A0A087XAC7_POEFO Loading...

Receptor activity-modifying protein 1

Accessory protein that interacts with and modulates the function of G-protein coupled receptors including calcitonin gene-related peptide type 1 receptor (CALCRL) and calcitonin receptor (CALCR). Required for the transport of CALCRL to the plasma membrane. Together with CALCRL, form the receptor complex for the calcitonin gene-related peptides CGRP1/CALCA and CGRP2/CALCB. Together with CALCR, form the AMYR1 receptor complex for amylin/IAPP and CGRP1/CALCA.

AlphaFold DB , UniProt , Accession A0A087XAC7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 121 aa.

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

 

Download Structure   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
1C82.7Confident94.1Very high73 Ų7365.2 Ų65.249%0.49336%0.357SS..  0155.70-104.20000109.7Y5 C55 M61C1-Y5 HydrophobicContact CB-CD1 4.14Å; C1-Y5 HydrophobicContact CB-CG 4.16Å; C1-Y5 WeakPolarHBondContact SG-CB 3.4Å; C1-C55 WeakPolarHBondContact CA-SG 3.45Å; C1-C55 HydrophobicContact CB-CB 3.83Å; C1-C55 WeakPolarHBondContact CB-SG 3.43Å; C1-C55 PolarHBondContact N-SG 2.64Å; C1-C55 WeakPolarHBondContact SG-CB 3.49Å; C1-C55 CovalentContact SG-SG 2Å; C1-C55 PolarHBondContact SG-SG 3.43Å; C1-M61 HydrophobicContact CB-CE 3.31Å; C1-M61 HydrophobicContact CB-SD 4.27Å; C1-M61 WeakPolarHBondContact O-CE 3.4Å
2G90.6Very high94.3Very high38 Ų3870.7 Ų70.739%0.39238%0.375SS..  trans-143.2-164.9177.900000110.8H4 Y5G2-H4 PolarHBondContact O-N 2.86Å; G2-Y5 WeakPolarHBondContact O-CB 3.46Å; G2-Y5 PolarHBondContact O-N 3.01Å
3S92.1Very high94.6Very high97 Ų9765.4 Ų65.468%0.67835%0.347SS*.Hα-helixtrans-52.2-29.5-175.954.60000114.9Y5 E6 F7S3-Y5 VanDerWaalsContact C-N 3.31Å; S3-Y5 PolarHBondContact O-N 3.47Å; S3-E6 PolarHBondContact O-N 2.94Å; S3-F7 WeakPolarHBondContact O-CB 3.12Å; S3-F7 PolarHBondContact O-N 3.08Å
4H94.5Very high94.9Very high117 Ų11764.2 Ų64.254%0.54234%0.341SS..Hα-helixtrans-62.4-37.2174.6-173.1-75.5000112.7G2 V8 M53G2-H4 PolarHBondContact O-N 2.86Å; H4-V8 WeakPolarHBondContact O-CG1 3.06Å; H4-V8 WeakPolarHBondContact O-CG2 3.32Å; H4-V8 PolarHBondContact O-N 3.02Å; H4-V8 VanDerWaalsContact O-N 3.13Å; H4-M53 HydrophobicContact CB-CE 4.05Å; H4-M53 WeakPolarHBondContact ND1-CE 3.49Å
5Y96.1Very high95.1Very high0 Ų064.9 Ų64.90%035%0.348CS..Hα-helixtrans-67.1-44.4176.2174.8-112.1000111.4C1 G2 S3 F7 V8 I9 T46 L49 A50 M53 M61 V62C1-Y5 HydrophobicContact CB-CD1 4.14Å; C1-Y5 HydrophobicContact CB-CG 4.16Å; C1-Y5 WeakPolarHBondContact SG-CB 3.4Å; G2-Y5 WeakPolarHBondContact O-CB 3.46Å; G2-Y5 PolarHBondContact O-N 3.01Å; S3-Y5 VanDerWaalsContact C-N 3.31Å; S3-Y5 PolarHBondContact O-N 3.47Å; Y5-F7 VanDerWaalsContact C-N 3.33Å; Y5-F7 PolarHBondContact O-N 3.13Å; Y5-V8 HydrophobicContact CD2-CG2 4.39Å; Y5-V8 WeakPolarHBondContact O-CG2 3.37Å; Y5-V8 PolarHBondContact O-N 3.34Å; Y5-I9 HydrophobicContact CD2-CG2 4.06Å; Y5-I9 HydrophobicContact CE1-CD1 4.2Å; Y5-I9 HydrophobicContact CE1-CG2 4.12Å; Y5-I9 HydrophobicContact CE2-CG2 3.54Å; Y5-I9 WeakPolarHBondContact O-CG1 3.45Å; Y5-I9 WeakPolarHBondContact O-CG2 2.82Å; Y5-I9 PolarHBondContact O-N 3.5Å; Y5-T46 PolarHBondContact OH-O 3.35Å; Y5-L49 HydrophobicContact CE2-CB 4.09Å; Y5-A50 HydrophobicContact CE2-CB 3.75Å; Y5-M53 HydrophobicContact CD2-SD 4.08Å; Y5-M61 HydrophobicContact CD1-CB 4.14Å; Y5-M61 HydrophobicContact CD1-CE 4.45Å; Y5-M61 HydrophobicContact CD1-SD 4.3Å; Y5-M61 HydrophobicContact CE1-CB 4.39Å; Y5-V62 HydrophobicContact CE1-CB 4.27Å
6E95.3Very high95.3Very high76 Ų7668.6 Ų68.636%0.35536%0.356SS..Hα-helixtrans-58.1-45.1175.9-175.1176.2-169.500111.7S3 V8 I9 E10S3-E6 PolarHBondContact O-N 2.94Å; E6-V8 PolarHBondContact O-N 3.3Å; E6-I9 WeakPolarHBondContact O-CG1 3.44Å; E6-I9 PolarHBondContact O-N 3.03Å; E6-E10 PolarHBondContact O-N 3.1Å
7F96Very high95.4Very high116 Ų11664.6 Ų64.651%0.50934%0.335SS..Hα-helixtrans-59.9-48.4175.5177.4-100.9000112.3S3 Y5 I9 E10 E11S3-F7 WeakPolarHBondContact O-CB 3.12Å; S3-F7 PolarHBondContact O-N 3.08Å; Y5-F7 VanDerWaalsContact C-N 3.33Å; Y5-F7 PolarHBondContact O-N 3.13Å; F7-I9 PolarHBondContact O-N 3.42Å; F7-E10 PolarHBondContact O-N 3.35Å; F7-E11 HydrophobicContact CE1-CB 4.47Å; F7-E11 HydrophobicContact CZ-CB 4.47Å; F7-E11 HydrophobicContact CZ-CG 4.42Å; F7-E11 WeakPolarHBondContact CZ-OE2 3.27Å; F7-E11 WeakPolarHBondContact O-CB 3.04Å; F7-E11 PolarHBondContact O-N 3.49Å
8V96.8Very high95.6Very high15 Ų1569.1 Ų69.19%0.09135%0.347CS..Hα-helixtrans-70.3-32.1-177-62.80000113.3H4 Y5 E6 E10 F12 L49 M53H4-V8 WeakPolarHBondContact O-CG1 3.06Å; H4-V8 WeakPolarHBondContact O-CG2 3.32Å; H4-V8 PolarHBondContact O-N 3.02Å; H4-V8 VanDerWaalsContact O-N 3.13Å; Y5-V8 HydrophobicContact CD2-CG2 4.39Å; Y5-V8 WeakPolarHBondContact O-CG2 3.37Å; Y5-V8 PolarHBondContact O-N 3.34Å; E6-V8 PolarHBondContact O-N 3.3Å; V8-E10 VanDerWaalsContact C-N 3.34Å; V8-F12 HydrophobicContact CB-CD2 4.09Å; V8-F12 HydrophobicContact CB-CE2 4.45Å; V8-F12 HydrophobicContact CG1-CE2 4.4Å; V8-F12 WeakPolarHBondContact O-CB 3.29Å; V8-F12 WeakPolarHBondContact O-CD2 3.26Å; V8-F12 PolarHBondContact O-N 2Å; V8-L49 HydrophobicContact CB-CD1 4.22Å; V8-L49 HydrophobicContact CG2-CD1 3.98Å; V8-M53 HydrophobicContact CG2-SD 4.03Å
9I97.8Very high95.6Very high1 Ų169.9 Ų69.91%0.00535%0.352CS..Iπ-helixtrans-68.4-35.217561.9178.2000111.5Y5 E6 F7 C13 L14 T46 L49 F65Y5-I9 HydrophobicContact CD2-CG2 4.06Å; Y5-I9 HydrophobicContact CE1-CD1 4.2Å; Y5-I9 HydrophobicContact CE1-CG2 4.12Å; Y5-I9 HydrophobicContact CE2-CG2 3.54Å; Y5-I9 WeakPolarHBondContact O-CG1 3.45Å; Y5-I9 WeakPolarHBondContact O-CG2 2.82Å; Y5-I9 PolarHBondContact O-N 3.5Å; E6-I9 WeakPolarHBondContact O-CG1 3.44Å; E6-I9 PolarHBondContact O-N 3.03Å; F7-I9 PolarHBondContact O-N 3.42Å; I9-C13 WeakPolarHBondContact O-CA 3.48Å; I9-C13 VanDerWaalsContact O-CB 3.3Å; I9-C13 WeakPolarHBondContact O-CB 3.41Å; I9-C13 PolarHBondContact O-N 3.43Å; I9-C13 VanDerWaalsContact O-N 3.1Å; I9-L14 PolarHBondContact O-N 3.09Å; I9-T46 HydrophobicContact CB-CG2 4.33Å; I9-T46 HydrophobicContact CG2-CG2 4.09Å; I9-L49 HydrophobicContact CG2-CD1 4.18Å; I9-F65 HydrophobicContact CB-CE2 4.36Å; I9-F65 HydrophobicContact CD1-CB 3.77Å; I9-F65 HydrophobicContact CD1-CD1 4.4Å; I9-F65 HydrophobicContact CD1-CD2 3.65Å; I9-F65 HydrophobicContact CD1-CE2 4.3Å; I9-F65 HydrophobicContact CD1-CG 3.69Å; I9-F65 HydrophobicContact CG1-CD2 3.93Å; I9-F65 HydrophobicContact CG1-CE2 4.14Å; I9-F65 HydrophobicContact CG1-CG 4.42Å
10E96.3Very high95.7Very high81 Ų8166.5 Ų66.538%0.37934%0.335SS..Iπ-helixtrans-69.5-49.7173.8-72-167.2167.600111.5E6 F7 V8 F12 L14 T15 F65E6-E10 PolarHBondContact O-N 3.1Å; F7-E10 PolarHBondContact O-N 3.35Å; V8-E10 VanDerWaalsContact C-N 3.34Å; E10-F12 PolarHBondContact O-N 2.98Å; E10-L14 WeakPolarHBondContact O-CB 3.48Å; E10-T15 PolarHBondContact O-N 3.44Å; E10-T15 PolarHBondContact O-OG1 3.46Å; E10-F65 HydrophobicContact CG-CE2 4.45Å
11E97.1Very high95.7Very high103 Ų10363.5 Ų63.548%0.48132%0.32SS..Iπ-helixtrans-62.7-45.6-176-169.180.6-166.400111.8F7 T15F7-E11 HydrophobicContact CE1-CB 4.47Å; F7-E11 HydrophobicContact CZ-CB 4.47Å; F7-E11 HydrophobicContact CZ-CG 4.42Å; F7-E11 WeakPolarHBondContact CZ-OE2 3.27Å; F7-E11 WeakPolarHBondContact O-CB 3.04Å; F7-E11 PolarHBondContact O-N 3.49Å; E11-T15 WeakPolarHBondContact O-CB 3.09Å; E11-T15 PolarHBondContact O-OG1 3.39Å
12F96.7Very high96.3Very high131 Ų13166 Ų6658%0.57532%0.324SS*.Iπ-helixtrans-98.3-55.5-172.9-66.5-77.6000113V8 E10 R16V8-F12 HydrophobicContact CB-CD2 4.09Å; V8-F12 HydrophobicContact CB-CE2 4.45Å; V8-F12 HydrophobicContact CG1-CE2 4.4Å; V8-F12 WeakPolarHBondContact O-CB 3.29Å; V8-F12 WeakPolarHBondContact O-CD2 3.26Å; V8-F12 PolarHBondContact O-N 2Å; E10-F12 PolarHBondContact O-N 2.98Å; F12-R16 WeakPolarHBondContact O-CB 3.44Å; F12-R16 PolarHBondContact O-N 2.92Å
13C98.3Very high96.5Very high2 Ų271 Ų711%0.01434%0.337CS..Iπ-helixtrans-76.4-46.9-170.7-52.60000111.7I9 R16 F17 L42 C45 T46 L49I9-C13 WeakPolarHBondContact O-CA 3.48Å; I9-C13 VanDerWaalsContact O-CB 3.3Å; I9-C13 WeakPolarHBondContact O-CB 3.41Å; I9-C13 PolarHBondContact O-N 3.43Å; I9-C13 VanDerWaalsContact O-N 3.1Å; C13-R16 PolarHBondContact O-N 3.43Å; C13-F17 WeakPolarHBondContact O-CB 3.37Å; C13-F17 PolarHBondContact O-N 2.92Å; C13-L42 HydrophobicContact CB-CD1 3.74Å; C13-C45 WeakPolarHBondContact CA-SG 3.18Å; C13-C45 HydrophobicContact CB-CB 3.76Å; C13-C45 WeakPolarHBondContact CB-SG 3.49Å; C13-C45 WeakPolarHBondContact SG-CB 3.42Å; C13-C45 CovalentContact SG-SG 2.04Å; C13-C45 PolarHBondContact SG-SG 3.1Å; C13-T46 HydrophobicContact CB-CG2 4.29Å; C13-L49 WeakPolarHBondContact SG-CD1 3.4Å
