52.2126.9133.161.90000120.6
522V36.5Very low34.7Very low117 Ų117144.9 Ų144.971%0.70978%0.784SS**  159124.8108.5163.10000109.6
523N35.5Very low34.7Very low130 Ų130152.1 Ų152.170%0.69580%0.795SS**  trans52.1147152.7-68.814.7000119.3
524E36.4Very low34.2Very low140 Ų140147.9 Ų147.965%0.65479%0.786SS**  cis-171.7158.311.2-124.5169.1108.600106.1
525N35.1Very low34.2Very low128 Ų128145.9 Ų145.968%0.68478%0.783SS**  trans82.299145.3-62.2-16.2000120.9
526T36Very low34.1Very low132 Ų132147.6 Ų147.681%0.8179%0.789SS**  111.6119.3118.9-17.40000118.4
527D32Very low34.1Very low148 Ų148144.7 Ų144.779%0.79179%0.789SS**  trans-49.6140.6169.2-65.5-60.2000115.2
528Q35.5Very low34.3Very low191 Ų191143.9 Ų143.989%0.89380%0.796SS**  trans-126.791.4150.4-92.8-172.3-7.800110.5
529F31Very low34.1Very low189 Ų189140.1 Ų140.183%0.82979%0.79SS**  trans-80.8126.6152.9-124.8-95.2000107.8
530V36.5Very low34.1Very low137 Ų137142.5 Ų142.583%0.8380%0.795SS**  trans-115.9111.1168.2177.60000109.5
531R29.7Very low33.9Very low199 Ų199140.9 Ų140.975%0.75180%0.795SS**  trans-108.1137.4174.6177.1-174.3-101.6166.6-4.5109.3
532M29Very low33.9Very low156 Ų156145 Ų14577%0.76880%0.802SS**  trans40.6139154.9-68.3-165.7-11900121.8
533R33.4Very low33.6Very low259 Ų259148.1 Ų148.198%0.97781%0.809SS**  trans-147.1120.4137.4-93.9-177.9-171.1-178.82111.8
534S29.1Very low33.5Very low110 Ų110146.5 Ų146.577%0.76981%0.808SS**  trans-125.5125.3153.960.50000107.7
535A33.3Very low33.4Very low98 Ų98147.5 Ų147.581%0.8182%0.817SS**  trans-176.2122.1153.800000110.7
536T37.1Very low33.2Very low149 Ų149152.6 Ų152.691%0.91483%0.827SS**  trans-140104146.325.60000109.6
537S36.4Very low33.3Very low125 Ų125151.7 Ų151.787%0.87482%0.823SS**  trans9.6129.5149.7-156.50000121
538G38.6Very low33.4Very low81 Ų81150.7 Ų150.784%0.83582%0.822SS**  trans-155.998.1155.100000108.6
539S32.1Very low33.1Very low106 Ų106150.1 Ų150.174%0.74182%0.82SS**  trans-81.7139.9-178.9-166.20000111.1
540I36.3Very low33.3Very low165 Ų165147 Ų14785%0.84682%0.822SS**  trans171.5115.9132.6-82152.1000106.6
541G28.9Very low32.9Very low70 Ų70149.5 Ų149.572%0.72282%0.824SS**  trans-88.2160.1-176.600000114.2
542F32.4Very low33.2Very low215 Ų215145 Ų14594%0.94382%0.823SS**  trans-150.1127.9141.6-148.5-96.2000108.5
543E31.4Very low33.4Very low182 Ų182143.5 Ų143.585%0.8582%0.823SS**  trans-113.5130.7-170.5-173.3170.4178.100107.8
544S33.6Very low33.3Very low96 Ų96138.2 Ų138.267%0.67181%0.814SS**  trans-170.8105.5152.7-161.20000112.4
545L34.3Very low33.5Very low162 Ų162140.6 Ų140.685%0.84882%0.817SS**  trans63.1113.1132.6-73.2145.8000121.3
546R30.8Very low33.6Very low235 Ų235143.8 Ų143.889%0.88782%0.815SS**  trans-82.9156.6149.5-84-175.3-176169.21.2110.7
547P37.5Very low33.5Very low112 Ų112143.1 Ų143.173%0.72781%0.811SS**  -141.5136.6113.519.52.6000112.3
548T33.5Very low33.3Very low127 Ų127144.1 Ų144.178%0.77981%0.806SS**  109.314379.1-52.80000111.1
549E30.4Very low33.3Very low179 Ų179146.6 Ų146.684%0.83681%0.805SS**  trans-57.7157.4-172.1-62.7159.6120.200116.8
550S34.4Very low33.3Very low125 Ų125148.5 Ų148.587%0.87481%0.807SS**  -169.413812937.80000112.7
