A0A3Q0KIM8_SCHMA Loading...

Sugar phosphate exchanger 3

AlphaFold DB , UniProt , Accession A0A3Q0KIM8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 510 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
1M44Very low71Confident196 Ų19690.9 Ų90.997%0.96645%0.447SS*.  0117.80-137.2177.6-169.100107.3R3M1-R3 PolarHBondContact O-N 2.84Å; M1-R3 VanDerWaalsContact O-N 3.14Å
2K52.9Low71.1Confident207 Ų20786.9 Ų86.990%0.943%0.425SS*.  trans-56.8119.8173.8-79.6-176.1175.3-1770107.5S4K2-S4 PolarHBondContact O-N 3.34Å; K2-S4 VanDerWaalsContact O-N 3.1Å
3R67.1Low70.9Confident83 Ų8384.2 Ų84.231%0.31341%0.411SS..  trans-70.4106.4179.4-66.7-176.6171.2167.1-5.4108M1 E228 M232M1-R3 PolarHBondContact O-N 2.84Å; M1-R3 VanDerWaalsContact O-N 3.14Å; R3-E228 WeakPolarHBondContact CD-OE2 3.2Å; R3-E228 IonicContact NE-OE2 2.85Å; R3-E228 PolarHBondContact NE-OE2 3.04Å; R3-M232 HydrophobicContact CB-CG 4.05Å; R3-M232 HydrophobicContact CB-SD 3.54Å; R3-M232 VanDerWaalsContact CB-SD 3.54Å
4S71.9Confident70.1Confident52 Ų5286.1 Ų86.136%0.36443%0.43SS..PPolyproline II helixtrans-87.9149.5179.1620000111.2K2 R112K2-S4 PolarHBondContact O-N 3.34Å; K2-S4 VanDerWaalsContact O-N 3.1Å; S4-R112 PolarHBondContact O-NH1 3.17Å; S4-R112 PolarHBondContact OG-NH2 2.93Å
5L80Confident69.8Low43 Ų4386.5 Ų86.523%0.22544%0.444CS..PPolyproline II helixtrans-60.5149.8168.7-70.4167.1000110.7Y9 R112 M232 L233 N236L5-Y9 HydrophobicContact CB-CD1 4.29Å; L5-Y9 HydrophobicContact CB-CG 4.19Å; L5-Y9 HydrophobicContact CD1-CD1 3.62Å; L5-Y9 HydrophobicContact CD1-CE1 3.88Å; L5-Y9 HydrophobicContact CD1-CG 4.3Å; L5-Y9 HydrophobicContact CD2-CD1 4.04Å; L5-Y9 HydrophobicContact CD2-CD2 4.15Å; L5-Y9 HydrophobicContact CD2-CE1 4.19Å; L5-Y9 HydrophobicContact CD2-CE2 4.33Å; L5-Y9 HydrophobicContact CD2-CG 4.01Å; L5-Y9 HydrophobicContact CG-CD1 4.2Å; L5-Y9 HydrophobicContact CG-CG 4.4Å; L5-R112 VanDerWaalsContact C-NH1 3.28Å; L5-R112 PolarHBondContact O-NH1 3.41Å; L5-M232 HydrophobicContact CD2-CB 4.26Å; L5-L233 HydrophobicContact CD2-CD2 4.03Å; L5-N236 HydrophobicContact CD1-CB 3.49Å; L5-N236 VanDerWaalsContact CD1-CB 3.49Å; L5-N236 HydrophobicContact CG-CB 4.09Å
6P83Confident69.5Low5 Ų585.6 Ų85.63%0.03244%0.444CS..PPolyproline II helixtrans-68.1153.4179.931-36.9000111.6C8 Y9 L224 V226 I227P6-C8 VanDerWaalsContact C-N 3.27Å; P6-C8 PolarHBondContact O-N 3.06Å; P6-Y9 WeakPolarHBondContact O-CB 3.29Å; P6-Y9 PolarHBondContact O-N 2.83Å; P6-L224 WeakPolarHBondContact CB-O 3.42Å; P6-V226 WeakPolarHBondContact CG-O 3.37Å; P6-I227 HydrophobicContact CG-CG1 4.09Å
7P82.2Confident69.3Low79 Ų7980.7 Ų80.751%0.51342%0.418SS..THydrogen-bonded Turntrans-54.6-39.2-173-27.334.7000114Y9 Y223 L224P7-Y9 VanDerWaalsContact C-N 3.33Å; P7-Y9 PolarHBondContact O-N 3.06Å; P7-Y223 HydrophobicContact CG-CE1 4.15Å; P7-L224 HydrophobicContact CB-CD2 4.27Å; P7-L224 HydrophobicContact CG-CD2 4.43Å
8C81.2Confident69.1Low42 Ų4286.7 Ų86.728%0.28444%0.435SS..THydrogen-bonded Turntrans-91.714.5179.1-62.10000113.4P6 R10 P11 F12 L224 T225P6-C8 VanDerWaalsContact C-N 3.27Å; P6-C8 PolarHBondContact O-N 3.06Å; C8-R10 PolarHBondContact O-N 3.1Å; C8-P11 HydrophobicContact CB-CG 4.14Å; C8-P11 VanDerWaalsContact O-CD 3.26Å; C8-P11 WeakPolarHBondContact O-CD 3.4Å; C8-P11 VanDerWaalsContact O-CG 3.29Å; C8-P11 WeakPolarHBondContact O-CG 3.15Å; C8-F12 WeakPolarHBondContact O-CB 3.2Å; C8-F12 PolarHBondContact O-N 2.64Å; C8-L224 HydrophobicContact CB-CB 4.29Å; C8-L224 VanDerWaalsContact CB-O 3.26Å; C8-L224 WeakPolarHBondContact CB-O 3.4Å; C8-L224 PolarHBondContact N-O 3.36Å; C8-T225 HydrophobicContact CB-CG2 4.49Å
9Y76.2Confident68.8Low17 Ų1788 Ų887%0.06744%0.443CS..Hα-helixtrans-57.4-50.8179.9-179.9-105.6000112.5L5 P6 P7 F12 Q13 I227 L233L5-Y9 HydrophobicContact CB-CD1 4.29Å; L5-Y9 HydrophobicContact CB-CG 4.19Å; L5-Y9 HydrophobicContact CD1-CD1 3.62Å; L5-Y9 HydrophobicContact CD1-CE1 3.88Å; L5-Y9 HydrophobicContact CD1-CG 4.3Å; L5-Y9 HydrophobicContact CD2-CD1 4.04Å; L5-Y9 HydrophobicContact CD2-CD2 4.15Å; L5-Y9 HydrophobicContact CD2-CE1 4.19Å; L5-Y9 HydrophobicContact CD2-CE2 4.33Å; L5-Y9 HydrophobicContact CD2-CG 4.01Å; L5-Y9 HydrophobicContact CG-CD1 4.2Å; L5-Y9 HydrophobicContact CG-CG 4.4Å; P6-Y9 WeakPolarHBondContact O-CB 3.29Å; P6-Y9 PolarHBondContact O-N 2.83Å; P7-Y9 VanDerWaalsContact C-N 3.33Å; P7-Y9 PolarHBondContact O-N 3.06Å; Y9-F12 CarbonylContact O-C 3.58Å; Y9-F12 PolarHBondContact O-N 3.07Å; Y9-Q13 HydrophobicContact CE1-CB 4.17Å; Y9-Q13 HydrophobicContact CE1-CG 4.21Å; Y9-Q13 HydrophobicContact CE2-CB 4.47Å; Y9-Q13 WeakPolarHBondContact O-CB 3.33Å; Y9-Q13 PolarHBondContact O-N 3.19Å; Y9-I227 HydrophobicContact CD2-CD1 3.62Å; Y9-I227 HydrophobicContact CD2-CG1 4.05Å; Y9-I227 HydrophobicContact CE2-CD1 3.49Å; Y9-I227 VanDerWaalsContact CE2-CD1 3.49Å; Y9-I227 HydrophobicContact CE2-CG1 4.33Å; Y9-L233 HydrophobicContact CE1-CD2 4.41Å; Y9-L233 HydrophobicContact CE2-CD2 3.64Å; Y9-L233 VanDerWaalsContact CZ-CD2 3.49Å; Y9-L233 WeakPolarHBondContact OH-CD2 3.45Å
10R71.1Confident69.3Low200 Ų20086.5 Ų86.576%0.75544%0.436SS*.Hα-helixtrans-60.3-49.8-177.8-71.5-174.4179.7178.40.5114.2C8 F12 Q13 T14C8-R10 PolarHBondContact O-N 3.1Å; R10-F12 VanDerWaalsContact C-N 3.27Å; R10-F12 PolarHBondContact O-N 3.49Å; R10-Q13 PolarHBondContact O-N 2.91Å; R10-T14 PolarHBondContact O-N 3.32Å; R10-T14 PolarHBondContact O-OG1 3.35Å
11P71.1Confident69.8Low76 Ų7685 Ų8549%0.49443%0.427SS..Hα-helixtrans-65-34.317622.7-31.7000111.8C8 T14 S15C8-P11 HydrophobicContact CB-CG 4.14Å; C8-P11 VanDerWaalsContact O-CD 3.26Å; C8-P11 WeakPolarHBondContact O-CD 3.4Å; C8-P11 VanDerWaalsContact O-CG 3.29Å; C8-P11 WeakPolarHBondContact O-CG 3.15Å; P11-T14 PolarHBondContact O-OG1 3.43Å; P11-S15 WeakPolarHBondContact O-CB 3.23Å; P11-S15 PolarHBondContact O-N 3.28Å