14L98.3Very high96.6Very high49 Ų4967.7 Ų67.726%0.25731%0.312SS..Iπ-helixtrans-69.1-38.4-179.7-175.361.7000112.2I9 E10 F17 R18 F65 V69I9-L14 PolarHBondContact O-N 3.09Å; E10-L14 WeakPolarHBondContact O-CB 3.48Å; L14-F17 HydrophobicContact CD1-CD1 4.45Å; L14-F17 PolarHBondContact O-N 3.39Å; L14-R18 VanDerWaalsContact O-CB 3.3Å; L14-R18 WeakPolarHBondContact O-CB 3.43Å; L14-R18 PolarHBondContact O-N 3.2Å; L14-F65 HydrophobicContact CB-CE2 3.83Å; L14-F65 HydrophobicContact CB-CZ 3.93Å; L14-F65 HydrophobicContact CD1-CE2 4.44Å; L14-F65 HydrophobicContact CD1-CZ 4.33Å; L14-F65 HydrophobicContact CD2-CE2 4.26Å; L14-F65 HydrophobicContact CG-CE2 4.41Å; L14-V69 HydrophobicContact CD1-CG2 3.93Å
15T97.9Very high96.5Very high74 Ų7467.6 Ų67.645%0.45432%0.316SS..Hα-helixtrans-59.4-46.7175.1-60.70000111.3E10 E11 R18 L19E10-T15 PolarHBondContact O-N 3.44Å; E10-T15 PolarHBondContact O-OG1 3.46Å; E11-T15 WeakPolarHBondContact O-CB 3.09Å; E11-T15 PolarHBondContact O-OG1 3.39Å; T15-R18 PolarHBondContact O-N 3.49Å; T15-L19 PolarHBondContact O-N 3.39Å
16R97.8Very high96.2Very high124 Ų12473.9 Ų73.947%0.46835%0.345SS..Hα-helixtrans-61.4-50.9176.3179.759.8-178.9134.414.4111.3F12 C13 R18 L19 D20F12-R16 WeakPolarHBondContact O-CB 3.44Å; F12-R16 PolarHBondContact O-N 2.92Å; C13-R16 PolarHBondContact O-N 3.43Å; R16-R18 PolarHBondContact O-N 3.28Å; R16-L19 WeakPolarHBondContact O-CB 3.36Å; R16-L19 PolarHBondContact O-N 3.01Å; R16-D20 IonicContact CZ-OD1 2.9Å; R16-D20 IonicContact CZ-OD2 3.73Å; R16-D20 IonicContact NE-OD1 3.65Å; R16-D20 IonicContact NE-OD2 3.7Å; R16-D20 IonicContact NH1-OD1 2.92Å; R16-D20 PolarHBondContact NH1-OD1 2.91Å; R16-D20 IonicContact NH2-OD1 2.84Å; R16-D20 PolarHBondContact NH2-OD1 3.43Å; R16-D20 IonicContact NH2-OD2 3.89Å; R16-D20 PolarHBondContact O-N 3.49Å
17F98.1Very high96Very high2 Ų275.1 Ų75.11%0.00936%0.362CS..Hα-helixtrans-58.1-36.4178.5-178.7-103.7000112.8C13 L14 L19 D20 M21 F38 L42 V69 Y73 F74C13-F17 WeakPolarHBondContact O-CB 3.37Å; C13-F17 PolarHBondContact O-N 2.92Å; L14-F17 HydrophobicContact CD1-CD1 4.45Å; L14-F17 PolarHBondContact O-N 3.39Å; F17-L19 VanDerWaalsContact C-N 3.34Å; F17-L19 PolarHBondContact O-N 3.02Å; F17-D20 PolarHBondContact O-N 3.47Å; F17-M21 HydrophobicContact CD1-CG 3.94Å; F17-M21 HydrophobicContact CD2-CG 4.32Å; F17-M21 HydrophobicContact CE1-CG 3.52Å; F17-M21 HydrophobicContact CE1-SD 4.27Å; F17-M21 HydrophobicContact CE2-CG 3.94Å; F17-M21 HydrophobicContact CE2-SD 4.08Å; F17-M21 HydrophobicContact CG-CG 4.33Å; F17-M21 HydrophobicContact CZ-CG 3.51Å; F17-M21 HydrophobicContact CZ-SD 3.7Å; F17-M21 WeakPolarHBondContact O-CB 3.1Å; F17-M21 VanDerWaalsContact O-CG 3.23Å; F17-M21 WeakPolarHBondContact O-CG 3.27Å; F17-M21 PolarHBondContact O-N 3.14Å; F17-F38 HydrophobicContact CD2-CB 4.1Å; F17-F38 HydrophobicContact CE2-CB 3.96Å; F17-L42 HydrophobicContact CB-CB 4.41Å; F17-L42 HydrophobicContact CB-CD1 4.04Å; F17-L42 HydrophobicContact CB-CD2 4.26Å; F17-L42 HydrophobicContact CB-CG 4.46Å; F17-L42 HydrophobicContact CD1-CD2 3.99Å; F17-L42 HydrophobicContact CD2-CB 3.89Å; F17-L42 HydrophobicContact CD2-CD2 3.81Å; F17-L42 HydrophobicContact CD2-CG 4.37Å; F17-L42 HydrophobicContact CE1-CD2 4.27Å; F17-L42 HydrophobicContact CE2-CD2 4.11Å; F17-L42 HydrophobicContact CG-CB 4.32Å; F17-L42 HydrophobicContact CG-CD1 4.44Å; F17-L42 HydrophobicContact CG-CD2 3.75Å; F17-L42 HydrophobicContact CG-CG 4.39Å; F17-L42 HydrophobicContact CZ-CD2 4.33Å; F17-V69 HydrophobicContact CD1-CG1 4.41Å; F17-V69 HydrophobicContact CE1-CG1 3.74Å; F17-V69 HydrophobicContact CZ-CG1 4.23Å; F17-Y73 HydrophobicContact CD1-CD2 4.44Å; F17-Y73 HydrophobicContact CD1-CE2 4.07Å; F17-Y73 AromaticContact CE1-CD2 3.72Å; F17-Y73 HydrophobicContact CE1-CD2 3.72Å; F17-Y73 AromaticContact CE1-CE2 3.8Å; F17-Y73 HydrophobicContact CE1-CE2 3.8Å; F17-Y73 HydrophobicContact CE1-CG 4.17Å; F17-F74 HydrophobicContact CZ-CE2 4.2Å; F17-F74 HydrophobicContact CZ-CZ 4.05Å
18R97.7Very high95.8Very high144 Ų14472.7 Ų72.754%0.54335%0.352SS..Hα-helixtrans-63.3-40175.8-178.6177.4-175.81610.6112L14 T15 R16 Q22L14-R18 VanDerWaalsContact O-CB 3.3Å; L14-R18 WeakPolarHBondContact O-CB 3.43Å; L14-R18 PolarHBondContact O-N 3.2Å; T15-R18 PolarHBondContact O-N 3.49Å; R16-R18 PolarHBondContact O-N 3.28Å; R18-Q22 VanDerWaalsContact O-CG 3.27Å; R18-Q22 WeakPolarHBondContact O-CG 3.26Å; R18-Q22 PolarHBondContact O-N 3.13Å; R18-Q22 VanDerWaalsContact O-N 3.13Å
19L97.1Very high95.7Very high85 Ų8573.9 Ų73.945%0.44536%0.355SS..Hα-helixtrans-65.7-45.3175.8-65.9171.6000110.4T15 R16 F17 M21 Q22 E23T15-L19 PolarHBondContact O-N 3.39Å; R16-L19 WeakPolarHBondContact O-CB 3.36Å; R16-L19 PolarHBondContact O-N 3.01Å; F17-L19 VanDerWaalsContact C-N 3.34Å; F17-L19 PolarHBondContact O-N 3.02Å; L19-M21 VanDerWaalsContact C-N 3.32Å; L19-M21 PolarHBondContact O-N 3.3Å; L19-Q22 WeakPolarHBondContact O-CB 3.49Å; L19-Q22 PolarHBondContact O-N 3.45Å; L19-E23 PolarHBondContact O-N 2.91Å
20D96.6Very high95.4Very high2 Ų277 Ų771%0.01138%0.376CS..Hα-helixtrans-61.7-41.1178-59.7-38.7000111.6R16 F17 Q22 E23 F38R16-D20 IonicContact CZ-OD1 2.9Å; R16-D20 IonicContact CZ-OD2 3.73Å; R16-D20 IonicContact NE-OD1 3.65Å; R16-D20 IonicContact NE-OD2 3.7Å; R16-D20 IonicContact NH1-OD1 2.92Å; R16-D20 PolarHBondContact NH1-OD1 2.91Å; R16-D20 IonicContact NH2-OD1 2.84Å; R16-D20 PolarHBondContact NH2-OD1 3.43Å; R16-D20 IonicContact NH2-OD2 3.89Å; R16-D20 PolarHBondContact O-N 3.49Å; F17-D20 PolarHBondContact O-N 3.47Å; D20-Q22 VanDerWaalsContact C-N 3.25Å; D20-Q22 PolarHBondContact O-N 3.48Å; D20-E23 WeakPolarHBondContact O-CB 3.38Å; D20-E23 PolarHBondContact O-N 3.47Å; D20-F38 HydrophobicContact CB-CB 4.11Å; D20-F38 HydrophobicContact CB-CD1 3.67Å; D20-F38 HydrophobicContact CB-CD2 3.92Å; D20-F38 HydrophobicContact CB-CE1 3.97Å; D20-F38 HydrophobicContact CB-CE2 4.19Å; D20-F38 HydrophobicContact CB-CG 3.64Å; D20-F38 HydrophobicContact CB-CZ 4.21Å
21M96.2Very high95.2Very high3 Ų374.9 Ų74.92%0.01537%0.37CS..Hα-helixtrans-70.6-16.5176.4-69.8-63.1-67.900114.1F17 L19 L24 W29 T35 Y73 F74F17-M21 HydrophobicContact CD1-CG 3.94Å; F17-M21 HydrophobicContact CD2-CG 4.32Å; F17-M21 HydrophobicContact CE1-CG 3.52Å; F17-M21 HydrophobicContact CE1-SD 4.27Å; F17-M21 HydrophobicContact CE2-CG 3.94Å; F17-M21 HydrophobicContact CE2-SD 4.08Å; F17-M21 HydrophobicContact CG-CG 4.33Å; F17-M21 HydrophobicContact CZ-CG 3.51Å; F17-M21 HydrophobicContact CZ-SD 3.7Å; F17-M21 WeakPolarHBondContact O-CB 3.1Å; F17-M21 VanDerWaalsContact O-CG 3.23Å; F17-M21 WeakPolarHBondContact O-CG 3.27Å; F17-M21 PolarHBondContact O-N 3.14Å; L19-M21 VanDerWaalsContact C-N 3.32Å; L19-M21 PolarHBondContact O-N 3.3Å; M21-L24 HydrophobicContact SD-CD1 4.43Å; M21-W29 HydrophobicContact CE-CB 4.15Å; M21-W29 HydrophobicContact CE-CD2 3.93Å; M21-W29 HydrophobicContact CE-CG 3.57Å; M21-W29 PolarHBondContact O-NE1 2.73Å; M21-T35 HydrophobicContact CE-CG2 4.26Å; M21-T35 HydrophobicContact SD-CG2 4.12Å; M21-Y73 HydrophobicContact CB-CD1 4.18Å; M21-Y73 HydrophobicContact CB-CE1 3.89Å; M21-Y73 HydrophobicContact CE-CD1 3.8Å; M21-Y73 HydrophobicContact CE-CG 4.16Å; M21-Y73 HydrophobicContact CG-CD1 4.18Å; M21-Y73 HydrophobicContact CG-CE1 4.18Å; M21-F74 HydrophobicContact CE-CE1 4.17Å; M21-F74 HydrophobicContact CE-CZ 4.23Å
22Q95.4Very high94.9Very high127 Ų12775.5 Ų75.559%0.59337%0.368SS*.Hα-helixtrans-81.3-19.7172.9-78.7173.9-19.400112.6R18 L19 D20R18-Q22 VanDerWaalsContact O-CG 3.27Å; R18-Q22 WeakPolarHBondContact O-CG 3.26Å; R18-Q22 PolarHBondContact O-N 3.13Å; R18-Q22 VanDerWaalsContact O-N 3.13Å; L19-Q22 WeakPolarHBondContact O-CB 3.49Å; L19-Q22 PolarHBondContact O-N 3.45Å; D20-Q22 VanDerWaalsContact C-N 3.25Å; D20-Q22 PolarHBondContact O-N 3.48Å
23E94.7Very high94.6Very high141 Ų14177.6 Ų77.666%0.65938%0.38SS*.SBendtrans-73.3-18.8173.1-61.6-178.5-172.900111.9L19 D20L19-E23 PolarHBondContact O-N 2.91Å; D20-E23 WeakPolarHBondContact O-CB 3.38Å; D20-E23 PolarHBondContact O-N 3.47Å
24L93.9Very high94.3Very high28 Ų2880.3 Ų80.315%0.14739%0.394CS..SBendtrans-98.1142.8176.7-62.8178.3000111.8M21 Q28 D34 T35 F38M21-L24 HydrophobicContact SD-CD1 4.43Å; L24-Q28 HydrophobicContact CB-CB 4.48Å; L24-D34 HydrophobicContact CD1-CB 4.26Å; L24-D34 HydrophobicContact CD2-CB 4.31Å; L24-T35 HydrophobicContact CD1-CG2 3.78Å; L24-F38 HydrophobicContact CD1-CD2 4.01Å; L24-F38 HydrophobicContact CD1-CE2 3.72Å; L24-F38 HydrophobicContact CD2-CE2 4.42Å; L24-F38 HydrophobicContact CG-CE2 3.93Å