551Q29.1Very low33.4Very low189 Ų189147.4 Ų147.488%0.88380%0.802SS**  trans-72153.2175.3-67165.4-16.700112.6
552S34.7Very low33.7Very low105 Ų105153 Ų15373%0.73481%0.807SS**  trans174.6108.4137.334.10000110.6
553T34.5Very low33.8Very low124 Ų124151.4 Ų151.476%0.76180%0.799SS**  80110.8110.654.90000117.2
554D30.9Very low33.8Very low147 Ų147152.9 Ų152.979%0.78680%0.797SS**  32.3127.6128.8-56.1-31.3000120.1
555L33.9Very low33.7Very low160 Ų160154.3 Ų154.384%0.83880%0.796SS**  167143.294.9-145.676.2000111.8
556H33.6Very low33.9Very low166 Ų166154.2 Ų154.277%0.76979%0.791SS**  trans-27.5144.2166.3-81.1-98.1000118.6
557T35.1Very low33.9Very low134 Ų134148.7 Ų148.782%0.82278%0.784SS**  170.8143.399.832.60000114.6
558N34Very low33.7Very low146 Ų146150.4 Ų150.478%0.78179%0.792SS**  trans-29.4146.4163.4-76.7-54000117.1
559T37.2Very low33.9Very low133 Ų133148 Ų14882%0.81679%0.792SS**  174.8145.498.320.30000113.2
560D33.5Very low34.1Very low146 Ų146147.1 Ų147.178%0.78179%0.794SS**  trans-46.6162.6165.7-68.3-71.9000115.1
561I37.3Very low34.2Very low143 Ų143145.8 Ų145.873%0.73378%0.784SS**  156132.1123.3-79.4160.1000113.9
562K36.3Very low34.2Very low188 Ų188141.8 Ų141.882%0.81778%0.777SS**  trans70.1118.5154.3-82.8163.2-175.8173.60120
563K34Very low34.4Very low180 Ų180144.7 Ų144.778%0.78378%0.783SS**  61.711469.5-95.7-179-178.7170.40116.1
564R30.6Very low34.3Very low214 Ų214147.2 Ų147.281%0.80879%0.791SS**  95.4146124.8-111.4-175.4-158.1-163.13.9120.9
565L33.1Very low34.5Very low125 Ų125143.1 Ų143.165%0.65478%0.784SS**  trans82.2137.4162.2-86.475.2000115.3
566H36.9Very low34.6Very low160 Ų160144.1 Ų144.174%0.74179%0.789SS**  cis-155.1128.329.1-88-90.3000108.7
567T31.5Very low34.6Very low120 Ų120140.6 Ų140.674%0.73679%0.789SS**  27133.893.710.20000121.1
568T34.3Very low34.4Very low148 Ų148139.1 Ų139.191%0.90878%0.784SS**  trans98.8132.6154.358.30000121.7
569G37.7Very low34.5Very low75 Ų75139 Ų13977%0.77379%0.788SS**  trans128.271.4163.900000114.6
570N34Very low34.1Very low162 Ų162144 Ų14487%0.86679%0.792SS**  52.2125.691.9-102.59.6000118.4
571S35.1Very low34Very low97 Ų97141.5 Ų141.568%0.67879%0.786SS**  trans92.9103141.9-57.50000121.4
572S31.1Very low33.6Very low104 Ų104139.6 Ų139.673%0.72779%0.786SS**  55.9119.7126.362.20000121.6
573L37Very low33.4Very low166 Ų166138.3 Ų138.387%0.86979%0.787SS**  trans-176.694.6139.6-98.1154.5000107.5
574L32.4Very low33.1Very low177 Ų177135.9 Ų135.993%0.92779%0.792SS**  46.2115.295.5-86.2167.3000115.4
575G35.7Very low33.1Very low61 Ų61131.6 Ų131.663%0.62979%0.789SS**  trans169.689.2163.400000114.9
576L35.4Very low33Very low181 Ų181134.2 Ų134.295%0.94880%0.798SS**  trans61.8134.4136.7-60.5151000118.1
577A35.5Very low32.7Very low93 Ų93135 Ų13577%0.76980%0.802SS**  cis-158.6147.51900000110.8
578S30.7Very low32.7Very low103 Ų103138.4 Ų138.472%0.7281%0.81SS**  trans-82133.2168.7148.70000110.1
579V35.8Very low32.7Very low143 Ų143140.1 Ų140.187%0.86781%0.807SS**  trans-133.6113.9149.9179.20000109.2
580R27.7Very low32.6Very low237 Ų237142.7 Ų142.789%0.89480%0.802SS**  trans-122.9109.6175.1179.8-171-163-173.25.6105
581S31.2Very low32.7Very low94 Ų94141.7 Ų141.766%0.65780%0.797SS**  trans-177.6126151.164.30000112