12F72.6Confident71.6Confident43 Ų4380 Ų8019%0.18940%0.397CS..Hα-helixtrans-73.4-34179-160.7-115.7000112.8C8 Y9 R10 V16 L17 Y27C8-F12 WeakPolarHBondContact O-CB 3.2Å; C8-F12 PolarHBondContact O-N 2.64Å; Y9-F12 CarbonylContact O-C 3.58Å; Y9-F12 PolarHBondContact O-N 3.07Å; R10-F12 VanDerWaalsContact C-N 3.27Å; R10-F12 PolarHBondContact O-N 3.49Å; F12-V16 HydrophobicContact CD2-CB 4.5Å; F12-V16 HydrophobicContact CD2-CG2 4.29Å; F12-V16 HydrophobicContact CE2-CB 4.13Å; F12-V16 HydrophobicContact CE2-CG1 4.46Å; F12-V16 HydrophobicContact CE2-CG2 3.94Å; F12-V16 HydrophobicContact CZ-CB 4.23Å; F12-V16 HydrophobicContact CZ-CG1 4.2Å; F12-V16 HydrophobicContact CZ-CG2 4.48Å; F12-V16 PolarHBondContact O-N 2.95Å; F12-L17 HydrophobicContact CD1-CD1 3.17Å; F12-L17 HydrophobicContact CD1-CG 3.78Å; F12-L17 HydrophobicContact CE1-CD1 3.44Å; F12-L17 VanDerWaalsContact CE1-CD1 3.44Å; F12-L17 HydrophobicContact CE1-CD2 3.94Å; F12-L17 HydrophobicContact CE1-CG 3.66Å; F12-L17 HydrophobicContact CG-CD1 4.21Å; F12-L17 PolarHBondContact O-N 3.41Å; F12-Y27 HydrophobicContact CD1-CE1 4.41Å; F12-Y27 AromaticContact CE1-CD1 3.86Å; F12-Y27 HydrophobicContact CE1-CD1 3.86Å; F12-Y27 AromaticContact CE1-CD2 3.77Å; F12-Y27 HydrophobicContact CE1-CD2 3.77Å; F12-Y27 AromaticContact CE1-CE1 3.6Å; F12-Y27 HydrophobicContact CE1-CE1 3.6Å; F12-Y27 AromaticContact CE1-CE2 3.52Å; F12-Y27 HydrophobicContact CE1-CE2 3.52Å; F12-Y27 AromaticContact CE1-CG 3.93Å; F12-Y27 HydrophobicContact CE1-CG 3.93Å; F12-Y27 AromaticContact CE1-CZ 3.42Å; F12-Y27 VanDerWaalsContact CE1-CZ 3.42Å; F12-Y27 HydrophobicContact CE2-CE2 4.36Å; F12-Y27 AromaticContact CZ-CD2 3.63Å; F12-Y27 HydrophobicContact CZ-CD2 3.63Å; F12-Y27 HydrophobicContact CZ-CE1 4.24Å; F12-Y27 AromaticContact CZ-CE2 3.26Å; F12-Y27 HydrophobicContact CZ-CE2 3.26Å; F12-Y27 HydrophobicContact CZ-CG 4.26Å; F12-Y27 AromaticContact CZ-CZ 3.6Å
13Q68Low73.2Confident52 Ų5275.9 Ų75.924%0.24338%0.376CS..Iπ-helixtrans-63-46.4175.6-177.1-173.810.700111.5Y9 R10 R18 N19Y9-Q13 HydrophobicContact CE1-CB 4.17Å; Y9-Q13 HydrophobicContact CE1-CG 4.21Å; Y9-Q13 HydrophobicContact CE2-CB 4.47Å; Y9-Q13 WeakPolarHBondContact O-CB 3.33Å; Y9-Q13 PolarHBondContact O-N 3.19Å; R10-Q13 PolarHBondContact O-N 2.91Å; Q13-R18 PolarHBondContact O-N 3.48Å; Q13-R18 VanDerWaalsContact O-N 3.14Å; Q13-N19 PolarHBondContact NE2-OD1 3.03Å
14T60.9Low74Confident111 Ų11172 Ų7268%0.68136%0.362SS*.Iπ-helixtrans-72.6-36.1-177.347.10000112.7R10 P11R10-T14 PolarHBondContact O-N 3.32Å; R10-T14 PolarHBondContact O-OG1 3.35Å; P11-T14 PolarHBondContact O-OG1 3.43Å
15S64.4Low74.8Confident91 Ų9169.5 Ų69.564%0.63634%0.344SS*.Iπ-helixtrans-82.5-52.2-177.7-178.80000113.2P11P11-S15 WeakPolarHBondContact O-CB 3.23Å; P11-S15 PolarHBondContact O-N 3.28Å
16V65.5Low75.3Confident73 Ų7371.4 Ų71.444%0.44235%0.354SS..Iπ-helixtrans-113.1-44.5-162.9-179.10000112.8F12F12-V16 HydrophobicContact CD2-CB 4.5Å; F12-V16 HydrophobicContact CD2-CG2 4.29Å; F12-V16 HydrophobicContact CE2-CB 4.13Å; F12-V16 HydrophobicContact CE2-CG1 4.46Å; F12-V16 HydrophobicContact CE2-CG2 3.94Å; F12-V16 HydrophobicContact CZ-CB 4.23Å; F12-V16 HydrophobicContact CZ-CG1 4.2Å; F12-V16 HydrophobicContact CZ-CG2 4.48Å; F12-V16 PolarHBondContact O-N 2.95Å
17L66.8Low75.7Confident2 Ų272.9 Ų72.91%0.0136%0.359CS..Iπ-helixtrans-88.9-24.2-162.1-65166.5000115F12 N19 D20 L24 Y27 I227F12-L17 HydrophobicContact CD1-CD1 3.17Å; F12-L17 HydrophobicContact CD1-CG 3.78Å; F12-L17 HydrophobicContact CE1-CD1 3.44Å; F12-L17 VanDerWaalsContact CE1-CD1 3.44Å; F12-L17 HydrophobicContact CE1-CD2 3.94Å; F12-L17 HydrophobicContact CE1-CG 3.66Å; F12-L17 HydrophobicContact CG-CD1 4.21Å; F12-L17 PolarHBondContact O-N 3.41Å; L17-N19 PolarHBondContact O-N 3.02Å; L17-D20 PolarHBondContact O-N 3Å; L17-D20 VanDerWaalsContact O-N 3.09Å; L17-L24 HydrophobicContact CB-CD2 4.25Å; L17-L24 HydrophobicContact CB-CG 4.3Å; L17-L24 HydrophobicContact CD1-CD2 3.48Å; L17-L24 VanDerWaalsContact CD1-CD2 3.48Å; L17-L24 HydrophobicContact CD1-CG 4.36Å; L17-L24 HydrophobicContact CD2-CD2 3.82Å; L17-L24 HydrophobicContact CD2-CG 3.98Å; L17-L24 HydrophobicContact CG-CD2 4.05Å; L17-L24 HydrophobicContact CG-CG 4.45Å; L17-Y27 HydrophobicContact CD2-CD1 4.42Å; L17-Y27 HydrophobicContact CD2-CG 4.13Å; L17-I227 HydrophobicContact CD1-CD1 4.49Å
18R65.4Low76.1Confident189 Ų18969.1 Ų69.171%0.71334%0.335SS*.THydrogen-bonded Turntrans39.640.1176.4-67.8-167.9-178.3-165.20.8115Q13 D20Q13-R18 PolarHBondContact O-N 3.48Å; Q13-R18 VanDerWaalsContact O-N 3.14Å; R18-D20 PolarHBondContact O-N 3.48Å
19N63.5Low76.7Confident111 Ų11168.5 Ų68.559%0.59433%0.328SS*.THydrogen-bonded Turntrans51.716.9-179-69.5-12000116.7Q13 L17 F21Q13-N19 PolarHBondContact NE2-OD1 3.03Å; L17-N19 PolarHBondContact O-N 3.02Å; N19-F21 PolarHBondContact O-N 3.2Å
20D77.9Confident77.6Confident57 Ų5771.9 Ų71.931%0.30535%0.347SS..  trans-85.8113.8177.7-176.7-11.1000109.4L17 R18 R22 R23 L24L17-D20 PolarHBondContact O-N 3Å; L17-D20 VanDerWaalsContact O-N 3.09Å; R18-D20 PolarHBondContact O-N 3.48Å; D20-R22 PolarHBondContact O-N 3.14Å; D20-R22 VanDerWaalsContact O-N 3.16Å; D20-R22 WeakPolarHBondContact OD1-CB 3.16Å; D20-R22 PolarHBondContact OD1-N 3.09Å; D20-R23 HydrophobicContact CB-CB 4.09Å; D20-R23 HydrophobicContact CB-CG 3.8Å; D20-R23 PolarHBondContact O-N 2.72Å; D20-R23 VanDerWaalsContact O-N 3.08Å; D20-R23 IonicContact OD2-NE 3.35Å; D20-R23 PolarHBondContact OD2-NE 3.23Å; D20-L24 PolarHBondContact O-N 2.9Å
21F80.6Confident78.7Confident55 Ų5563.1 Ų63.124%0.24132%0.315CS..Hα-helixtrans-52.5-37.3178.5-179.3-92.7000111.9N19 L24 A25 W168 P230 L268N19-F21 PolarHBondContact O-N 3.2Å; F21-L24 PolarHBondContact O-N 3.06Å; F21-A25 WeakPolarHBondContact O-CB 3.43Å; F21-A25 PolarHBondContact O-N 3.18Å; F21-W168 HydrophobicContact CD2-CE3 4.45Å; F21-W168 HydrophobicContact CD2-CZ3 4.09Å; F21-W168 HydrophobicContact CE2-CE3 4.02Å; F21-W168 HydrophobicContact CE2-CZ3 4.03Å; F21-W168 HydrophobicContact CZ-CE3 4.27Å; F21-P230 HydrophobicContact CD2-CB 4.19Å; F21-P230 HydrophobicContact CE2-CB 3.55Å; F21-P230 HydrophobicContact CE2-CG 3.97Å; F21-L268 HydrophobicContact CD1-CD2 3.94Å; F21-L268 HydrophobicContact CE1-CB 4.16Å; F21-L268 HydrophobicContact CE1-CD2 3.83Å; F21-L268 HydrophobicContact CE1-CG 4.33Å