25D92.5Very high94.1Very high116 Ų11678 Ų7862%0.6238%0.383SS*.  trans-65.2146.4165.8-83.2-29.1000110.3S27 Q28D25-S27 PolarHBondContact O-N 3.35Å; D25-S27 VanDerWaalsContact O-N 3.08Å; D25-Q28 HydrophobicContact CB-CG 4.35Å; D25-Q28 WeakPolarHBondContact O-CA 3.47Å; D25-Q28 WeakPolarHBondContact O-CB 3.37Å; D25-Q28 PolarHBondContact O-N 3.35Å
26Q90.8Very high93.9Very high131 Ų13175.8 Ų75.861%0.61237%0.371SS*.G310 helixtrans-59.4-26.7-179.3-168.8173.66.800113.1Q28 W29Q26-Q28 PolarHBondContact O-N 3.31Å; Q26-W29 HydrophobicContact CB-CD2 4.39Å; Q26-W29 HydrophobicContact CB-CZ2 4.43Å; Q26-W29 HydrophobicContact CG-CD2 3.79Å; Q26-W29 HydrophobicContact CG-CE3 3.67Å; Q26-W29 HydrophobicContact CG-CG 4.48Å; Q26-W29 HydrophobicContact CG-CH2 4Å; Q26-W29 HydrophobicContact CG-CZ2 4.08Å; Q26-W29 HydrophobicContact CG-CZ3 3.8Å; Q26-W29 WeakPolarHBondContact O-CB 3.31Å; Q26-W29 PolarHBondContact O-N 3.01Å
27S89.8Confident93.8Very high102 Ų10276.1 Ų76.171%0.71338%0.376SS*.G310 helixtrans-63.7-26.6173.556.40000112.9D25D25-S27 PolarHBondContact O-N 3.35Å; D25-S27 VanDerWaalsContact O-N 3.08Å
28Q92.8Very high93.8Very high66 Ų6677.4 Ų77.431%0.30838%0.382SS..G310 helixtrans-88-8.8-178.5-59.2-180-83.100113L24 D25 Q26 C30 S31L24-Q28 HydrophobicContact CB-CB 4.48Å; D25-Q28 HydrophobicContact CB-CG 4.35Å; D25-Q28 WeakPolarHBondContact O-CA 3.47Å; D25-Q28 WeakPolarHBondContact O-CB 3.37Å; D25-Q28 PolarHBondContact O-N 3.35Å; Q26-Q28 PolarHBondContact O-N 3.31Å; Q28-C30 PolarHBondContact O-N 2.82Å; Q28-S31 VanDerWaalsContact O-CB 3.27Å; Q28-S31 WeakPolarHBondContact O-CB 3.41Å; Q28-S31 PolarHBondContact O-N 3.25Å
29W93.9Very high93.8Very high39 Ų3972.4 Ų72.415%0.14836%0.363CS..G310 helixtrans-58.6-24.5179.8-68.73000113.3M21 Q26 Y73 F74M21-W29 HydrophobicContact CE-CB 4.15Å; M21-W29 HydrophobicContact CE-CD2 3.93Å; M21-W29 HydrophobicContact CE-CG 3.57Å; M21-W29 PolarHBondContact O-NE1 2.73Å; Q26-W29 HydrophobicContact CB-CD2 4.39Å; Q26-W29 HydrophobicContact CB-CZ2 4.43Å; Q26-W29 HydrophobicContact CG-CD2 3.79Å; Q26-W29 HydrophobicContact CG-CE3 3.67Å; Q26-W29 HydrophobicContact CG-CG 4.48Å; Q26-W29 HydrophobicContact CG-CH2 4Å; Q26-W29 HydrophobicContact CG-CZ2 4.08Å; Q26-W29 HydrophobicContact CG-CZ3 3.8Å; Q26-W29 WeakPolarHBondContact O-CB 3.31Å; Q26-W29 PolarHBondContact O-N 3.01Å; W29-Y73 HydrophobicContact CD2-CD1 4.31Å; W29-Y73 HydrophobicContact CE3-CD1 4.22Å; W29-Y73 AromaticContact CH2-CD1 3.78Å; W29-Y73 HydrophobicContact CH2-CD1 3.78Å; W29-Y73 HydrophobicContact CH2-CE1 4.21Å; W29-Y73 AromaticContact CZ2-CD1 3.89Å; W29-Y73 HydrophobicContact CZ2-CD1 3.89Å; W29-Y73 HydrophobicContact CZ2-CE1 4.23Å; W29-Y73 AromaticContact CZ3-CD1 3.95Å; W29-Y73 HydrophobicContact CZ3-CD1 3.95Å; W29-F74 VanDerWaalsContact O-CD1 3.23Å; W29-F74 WeakPolarHBondContact O-CD1 3.38Å; W29-F74 WeakPolarHBondContact O-CE1 3.06Å
30C92.4Very high93.8Very high67 Ų6774.7 Ų74.745%0.45337%0.372SS..G310 helixtrans-90.8-2.9176.6-59.30000114.5Q28 W32 C77Q28-C30 PolarHBondContact O-N 2.82Å; C30-W32 PolarHBondContact O-N 3.24Å; C30-C77 WeakPolarHBondContact CA-SG 3.27Å; C30-C77 HydrophobicContact CB-CB 3.74Å; C30-C77 WeakPolarHBondContact CB-SG 2.97Å; C30-C77 WeakPolarHBondContact SG-CA 3.29Å; C30-C77 WeakPolarHBondContact SG-CB 3.45Å; C30-C77 CovalentContact SG-SG 2.05Å; C30-C77 PolarHBondContact SG-SG 2.88Å
31S91.4Very high93.9Very high36 Ų3678.3 Ų78.325%0.25239%0.388SS..  trans-79.8111.2171.3179.60000109.2Q28 E33 D34 T35Q28-S31 VanDerWaalsContact O-CB 3.27Å; Q28-S31 WeakPolarHBondContact O-CB 3.41Å; Q28-S31 PolarHBondContact O-N 3.25Å; S31-E33 VanDerWaalsContact C-N 3.28Å; S31-D34 WeakPolarHBondContact CB-OD2 3.48Å; S31-D34 PolarHBondContact O-N 2.82Å; S31-D34 VanDerWaalsContact OG-CG 3.26Å; S31-D34 PolarHBondContact OG-N 3.19Å; S31-D34 PolarHBondContact OG-OD2 3.05Å; S31-T35 PolarHBondContact O-N 3.08Å; S31-T35 VanDerWaalsContact O-N 3.13Å; S31-T35 PolarHBondContact O-OG1 3.05Å
32W89.9Confident94Very high116 Ų11678.3 Ų78.344%0.43939%0.389SS..Hα-helixtrans-66.9-33.7175.9-179.1-115.1000111.5C30 D34 T35 A36 Y39 R82C30-W32 PolarHBondContact O-N 3.24Å; W32-D34 VanDerWaalsContact C-N 3.28Å; W32-D34 PolarHBondContact O-N 2.97Å; W32-T35 PolarHBondContact O-N 2.82Å; W32-A36 HydrophobicContact CD2-CB 3.94Å; W32-A36 HydrophobicContact CE3-CB 4.32Å; W32-A36 HydrophobicContact CG-CB 4.46Å; W32-A36 HydrophobicContact CH2-CB 4.14Å; W32-A36 HydrophobicContact CZ2-CB 3.72Å; W32-A36 HydrophobicContact CZ3-CB 4.42Å; W32-A36 WeakPolarHBondContact O-CA 3.05Å; W32-A36 WeakPolarHBondContact O-CB 3.41Å; W32-A36 PolarHBondContact O-N 3.19Å; W32-Y39 HydrophobicContact CH2-CD1 4.12Å; W32-Y39 HydrophobicContact CH2-CG 4.33Å; W32-Y39 HydrophobicContact CZ3-CD1 4.41Å; W32-Y39 HydrophobicContact CZ3-CG 4.23Å; W32-R82 HydrophobicContact CG-CG 4.49Å
33E90.2Very high94.1Very high175 Ų17574 Ų7482%0.81837%0.371SS*.Hα-helixtrans-58.8-41.8176.2-172.7171.8-175.400111.6S31S31-E33 VanDerWaalsContact C-N 3.28Å
34D93Very high94.3Very high60 Ų6071.2 Ų71.232%0.32136%0.36SS..Hα-helixtrans-77.2-33.3-179.3-60.1-40.6000112.7L24 S31 W32L24-D34 HydrophobicContact CD1-CB 4.26Å; L24-D34 HydrophobicContact CD2-CB 4.31Å; S31-D34 WeakPolarHBondContact CB-OD2 3.48Å; S31-D34 PolarHBondContact O-N 2.82Å; S31-D34 VanDerWaalsContact OG-CG 3.26Å; S31-D34 PolarHBondContact OG-N 3.19Å; S31-D34 PolarHBondContact OG-OD2 3.05Å; W32-D34 VanDerWaalsContact C-N 3.28Å; W32-D34 PolarHBondContact O-N 2.97Å
35T94.4Very high94.5Very high1 Ų171.7 Ų71.71%0.00637%0.366CS..Hα-helixtrans-100.5-14.4-171.3560000114.6M21 L24 S31 W32 K37 F38 Y39 F74M21-T35 HydrophobicContact CE-CG2 4.26Å; M21-T35 HydrophobicContact SD-CG2 4.12Å; L24-T35 HydrophobicContact CD1-CG2 3.78Å; S31-T35 PolarHBondContact O-N 3.08Å; S31-T35 VanDerWaalsContact O-N 3.13Å; S31-T35 PolarHBondContact O-OG1 3.05Å; W32-T35 PolarHBondContact O-N 2.82Å; T35-K37 VanDerWaalsContact C-N 3.34Å; T35-K37 PolarHBondContact O-N 3.44Å; T35-F38 PolarHBondContact O-N 2.86Å; T35-Y39 WeakPolarHBondContact O-CB 3.07Å; T35-Y39 PolarHBondContact O-N 2.86Å; T35-F74 HydrophobicContact CG2-CE1 4.22Å
36A93.7Very high94.8Very high26 Ų2666.1 Ų66.122%0.21534%0.336CS..Hα-helixtrans-56.4-46.3-175.400000112.4W32 Y39 E40W32-A36 HydrophobicContact CD2-CB 3.94Å; W32-A36 HydrophobicContact CE3-CB 4.32Å; W32-A36 HydrophobicContact CG-CB 4.46Å; W32-A36 HydrophobicContact CH2-CB 4.14Å; W32-A36 HydrophobicContact CZ2-CB 3.72Å; W32-A36 HydrophobicContact CZ3-CB 4.42Å; W32-A36 WeakPolarHBondContact O-CA 3.05Å; W32-A36 WeakPolarHBondContact O-CB 3.41Å; W32-A36 PolarHBondContact O-N 3.19Å; A36-Y39 PolarHBondContact O-N 3.24Å; A36-E40 WeakPolarHBondContact O-CB 3.44Å; A36-E40 PolarHBondContact O-N 3.08Å
37K95.9Very high95.1Very high131 Ų13165.4 Ų65.457%0.5733%0.329SS*.Hα-helixtrans-62.3-47.7-178.3-174.2-176.2174.7-169.50111.8T35 Y39 E40 E41T35-K37 VanDerWaalsContact C-N 3.34Å; T35-K37 PolarHBondContact O-N 3.44Å; K37-Y39 VanDerWaalsContact C-N 3.32Å; K37-Y39 PolarHBondContact O-N 2.04Å; K37-E40 WeakPolarHBondContact O-CB 3.39Å; K37-E40 PolarHBondContact O-N 2.92Å; K37-E41 VanDerWaalsContact CE-OE1 3.29Å; K37-E41 WeakPolarHBondContact CE-OE1 3.4Å; K37-E41 WeakPolarHBondContact O-CG 3.44Å; K37-E41 PolarHBondContact O-N 2.94Å
38F97.6Very high95.5Very high29 Ų2964.8 Ų64.813%0.12732%0.317CS..Hα-helixtrans-65.6-37.6179.5-54.1-34.2000112F17 D20 L24 T35 E41 L42F17-F38 HydrophobicContact CD2-CB 4.1Å; F17-F38 HydrophobicContact CE2-CB 3.96Å; D20-F38 HydrophobicContact CB-CB 4.11Å; D20-F38 HydrophobicContact CB-CD1 3.67Å; D20-F38 HydrophobicContact CB-CD2 3.92Å; D20-F38 HydrophobicContact CB-CE1 3.97Å; D20-F38 HydrophobicContact CB-CE2 4.19Å; D20-F38 HydrophobicContact CB-CG 3.64Å; D20-F38 HydrophobicContact CB-CZ 4.21Å; L24-F38 HydrophobicContact CD1-CD2 4.01Å; L24-F38 HydrophobicContact CD1-CE2 3.72Å; L24-F38 HydrophobicContact CD2-CE2 4.42Å; L24-F38 HydrophobicContact CG-CE2 3.93Å; T35-F38 PolarHBondContact O-N 2.86Å; F38-E41 PolarHBondContact O-N 3.15Å; F38-L42 WeakPolarHBondContact O-CB 3.3Å; F38-L42 PolarHBondContact O-N 3Å
39Y96.8Very high95.8Very high39 Ų3963.4 Ų63.415%0.15331%0.311CS..Hα-helixtrans-69.3-36.2176.5-164.4-85.9000112.3W32 T35 A36 K37 L42 T43 F66 H70 F74W32-Y39 HydrophobicContact CH2-CD1 4.12Å; W32-Y39 HydrophobicContact CH2-CG 4.33Å; W32-Y39 HydrophobicContact CZ3-CD1 4.41Å; W32-Y39 HydrophobicContact CZ3-CG 4.23Å; T35-Y39 WeakPolarHBondContact O-CB 3.07Å; T35-Y39 PolarHBondContact O-N 2.86Å; A36-Y39 PolarHBondContact O-N 3.24Å; K37-Y39 VanDerWaalsContact C-N 3.32Å; K37-Y39 PolarHBondContact O-N 2.04Å; Y39-L42 PolarHBondContact O-N 3.02Å; Y39-T43 WeakPolarHBondContact O-CB 3.49Å; Y39-T43 PolarHBondContact O-N 3.19Å; Y39-T43 PolarHBondContact O-OG1 3.23Å; Y39-F66 HydrophobicContact CE1-CD1 4.46Å; Y39-F66 HydrophobicContact CE1-CE1 4.07Å; Y39-F66 AromaticContact CE2-CD1 3.91Å; Y39-F66 HydrophobicContact CE2-CD1 3.91Å; Y39-F66 AromaticContact CE2-CE1 3.91Å; Y39-F66 HydrophobicContact CE2-CE1 3.91Å; Y39-F66 AromaticContact CZ-CD1 3.58Å; Y39-F66 AromaticContact CZ-CE1 3.56Å; Y39-F66 WeakPolarHBondContact OH-CD1 3.23Å; Y39-F66 WeakPolarHBondContact OH-CE1 3.43Å; Y39-H70 AromaticContact CE2-CE1 3.92Å; Y39-H70 AromaticContact CE2-NE2 3.62Å; Y39-H70 AromaticContact CZ-NE2 3.54Å; Y39-H70 PolarHBondContact OH-NE2 3.35Å; Y39-F74 AromaticContact CD2-CE2 3.98Å; Y39-F74 HydrophobicContact CD2-CE2 3.98Å; Y39-F74 HydrophobicContact CD2-CZ 4.4Å; Y39-F74 HydrophobicContact CE2-CE2 4.15Å