582S29.3Very low32.7Very low104 Ų104144 Ų14473%0.72780%0.801SS**  61.9102.8128.5-45.50000118.9
583N33.3Very low32.9Very low160 Ų160147.5 Ų147.586%0.85681%0.806SS**  -171.4109.7114.1-92.6-16.1000111
584C26.4Very low32.9Very low129 Ų129144.5 Ų144.587%0.87280%0.799SS**  trans-116.378.4174.6178.90000107.1
585T30Very low33Very low124 Ų124140.5 Ų140.576%0.76179%0.786SS**  trans-168141.6167.4-0.10000107.6
586Q31.4Very low33Very low180 Ų180145.7 Ų145.784%0.84179%0.794SS**  trans92.869.5-179.1-56.5179.9-11.800116.9
587Q31.7Very low33Very low177 Ų177145 Ų14583%0.82779%0.789SS**  trans-155.444.8141.4-138.2101.131.600111.7
588H32.1Very low32.9Very low192 Ų192152 Ų15289%0.88980%0.796SS**SBendtrans-116.621.1179.3-131-55.7000113.4
589Q33.6Very low33Very low184 Ų184151.8 Ų151.886%0.8680%0.795SS**SBendtrans-123.211.3-170.1-122-179.4-17.700116
590I36Very low33Very low128 Ų128154.3 Ų154.366%0.65680%0.797SS**SBendtrans-106.7-6-174.6-63.7176.6000114.1
591N35Very low33.4Very low142 Ų142149.1 Ų149.176%0.75980%0.797SS**SBendtrans-107.119.2-176.6-83.60.9000116
592N35.7Very low33.7Very low145 Ų145153.9 Ų153.978%0.77581%0.809SS**SBendtrans-116.814.2178.2-102.810.5000114.9
593Q35.2Very low34.5Very low177 Ų177158.4 Ų158.483%0.82782%0.818SS**SBendtrans-113.7-0178.5-92.5-179.9-10.400114.9
594S36Very low34.8Very low103 Ų103158.2 Ų158.272%0.7282%0.817SS**SBendtrans-102.37.1-176.741.80000114.8
595S35.9Very low35.8Very low94 Ų94157.8 Ų157.866%0.65781%0.813SS**SBendtrans-120.415.1-177.257.20000115
596Q34.5Very low36.6Very low170 Ų170155.3 Ų155.379%0.79481%0.812SS**SBendtrans-114.111.7-179.6-109.2-176-14.900115.2
597I37.1Very low37Very low165 Ų165155.4 Ų155.485%0.84681%0.813SS**SBendtrans-112.417.3179.9-57.8174.5000111.5
598R33.3Very low37.5Very low241 Ų241156.3 Ų156.391%0.90981%0.814SS**SBendtrans-13652.3-174.6-153178.9-147.8166.56.6113.4
599S32.4Very low38.4Very low99 Ų99157.2 Ų157.269%0.69283%0.833SS**SBendtrans-167.268.9171.857.20000110.1
600Q35.1Very low38.6Very low196 Ų196155.9 Ų155.992%0.91683%0.832SS**  trans-176.990.6163.2-106.7168.322.200108.4
601S36.7Very low38.8Very low127 Ų127157.4 Ų157.489%0.88884%0.841SS**  trans165.483.2152.856.30000108.5
602E37.1Very low39Very low195 Ų195158.2 Ų158.291%0.91185%0.845SS**  trans-138.187.3169.5-157.8171.1155.800106
603E45.1Very low39.2Very low199 Ų199159 Ų15993%0.9385%0.85SS**  trans-139.5106.4163.7-81.8-170132.800107.4
604D41Very low39.4Very low156 Ų156157.9 Ų157.983%0.83485%0.851SS**  trans-74.3179.3160.2-130-3.3000108.8
605P46.2Very low39.6Very low119 Ų119161.5 Ų161.577%0.77386%0.86SS**  cis-137.1-178.3-6.936.7-16.4000113.9
606G48.2Very low39.9Very low73 Ų73166.4 Ų166.475%0.75387%0.874SS**  trans144.4113.915100000117.6
607E39.1Very low40.3Very low181 Ų181166.1 Ų166.185%0.84688%0.88SS**  trans-48.8148.8163.8-76.9169.7117.200113.7
608F41.5Very low40.6Very low196 Ų196166.2 Ų166.286%0.8688%0.883SS**  176.2141.2113.8-104.1-82.7000111.8
609V51.4Low41.2Very low212 Ų212159.4 Ų159.4100%1.28588%0.881SS**  trans90.30176.4-165.60000117.1

Retrieved 609 of 609 residues in 783.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).