22R82.5Confident79.9Confident91 Ų9159.5 Ų59.534%0.34329%0.292SS..Hα-helixtrans-66.4-44.7-180-61.4176.9177.2-144.3-4.3111.1D20 L24 A25 I26 R262 D266 L268D20-R22 PolarHBondContact O-N 3.14Å; D20-R22 VanDerWaalsContact O-N 3.16Å; D20-R22 WeakPolarHBondContact OD1-CB 3.16Å; D20-R22 PolarHBondContact OD1-N 3.09Å; R22-L24 VanDerWaalsContact C-N 3.32Å; R22-L24 PolarHBondContact O-N 2.8Å; R22-A25 PolarHBondContact O-N 3.43Å; R22-I26 VanDerWaalsContact O-CG1 3.28Å; R22-I26 WeakPolarHBondContact O-CG1 3.4Å; R22-I26 PolarHBondContact O-N 2.95Å; R22-R262 PolarHBondContact NH2-O 3.15Å; R22-D266 IonicContact CZ-OD2 3.08Å; R22-D266 IonicContact NH1-OD2 2.73Å; R22-D266 PolarHBondContact NH1-OD2 3.42Å; R22-D266 IonicContact NH2-OD2 2.69Å; R22-D266 PolarHBondContact NH2-OD2 3.4Å; R22-L268 HydrophobicContact CG-CD2 4.19Å
23R84.6Confident81.1Confident121 Ų12159.3 Ų59.346%0.45729%0.29SS..Hα-helixtrans-63.5-41.1178-65-179.2-167.4-151.7-6111.3D20 I26 Y27D20-R23 HydrophobicContact CB-CB 4.09Å; D20-R23 HydrophobicContact CB-CG 3.8Å; D20-R23 PolarHBondContact O-N 2.72Å; D20-R23 VanDerWaalsContact O-N 3.08Å; D20-R23 IonicContact OD2-NE 3.35Å; D20-R23 PolarHBondContact OD2-NE 3.23Å; R23-I26 PolarHBondContact O-N 3.25Å; R23-Y27 VanDerWaalsContact O-CB 3.25Å; R23-Y27 WeakPolarHBondContact O-CB 3.38Å; R23-Y27 PolarHBondContact O-N 3.13Å
24L85.6Confident82.5Confident2 Ų261.5 Ų61.51%0.0130%0.299CS..Hα-helixtrans-62.7-46174.1-78.8155.4000112.2L17 D20 F21 R22 I26 Y27 I28 W168 I227 L233L17-L24 HydrophobicContact CB-CD2 4.25Å; L17-L24 HydrophobicContact CB-CG 4.3Å; L17-L24 HydrophobicContact CD1-CD2 3.48Å; L17-L24 VanDerWaalsContact CD1-CD2 3.48Å; L17-L24 HydrophobicContact CD1-CG 4.36Å; L17-L24 HydrophobicContact CD2-CD2 3.82Å; L17-L24 HydrophobicContact CD2-CG 3.98Å; L17-L24 HydrophobicContact CG-CD2 4.05Å; L17-L24 HydrophobicContact CG-CG 4.45Å; D20-L24 PolarHBondContact O-N 2.9Å; F21-L24 PolarHBondContact O-N 3.06Å; R22-L24 VanDerWaalsContact C-N 3.32Å; R22-L24 PolarHBondContact O-N 2.8Å; L24-I26 PolarHBondContact O-N 2.81Å; L24-Y27 WeakPolarHBondContact O-CB 3.09Å; L24-Y27 PolarHBondContact O-N 2.73Å; L24-I28 WeakPolarHBondContact O-CG1 3.49Å; L24-I28 PolarHBondContact O-N 3.23Å; L24-W168 HydrophobicContact CB-CE3 4.25Å; L24-W168 HydrophobicContact CB-CH2 3.72Å; L24-W168 HydrophobicContact CB-CZ3 3.4Å; L24-W168 VanDerWaalsContact CB-CZ3 3.4Å; L24-W168 HydrophobicContact CD1-CH2 4.32Å; L24-W168 HydrophobicContact CD1-CZ3 4.38Å; L24-W168 HydrophobicContact CD2-CH2 4.16Å; L24-W168 HydrophobicContact CG-CH2 4.32Å; L24-W168 HydrophobicContact CG-CZ3 4.37Å; L24-I227 HydrophobicContact CD2-CD1 3.49Å; L24-I227 VanDerWaalsContact CD2-CD1 3.49Å; L24-L233 HydrophobicContact CD1-CD1 3.48Å; L24-L233 VanDerWaalsContact CD1-CD1 3.48Å
25A87.5Confident84.2Confident0 Ų056.4 Ų56.40%027%0.268CS..Hα-helixtrans-62.5-42.217800000111.9F21 R22 I28 L29 W168 W169 L268F21-A25 WeakPolarHBondContact O-CB 3.43Å; F21-A25 PolarHBondContact O-N 3.18Å; R22-A25 PolarHBondContact O-N 3.43Å; A25-I28 PolarHBondContact O-N 3.35Å; A25-L29 WeakPolarHBondContact O-CB 3.35Å; A25-L29 PolarHBondContact O-N 3.04Å; A25-W168 HydrophobicContact CB-CB 4.31Å; A25-W168 HydrophobicContact CB-CE3 4.05Å; A25-W169 HydrophobicContact CB-CZ2 4.32Å; A25-W169 PolarHBondContact O-NE1 3.09Å; A25-L268 HydrophobicContact CB-CD2 3.92Å
26I90Very high85.8Confident82 Ų8252.2 Ų52.242%0.42124%0.238SC..Hα-helixtrans-64.7-42.8174.2-67.7165.8000110.6R22 R23 L24 I28 L29 L30 W169R22-I26 VanDerWaalsContact O-CG1 3.28Å; R22-I26 WeakPolarHBondContact O-CG1 3.4Å; R22-I26 PolarHBondContact O-N 2.95Å; R23-I26 PolarHBondContact O-N 3.25Å; L24-I26 PolarHBondContact O-N 2.81Å; I26-I28 PolarHBondContact O-N 3.08Å; I26-L29 WeakPolarHBondContact O-CB 3.19Å; I26-L29 PolarHBondContact O-N 3.16Å; I26-L30 HydrophobicContact CG2-CD1 3.99Å; I26-L30 HydrophobicContact CG2-CG 4.34Å; I26-L30 WeakPolarHBondContact O-CG 3.45Å; I26-L30 PolarHBondContact O-N 3.03Å; I26-W169 HydrophobicContact CG1-CH2 4.4Å; I26-W169 HydrophobicContact CG1-CZ2 4.02Å
27Y91.6Very high87.3Confident36 Ų3648.8 Ų48.814%0.14122%0.217CC..Hα-helixtrans-58.5-47.8176.5170.9-105.6000111.8F12 L17 R23 L24 L29 L30 L31 T225F12-Y27 HydrophobicContact CD1-CE1 4.41Å; F12-Y27 AromaticContact CE1-CD1 3.86Å; F12-Y27 HydrophobicContact CE1-CD1 3.86Å; F12-Y27 AromaticContact CE1-CD2 3.77Å; F12-Y27 HydrophobicContact CE1-CD2 3.77Å; F12-Y27 AromaticContact CE1-CE1 3.6Å; F12-Y27 HydrophobicContact CE1-CE1 3.6Å; F12-Y27 AromaticContact CE1-CE2 3.52Å; F12-Y27 HydrophobicContact CE1-CE2 3.52Å; F12-Y27 AromaticContact CE1-CG 3.93Å; F12-Y27 HydrophobicContact CE1-CG 3.93Å; F12-Y27 AromaticContact CE1-CZ 3.42Å; F12-Y27 VanDerWaalsContact CE1-CZ 3.42Å; F12-Y27 HydrophobicContact CE2-CE2 4.36Å; F12-Y27 AromaticContact CZ-CD2 3.63Å; F12-Y27 HydrophobicContact CZ-CD2 3.63Å; F12-Y27 HydrophobicContact CZ-CE1 4.24Å; F12-Y27 AromaticContact CZ-CE2 3.26Å; F12-Y27 HydrophobicContact CZ-CE2 3.26Å; F12-Y27 HydrophobicContact CZ-CG 4.26Å; F12-Y27 AromaticContact CZ-CZ 3.6Å; L17-Y27 HydrophobicContact CD2-CD1 4.42Å; L17-Y27 HydrophobicContact CD2-CG 4.13Å; R23-Y27 VanDerWaalsContact O-CB 3.25Å; R23-Y27 WeakPolarHBondContact O-CB 3.38Å; R23-Y27 PolarHBondContact O-N 3.13Å; L24-Y27 WeakPolarHBondContact O-CB 3.09Å; L24-Y27 PolarHBondContact O-N 2.73Å; Y27-L29 VanDerWaalsContact C-N 3.32Å; Y27-L29 PolarHBondContact O-N 2.87Å; Y27-L30 PolarHBondContact O-N 3.31Å; Y27-L31 HydrophobicContact CE1-CD2 4.09Å; Y27-L31 VanDerWaalsContact O-CB 3.31Å; Y27-L31 WeakPolarHBondContact O-CB 3.26Å; Y27-L31 PolarHBondContact O-N 2.86Å; Y27-T225 WeakPolarHBondContact OH-CB 3.26Å; Y27-T225 PolarHBondContact OH-OG1 2.69Å