40E97.6Very high95.9Very high134 Ų13461.5 Ų61.563%0.62630%0.304SS*.Hα-helixtrans-62.8-46.9172-176.5-178175.100111.2A36 K37 L42 T43 N44A36-E40 WeakPolarHBondContact O-CB 3.44Å; A36-E40 PolarHBondContact O-N 3.08Å; K37-E40 WeakPolarHBondContact O-CB 3.39Å; K37-E40 PolarHBondContact O-N 2.92Å; E40-L42 PolarHBondContact O-N 2.92Å; E40-T43 WeakPolarHBondContact O-CB 3.05Å; E40-T43 PolarHBondContact O-N 3.25Å; E40-N44 WeakPolarHBondContact O-CB 3.32Å; E40-N44 PolarHBondContact O-N 3.4Å
41E98.2Very high96.1Very high77 Ų7761.4 Ų61.436%0.3630%0.304SS..Hα-helixtrans-60.1-43.3176.1-73-179.3-166.400111.8K37 F38 T43 N44 C45K37-E41 VanDerWaalsContact CE-OE1 3.29Å; K37-E41 WeakPolarHBondContact CE-OE1 3.4Å; K37-E41 WeakPolarHBondContact O-CG 3.44Å; K37-E41 PolarHBondContact O-N 2.94Å; F38-E41 PolarHBondContact O-N 3.15Å; E41-T43 PolarHBondContact O-N 3.36Å; E41-N44 PolarHBondContact O-N 3.13Å; E41-C45 VanDerWaalsContact O-CB 3.32Å; E41-C45 WeakPolarHBondContact O-CB 3.45Å; E41-C45 PolarHBondContact O-N 3.32Å
42L98.5Very high96.4Very high4 Ų465.7 Ų65.72%0.02132%0.324CS..Hα-helixtrans-58.7-47173.3177.260000111.8C13 F17 F38 Y39 E40 C45 T46 F65 F66 V69C13-L42 HydrophobicContact CB-CD1 3.74Å; F17-L42 HydrophobicContact CB-CB 4.41Å; F17-L42 HydrophobicContact CB-CD1 4.04Å; F17-L42 HydrophobicContact CB-CD2 4.26Å; F17-L42 HydrophobicContact CB-CG 4.46Å; F17-L42 HydrophobicContact CD1-CD2 3.99Å; F17-L42 HydrophobicContact CD2-CB 3.89Å; F17-L42 HydrophobicContact CD2-CD2 3.81Å; F17-L42 HydrophobicContact CD2-CG 4.37Å; F17-L42 HydrophobicContact CE1-CD2 4.27Å; F17-L42 HydrophobicContact CE2-CD2 4.11Å; F17-L42 HydrophobicContact CG-CB 4.32Å; F17-L42 HydrophobicContact CG-CD1 4.44Å; F17-L42 HydrophobicContact CG-CD2 3.75Å; F17-L42 HydrophobicContact CG-CG 4.39Å; F17-L42 HydrophobicContact CZ-CD2 4.33Å; F38-L42 WeakPolarHBondContact O-CB 3.3Å; F38-L42 PolarHBondContact O-N 3Å; Y39-L42 PolarHBondContact O-N 3.02Å; E40-L42 PolarHBondContact O-N 2.92Å; L42-C45 PolarHBondContact O-N 3.45Å; L42-T46 WeakPolarHBondContact O-CG2 3.3Å; L42-T46 PolarHBondContact O-N 3.1Å; L42-T46 VanDerWaalsContact O-N 3.08Å; L42-F65 HydrophobicContact CD1-CE1 3.78Å; L42-F65 HydrophobicContact CD1-CZ 3.8Å; L42-F65 HydrophobicContact CD2-CE1 4.3Å; L42-F65 HydrophobicContact CG-CE1 4.23Å; L42-F66 HydrophobicContact CD2-CD1 4.4Å; L42-F66 HydrophobicContact CD2-CE1 3.67Å; L42-F66 HydrophobicContact CD2-CZ 4.35Å; L42-F66 HydrophobicContact CG-CE1 3.88Å; L42-F66 HydrophobicContact CG-CZ 4.07Å; L42-V69 HydrophobicContact CD2-CG1 4.11Å; L42-V69 HydrophobicContact CD2-CG2 4.28Å
43T98.3Very high96.6Very high36 Ų3663.4 Ų63.422%0.22132%0.319CS..Hα-helixtrans-61.3-48.2178.9-56.30000111Y39 E40 E41 C45 T46 Y47 W57Y39-T43 WeakPolarHBondContact O-CB 3.49Å; Y39-T43 PolarHBondContact O-N 3.19Å; Y39-T43 PolarHBondContact O-OG1 3.23Å; E40-T43 WeakPolarHBondContact O-CB 3.05Å; E40-T43 PolarHBondContact O-N 3.25Å; E41-T43 PolarHBondContact O-N 3.36Å; T43-C45 PolarHBondContact O-N 2.83Å; T43-T46 PolarHBondContact O-N 3.24Å; T43-T46 PolarHBondContact O-OG1 2.86Å; T43-Y47 PolarHBondContact O-N 3.46Å; T43-W57 HydrophobicContact CG2-CH2 3.76Å; T43-W57 HydrophobicContact CG2-CZ2 3.62Å
44N98.5Very high96.9Very high82 Ų8262.5 Ų62.544%0.43932%0.32SS..Hα-helixtrans-64.3-40.4179.1-163.1-1.4000111.8E40 E41 T46 Y47 L48E40-N44 WeakPolarHBondContact O-CB 3.32Å; E40-N44 PolarHBondContact O-N 3.4Å; E41-N44 PolarHBondContact O-N 3.13Å; N44-T46 PolarHBondContact O-N 3.12Å; N44-Y47 WeakPolarHBondContact O-CB 3.27Å; N44-Y47 PolarHBondContact O-N 3.36Å; N44-L48 WeakPolarHBondContact O-CB 3.47Å; N44-L48 WeakPolarHBondContact O-CG 3.45Å; N44-L48 PolarHBondContact O-N 3.33Å
45C98.4Very high97Very high38 Ų3860.7 Ų60.726%0.25731%0.312SS..Hα-helixtrans-57.3-49174.4-178.20000112C13 E41 L42 T43 Y47 L48 L49C13-C45 WeakPolarHBondContact CA-SG 3.18Å; C13-C45 HydrophobicContact CB-CB 3.76Å; C13-C45 WeakPolarHBondContact CB-SG 3.49Å; C13-C45 WeakPolarHBondContact SG-CB 3.42Å; C13-C45 CovalentContact SG-SG 2.04Å; C13-C45 PolarHBondContact SG-SG 3.1Å; E41-C45 VanDerWaalsContact O-CB 3.32Å; E41-C45 WeakPolarHBondContact O-CB 3.45Å; E41-C45 PolarHBondContact O-N 3.32Å; L42-C45 PolarHBondContact O-N 3.45Å; T43-C45 PolarHBondContact O-N 2.83Å; C45-Y47 VanDerWaalsContact C-N 3.28Å; C45-Y47 PolarHBondContact O-N 3.22Å; C45-L48 PolarHBondContact O-N 3.02Å; C45-L49 WeakPolarHBondContact O-CG 3.49Å; C45-L49 PolarHBondContact O-N 2.74Å
46T98.3Very high97Very high0 Ų069.7 Ų69.70%035%0.347CS..Hα-helixtrans-64.2-34.1178.865.60000112.7Y5 I9 C13 L42 T43 N44 A50 W57 V62 F65 F66Y5-T46 PolarHBondContact OH-O 3.35Å; I9-T46 HydrophobicContact CB-CG2 4.33Å; I9-T46 HydrophobicContact CG2-CG2 4.09Å; C13-T46 HydrophobicContact CB-CG2 4.29Å; L42-T46 WeakPolarHBondContact O-CG2 3.3Å; L42-T46 PolarHBondContact O-N 3.1Å; L42-T46 VanDerWaalsContact O-N 3.08Å; T43-T46 PolarHBondContact O-N 3.24Å; T43-T46 PolarHBondContact O-OG1 2.86Å; N44-T46 PolarHBondContact O-N 3.12Å; T46-A50 WeakPolarHBondContact O-CB 3.4Å; T46-A50 PolarHBondContact O-N 2.86Å; T46-A50 VanDerWaalsContact O-N 3.08Å; T46-W57 PolarHBondContact OG1-NE1 3.45Å; T46-W57 VanDerWaalsContact OG1-NE1 3.12Å; T46-V62 HydrophobicContact CG2-CG2 4.22Å; T46-F65 HydrophobicContact CG2-CD1 4.25Å; T46-F65 HydrophobicContact CG2-CE1 3.85Å; T46-F65 HydrophobicContact CG2-CZ 4.49Å; T46-F66 HydrophobicContact CG2-CE2 4.34Å; T46-F66 HydrophobicContact CG2-CZ 4.44Å
47Y98.2Very high97.2Very high116 Ų11672.2 Ų72.246%0.45535%0.351SS..Hα-helixtrans-67.8-48.4175.8171.4-98.1000111.7T43 N44 C45 L49 A50 S51 W57T43-Y47 PolarHBondContact O-N 3.46Å; N44-Y47 WeakPolarHBondContact O-CB 3.27Å; N44-Y47 PolarHBondContact O-N 3.36Å; C45-Y47 VanDerWaalsContact C-N 3.28Å; C45-Y47 PolarHBondContact O-N 3.22Å; Y47-L49 PolarHBondContact O-N 3.06Å; Y47-A50 PolarHBondContact O-N 2.95Å; Y47-S51 WeakPolarHBondContact O-CB 3.39Å; Y47-S51 PolarHBondContact O-N 2.88Å; Y47-W57 HydrophobicContact CD2-CB 4.01Å; Y47-W57 AromaticContact CD2-CD2 3.9Å; Y47-W57 HydrophobicContact CD2-CD2 3.9Å; Y47-W57 AromaticContact CD2-CE3 3.95Å; Y47-W57 HydrophobicContact CD2-CE3 3.95Å; Y47-W57 AromaticContact CD2-CG 3.93Å; Y47-W57 HydrophobicContact CD2-CG 3.93Å
48L98.1Very high97.2Very high89 Ų8969.1 Ų69.147%0.46634%0.344SS..Hα-helixtrans-62.2-42.8179.1-70.9173.1000111.8N44 C45 S51 N52N44-L48 WeakPolarHBondContact O-CB 3.47Å; N44-L48 WeakPolarHBondContact O-CG 3.45Å; N44-L48 PolarHBondContact O-N 3.33Å; C45-L48 PolarHBondContact O-N 3.02Å; L48-S51 PolarHBondContact O-N 2.86Å; L48-N52 WeakPolarHBondContact O-CB 3.48Å; L48-N52 PolarHBondContact O-N 3.3Å
49L97.4Very high97.1Very high36 Ų3669 Ų6919%0.18835%0.345CS..Hα-helixtrans-63.7-40.9174.9-70-178.9000111.8Y5 V8 I9 C13 C45 Y47 N52 M53Y5-L49 HydrophobicContact CE2-CB 4.09Å; V8-L49 HydrophobicContact CB-CD1 4.22Å; V8-L49 HydrophobicContact CG2-CD1 3.98Å; I9-L49 HydrophobicContact CG2-CD1 4.18Å; C13-L49 WeakPolarHBondContact SG-CD1 3.4Å; C45-L49 WeakPolarHBondContact O-CG 3.49Å; C45-L49 PolarHBondContact O-N 2.74Å; Y47-L49 PolarHBondContact O-N 3.06Å; L49-N52 PolarHBondContact O-N 3.49Å; L49-M53 WeakPolarHBondContact O-CB 3.46Å; L49-M53 VanDerWaalsContact O-CG 3.31Å; L49-M53 WeakPolarHBondContact O-CG 3.41Å; L49-M53 PolarHBondContact O-N 3.47Å
50A97.3Very high97Very high0 Ų075.3 Ų75.30%037%0.369CS..Hα-helixtrans-62.7-45175.600000111.1Y5 T46 Y47 M53 N54 C55 W57Y5-A50 HydrophobicContact CE2-CB 3.75Å; T46-A50 WeakPolarHBondContact O-CB 3.4Å; T46-A50 PolarHBondContact O-N 2.86Å; T46-A50 VanDerWaalsContact O-N 3.08Å; Y47-A50 PolarHBondContact O-N 2.95Å; A50-M53 CarbonylContact O-C 3.5Å; A50-M53 PolarHBondContact O-N 2.82Å; A50-N54 PolarHBondContact O-N 3.18Å; A50-C55 HydrophobicContact CB-CB 4.25Å; A50-C55 WeakPolarHBondContact O-CB 3.32Å; A50-C55 PolarHBondContact O-N 3.08Å; A50-W57 HydrophobicContact CB-CB 3.98Å; A50-W57 HydrophobicContact CB-CG 4.39Å
51S97Very high96.9Very high64 Ų6470.2 Ų70.245%0.44835%0.345SS..Hα-helixtrans-60.7-46.1177.1-174.10000111.9Y47 L48 M53 N54Y47-S51 WeakPolarHBondContact O-CB 3.39Å; Y47-S51 PolarHBondContact O-N 2.88Å; L48-S51 PolarHBondContact O-N 2.86Å; S51-M53 PolarHBondContact O-N 3.42Å; S51-N54 PolarHBondContact O-N 3.49Å
52N96.3Very high96.9Very high126 Ų12666.7 Ų66.767%0.67433%0.329SS*.Hα-helixtrans-64.6-28.2178.3-77.6-14.4000113L48 L49 N54L48-N52 WeakPolarHBondContact O-CB 3.48Å; L48-N52 PolarHBondContact O-N 3.3Å; L49-N52 PolarHBondContact O-N 3.49Å; N52-N54 VanDerWaalsContact C-N 3.31Å
53M95.3Very high96.8Very high69 Ų6970.6 Ų70.634%0.3435%0.35SS..THydrogen-bonded Turntrans-91.79.9175.7-66.4-169.472.900113.2H4 Y5 V8 L49 A50 S51 C55H4-M53 HydrophobicContact CB-CE 4.05Å; H4-M53 WeakPolarHBondContact ND1-CE 3.49Å; Y5-M53 HydrophobicContact CD2-SD 4.08Å; V8-M53 HydrophobicContact CG2-SD 4.03Å; L49-M53 WeakPolarHBondContact O-CB 3.46Å; L49-M53 VanDerWaalsContact O-CG 3.31Å; L49-M53 WeakPolarHBondContact O-CG 3.41Å; L49-M53 PolarHBondContact O-N 3.47Å; A50-M53 CarbonylContact O-C 3.5Å; A50-M53 PolarHBondContact O-N 2.82Å; S51-M53 PolarHBondContact O-N 3.42Å; M53-C55 PolarHBondContact O-N 3.38Å
54N95.5Very high96.7Very high155 Ų15572.3 Ų72.383%0.82936%0.355SS*.THydrogen-bonded Turntrans52.339.6-176.5-71.959.5000113.1A50 S51 N52A50-N54 PolarHBondContact O-N 3.18Å; S51-N54 PolarHBondContact O-N 3.49Å; N52-N54 VanDerWaalsContact C-N 3.31Å
55C95.1Very high96.7Very high23 Ų2368.8 Ų68.816%0.15534%0.336CS..  trans-104.8147.2176.5-67.20000112.1C1 A50 M53C1-C55 WeakPolarHBondContact CA-SG 3.45Å; C1-C55 HydrophobicContact CB-CB 3.83Å; C1-C55 WeakPolarHBondContact CB-SG 3.43Å; C1-C55 PolarHBondContact N-SG 2.64Å; C1-C55 WeakPolarHBondContact SG-CB 3.49Å; C1-C55 CovalentContact SG-SG 2Å; C1-C55 PolarHBondContact SG-SG 3.43Å; A50-C55 HydrophobicContact CB-CB 4.25Å; A50-C55 WeakPolarHBondContact O-CB 3.32Å; A50-C55 PolarHBondContact O-N 3.08Å; M53-C55 PolarHBondContact O-N 3.38Å
56Y95.2Very high96.7Very high190 Ų19068.1 Ų68.175%0.74533%0.329SS*.  trans-68.1138.7170.3-163.1-99000110.8P58 N59Y56-P58 VanDerWaalsContact CD1-O 3.27Å; Y56-P58 WeakPolarHBondContact CD1-O 3.33Å; Y56-N59 PolarHBondContact O-ND2 3.44Å
57W97.1Very high96.7Very high78 Ų7872.1 Ų72.130%0.29535%0.35SS..SBendtrans-127.2131.4173.6-171.2101.8000108.1T43 T46 Y47 A50T43-W57 HydrophobicContact CG2-CH2 3.76Å; T43-W57 HydrophobicContact CG2-CZ2 3.62Å; T46-W57 PolarHBondContact OG1-NE1 3.45Å; T46-W57 VanDerWaalsContact OG1-NE1 3.12Å; Y47-W57 HydrophobicContact CD2-CB 4.01Å; Y47-W57 AromaticContact CD2-CD2 3.9Å; Y47-W57 HydrophobicContact CD2-CD2 3.9Å; Y47-W57 AromaticContact CD2-CE3 3.95Å; Y47-W57 HydrophobicContact CD2-CE3 3.95Å; Y47-W57 AromaticContact CD2-CG 3.93Å; Y47-W57 HydrophobicContact CD2-CG 3.93Å; A50-W57 HydrophobicContact CB-CB 3.98Å; A50-W57 HydrophobicContact CB-CG 4.39Å
58P96.8Very high96.6Very high67 Ų6771.6 Ų71.644%0.43535%0.351SS..SBendcis-76.2164.4-232.2-35.2000113Y56 V62Y56-P58 VanDerWaalsContact CD1-O 3.27Å; Y56-P58 WeakPolarHBondContact CD1-O 3.33Å; P58-V62 HydrophobicContact CB-CG1 4.09Å
59N95.3Very high96.6Very high27 Ų2767.6 Ų67.614%0.14433%0.33CS..  trans-149.5169.5176.966.859.6000110.9Y56 M61 V62 D63Y56-N59 PolarHBondContact O-ND2 3.44Å; N59-M61 VanDerWaalsContact C-N 3.27Å; N59-M61 PolarHBondContact O-N 2.88Å; N59-M61 VanDerWaalsContact O-N 3.13Å; N59-M61 PolarHBondContact OD1-N 3.03Å; N59-M61 VanDerWaalsContact OD1-N 3.1Å; N59-V62 VanDerWaalsContact N-CG1 3.26Å; N59-V62 WeakPolarHBondContact O-CG1 3.5Å; N59-V62 PolarHBondContact O-N 2.05Å; N59-V62 VanDerWaalsContact O-N 3.08Å; N59-V62 PolarHBondContact OD1-N 3.35Å; N59-D63 PolarHBondContact O-N 2.96Å
60R95.4Very high96.6Very high170 Ų17069.2 Ų69.264%0.64234%0.337SS*.Hα-helixtrans-53.6-37.8-174.6-165-177.184.588.214.8114.5D63 E64R60-D63 PolarHBondContact O-N 3.36Å; R60-E64 IonicContact CZ-OE1 3.36Å; R60-E64 IonicContact CZ-OE2 3.64Å; R60-E64 IonicContact NH1-OE1 2.64Å; R60-E64 PolarHBondContact NH1-OE1 3.39Å; R60-E64 IonicContact NH1-OE2 3.67Å; R60-E64 IonicContact NH2-OE1 3.74Å; R60-E64 IonicContact NH2-OE2 3.43Å; R60-E64 PolarHBondContact NH2-OE2 2.89Å; R60-E64 WeakPolarHBondContact O-CG 3.07Å; R60-E64 PolarHBondContact O-N 2.85Å
61M95.7Very high96.6Very high28 Ų2878.1 Ų78.114%0.13837%0.37CS..Hα-helixtrans-69.1-42.6-179.8-75.7156.6-71.600111.3C1 Y5 N59 D63 E64 F65C1-M61 HydrophobicContact CB-CE 3.31Å; C1-M61 HydrophobicContact CB-SD 4.27Å; C1-M61 WeakPolarHBondContact O-CE 3.4Å; Y5-M61 HydrophobicContact CD1-CB 4.14Å; Y5-M61 HydrophobicContact CD1-CE 4.45Å; Y5-M61 HydrophobicContact CD1-SD 4.3Å; Y5-M61 HydrophobicContact CE1-CB 4.39Å; N59-M61 VanDerWaalsContact C-N 3.27Å; N59-M61 PolarHBondContact O-N 2.88Å; N59-M61 VanDerWaalsContact O-N 3.13Å; N59-M61 PolarHBondContact OD1-N 3.03Å; N59-M61 VanDerWaalsContact OD1-N 3.1Å; M61-D63 VanDerWaalsContact C-N 3.31Å; M61-D63 PolarHBondContact O-N 3.5Å; M61-E64 PolarHBondContact O-N 3.08Å; M61-F65 VanDerWaalsContact O-CB 3.26Å; M61-F65 WeakPolarHBondContact O-CB 3.3Å; M61-F65 PolarHBondContact O-N 2.84Å
62V96.8Very high96.5Very high2 Ų283.4 Ų83.41%0.01238%0.381CS..Hα-helixtrans-70.8-29.6177.768.80000111.7Y5 T46 P58 N59 F65 F66Y5-V62 HydrophobicContact CE1-CB 4.27Å; T46-V62 HydrophobicContact CG2-CG2 4.22Å; P58-V62 HydrophobicContact CB-CG1 4.09Å; N59-V62 VanDerWaalsContact N-CG1 3.26Å; N59-V62 WeakPolarHBondContact O-CG1 3.5Å; N59-V62 PolarHBondContact O-N 2.05Å; N59-V62 VanDerWaalsContact O-N 3.08Å; N59-V62 PolarHBondContact OD1-N 3.35Å; V62-F65 WeakPolarHBondContact O-CB 3.08Å; V62-F66 HydrophobicContact CG2-CD2 3.63Å; V62-F66 HydrophobicContact CG2-CE2 3.51Å; V62-F66 VanDerWaalsContact O-CD2 3.26Å; V62-F66 WeakPolarHBondContact O-CD2 3.29Å; V62-F66 PolarHBondContact O-N 2.92Å
63D96.9Very high96.5Very high87 Ų8778.6 Ų78.647%0.46535%0.353SS..Hα-helixtrans-63.7-50.2171.4-66.1-29000111.6N59 R60 M61 F65 F66 I67N59-D63 PolarHBondContact O-N 2.96Å; R60-D63 PolarHBondContact O-N 3.36Å; M61-D63 VanDerWaalsContact C-N 3.31Å; M61-D63 PolarHBondContact O-N 3.5Å; D63-F65 VanDerWaalsContact C-N 3.31Å; D63-F65 PolarHBondContact O-N 3.07Å; D63-F66 PolarHBondContact O-N 3.01Å; D63-I67 VanDerWaalsContact O-CG1 3.29Å; D63-I67 WeakPolarHBondContact O-CG1 3.48Å; D63-I67 PolarHBondContact O-N 3.37Å
64E97.1Very high96.4Very high72 Ų7276 Ų7634%0.33634%0.34SS..Hα-helixtrans-60.6-41.7176.9-74.7176.1162.200111.5R60 M61 I67 Q68R60-E64 IonicContact CZ-OE1 3.36Å; R60-E64 IonicContact CZ-OE2 3.64Å; R60-E64 IonicContact NH1-OE1 2.64Å; R60-E64 PolarHBondContact NH1-OE1 3.39Å; R60-E64 IonicContact NH1-OE2 3.67Å; R60-E64 IonicContact NH2-OE1 3.74Å; R60-E64 IonicContact NH2-OE2 3.43Å; R60-E64 PolarHBondContact NH2-OE2 2.89Å; R60-E64 WeakPolarHBondContact O-CG 3.07Å; R60-E64 PolarHBondContact O-N 2.85Å; M61-E64 PolarHBondContact O-N 3.08Å; E64-I67 PolarHBondContact O-N 3.32Å; E64-Q68 WeakPolarHBondContact O-CG 3.38Å; E64-Q68 PolarHBondContact O-N 3.45Å; E64-Q68 VanDerWaalsContact O-N 3.09Å
65F97.5Very high96.4Very high8 Ų873.9 Ų73.94%0.03533%0.325CS..Hα-helixtrans-56.9-53.6174.1174-97.6000112.4I9 E10 L14 L42 T46 M61 V62 D63 I67 Q68 V69I9-F65 HydrophobicContact CB-CE2 4.36Å; I9-F65 HydrophobicContact CD1-CB 3.77Å; I9-F65 HydrophobicContact CD1-CD1 4.4Å; I9-F65 HydrophobicContact CD1-CD2 3.65Å; I9-F65 HydrophobicContact CD1-CE2 4.3Å; I9-F65 HydrophobicContact CD1-CG 3.69Å; I9-F65 HydrophobicContact CG1-CD2 3.93Å; I9-F65 HydrophobicContact CG1-CE2 4.14Å; I9-F65 HydrophobicContact CG1-CG 4.42Å; E10-F65 HydrophobicContact CG-CE2 4.45Å; L14-F65 HydrophobicContact CB-CE2 3.83Å; L14-F65 HydrophobicContact CB-CZ 3.93Å; L14-F65 HydrophobicContact CD1-CE2 4.44Å; L14-F65 HydrophobicContact CD1-CZ 4.33Å; L14-F65 HydrophobicContact CD2-CE2 4.26Å; L14-F65 HydrophobicContact CG-CE2 4.41Å; L42-F65 HydrophobicContact CD1-CE1 3.78Å; L42-F65 HydrophobicContact CD1-CZ 3.8Å; L42-F65 HydrophobicContact CD2-CE1 4.3Å; L42-F65 HydrophobicContact CG-CE1 4.23Å; T46-F65 HydrophobicContact CG2-CD1 4.25Å; T46-F65 HydrophobicContact CG2-CE1 3.85Å; T46-F65 HydrophobicContact CG2-CZ 4.49Å; M61-F65 VanDerWaalsContact O-CB 3.26Å; M61-F65 WeakPolarHBondContact O-CB 3.3Å; M61-F65 PolarHBondContact O-N 2.84Å; V62-F65 WeakPolarHBondContact O-CB 3.08Å; D63-F65 VanDerWaalsContact C-N 3.31Å; D63-F65 PolarHBondContact O-N 3.07Å; F65-I67 VanDerWaalsContact C-N 3.32Å; F65-I67 PolarHBondContact O-N 3.06Å; F65-Q68 WeakPolarHBondContact O-CB 3.23Å; F65-Q68 PolarHBondContact O-N 3.43Å; F65-Q68 VanDerWaalsContact O-N 3.1Å; F65-V69 HydrophobicContact CD1-CG2 4.42Å; F65-V69 HydrophobicContact CE1-CG2 4.08Å; F65-V69 HydrophobicContact CZ-CG2 4.2Å; F65-V69 WeakPolarHBondContact O-CG2 3.16Å; F65-V69 PolarHBondContact O-N 3.42Å