28I91.9Very high88.8Confident0 Ų051 Ų510%023%0.227CC..Hα-helixtrans-64.1-39.6178-64.7-64.7000110.9L24 A25 I26 L30 L31 T32 L164 W168 V226 I227L24-I28 WeakPolarHBondContact O-CG1 3.49Å; L24-I28 PolarHBondContact O-N 3.23Å; A25-I28 PolarHBondContact O-N 3.35Å; I26-I28 PolarHBondContact O-N 3.08Å; I28-L30 PolarHBondContact O-N 3.03Å; I28-L31 PolarHBondContact O-N 3.05Å; I28-T32 HydrophobicContact CG2-CG2 4.27Å; I28-T32 WeakPolarHBondContact O-CB 3.42Å; I28-T32 WeakPolarHBondContact O-CG2 3.49Å; I28-T32 PolarHBondContact O-N 3.5Å; I28-T32 PolarHBondContact O-OG1 2.94Å; I28-L164 HydrophobicContact CG2-CB 4.28Å; I28-W168 HydrophobicContact CB-CG 4.26Å; I28-W168 HydrophobicContact CG1-CD2 4.13Å; I28-W168 HydrophobicContact CG1-CG 4.29Å; I28-W168 HydrophobicContact CG1-CZ2 4.17Å; I28-W168 HydrophobicContact CG2-CG 4.22Å; I28-V226 HydrophobicContact CD1-CG2 4.29Å; I28-I227 HydrophobicContact CD1-CB 4.39Å
29L92.8Very high90.3Very high29 Ų2942 Ų4215%0.15219%0.193CC..Hα-helixtrans-59.7-45.5175.1-17271.7000111.9A25 I26 Y27 T32 Y33 V165 W169 I177 W181A25-L29 WeakPolarHBondContact O-CB 3.35Å; A25-L29 PolarHBondContact O-N 3.04Å; I26-L29 WeakPolarHBondContact O-CB 3.19Å; I26-L29 PolarHBondContact O-N 3.16Å; Y27-L29 VanDerWaalsContact C-N 3.32Å; Y27-L29 PolarHBondContact O-N 2.87Å; L29-T32 PolarHBondContact O-OG1 2.85Å; L29-T32 VanDerWaalsContact O-OG1 3.08Å; L29-Y33 WeakPolarHBondContact O-CB 3.42Å; L29-Y33 PolarHBondContact O-N 2.76Å; L29-V165 HydrophobicContact CD1-CG1 4Å; L29-V165 HydrophobicContact CD1-CG2 4.2Å; L29-W169 HydrophobicContact CB-CZ2 4.47Å; L29-W169 HydrophobicContact CD2-CZ2 3.89Å; L29-I177 HydrophobicContact CD1-CG2 4.36Å; L29-I177 HydrophobicContact CD2-CG2 4.33Å; L29-W181 HydrophobicContact CD1-CB 4.14Å; L29-W181 VanDerWaalsContact CD1-CD1 3.47Å; L29-W181 HydrophobicContact CD1-CG 3.88Å; L29-W181 PolarHBondContact O-NE1 2.95Å
30L94.9Very high91.9Very high88 Ų8836.7 Ų36.746%0.46117%0.165SC..Hα-helixtrans-70.1-39.6178-69.2175.2000112.2I26 Y27 I28 Y33 F34I26-L30 HydrophobicContact CG2-CD1 3.99Å; I26-L30 HydrophobicContact CG2-CG 4.34Å; I26-L30 WeakPolarHBondContact O-CG 3.45Å; I26-L30 PolarHBondContact O-N 3.03Å; Y27-L30 PolarHBondContact O-N 3.31Å; I28-L30 PolarHBondContact O-N 3.03Å; L30-Y33 WeakPolarHBondContact O-CB 3.34Å; L30-Y33 PolarHBondContact O-N 3.42Å; L30-F34 WeakPolarHBondContact O-CD2 3.33Å; L30-F34 PolarHBondContact O-N 2.88Å
31L95.4Very high92.8Very high17 Ų1734.2 Ų34.29%0.08915%0.152CC..Hα-helixtrans-61.2-52.5177-178.966.6000109.9Y27 I28 Y33 F34 C35 V221 V222 V226Y27-L31 HydrophobicContact CE1-CD2 4.09Å; Y27-L31 VanDerWaalsContact O-CB 3.31Å; Y27-L31 WeakPolarHBondContact O-CB 3.26Å; Y27-L31 PolarHBondContact O-N 2.86Å; I28-L31 PolarHBondContact O-N 3.05Å; L31-Y33 VanDerWaalsContact C-N 3.27Å; L31-Y33 PolarHBondContact O-N 3.44Å; L31-F34 PolarHBondContact O-N 3.18Å; L31-C35 PolarHBondContact O-N 3.4Å; L31-C35 PolarHBondContact O-SG 3.01Å; L31-V221 HydrophobicContact CD1-CG1 4.11Å; L31-V222 HydrophobicContact CD1-CG2 4.2Å; L31-V222 HydrophobicContact CG-CG2 4.42Å; L31-V226 HydrophobicContact CD2-CB 3.91Å; L31-V226 HydrophobicContact CD2-CG2 3.95Å
32T95.8Very high93.5Very high0 Ų031.9 Ų31.90%014%0.142CC..Hα-helixtrans-65.1-32.1179.158.20000112.5I28 L29 Y36 V161 L164 V165 W181I28-T32 HydrophobicContact CG2-CG2 4.27Å; I28-T32 WeakPolarHBondContact O-CB 3.42Å; I28-T32 WeakPolarHBondContact O-CG2 3.49Å; I28-T32 PolarHBondContact O-N 3.5Å; I28-T32 PolarHBondContact O-OG1 2.94Å; L29-T32 PolarHBondContact O-OG1 2.85Å; L29-T32 VanDerWaalsContact O-OG1 3.08Å; T32-Y36 PolarHBondContact O-N 2.92Å; T32-Y36 VanDerWaalsContact O-N 3.13Å; T32-V161 HydrophobicContact CG2-CB 4.1Å; T32-V161 HydrophobicContact CG2-CG1 4.16Å; T32-L164 HydrophobicContact CG2-CB 3.85Å; T32-L164 HydrophobicContact CG2-CD1 3.93Å; T32-V165 HydrophobicContact CG2-CG2 4.27Å; T32-V165 VanDerWaalsContact OG1-CG2 3.27Å; T32-V165 WeakPolarHBondContact OG1-CG2 3.28Å; T32-W181 PolarHBondContact OG1-NE1 3.44Å
33Y97.2Very high94Very high38 Ų3828.1 Ų28.115%0.14913%0.128CC..Hα-helixtrans-56.2-56.5171.2-178.3-87.6000110.8L29 L30 L31 C35 Y36 T37 W181 S183 H184 L187L29-Y33 WeakPolarHBondContact O-CB 3.42Å; L29-Y33 PolarHBondContact O-N 2.76Å; L30-Y33 WeakPolarHBondContact O-CB 3.34Å; L30-Y33 PolarHBondContact O-N 3.42Å; L31-Y33 VanDerWaalsContact C-N 3.27Å; L31-Y33 PolarHBondContact O-N 3.44Å; Y33-C35 PolarHBondContact O-N 3.45Å; Y33-Y36 PolarHBondContact O-N 3.43Å; Y33-T37 PolarHBondContact O-N 3.1Å; Y33-T37 PolarHBondContact O-OG1 3.14Å; Y33-T37 VanDerWaalsContact O-OG1 3.13Å; Y33-W181 WeakPolarHBondContact CD2-O 3.25Å; Y33-W181 WeakPolarHBondContact CE2-O 3.43Å; Y33-S183 WeakPolarHBondContact CE2-OG 3.39Å; Y33-S183 PolarHBondContact OH-OG 3.32Å; Y33-H184 HydrophobicContact CD1-CB 4.33Å; Y33-H184 HydrophobicContact CD2-CB 3.7Å; Y33-H184 HydrophobicContact CE1-CB 4.38Å; Y33-H184 HydrophobicContact CE2-CB 3.76Å; Y33-H184 HydrophobicContact CG-CB 3.98Å; Y33-H184 VanDerWaalsContact O-CB 3.27Å; Y33-H184 WeakPolarHBondContact O-CB 3.32Å; Y33-L187 HydrophobicContact CE1-CD2 3.62Å
34F97.6Very high94.4Very high99 Ų9922.5 Ų22.543%0.43411%0.107SC..Hα-helixtrans-67.4-35.6-179.6-74.5-65.7000113L30 L31 Y36 T37 F38L30-F34 WeakPolarHBondContact O-CD2 3.33Å; L30-F34 PolarHBondContact O-N 2.88Å; L31-F34 PolarHBondContact O-N 3.18Å; F34-Y36 VanDerWaalsContact C-N 3.28Å; F34-Y36 PolarHBondContact O-N 3.27Å; F34-T37 WeakPolarHBondContact O-CB 3.44Å; F34-T37 PolarHBondContact O-N 3.3Å; F34-F38 HydrophobicContact CB-CE2 4.3Å; F34-F38 HydrophobicContact CB-CZ 4.21Å; F34-F38 VanDerWaalsContact O-CD2 3.25Å; F34-F38 WeakPolarHBondContact O-CD2 3.27Å; F34-F38 WeakPolarHBondContact O-CG 3.37Å; F34-F38 PolarHBondContact O-N 3.44Å
35C97.5Very high94.8Very high3 Ų322.4 Ų22.42%0.0211%0.106CC..Hα-helixtrans-52.6-50.1172.7-66.50000111.2L31 Y33 F38 Y39 M119 V161 V222L31-C35 PolarHBondContact O-N 3.4Å; L31-C35 PolarHBondContact O-SG 3.01Å; Y33-C35 PolarHBondContact O-N 3.45Å; C35-F38 PolarHBondContact O-N 3.29Å; C35-Y39 VanDerWaalsContact O-CD2 3.26Å; C35-Y39 WeakPolarHBondContact O-CD2 3.49Å; C35-Y39 PolarHBondContact O-N 3.47Å; C35-M119 HydrophobicContact CB-CE 3.91Å; C35-M119 HydrophobicContact CB-SD 3.85Å; C35-V161 HydrophobicContact CB-CG1 4.25Å; C35-V222 WeakPolarHBondContact SG-CG2 3.27Å
36Y96.7Very high95.1Very high4 Ų422.7 Ų22.72%0.01611%0.108CC..Hα-helixtrans-78.4-27.2-176.4-143.3-106.6000112.8T32 Y33 F34 F38 Y39 H40 Y95 W158 V161 H184T32-Y36 PolarHBondContact O-N 2.92Å; T32-Y36 VanDerWaalsContact O-N 3.13Å; Y33-Y36 PolarHBondContact O-N 3.43Å; F34-Y36 VanDerWaalsContact C-N 3.28Å; F34-Y36 PolarHBondContact O-N 3.27Å; Y36-F38 VanDerWaalsContact C-N 3.3Å; Y36-F38 PolarHBondContact O-N 3.48Å; Y36-Y39 AromaticContact CD2-CD2 3.91Å; Y36-Y39 HydrophobicContact CD2-CD2 3.91Å; Y36-Y39 HydrophobicContact CD2-CG 4.44Å; Y36-Y39 HydrophobicContact CE2-CD2 4.38Å; Y36-Y39 PolarHBondContact O-N 3.33Å; Y36-H40 AromaticContact CD1-CD2 3.48Å; Y36-H40 VanDerWaalsContact CD1-CD2 3.48Å; Y36-H40 WeakPolarHBondContact CD1-CD2 3.07Å; Y36-H40 AromaticContact CD1-NE2 3.72Å; Y36-H40 AromaticContact CE1-CD2 3.42Å; Y36-H40 VanDerWaalsContact CE1-CD2 3.42Å; Y36-H40 WeakPolarHBondContact CE1-CD2 3.41Å; Y36-H40 AromaticContact CE1-NE2 3.16Å; Y36-H40 WeakPolarHBondContact CE1-NE2 3.46Å; Y36-H40 AromaticContact CZ-NE2 3.88Å; Y36-H40 PolarHBondContact O-CD2 3.23Å; Y36-H40 PolarHBondContact O-N 2.94Å; Y36-Y95 PolarHBondContact OH-OH 2.78Å; Y36-W158 AromaticContact CD1-CE3 3.92Å; Y36-W158 HydrophobicContact CD1-CE3 3.92Å; Y36-W158 AromaticContact CD1-CZ3 3.82Å; Y36-W158 HydrophobicContact CD1-CZ3 3.82Å; Y36-W158 HydrophobicContact CD2-CE3 4.01Å; Y36-W158 HydrophobicContact CE1-CD2 4.37Å; Y36-W158 AromaticContact CE1-CE3 3.43Å; Y36-W158 HydrophobicContact CE1-CE3 3.43Å; Y36-W158 VanDerWaalsContact CE1-CE3 3.43Å; Y36-W158 AromaticContact CE1-CZ3 3.58Å; Y36-W158 HydrophobicContact CE1-CZ3 3.58Å; Y36-W158 HydrophobicContact CE2-CB 3.81Å; Y36-W158 HydrophobicContact CE2-CD2 4.36Å; Y36-W158 AromaticContact CE2-CE3 3.61Å; Y36-W158 HydrophobicContact CE2-CE3 3.61Å; Y36-W158 HydrophobicContact CE2-CZ3 4.46Å; Y36-W158 HydrophobicContact CG-CE3 4.17Å; Y36-W158 HydrophobicContact CG-CZ3 4.29Å; Y36-W158 AromaticContact CZ-CD2 3.96Å; Y36-W158 AromaticContact CZ-CE3 3.29Å; Y36-W158 AromaticContact CZ-CZ3 3.96Å; Y36-W158 WeakPolarHBondContact OH-CB 3.48Å; Y36-V161 HydrophobicContact CD2-CG2 3.89Å; Y36-V161 HydrophobicContact CE2-CG2 4.44Å; Y36-V161 HydrophobicContact CG-CG2 4.39Å; Y36-H184 AromaticContact CD1-CE1 3.31Å; Y36-H184 WeakPolarHBondContact CD1-CE1 3.39Å; Y36-H184 AromaticContact CD1-ND1 3.45Å; Y36-H184 WeakPolarHBondContact CD1-ND1 3.45Å
37T98Very high95.2Very high1 Ų118.8 Ų18.81%0.0069%0.088CC..Hα-helixtrans-55.9-44.1164.2-66.50000111.4Y33 F34 H40 A41 H184 L187 G188 I191Y33-T37 PolarHBondContact O-N 3.1Å; Y33-T37 PolarHBondContact O-OG1 3.14Å; Y33-T37 VanDerWaalsContact O-OG1 3.13Å; F34-T37 WeakPolarHBondContact O-CB 3.44Å; F34-T37 PolarHBondContact O-N 3.3Å; T37-H40 PolarHBondContact O-N 3.45Å; T37-A41 WeakPolarHBondContact O-CB 3.47Å; T37-A41 PolarHBondContact O-N 3.14Å; T37-H184 WeakPolarHBondContact CA-O 3.25Å; T37-H184 WeakPolarHBondContact OG1-CA 3.5Å; T37-H184 WeakPolarHBondContact OG1-CB 3.45Å; T37-H184 PolarHBondContact OG1-O 2.93Å; T37-L187 HydrophobicContact CG2-CB 4.39Å; T37-L187 HydrophobicContact CG2-CD2 4.07Å; T37-L187 HydrophobicContact CG2-CG 4Å; T37-G188 WeakPolarHBondContact O-CA 3.09Å; T37-I191 HydrophobicContact CG2-CD1 3.81Å
38F97.8Very high95.3Very high48 Ų4817 Ų1721%0.2118%0.081CC..Hα-helixtrans-67.9-40.4179.2-57.6-30.5000112.8F34 C35 Y36 H40 A41 S42 M119 I214 M215F34-F38 HydrophobicContact CB-CE2 4.3Å; F34-F38 HydrophobicContact CB-CZ 4.21Å; F34-F38 VanDerWaalsContact O-CD2 3.25Å; F34-F38 WeakPolarHBondContact O-CD2 3.27Å; F34-F38 WeakPolarHBondContact O-CG 3.37Å; F34-F38 PolarHBondContact O-N 3.44Å; C35-F38 PolarHBondContact O-N 3.29Å; Y36-F38 VanDerWaalsContact C-N 3.3Å; Y36-F38 PolarHBondContact O-N 3.48Å; F38-H40 VanDerWaalsContact C-N 3.27Å; F38-H40 PolarHBondContact O-N 3.22Å; F38-A41 PolarHBondContact O-N 2.83Å; F38-S42 PolarHBondContact O-N 3.17Å; F38-S42 VanDerWaalsContact O-N 3.08Å; F38-M119 HydrophobicContact CD2-CE 4.27Å; F38-I214 HydrophobicContact CD1-CG2 3.51Å; F38-I214 HydrophobicContact CD2-CG2 4.45Å; F38-I214 HydrophobicContact CE1-CG2 3.56Å; F38-I214 HydrophobicContact CE2-CG2 4.49Å; F38-I214 HydrophobicContact CG-CG2 4Å; F38-I214 HydrophobicContact CZ-CG2 4.07Å; F38-M215 HydrophobicContact CB-CB 4.2Å; F38-M215 HydrophobicContact CB-CG 4.37Å
39Y97.1Very high95.3Very high0 Ų017 Ų170%08%0.081CC..Hα-helixtrans-57.9-39.3171.1-82.6-71.9000112.5C35 Y36 S42 R43 L115 M119 S122 Q154 S156 G157 M215C35-Y39 VanDerWaalsContact O-CD2 3.26Å; C35-Y39 WeakPolarHBondContact O-CD2 3.49Å; C35-Y39 PolarHBondContact O-N 3.47Å; Y36-Y39 AromaticContact CD2-CD2 3.91Å; Y36-Y39 HydrophobicContact CD2-CD2 3.91Å; Y36-Y39 HydrophobicContact CD2-CG 4.44Å; Y36-Y39 HydrophobicContact CE2-CD2 4.38Å; Y36-Y39 PolarHBondContact O-N 3.33Å; Y39-S42 PolarHBondContact O-OG 3.5Å; Y39-R43 WeakPolarHBondContact O-CD 3.38Å; Y39-R43 VanDerWaalsContact O-CG 3.27Å; Y39-R43 WeakPolarHBondContact O-CG 3.45Å; Y39-L115 HydrophobicContact CE2-CD1 4.2Å; Y39-M119 HydrophobicContact CD2-CG 4.34Å; Y39-M119 HydrophobicContact CE1-CG 4.46Å; Y39-M119 HydrophobicContact CE2-CG 3.33Å; Y39-M119 HydrophobicContact CE2-SD 4.2Å; Y39-M119 VanDerWaalsContact CZ-CG 3.42Å; Y39-M119 WeakPolarHBondContact OH-CA 3.11Å; Y39-M119 WeakPolarHBondContact OH-CG 3.25Å; Y39-M119 PolarHBondContact OH-N 3.46Å; Y39-M119 VanDerWaalsContact OH-N 3.13Å; Y39-S122 WeakPolarHBondContact CE1-OG 3.38Å; Y39-Q154 HydrophobicContact CD1-CB 4.38Å; Y39-Q154 HydrophobicContact CD1-CG 4.12Å; Y39-Q154 HydrophobicContact CE1-CB 4.37Å; Y39-Q154 HydrophobicContact CE1-CG 4.22Å; Y39-S156 PolarHBondContact OH-OG 2.9Å; Y39-G157 WeakPolarHBondContact OH-CA 3.46Å; Y39-M215 HydrophobicContact CD1-SD 3.69Å; Y39-M215 HydrophobicContact CE1-SD 4Å; Y39-M215 HydrophobicContact CG-SD 4.11Å