66F98.2Very high96.2Very high23 Ų2378.9 Ų78.910%0.10135%0.35CS..Hα-helixtrans-66.3-34.3-179.6-85.4-69.1000112.4Y39 L42 T46 V62 D63 Q68 V69 H70Y39-F66 HydrophobicContact CE1-CD1 4.46Å; Y39-F66 HydrophobicContact CE1-CE1 4.07Å; Y39-F66 AromaticContact CE2-CD1 3.91Å; Y39-F66 HydrophobicContact CE2-CD1 3.91Å; Y39-F66 AromaticContact CE2-CE1 3.91Å; Y39-F66 HydrophobicContact CE2-CE1 3.91Å; Y39-F66 AromaticContact CZ-CD1 3.58Å; Y39-F66 AromaticContact CZ-CE1 3.56Å; Y39-F66 WeakPolarHBondContact OH-CD1 3.23Å; Y39-F66 WeakPolarHBondContact OH-CE1 3.43Å; L42-F66 HydrophobicContact CD2-CD1 4.4Å; L42-F66 HydrophobicContact CD2-CE1 3.67Å; L42-F66 HydrophobicContact CD2-CZ 4.35Å; L42-F66 HydrophobicContact CG-CE1 3.88Å; L42-F66 HydrophobicContact CG-CZ 4.07Å; T46-F66 HydrophobicContact CG2-CE2 4.34Å; T46-F66 HydrophobicContact CG2-CZ 4.44Å; V62-F66 HydrophobicContact CG2-CD2 3.63Å; V62-F66 HydrophobicContact CG2-CE2 3.51Å; V62-F66 VanDerWaalsContact O-CD2 3.26Å; V62-F66 WeakPolarHBondContact O-CD2 3.29Å; V62-F66 PolarHBondContact O-N 2.92Å; D63-F66 PolarHBondContact O-N 3.01Å; F66-Q68 VanDerWaalsContact C-N 3.27Å; F66-Q68 PolarHBondContact O-N 2.83Å; F66-V69 PolarHBondContact O-N 3.19Å; F66-H70 PolarHBondContact O-CD2 3.39Å; F66-H70 PolarHBondContact O-N 3.39Å
67I97.8Very high96Very high85 Ų8570.8 Ų70.844%0.43632%0.321SS..Hα-helixtrans-58.5-42.2172.4-71.9167000110.7D63 E64 F65 H70 R71D63-I67 VanDerWaalsContact O-CG1 3.29Å; D63-I67 WeakPolarHBondContact O-CG1 3.48Å; D63-I67 PolarHBondContact O-N 3.37Å; E64-I67 PolarHBondContact O-N 3.32Å; F65-I67 VanDerWaalsContact C-N 3.32Å; F65-I67 PolarHBondContact O-N 3.06Å; I67-H70 PolarHBondContact O-N 3.25Å; I67-R71 WeakPolarHBondContact O-CB 3.41Å; I67-R71 VanDerWaalsContact O-CG 3.32Å; I67-R71 WeakPolarHBondContact O-CG 3.49Å; I67-R71 PolarHBondContact O-N 3.31Å
68Q97.8Very high95.4Very high105 Ų10571.1 Ų71.149%0.49134%0.335SS..Hα-helixtrans-65.9-42.2176.6-69-174.577.800112.1E64 F65 F66 H70 R71 R72E64-Q68 WeakPolarHBondContact O-CG 3.38Å; E64-Q68 PolarHBondContact O-N 3.45Å; E64-Q68 VanDerWaalsContact O-N 3.09Å; F65-Q68 WeakPolarHBondContact O-CB 3.23Å; F65-Q68 PolarHBondContact O-N 3.43Å; F65-Q68 VanDerWaalsContact O-N 3.1Å; F66-Q68 VanDerWaalsContact C-N 3.27Å; F66-Q68 PolarHBondContact O-N 2.83Å; Q68-H70 PolarHBondContact O-N 2.72Å; Q68-R71 PolarHBondContact O-N 2.87Å; Q68-R72 WeakPolarHBondContact O-CB 3.45Å; Q68-R72 PolarHBondContact O-N 3.35Å
69V97.9Very high94.3Very high4 Ų475 Ų752%0.02435%0.349CS..Hα-helixtrans-57.6-49.2173.6173.20000110.7L14 F17 L42 F65 F66 R71 R72 Y73 F74L14-V69 HydrophobicContact CD1-CG2 3.93Å; F17-V69 HydrophobicContact CD1-CG1 4.41Å; F17-V69 HydrophobicContact CE1-CG1 3.74Å; F17-V69 HydrophobicContact CZ-CG1 4.23Å; L42-V69 HydrophobicContact CD2-CG1 4.11Å; L42-V69 HydrophobicContact CD2-CG2 4.28Å; F65-V69 HydrophobicContact CD1-CG2 4.42Å; F65-V69 HydrophobicContact CE1-CG2 4.08Å; F65-V69 HydrophobicContact CZ-CG2 4.2Å; F65-V69 WeakPolarHBondContact O-CG2 3.16Å; F65-V69 PolarHBondContact O-N 3.42Å; F66-V69 PolarHBondContact O-N 3.19Å; V69-R71 PolarHBondContact O-N 3.28Å; V69-R72 PolarHBondContact O-N 2.99Å; V69-R72 VanDerWaalsContact O-N 3.14Å; V69-Y73 HydrophobicContact CG1-CD2 4.06Å; V69-Y73 WeakPolarHBondContact O-CD2 3.41Å; V69-Y73 PolarHBondContact O-N 3.32Å; V69-F74 HydrophobicContact CG1-CE2 4.21Å
70H96.6Very high92.7Very high71 Ų7178.8 Ų78.833%0.32938%0.378SS..Hα-helixtrans-61.4-42177.5-81.5-72000113Y39 F66 I67 Q68 R72 F74 H75Y39-H70 AromaticContact CE2-CE1 3.92Å; Y39-H70 AromaticContact CE2-NE2 3.62Å; Y39-H70 AromaticContact CZ-NE2 3.54Å; Y39-H70 PolarHBondContact OH-NE2 3.35Å; F66-H70 PolarHBondContact O-CD2 3.39Å; F66-H70 PolarHBondContact O-N 3.39Å; I67-H70 PolarHBondContact O-N 3.25Å; Q68-H70 PolarHBondContact O-N 2.72Å; H70-R72 VanDerWaalsContact C-N 3.3Å; H70-R72 PolarHBondContact O-N 3.44Å; H70-F74 AromaticContact CE1-CD2 3.89Å; H70-F74 AromaticContact ND1-CD2 3.48Å; H70-F74 WeakPolarHBondContact ND1-CD2 3.37Å; H70-F74 CarbonylContact O-C 3.25Å; H70-F74 VanDerWaalsContact O-C 3.25Å; H70-F74 VanDerWaalsContact O-CA 3.32Å; H70-F74 WeakPolarHBondContact O-CA 3.43Å; H70-F74 PolarHBondContact O-N 3.33Å; H70-H75 PolarHBondContact O-N 2.97Å; H70-H75 VanDerWaalsContact O-N 3.08Å
71R96.6Very high90.9Very high186 Ų18674.3 Ų74.370%0.70238%0.384SS*.Hα-helixtrans-64.8-32.8174.7-75.5176.7179.5174.51.7112.8I67 Q68 V69 H75I67-R71 WeakPolarHBondContact O-CB 3.41Å; I67-R71 VanDerWaalsContact O-CG 3.32Å; I67-R71 WeakPolarHBondContact O-CG 3.49Å; I67-R71 PolarHBondContact O-N 3.31Å; Q68-R71 PolarHBondContact O-N 2.87Å; V69-R71 PolarHBondContact O-N 3.28Å; R71-H75 WeakPolarHBondContact O-CB 3.44Å
72R95.8Very high89.3Confident176 Ų17677.7 Ų77.766%0.66440%0.396SS*.Hα-helixtrans-80.1-51-178.1-175.260.6179.5170.12.8112.1Q68 V69 H70Q68-R72 WeakPolarHBondContact O-CB 3.45Å; Q68-R72 PolarHBondContact O-N 3.35Å; V69-R72 PolarHBondContact O-N 2.99Å; V69-R72 VanDerWaalsContact O-N 3.14Å; H70-R72 VanDerWaalsContact C-N 3.3Å; H70-R72 PolarHBondContact O-N 3.44Å
73Y95.8Very high87.8Confident24 Ų2486.9 Ų86.99%0.09443%0.43CS..Hα-helixtrans-99.9-29.6-169.8-62.9-80.7000113.3F17 M21 W29 V69F17-Y73 HydrophobicContact CD1-CD2 4.44Å; F17-Y73 HydrophobicContact CD1-CE2 4.07Å; F17-Y73 AromaticContact CE1-CD2 3.72Å; F17-Y73 HydrophobicContact CE1-CD2 3.72Å; F17-Y73 AromaticContact CE1-CE2 3.8Å; F17-Y73 HydrophobicContact CE1-CE2 3.8Å; F17-Y73 HydrophobicContact CE1-CG 4.17Å; M21-Y73 HydrophobicContact CB-CD1 4.18Å; M21-Y73 HydrophobicContact CB-CE1 3.89Å; M21-Y73 HydrophobicContact CE-CD1 3.8Å; M21-Y73 HydrophobicContact CE-CG 4.16Å; M21-Y73 HydrophobicContact CG-CD1 4.18Å; M21-Y73 HydrophobicContact CG-CE1 4.18Å; W29-Y73 HydrophobicContact CD2-CD1 4.31Å; W29-Y73 HydrophobicContact CE3-CD1 4.22Å; W29-Y73 AromaticContact CH2-CD1 3.78Å; W29-Y73 HydrophobicContact CH2-CD1 3.78Å; W29-Y73 HydrophobicContact CH2-CE1 4.21Å; W29-Y73 AromaticContact CZ2-CD1 3.89Å; W29-Y73 HydrophobicContact CZ2-CD1 3.89Å; W29-Y73 HydrophobicContact CZ2-CE1 4.23Å; W29-Y73 AromaticContact CZ3-CD1 3.95Å; W29-Y73 HydrophobicContact CZ3-CD1 3.95Å; V69-Y73 HydrophobicContact CG1-CD2 4.06Å; V69-Y73 WeakPolarHBondContact O-CD2 3.41Å; V69-Y73 PolarHBondContact O-N 3.32Å
74F94.8Very high86.6Confident14 Ų1491.6 Ų91.66%0.06145%0.454CS..SBendtrans-117.711.8-168.1-53.1-61.6000114.3F17 M21 W29 T35 Y39 V69 H70 N76 C77F17-F74 HydrophobicContact CZ-CE2 4.2Å; F17-F74 HydrophobicContact CZ-CZ 4.05Å; M21-F74 HydrophobicContact CE-CE1 4.17Å; M21-F74 HydrophobicContact CE-CZ 4.23Å; W29-F74 VanDerWaalsContact O-CD1 3.23Å; W29-F74 WeakPolarHBondContact O-CD1 3.38Å; W29-F74 WeakPolarHBondContact O-CE1 3.06Å; T35-F74 HydrophobicContact CG2-CE1 4.22Å; Y39-F74 AromaticContact CD2-CE2 3.98Å; Y39-F74 HydrophobicContact CD2-CE2 3.98Å; Y39-F74 HydrophobicContact CD2-CZ 4.4Å; Y39-F74 HydrophobicContact CE2-CE2 4.15Å; V69-F74 HydrophobicContact CG1-CE2 4.21Å; H70-F74 AromaticContact CE1-CD2 3.89Å; H70-F74 AromaticContact ND1-CD2 3.48Å; H70-F74 WeakPolarHBondContact ND1-CD2 3.37Å; H70-F74 CarbonylContact O-C 3.25Å; H70-F74 VanDerWaalsContact O-C 3.25Å; H70-F74 VanDerWaalsContact O-CA 3.32Å; H70-F74 WeakPolarHBondContact O-CA 3.43Å; H70-F74 PolarHBondContact O-N 3.33Å; F74-N76 VanDerWaalsContact C-N 3.28Å; F74-N76 PolarHBondContact O-N 3.41Å; F74-C77 HydrophobicContact CB-CB 4.46Å; F74-C77 WeakPolarHBondContact O-CB 3.49Å; F74-C77 PolarHBondContact O-N 2.73Å
75H93.6Very high85.6Confident112 Ų11297.8 Ų97.852%0.51948%0.475SS..THydrogen-bonded Turntrans-60.6-29.6-17367.8-76.8000115.2H70 R71H70-H75 PolarHBondContact O-N 2.97Å; H70-H75 VanDerWaalsContact O-N 3.08Å; R71-H75 WeakPolarHBondContact O-CB 3.44Å
76N92.2Very high85Confident128 Ų128103.7 Ų103.768%0.68451%0.506SS*.THydrogen-bonded Turntrans-96.61.6178.5-67.9-28000113.2F74F74-N76 VanDerWaalsContact C-N 3.28Å; F74-N76 PolarHBondContact O-N 3.41Å
77C91.1Very high84.3Confident20 Ų20105.2 Ų105.214%0.13552%0.519CS..  trans-83.5130.6-174.3-57.20000111.4C30 F74C30-C77 WeakPolarHBondContact CA-SG 3.27Å; C30-C77 HydrophobicContact CB-CB 3.74Å; C30-C77 WeakPolarHBondContact CB-SG 2.97Å; C30-C77 WeakPolarHBondContact SG-CA 3.29Å; C30-C77 WeakPolarHBondContact SG-CB 3.45Å; C30-C77 CovalentContact SG-SG 2.05Å; C30-C77 PolarHBondContact SG-SG 2.88Å; F74-C77 HydrophobicContact CB-CB 4.46Å; F74-C77 WeakPolarHBondContact O-CB 3.49Å; F74-C77 PolarHBondContact O-N 2.73Å
78S84.8Confident83.9Confident85 Ų85105.2 Ų105.259%0.59452%0.524SS*.  trans-72.2142.8175.583.10000111.2S80S78-S80 PolarHBondContact O-N 3.13Å
79M71.9Confident83.5Confident148 Ų148106.7 Ų106.773%0.72954%0.535SS*.G310 helixtrans-75-6.4175.8-69.1-75.3-81.700113.1G81M79-G81 VanDerWaalsContact C-N 3.3Å; M79-G81 PolarHBondContact O-N 3.4Å