40H95.9Very high95.1Very high0 Ų015.7 Ų15.70%07%0.074CC..Hα-helixtrans-76.3-37.6178.8-88-89.5000112.8Y36 T37 F38 S42 R43 K44 T185 N189Y36-H40 AromaticContact CD1-CD2 3.48Å; Y36-H40 VanDerWaalsContact CD1-CD2 3.48Å; Y36-H40 WeakPolarHBondContact CD1-CD2 3.07Å; Y36-H40 AromaticContact CD1-NE2 3.72Å; Y36-H40 AromaticContact CE1-CD2 3.42Å; Y36-H40 VanDerWaalsContact CE1-CD2 3.42Å; Y36-H40 WeakPolarHBondContact CE1-CD2 3.41Å; Y36-H40 AromaticContact CE1-NE2 3.16Å; Y36-H40 WeakPolarHBondContact CE1-NE2 3.46Å; Y36-H40 AromaticContact CZ-NE2 3.88Å; Y36-H40 PolarHBondContact O-CD2 3.23Å; Y36-H40 PolarHBondContact O-N 2.94Å; T37-H40 PolarHBondContact O-N 3.45Å; F38-H40 VanDerWaalsContact C-N 3.27Å; F38-H40 PolarHBondContact O-N 3.22Å; H40-S42 PolarHBondContact O-N 3.47Å; H40-R43 PolarHBondContact NE2-NH1 2.91Å; H40-R43 PolarHBondContact O-N 3Å; H40-R43 VanDerWaalsContact O-N 3.13Å; H40-K44 PolarHBondContact O-N 3.47Å; H40-T185 WeakPolarHBondContact CE1-CG2 3.33Å; H40-T185 WeakPolarHBondContact ND1-CG2 3.45Å; H40-N189 PolarHBondContact ND1-OD1 3.23Å
41A97.2Very high94.7Very high4 Ų411.9 Ų11.93%0.0335%0.054CC..Hα-helixtrans-60.5-32.2174.400000112.7T37 F38 P45 G188 I191 G192T37-A41 WeakPolarHBondContact O-CB 3.47Å; T37-A41 PolarHBondContact O-N 3.14Å; F38-A41 PolarHBondContact O-N 2.83Å; A41-P45 VanDerWaalsContact O-CD 3.25Å; A41-P45 WeakPolarHBondContact O-CD 3.26Å; A41-G188 WeakPolarHBondContact CA-O 3.43Å; A41-G188 WeakPolarHBondContact CB-O 3.25Å; A41-G188 PolarHBondContact N-O 3.27Å; A41-I191 HydrophobicContact CB-CB 4.34Å; A41-I191 HydrophobicContact CB-CG2 4.13Å; A41-G192 WeakPolarHBondContact O-CA 3.49Å
42S95.8Very high94.3Very high6 Ų612.2 Ų12.24%0.0426%0.057CC..Hα-helixtrans-79.1-19.217771.50000114.6F38 Y39 H40 P45 T126 M215F38-S42 PolarHBondContact O-N 3.17Å; F38-S42 VanDerWaalsContact O-N 3.08Å; Y39-S42 PolarHBondContact O-OG 3.5Å; H40-S42 PolarHBondContact O-N 3.47Å; S42-P45 WeakPolarHBondContact O-CD 3.2Å; S42-T126 WeakPolarHBondContact CB-OG1 3.37Å; S42-M215 VanDerWaalsContact CB-CE 3.48Å; S42-M215 VanDerWaalsContact OG-CE 3.26Å; S42-M215 WeakPolarHBondContact OG-CE 3.02Å
43R94.2Very high93.9Very high13 Ų1312.2 Ų12.25%0.0496%0.057CC..Hα-helixtrans-82.8-31.6179.2-70.5167.4-174.6179.3-2113.1Y39 H40 P45 Y91 Y95Y39-R43 WeakPolarHBondContact O-CD 3.38Å; Y39-R43 VanDerWaalsContact O-CG 3.27Å; Y39-R43 WeakPolarHBondContact O-CG 3.45Å; H40-R43 PolarHBondContact NE2-NH1 2.91Å; H40-R43 PolarHBondContact O-N 3Å; H40-R43 VanDerWaalsContact O-N 3.13Å; R43-P45 VanDerWaalsContact C-CD 3.45Å; R43-Y91 HydrophobicContact CG-CE1 4.25Å; R43-Y91 WeakPolarHBondContact CG-OH 2.98Å; R43-Y91 PolarHBondContact NE-OH 2.91Å; R43-Y95 PolarHBondContact NH2-OH 3.27Å
44K92.4Very high93.1Very high2 Ų211.2 Ų11.21%0.0095%0.054CC..SBendtrans-67.9-36-174.1-164.969.8172.9177.30115.8H40 L46 S47 N189 S193 L310 D336H40-K44 PolarHBondContact O-N 3.47Å; K44-L46 VanDerWaalsContact C-N 3.31Å; K44-L46 PolarHBondContact O-N 3.11Å; K44-L46 VanDerWaalsContact O-N 3.11Å; K44-S47 WeakPolarHBondContact CD-OG 3.07Å; K44-S47 WeakPolarHBondContact O-CB 3.43Å; K44-S47 PolarHBondContact O-N 2.64Å; K44-S47 PolarHBondContact O-OG 3.42Å; K44-N189 HydrophobicContact CD-CB 4.26Å; K44-N189 WeakPolarHBondContact CG-O 3.37Å; K44-S193 WeakPolarHBondContact CE-OG 3.44Å; K44-S193 WeakPolarHBondContact CG-OG 3.31Å; K44-L310 HydrophobicContact CD-CD1 3.68Å; K44-L310 HydrophobicContact CD-CG 4.34Å; K44-L310 PolarHBondContact NZ-O 3.38Å; K44-D336 IonicContact NZ-OD2 2.84Å
45P94.6Very high91.7Very high0 Ų013.6 Ų13.60%06%0.06CC..Hα-helixtrans-54.1-39.2-168.1-31.837000115.3A41 S42 R43 S47 I48 V49 A196 S207 F208 P211A41-P45 VanDerWaalsContact O-CD 3.25Å; A41-P45 WeakPolarHBondContact O-CD 3.26Å; S42-P45 WeakPolarHBondContact O-CD 3.2Å; R43-P45 VanDerWaalsContact C-CD 3.45Å; P45-S47 PolarHBondContact O-N 2.95Å; P45-I48 PolarHBondContact O-N 3.17Å; P45-V49 WeakPolarHBondContact O-CB 3.34Å; P45-V49 WeakPolarHBondContact O-CG2 3.35Å; P45-V49 PolarHBondContact O-N 3.11Å; P45-A196 HydrophobicContact CB-CB 4.22Å; P45-S207 VanDerWaalsContact CB-O 3.32Å; P45-S207 WeakPolarHBondContact CB-O 3.49Å; P45-S207 WeakPolarHBondContact CG-O 3.49Å; P45-F208 HydrophobicContact CB-CD1 3.84Å; P45-F208 HydrophobicContact CB-CD2 4.37Å; P45-F208 HydrophobicContact CB-CE1 3.7Å; P45-F208 HydrophobicContact CB-CE2 4.23Å; P45-F208 HydrophobicContact CB-CG 4.19Å; P45-F208 HydrophobicContact CB-CZ 3.9Å; P45-F208 HydrophobicContact CG-CD1 4.44Å; P45-P211 HydrophobicContact CG-CG 4.19Å
46L93.4Very high89.8Confident6 Ų614.2 Ų14.23%0.0316%0.064CC..Hα-helixtrans-59.7-34.6178.9-174.960.2000112.9K44 I48 K50 L84 E88 F129 F208K44-L46 VanDerWaalsContact C-N 3.31Å; K44-L46 PolarHBondContact O-N 3.11Å; K44-L46 VanDerWaalsContact O-N 3.11Å; L46-I48 PolarHBondContact O-N 3.48Å; L46-K50 WeakPolarHBondContact O-CB 3.48Å; L46-K50 WeakPolarHBondContact O-CG 3.42Å; L46-K50 PolarHBondContact O-N 3.27Å; L46-K50 VanDerWaalsContact O-N 3.08Å; L46-L84 HydrophobicContact CD1-CD2 4.03Å; L46-E88 HydrophobicContact CD2-CG 3.92Å; L46-F129 HydrophobicContact CD1-CE1 4.15Å; L46-F129 HydrophobicContact CD1-CZ 3.83Å; L46-F129 HydrophobicContact CD2-CZ 4.49Å; L46-F208 HydrophobicContact CB-CE1 4.18Å; L46-F208 HydrophobicContact CB-CZ 4.06Å; L46-F208 HydrophobicContact CD1-CZ 4.32Å
47S92.2Very high87.7Confident0 Ų016.4 Ų16.40%08%0.08CC..Hα-helixtrans-64.2-27.5177.3720000113.8K44 P45 K50 L310 Y311K44-S47 WeakPolarHBondContact CD-OG 3.07Å; K44-S47 WeakPolarHBondContact O-CB 3.43Å; K44-S47 PolarHBondContact O-N 2.64Å; K44-S47 PolarHBondContact O-OG 3.42Å; P45-S47 PolarHBondContact O-N 2.95Å; S47-K50 WeakPolarHBondContact O-CG 3.38Å; S47-L310 WeakPolarHBondContact CB-O 3.42Å; S47-Y311 WeakPolarHBondContact CB-O 3.47Å
48I92.4Very high85.5Confident0 Ų023.3 Ų23.30%012%0.122CC..Hα-helixtrans-91.1-51177.7-55.6-55000109.8P45 L46 K50 T51 A196 V200 P314 A329P45-I48 PolarHBondContact O-N 3.17Å; L46-I48 PolarHBondContact O-N 3.48Å; I48-K50 PolarHBondContact O-N 3.19Å; I48-T51 WeakPolarHBondContact O-CB 3.46Å; I48-T51 WeakPolarHBondContact O-CG2 3.43Å; I48-T51 PolarHBondContact O-N 2.87Å; I48-T51 PolarHBondContact O-OG1 2.95Å; I48-A196 HydrophobicContact CB-CB 3.7Å; I48-A196 HydrophobicContact CG1-CB 3.87Å; I48-A196 HydrophobicContact CG2-CB 3.92Å; I48-V200 HydrophobicContact CG2-CB 4.13Å; I48-V200 HydrophobicContact CG2-CG1 4.3Å; I48-V200 HydrophobicContact CG2-CG2 4.2Å; I48-P314 HydrophobicContact CD1-CB 3.63Å; I48-P314 HydrophobicContact CD1-CG 3.44Å; I48-P314 VanDerWaalsContact CD1-CG 3.44Å; I48-A329 HydrophobicContact CD1-CB 3.67Å; I48-A329 HydrophobicContact CG1-CB 4.26Å; I48-A329 HydrophobicContact CG2-CB 4.02Å
49V91.9Very high83.2Confident0 Ų027.3 Ų27.30%015%0.145CC..Hα-helixtrans-61.4-30.4-175.11700000112.4P45 T51 V52 L53 V200 W204 F208P45-V49 WeakPolarHBondContact O-CB 3.34Å; P45-V49 WeakPolarHBondContact O-CG2 3.35Å; P45-V49 PolarHBondContact O-N 3.11Å; V49-T51 PolarHBondContact O-N 3.01Å; V49-T51 VanDerWaalsContact O-N 3.08Å; V49-V52 WeakPolarHBondContact O-CG2 3.42Å; V49-V52 PolarHBondContact O-N 3.32Å; V49-V52 VanDerWaalsContact O-N 3.08Å; V49-L53 HydrophobicContact CG1-CD1 3.81Å; V49-L53 HydrophobicContact CG1-CD2 4.05Å; V49-L53 HydrophobicContact CG1-CG 3.72Å; V49-L53 WeakPolarHBondContact O-CG 3.49Å; V49-L53 PolarHBondContact O-N 3.02Å; V49-V200 HydrophobicContact CG2-CG2 4.4Å; V49-W204 HydrophobicContact CG1-CB 3.82Å; V49-W204 HydrophobicContact CG1-CD2 4.11Å; V49-W204 HydrophobicContact CG1-CE3 3.78Å; V49-W204 HydrophobicContact CG1-CG 4.18Å; V49-W204 HydrophobicContact CG2-CB 4.23Å; V49-F208 HydrophobicContact CB-CE2 4.12Å; V49-F208 HydrophobicContact CB-CZ 4.45Å; V49-F208 HydrophobicContact CG1-CE2 4.18Å; V49-F208 HydrophobicContact CG2-CE2 3.85Å; V49-F208 HydrophobicContact CG2-CZ 4.46Å
50K90.2Very high81.2Confident0 Ų030.8 Ų30.80%018%0.181CC..Hα-helixtrans-56.9-26.7175.467.4-177.2-177.9-171.20114.5L46 S47 I48 V52 L53 H54 L84 E88 Y311L46-K50 WeakPolarHBondContact O-CB 3.48Å; L46-K50 WeakPolarHBondContact O-CG 3.42Å; L46-K50 PolarHBondContact O-N 3.27Å; L46-K50 VanDerWaalsContact O-N 3.08Å; S47-K50 WeakPolarHBondContact O-CG 3.38Å; I48-K50 PolarHBondContact O-N 3.19Å; K50-V52 PolarHBondContact O-N 3.44Å; K50-L53 PolarHBondContact O-N 3.29Å; K50-H54 PolarHBondContact O-CD2 3.37Å; K50-L84 HydrophobicContact CB-CD1 3.5Å; K50-L84 HydrophobicContact CB-CD2 4.46Å; K50-L84 HydrophobicContact CB-CG 4.41Å; K50-E88 IonicContact NZ-OE1 3.52Å; K50-E88 PolarHBondContact NZ-OE1 2.93Å; K50-E88 IonicContact NZ-OE2 3.07Å; K50-Y311 WeakPolarHBondContact CE-O 3.37Å; K50-Y311 PolarHBondContact NZ-O 2.76Å
51T86.1Confident79.1Confident9 Ų937.6 Ų37.66%0.05521%0.213CC..Hα-helixtrans-64.1-20.7178.962.20000113.7I48 V49 N315 A325I48-T51 WeakPolarHBondContact O-CB 3.46Å; I48-T51 WeakPolarHBondContact O-CG2 3.43Å; I48-T51 PolarHBondContact O-N 2.87Å; I48-T51 PolarHBondContact O-OG1 2.95Å; V49-T51 PolarHBondContact O-N 3.01Å; V49-T51 VanDerWaalsContact O-N 3.08Å; T51-N315 HydrophobicContact CG2-CB 4.47Å; T51-A325 VanDerWaalsContact OG1-CB 3.22Å; T51-A325 WeakPolarHBondContact OG1-CB 3.07Å
52V86.1Confident77.1Confident23 Ų2340.5 Ų40.514%0.13923%0.232CC..Hα-helixtrans-108.5-29.1177.1-62.20000112.9V49 K50 H54 R55 F67 V200 A325V49-V52 WeakPolarHBondContact O-CG2 3.42Å; V49-V52 PolarHBondContact O-N 3.32Å; V49-V52 VanDerWaalsContact O-N 3.08Å; K50-V52 PolarHBondContact O-N 3.44Å; V52-H54 PolarHBondContact O-N 2.84Å; V52-H54 VanDerWaalsContact O-N 3.12Å; V52-R55 CarbonylContact O-C 3.33Å; V52-R55 PolarHBondContact O-N 3.4Å; V52-R55 VanDerWaalsContact O-O 3.07Å; V52-F67 HydrophobicContact CG2-CZ 4.45Å; V52-F67 WeakPolarHBondContact O-CE1 3.1Å; V52-V200 HydrophobicContact CB-CG2 4.29Å; V52-V200 HydrophobicContact CG1-CG2 3.75Å; V52-V200 HydrophobicContact CG2-CG2 3.52Å; V52-A325 HydrophobicContact CG1-CB 4.23Å
53L87.4Confident75.5Confident0 Ų046.9 Ų46.90%026%0.259CS..Hα-helixtrans-57.5-32.6-175.8-71.1175.2000113.5V49 K50 F67 G71 W72 F75 L84 W204V49-L53 HydrophobicContact CG1-CD1 3.81Å; V49-L53 HydrophobicContact CG1-CD2 4.05Å; V49-L53 HydrophobicContact CG1-CG 3.72Å; V49-L53 WeakPolarHBondContact O-CG 3.49Å; V49-L53 PolarHBondContact O-N 3.02Å; K50-L53 PolarHBondContact O-N 3.29Å; L53-F67 HydrophobicContact CD2-CZ 4.25Å; L53-G71 WeakPolarHBondContact O-CA 3.48Å; L53-W72 HydrophobicContact CD2-CB 3.64Å; L53-W72 HydrophobicContact CD2-CG 3.94Å; L53-W72 PolarHBondContact O-N 3.01Å; L53-F75 HydrophobicContact CB-CB 3.99Å; L53-F75 HydrophobicContact CB-CD2 4.19Å; L53-F75 HydrophobicContact CB-CG 4.37Å; L53-F75 HydrophobicContact CD1-CD2 3.8Å; L53-F75 HydrophobicContact CD1-CE2 4.06Å; L53-F75 HydrophobicContact CD1-CG 4.39Å; L53-F75 HydrophobicContact CD2-CD2 4.32Å; L53-F75 HydrophobicContact CG-CD2 4.33Å; L53-L84 HydrophobicContact CD1-CD2 3.99Å; L53-W204 HydrophobicContact CD2-CD2 4.29Å