80S61.4Low83.3Confident107 Ų107117 Ų11775%0.74857%0.574SS**G310 helixtrans-71.8-17-162.4-55.50000114.9S78S78-S80 PolarHBondContact O-N 3.13Å
81G58Low83.1Confident75 Ų75117.7 Ų117.777%0.77358%0.579SS**G310 helixtrans-97.3-13-175.200000116.4M79M79-G81 VanDerWaalsContact C-N 3.3Å; M79-G81 PolarHBondContact O-N 3.4Å
82R62.5Low83Confident100 Ų100111.5 Ų111.538%0.37756%0.56SS.*THydrogen-bonded Turntrans-95.5-19.9-172.1-66.3-168.7-154106.71.4114.9W32W32-R82 HydrophobicContact CG-CG 4.49Å
83R66.2Low83.1Confident194 Ų194104.4 Ų104.473%0.73254%0.542SS*.SBendtrans-96114.7-174.9-132.5-172.6-156.6-169.66.7108.9R85R83-R85 PolarHBondContact O-N 3.37Å
84L70.6Confident83.1Confident186 Ų186106.7 Ų106.797%0.97456%0.56SS**  trans-52.9108158.8-79.9151.7000106.9
85R77.6Confident83.2Confident202 Ų202113.2 Ų113.276%0.76259%0.588SS**  trans-142.9141.3-177.8-164.3171.1-161.6-175.12.3108R83R83-R85 PolarHBondContact O-N 3.37Å
86D82.9Confident83.3Confident132 Ų132112.2 Ų112.271%0.70659%0.586SS**PPolyproline II helixtrans-56.5142.5172.4-64-45.3000110.2
87P84.6Confident83.6Confident56 Ų56109.7 Ų109.736%0.36458%0.575SS.*PPolyproline II helixtrans-60.5152.5174.325-31000109.6N89 I91 L92P87-N89 PolarHBondContact O-N 2.93Å; P87-I91 HydrophobicContact CB-CB 4.4Å; P87-I91 HydrophobicContact CB-CG2 4.44Å; P87-L92 HydrophobicContact CG-CB 4.18Å; P87-L92 HydrophobicContact CG-CD1 4.14Å
88P88.4Confident84Confident84 Ų84112.8 Ų112.855%0.54559%0.593SS.*PPolyproline II helixtrans-55144.3178.822.7-33.2000111R90 I91 L92P88-R90 PolarHBondContact O-N 3.48Å; P88-I91 HydrophobicContact CG-CD1 3.86Å; P88-I91 HydrophobicContact CG-CG1 4.15Å; P88-I91 PolarHBondContact O-N 3.11Å; P88-L92 PolarHBondContact O-N 2.79Å; P88-L92 VanDerWaalsContact O-N 3.11Å
89N90.9Very high84.6Confident136 Ų136112 Ų11273%0.72759%0.586SS**Hα-helixtrans-53.9-26.1-175-67.49.2000113.9P87 I91 G93P87-N89 PolarHBondContact O-N 2.93Å; N89-I91 PolarHBondContact O-N 2.92Å; N89-G93 WeakPolarHBondContact O-CA 3.17Å; N89-G93 PolarHBondContact O-N 3.14Å
90R93.3Very high85.8Confident222 Ų222109.5 Ų109.584%0.83857%0.574SS**Hα-helixtrans-60.7-32.5173.9-176.8-178.7-68.6-165.8-0.7112.8P88 P94P88-R90 PolarHBondContact O-N 3.48Å; R90-P94 WeakPolarHBondContact O-CD 3.23Å; R90-P94 WeakPolarHBondContact O-CG 3.49Å
91I92.5Very high87.6Confident85 Ų85109 Ų10944%0.43656%0.563SS.*Hα-helixtrans-90.3-50176.6-59.1177.5000109.1P87 P88 N89 G93 P94 F95P87-I91 HydrophobicContact CB-CB 4.4Å; P87-I91 HydrophobicContact CB-CG2 4.44Å; P88-I91 HydrophobicContact CG-CD1 3.86Å; P88-I91 HydrophobicContact CG-CG1 4.15Å; P88-I91 PolarHBondContact O-N 3.11Å; N89-I91 PolarHBondContact O-N 2.92Å; I91-G93 PolarHBondContact O-N 3.22Å; I91-P94 WeakPolarHBondContact O-CD 3.4Å; I91-F95 HydrophobicContact CG2-CD2 3.91Å; I91-F95 HydrophobicContact CG2-CE2 3.74Å; I91-F95 VanDerWaalsContact O-CD2 3.23Å; I91-F95 WeakPolarHBondContact O-CD2 3.33Å
92L94.9Very high89.5Confident55 Ų55109.2 Ų109.229%0.28855%0.549SS..Hα-helixtrans-62.2-40.5-175.5-171.560.3000113.1P87 P88 F95 I96P87-L92 HydrophobicContact CG-CB 4.18Å; P87-L92 HydrophobicContact CG-CD1 4.14Å; P88-L92 PolarHBondContact O-N 2.79Å; P88-L92 VanDerWaalsContact O-N 3.11Å; L92-F95 WeakPolarHBondContact O-CB 3.34Å; L92-F95 PolarHBondContact O-N 3.39Å; L92-I96 HydrophobicContact CD1-CD1 4.28Å; L92-I96 HydrophobicContact CD2-CD1 4.5Å; L92-I96 HydrophobicContact CG-CD1 3.9Å; L92-I96 WeakPolarHBondContact O-CG1 3.2Å; L92-I96 PolarHBondContact O-N 2.85Å; L92-I96 VanDerWaalsContact O-N 3.14Å
93G96.2Very high91.2Very high28 Ų28108.4 Ų108.429%0.28956%0.555SS.*Hα-helixtrans-57.7-54.9-177.400000113.2N89 I91 F95 I96 V97N89-G93 WeakPolarHBondContact O-CA 3.17Å; N89-G93 PolarHBondContact O-N 3.14Å; I91-G93 PolarHBondContact O-N 3.22Å; G93-F95 VanDerWaalsContact C-N 3.3Å; G93-F95 PolarHBondContact O-N 3.35Å; G93-I96 PolarHBondContact O-N 2.92Å; G93-V97 WeakPolarHBondContact O-CG2 3.36Å; G93-V97 PolarHBondContact O-N 3.27Å
94P97.1Very high92.7Very high72 Ų72103.2 Ų103.247%0.46855%0.545SS..Hα-helixtrans-55-41.1173.8-2935000113.9R90 I91 I96 V97 V98R90-P94 WeakPolarHBondContact O-CD 3.23Å; R90-P94 WeakPolarHBondContact O-CG 3.49Å; I91-P94 WeakPolarHBondContact O-CD 3.4Å; P94-I96 PolarHBondContact O-N 2.97Å; P94-V97 PolarHBondContact O-N 3.06Å; P94-V98 WeakPolarHBondContact O-CB 3.45Å; P94-V98 VanDerWaalsContact O-CG2 3.3Å; P94-V98 WeakPolarHBondContact O-CG2 3.41Å; P94-V98 PolarHBondContact O-N 3.35Å
95F96.3Very high94Very high150 Ų15099.6 Ų99.666%0.65853%0.526SS*.Hα-helixtrans-61.9-27.8176.9-86-70.4000113.3I91 L92 G93 P99I91-F95 HydrophobicContact CG2-CD2 3.91Å; I91-F95 HydrophobicContact CG2-CE2 3.74Å; I91-F95 VanDerWaalsContact O-CD2 3.23Å; I91-F95 WeakPolarHBondContact O-CD2 3.33Å; L92-F95 WeakPolarHBondContact O-CB 3.34Å; L92-F95 PolarHBondContact O-N 3.39Å; G93-F95 VanDerWaalsContact C-N 3.3Å; G93-F95 PolarHBondContact O-N 3.35Å; F95-P99 WeakPolarHBondContact O-CD 3.3Å; F95-P99 WeakPolarHBondContact O-CG 3.44Å
96I96.9Very high94.9Very high92 Ų9295.1 Ų95.147%0.47252%0.515SS..Hα-helixtrans-84.8-46.2175.8-64.5167.5000110.9L92 G93 P94 P99 I100L92-I96 HydrophobicContact CD1-CD1 4.28Å; L92-I96 HydrophobicContact CD2-CD1 4.5Å; L92-I96 HydrophobicContact CG-CD1 3.9Å; L92-I96 WeakPolarHBondContact O-CG1 3.2Å; L92-I96 PolarHBondContact O-N 2.85Å; L92-I96 VanDerWaalsContact O-N 3.14Å; G93-I96 PolarHBondContact O-N 2.92Å; P94-I96 PolarHBondContact O-N 2.97Å; I96-P99 WeakPolarHBondContact O-CD 3.04Å; I96-I100 HydrophobicContact CG2-CD1 4Å; I96-I100 WeakPolarHBondContact O-CD1 3.46Å; I96-I100 WeakPolarHBondContact O-CG1 3.37Å
97V97.8Very high95.6Very high75 Ų7593 Ų9346%0.45551%0.506SS..Hα-helixtrans-70.9-41.4-172.4173.50000112G93 P94 I100 L101G93-V97 WeakPolarHBondContact O-CG2 3.36Å; G93-V97 PolarHBondContact O-N 3.27Å; P94-V97 PolarHBondContact O-N 3.06Å; V97-I100 PolarHBondContact O-N 3.23Å; V97-L101 HydrophobicContact CG1-CD1 3.7Å; V97-L101 HydrophobicContact CG1-CG 4.01Å; V97-L101 WeakPolarHBondContact O-CG 3.39Å; V97-L101 PolarHBondContact O-N 2.96Å
98V98.1Very high96.1Very high84 Ų8493 Ų9351%0.50951%0.512SS..Hα-helixtrans-60.4-50-175.8169.40000112.2P94 I100 L101 V102P94-V98 WeakPolarHBondContact O-CB 3.45Å; P94-V98 VanDerWaalsContact O-CG2 3.3Å; P94-V98 WeakPolarHBondContact O-CG2 3.41Å; P94-V98 PolarHBondContact O-N 3.35Å; V98-I100 VanDerWaalsContact C-N 3.31Å; V98-I100 PolarHBondContact O-N 3.24Å; V98-L101 PolarHBondContact O-N 2.88Å; V98-V102 HydrophobicContact CG1-CG2 4.39Å; V98-V102 VanDerWaalsContact O-CG2 3.32Å; V98-V102 WeakPolarHBondContact O-CG2 3.4Å; V98-V102 PolarHBondContact O-N 2.96Å
99P97.6Very high96.5Very high70 Ų7093.5 Ų93.546%0.45551%0.509SS..Hα-helixtrans-57.8-40.3175.8-26.535.2000113.5F95 I96 V102 T103F95-P99 WeakPolarHBondContact O-CD 3.3Å; F95-P99 WeakPolarHBondContact O-CG 3.44Å; I96-P99 WeakPolarHBondContact O-CD 3.04Å; P99-V102 PolarHBondContact O-N 2.99Å; P99-T103 WeakPolarHBondContact O-CG2 3.31Å; P99-T103 PolarHBondContact O-N 3.41Å; P99-T103 PolarHBondContact O-OG1 2.89Å
100I98.3Very high96.8Very high95 Ų9591.4 Ų91.449%0.48750%0.501SS..Hα-helixtrans-63.5-45.1178.1-64169.3000110.7I96 V97 V98 V102 T103 V104I96-I100 HydrophobicContact CG2-CD1 4Å; I96-I100 WeakPolarHBondContact O-CD1 3.46Å; I96-I100 WeakPolarHBondContact O-CG1 3.37Å; V97-I100 PolarHBondContact O-N 3.23Å; V98-I100 VanDerWaalsContact C-N 3.31Å; V98-I100 PolarHBondContact O-N 3.24Å; I100-V102 VanDerWaalsContact C-N 3.32Å; I100-V102 PolarHBondContact O-N 3.34Å; I100-T103 PolarHBondContact O-N 3.02Å; I100-T103 PolarHBondContact O-OG1 3.33Å; I100-V104 VanDerWaalsContact O-CG2 3.31Å; I100-V104 WeakPolarHBondContact O-CG2 3.39Å; I100-V104 PolarHBondContact O-N 3.37Å
101L98.3Very high96.9Very high97 Ų9784.7 Ų84.751%0.50848%0.484SS..Hα-helixtrans-63.4-40.8177.3-68.5176.9000111.3V97 V98 V104 L105V97-L101 HydrophobicContact CG1-CD1 3.7Å; V97-L101 HydrophobicContact CG1-CG 4.01Å; V97-L101 WeakPolarHBondContact O-CG 3.39Å; V97-L101 PolarHBondContact O-N 2.96Å; V98-L101 PolarHBondContact O-N 2.88Å; L101-V104 PolarHBondContact O-N 3.35Å; L101-L105 WeakPolarHBondContact O-CB 3.32Å; L101-L105 VanDerWaalsContact O-CG 3.22Å; L101-L105 WeakPolarHBondContact O-CG 3.36Å; L101-L105 PolarHBondContact O-N 3.31Å
102V98.3Very high96.9Very high78 Ų7886.9 Ų86.947%0.47349%0.487SS..Hα-helixtrans-62.5-45.3176.8171.80000111.3V98 P99 I100 V104 L105 M106V98-V102 HydrophobicContact CG1-CG2 4.39Å; V98-V102 VanDerWaalsContact O-CG2 3.32Å; V98-V102 WeakPolarHBondContact O-CG2 3.4Å; V98-V102 PolarHBondContact O-N 2.96Å; P99-V102 PolarHBondContact O-N 2.99Å; I100-V102 VanDerWaalsContact C-N 3.32Å; I100-V102 PolarHBondContact O-N 3.34Å; V102-V104 PolarHBondContact O-N 2.93Å; V102-L105 PolarHBondContact O-N 2.91Å; V102-M106 HydrophobicContact CG1-CG 4.25Å; V102-M106 WeakPolarHBondContact O-CB 3.22Å; V102-M106 VanDerWaalsContact O-CG 3.26Å; V102-M106 WeakPolarHBondContact O-CG 3.36Å; V102-M106 PolarHBondContact O-N 2.86Å
103T97.8Very high96.8Very high84 Ų8492.3 Ų92.352%0.51550%0.504SS..Hα-helixtrans-64.3-41.4178.456.50000111.8P99 I100 M106 T107P99-T103 WeakPolarHBondContact O-CG2 3.31Å; P99-T103 PolarHBondContact O-N 3.41Å; P99-T103 PolarHBondContact O-OG1 2.89Å; I100-T103 PolarHBondContact O-N 3.02Å; I100-T103 PolarHBondContact O-OG1 3.33Å; T103-M106 PolarHBondContact O-N 3.49Å; T103-T107 WeakPolarHBondContact O-CB 3.43Å; T103-T107 VanDerWaalsContact O-CG2 3.28Å; T103-T107 WeakPolarHBondContact O-CG2 3.28Å; T103-T107 PolarHBondContact O-N 3.47Å; T103-T107 PolarHBondContact O-OG1 3.34Å
104V98.1Very high96.4Very high84 Ų8493.9 Ų93.951%0.50951%0.51SS..Hα-helixtrans-63.6-43.6175.6172.70000111.5I100 L101 V102 T107 A108I100-V104 VanDerWaalsContact O-CG2 3.31Å; I100-V104 WeakPolarHBondContact O-CG2 3.39Å; I100-V104 PolarHBondContact O-N 3.37Å; L101-V104 PolarHBondContact O-N 3.35Å; V102-V104 PolarHBondContact O-N 2.93Å; V104-T107 WeakPolarHBondContact CA-OG1 3.39Å; V104-T107 PolarHBondContact O-OG1 3.46Å; V104-A108 WeakPolarHBondContact O-CB 3.26Å; V104-A108 PolarHBondContact O-N 2.88Å
105L97.9Very high95.9Very high111 Ų11197.4 Ų97.458%0.58152%0.518SS*.Hα-helixtrans-64.6-45.4177.5-74169.9000111.9L101 V102 A108 L109L101-L105 WeakPolarHBondContact O-CB 3.32Å; L101-L105 VanDerWaalsContact O-CG 3.22Å; L101-L105 WeakPolarHBondContact O-CG 3.36Å; L101-L105 PolarHBondContact O-N 3.31Å; V102-L105 PolarHBondContact O-N 2.91Å; L105-A108 PolarHBondContact O-N 2.94Å; L105-L109 WeakPolarHBondContact O-CB 3.31Å; L105-L109 VanDerWaalsContact O-CG 3.27Å; L105-L109 WeakPolarHBondContact O-CG 3.26Å; L105-L109 PolarHBondContact O-N 2.9Å
106M97.4Very high95.2Very high108 Ų10897.1 Ų97.153%0.53251%0.513SS..Hα-helixtrans-64.2-43179.2-72.4-59.7-64.100111.9V102 T103 L109 V110V102-M106 HydrophobicContact CG1-CG 4.25Å; V102-M106 WeakPolarHBondContact O-CB 3.22Å; V102-M106 VanDerWaalsContact O-CG 3.26Å; V102-M106 WeakPolarHBondContact O-CG 3.36Å; V102-M106 PolarHBondContact O-N 2.86Å; T103-M106 PolarHBondContact O-N 3.49Å; M106-L109 PolarHBondContact O-N 2.86Å; M106-L109 HydrophobicContact SD-CD1 4.23Å; M106-V110 WeakPolarHBondContact O-CB 3.49Å; M106-V110 VanDerWaalsContact O-CG2 3.26Å; M106-V110 WeakPolarHBondContact O-CG2 3.27Å; M106-V110 PolarHBondContact O-N 3.45Å
107T96.5Very high94Very high86 Ų8697 Ų9753%0.52852%0.52SS..Hα-helixtrans-62.7-43.7175.750.40000111.5T103 V104 L109 V110 V111T103-T107 WeakPolarHBondContact O-CB 3.43Å; T103-T107 VanDerWaalsContact O-CG2 3.28Å; T103-T107 WeakPolarHBondContact O-CG2 3.28Å; T103-T107 PolarHBondContact O-N 3.47Å; T103-T107 PolarHBondContact O-OG1 3.34Å; V104-T107 WeakPolarHBondContact CA-OG1 3.39Å; V104-T107 PolarHBondContact O-OG1 3.46Å; T107-L109 PolarHBondContact O-N 3.46Å; T107-V110 PolarHBondContact O-N 3.3Å; T107-V111 VanDerWaalsContact O-CG2 3.31Å; T107-V111 WeakPolarHBondContact O-CG2 3.39Å; T107-V111 PolarHBondContact O-N 2.88Å
108A96.4Very high92.4Very high57 Ų57100.3 Ų100.347%0.47153%0.53SS..Hα-helixtrans-60.5-43.6174.400000112.4V104 L105 V111 W112V104-A108 WeakPolarHBondContact O-CB 3.26Å; V104-A108 PolarHBondContact O-N 2.88Å; L105-A108 PolarHBondContact O-N 2.94Å; A108-V111 PolarHBondContact O-N 3.32Å; A108-W112 VanDerWaalsContact O-CB 3.31Å; A108-W112 WeakPolarHBondContact O-CB 3.44Å; A108-W112 PolarHBondContact O-N 2.95Å
109L96.9Very high90.5Very high95 Ų9599.3 Ų99.350%0.49754%0.538SS..Hα-helixtrans-62.1-43.4176.5-75.3171.7000112L105 M106 T107 W112 R113L105-L109 WeakPolarHBondContact O-CB 3.31Å; L105-L109 VanDerWaalsContact O-CG 3.27Å; L105-L109 WeakPolarHBondContact O-CG 3.26Å; L105-L109 PolarHBondContact O-N 2.9Å; M106-L109 PolarHBondContact O-N 2.86Å; M106-L109 HydrophobicContact SD-CD1 4.23Å; T107-L109 PolarHBondContact O-N 3.46Å; L109-W112 PolarHBondContact O-N 3.42Å; L109-R113 WeakPolarHBondContact O-CB 3.31Å; L109-R113 WeakPolarHBondContact O-CG 3.41Å; L109-R113 PolarHBondContact O-N 3.46Å
110V95.8Very high88.4Confident91 Ų91102.1 Ų102.155%0.55255%0.547SS*.Hα-helixtrans-63.5-48.2177.5169.50000110.7M106 T107 W112 R113 S114M106-V110 WeakPolarHBondContact O-CB 3.49Å; M106-V110 VanDerWaalsContact O-CG2 3.26Å; M106-V110 WeakPolarHBondContact O-CG2 3.27Å; M106-V110 PolarHBondContact O-N 3.45Å; T107-V110 PolarHBondContact O-N 3.3Å; V110-W112 VanDerWaalsContact C-N 3.32Å; V110-W112 PolarHBondContact O-N 3.44Å; V110-R113 PolarHBondContact O-N 2.88Å; V110-S114 VanDerWaalsContact O-CB 3.31Å; V110-S114 WeakPolarHBondContact O-CB 3.31Å; V110-S114 PolarHBondContact O-N 3.32Å
111V95.1Very high85.8Confident81 Ų81107 Ų10749%0.49158%0.581SS.*Hα-helixtrans-60.2-43.9177.6171.10000111T107 A108 S114 K115T107-V111 VanDerWaalsContact O-CG2 3.31Å; T107-V111 WeakPolarHBondContact O-CG2 3.39Å; T107-V111 PolarHBondContact O-N 2.88Å; A108-V111 PolarHBondContact O-N 3.32Å; V111-S114 PolarHBondContact O-N 2.91Å; V111-K115 HydrophobicContact CG1-CD 4.41Å; V111-K115 WeakPolarHBondContact O-CG 3.48Å; V111-K115 PolarHBondContact O-N 3.04Å
112W93.7Very high85.2Confident132 Ų132107.5 Ų107.550%0.559%0.585SS.*Hα-helixtrans-63.4-45.9178.4178.678.7000112.3A108 L109 V110 R116A108-W112 VanDerWaalsContact O-CB 3.31Å; A108-W112 WeakPolarHBondContact O-CB 3.44Å; A108-W112 PolarHBondContact O-N 2.95Å; L109-W112 PolarHBondContact O-N 3.42Å; V110-W112 VanDerWaalsContact C-N 3.32Å; V110-W112 PolarHBondContact O-N 3.44Å; W112-R116 WeakPolarHBondContact O-CB 3.37Å; W112-R116 PolarHBondContact O-N 3.01Å
113R91.4Very high84.5Confident169 Ų169109.1 Ų109.164%0.63859%0.591SS**Hα-helixtrans-62.4-44.3176.6-79.1-64.2-156.2174.16.3112.1L109 V110 R116 S117L109-R113 WeakPolarHBondContact O-CB 3.31Å; L109-R113 WeakPolarHBondContact O-CG 3.41Å; L109-R113 PolarHBondContact O-N 3.46Å; V110-R113 PolarHBondContact O-N 2.88Å; R113-R116 PolarHBondContact O-N 2.97Å; R113-S117 WeakPolarHBondContact O-CB 3.48Å; R113-S117 PolarHBondContact O-N 3.37Å
114S89.3Confident83.7Confident60 Ų60110.4 Ų110.442%0.4260%0.595SS.*Hα-helixtrans-61.5-50.4179.2168.20000111.2V110 V111 R116 S117 E118V110-S114 VanDerWaalsContact O-CB 3.31Å; V110-S114 WeakPolarHBondContact O-CB 3.31Å; V110-S114 PolarHBondContact O-N 3.32Å; V111-S114 PolarHBondContact O-N 2.91Å; S114-R116 VanDerWaalsContact C-N 3.33Å; S114-R116 PolarHBondContact O-N 3.34Å; S114-S117 WeakPolarHBondContact O-CB 3.47Å; S114-S117 PolarHBondContact O-N 3.01Å; S114-S117 VanDerWaalsContact O-N 3.11Å; S114-E118 PolarHBondContact O-N 3.01Å
115K85.3Confident82.9Confident146 Ų146112 Ų11264%0.63560%0.6SS**Hα-helixtrans-61.9-36.8176.9-73.2-170.7175.8-171.30113.5V111 S117 E118 G119V111-K115 HydrophobicContact CG1-CD 4.41Å; V111-K115 WeakPolarHBondContact O-CG 3.48Å; V111-K115 PolarHBondContact O-N 3.04Å; K115-S117 VanDerWaalsContact C-N 3.33Å; K115-E118 PolarHBondContact O-N 3.46Å; K115-G119 PolarHBondContact O-N 3.11Å
116R81.8Confident82Confident145 Ų145112.1 Ų112.155%0.54760%0.601SS.*Hα-helixtrans-69.3-32.5176-173.9171.7-178.3156.83112.4W112 R113 S114W112-R116 WeakPolarHBondContact O-CB 3.37Å; W112-R116 PolarHBondContact O-N 3.01Å; R113-R116 PolarHBondContact O-N 2.97Å; S114-R116 VanDerWaalsContact C-N 3.33Å; S114-R116 PolarHBondContact O-N 3.34Å
117S72.4Confident80.9Confident88 Ų88112.3 Ų112.362%0.61561%0.606SS**Hα-helixtrans-71.9-35.8175.2-166.30000112R113 S114 K115R113-S117 WeakPolarHBondContact O-CB 3.48Å; R113-S117 PolarHBondContact O-N 3.37Å; S114-S117 WeakPolarHBondContact O-CB 3.47Å; S114-S117 PolarHBondContact O-N 3.01Å; S114-S117 VanDerWaalsContact O-N 3.11Å; K115-S117 VanDerWaalsContact C-N 3.33Å
118E64.6Low79.8Confident145 Ų145114.2 Ų114.268%0.67861%0.611SS**Hα-helixtrans-74.6-30.1175.7-69.5-177.6168.500113S114 K115 I120S114-E118 PolarHBondContact O-N 3.01Å; K115-E118 PolarHBondContact O-N 3.46Å; E118-I120 VanDerWaalsContact C-N 3.26Å; E118-I120 PolarHBondContact O-N 3.43Å
119G57.2Low78.5Confident64 Ų64118.6 Ų118.666%0.6662%0.622SS**THydrogen-bonded Turntrans-80.22.5174.500000115.2K115K115-G119 PolarHBondContact O-N 3.11Å
120I53.2Low77Confident128 Ų128120.6 Ų120.666%0.65663%0.633SS**  trans-106.767.6167.8-71.3167.6000107.1E118E118-I120 VanDerWaalsContact C-N 3.26Å; E118-I120 PolarHBondContact O-N 3.43Å
121V44.4Very low75.3Confident198 Ų198123.3 Ų123.3100%1.264%0.64SS**  trans-144.50158.8-177.20000107

Retrieved 121 of 121 residues in 185 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).