54H81.2Confident74.1Confident18 Ų1846.9 Ų46.98%0.08326%0.26CS..THydrogen-bonded Turntrans-98-0.9179.575.170.8000114K50 V52 F75 W80K50-H54 PolarHBondContact O-CD2 3.37Å; V52-H54 PolarHBondContact O-N 2.84Å; V52-H54 VanDerWaalsContact O-N 3.12Å; H54-F75 VanDerWaalsContact CA-O 3.28Å; H54-F75 WeakPolarHBondContact CA-O 3.43Å; H54-F75 VanDerWaalsContact CB-O 3.3Å; H54-F75 WeakPolarHBondContact CB-O 3.29Å; H54-W80 HydrophobicContact CB-CB 3.71Å; H54-W80 HydrophobicContact CB-CD2 3.57Å; H54-W80 HydrophobicContact CB-CE3 4.01Å; H54-W80 HydrophobicContact CB-CG 3.43Å; H54-W80 VanDerWaalsContact CB-CG 3.43Å; H54-W80 AromaticContact CD2-CD2 3.51Å; H54-W80 AromaticContact CD2-CE2 3.66Å; H54-W80 AromaticContact CD2-CE3 3.36Å; H54-W80 AromaticContact CD2-CH2 3.52Å; H54-W80 AromaticContact CD2-CZ2 3.68Å; H54-W80 AromaticContact CD2-CZ3 3.37Å; H54-W80 WeakPolarHBondContact CD2-CZ3 3.11Å; H54-W80 AromaticContact CE1-CZ2 3.96Å; H54-W80 AromaticContact CG-CD2 3.51Å; H54-W80 AromaticContact CG-CE2 3.66Å; H54-W80 AromaticContact CG-CE3 3.83Å; H54-W80 AromaticContact CG-CG 3.89Å; H54-W80 AromaticContact ND1-CE2 3.96Å; H54-W80 AromaticContact NE2-CE2 4Å; H54-W80 AromaticContact NE2-CH2 3.51Å; H54-W80 AromaticContact NE2-CZ2 3.61Å; H54-W80 AromaticContact NE2-CZ3 3.86Å
55R68.3Low73Confident148 Ų14852.6 Ų52.656%0.55830%0.295SS*.  trans-143.196.8-176.2-93.6177-163.2-177.73.3110V52 S57V52-R55 CarbonylContact O-C 3.33Å; V52-R55 PolarHBondContact O-N 3.4Å; V52-R55 VanDerWaalsContact O-O 3.07Å; R55-S57 PolarHBondContact O-N 3.3Å
56S57.7Low71.8Confident17 Ų1753.7 Ų53.712%0.11931%0.306CS..  trans-83.7103.7166.2-150.90000109.6T68 E70S56-T68 WeakPolarHBondContact CB-O 3.18Å; S56-T68 PolarHBondContact OG-O 2.93Å; S56-E70 PolarHBondContact N-O 3.27Å
57S52Low70.9Confident50 Ų5054.2 Ų54.235%0.3531%0.308SS..  trans87.1117.2159.3-1380000119.5R55 N59 G60 Q61R55-S57 PolarHBondContact O-N 3.3Å; S57-N59 VanDerWaalsContact OG-C 3.24Å; S57-N59 PolarHBondContact OG-N 2.82Å; S57-N59 VanDerWaalsContact OG-N 3.1Å; S57-G60 PolarHBondContact OG-N 3.2Å; S57-Q61 WeakPolarHBondContact CB-O 3.5Å; S57-Q61 PolarHBondContact OG-N 2.79Å; S57-Q61 PolarHBondContact OG-O 2.78Å
58V51.3Low69.8Low146 Ų14656.4 Ų56.489%0.88532%0.322SS*.SBendtrans-73-9.7153.8172.50000111.1
59N50.8Low68.6Low131 Ų13161.3 Ų61.370%0.70136%0.356SS*.SBendtrans-13627.3-170.5-69.3-25.5000114.4S57 Q61S57-N59 VanDerWaalsContact OG-C 3.24Å; S57-N59 PolarHBondContact OG-N 2.82Å; S57-N59 VanDerWaalsContact OG-N 3.1Å; N59-Q61 PolarHBondContact O-N 2.84Å
60G53.4Low67.6Low73 Ų7367.5 Ų67.575%0.75339%0.385SS*.SBendtrans62.46.7172.300000117.5S57S57-G60 PolarHBondContact OG-N 3.2Å
61Q51.9Low67.3Low144 Ų14467.5 Ų67.567%0.67339%0.385SS*.SBendtrans-120.6126.8177.5-69.9-100.8-36.400109.4S57 N59 K63S57-Q61 WeakPolarHBondContact CB-O 3.5Å; S57-Q61 PolarHBondContact OG-N 2.79Å; S57-Q61 PolarHBondContact OG-O 2.78Å; N59-Q61 PolarHBondContact O-N 2.84Å; Q61-K63 PolarHBondContact O-N 3.31Å; Q61-K63 VanDerWaalsContact O-N 3.17Å
62P56.4Low67.3Low65 Ų6567 Ų6742%0.42238%0.382SS..  trans-66.3113167.925.7-28.9000108T64 F67P62-T64 PolarHBondContact O-N 3.44Å; P62-F67 HydrophobicContact CB-CB 3.88Å
63K61.3Low67.5Low139 Ų13971 Ų7160%0.60440%0.398SS*.SBendtrans-68.1-15.7175.3-70.7-172.3-179.3-175.70112.3Q61 E201Q61-K63 PolarHBondContact O-N 3.31Å; Q61-K63 VanDerWaalsContact O-N 3.17Å; K63-E201 VanDerWaalsContact CB-O 3.23Å; K63-E201 WeakPolarHBondContact CB-O 3.41Å; K63-E201 HydrophobicContact CD-CB 4.31Å; K63-E201 IonicContact NZ-OE2 3.12Å; K63-E201 PolarHBondContact NZ-OE2 3.39Å
64T65Low67.6Low14 Ų1472.3 Ų72.39%0.08641%0.406CS..SBendtrans-127.5128.6-169.630.10000110.5P62 F67 T202P62-T64 PolarHBondContact O-N 3.44Å; T64-F67 VanDerWaalsContact CB-CD2 3.46Å; T64-F67 HydrophobicContact CG2-CE2 4.36Å; T64-F67 WeakPolarHBondContact O-CB 3.46Å; T64-F67 PolarHBondContact O-N 3.42Å; T64-F67 WeakPolarHBondContact OG1-CD2 3.49Å; T64-F67 WeakPolarHBondContact OG1-CE2 3.5Å; T64-F67 WeakPolarHBondContact OG1-CG 3.4Å; T64-T202 VanDerWaalsContact CG2-C 3.4Å; T64-T202 WeakPolarHBondContact CG2-O 3.05Å
65V68.3Low68.1Low121 Ų12171.5 Ų71.573%0.73340%0.402SS*.THydrogen-bonded Turntrans-56.8140.8172.7-179.30000109.7F67 W72 E136V65-F67 VanDerWaalsContact C-N 3.34Å; V65-W72 WeakPolarHBondContact O-CZ3 3.36Å; V65-E136 WeakPolarHBondContact CG1-OE1 3.45Å
66G70.3Confident68.9Low23 Ų2365.9 Ų65.924%0.23738%0.383CS..THydrogen-bonded Turntrans85.4-6.6-177.400000115.5
67F75.3Confident70.3Confident18 Ų1867.2 Ų67.28%0.07939%0.393CS..  trans-80.4133.3170.1-81.8-113.6000111V52 L53 P62 T64 V65 W72 W204V52-F67 HydrophobicContact CG2-CZ 4.45Å; V52-F67 WeakPolarHBondContact O-CE1 3.1Å; L53-F67 HydrophobicContact CD2-CZ 4.25Å; P62-F67 HydrophobicContact CB-CB 3.88Å; T64-F67 VanDerWaalsContact CB-CD2 3.46Å; T64-F67 HydrophobicContact CG2-CE2 4.36Å; T64-F67 WeakPolarHBondContact O-CB 3.46Å; T64-F67 PolarHBondContact O-N 3.42Å; T64-F67 WeakPolarHBondContact OG1-CD2 3.49Å; T64-F67 WeakPolarHBondContact OG1-CE2 3.5Å; T64-F67 WeakPolarHBondContact OG1-CG 3.4Å; V65-F67 VanDerWaalsContact C-N 3.34Å; F67-W72 HydrophobicContact CD1-CB 4.46Å; F67-W72 AromaticContact CD2-CE3 3.55Å; F67-W72 HydrophobicContact CD2-CE3 3.55Å; F67-W72 HydrophobicContact CD2-CZ3 4.18Å; F67-W72 HydrophobicContact CE1-CB 4.1Å; F67-W72 HydrophobicContact CE2-CB 4.25Å; F67-W72 HydrophobicContact CE2-CD2 4.35Å; F67-W72 AromaticContact CE2-CE3 3.5Å; F67-W72 HydrophobicContact CE2-CE3 3.5Å; F67-W72 HydrophobicContact CE2-CZ3 4.24Å; F67-W72 HydrophobicContact CG-CE3 4.44Å; F67-W72 HydrophobicContact CZ-CB 4Å; F67-W72 HydrophobicContact CZ-CE3 4.36Å; F67-W204 AromaticContact CE2-CD1 3.46Å; F67-W204 VanDerWaalsContact CE2-CD1 3.46Å; F67-W204 AromaticContact CE2-NE1 3.59Å; F67-W204 AromaticContact CZ-CD1 3.91Å
68T68.7Low71.8Confident45 Ų4572.7 Ų72.728%0.27642%0.418SS..  trans-75.3177.416469.10000109.8S56 E70 G71S56-T68 WeakPolarHBondContact CB-O 3.18Å; S56-T68 PolarHBondContact OG-O 2.93Å; T68-E70 PolarHBondContact O-N 3.12Å; T68-E70 PolarHBondContact OG1-N 2.6Å; T68-E70 VanDerWaalsContact OG1-N 3.11Å; T68-G71 PolarHBondContact N-O 3.26Å; T68-G71 PolarHBondContact OG1-N 3.08Å; T68-G71 PolarHBondContact OG1-O 3.37Å
69S66.4Low73.6Confident104 Ų10468.9 Ų68.973%0.72739%0.393SS*.SBendtrans-59.5-20.4167.449.40000113
70E71.6Confident75.4Confident129 Ų12964.5 Ų64.560%0.60337%0.366SS*.SBendtrans-101-32.9-175.3-64.4177.8171.800111.9S56 T68 D76S56-E70 PolarHBondContact N-O 3.27Å; T68-E70 PolarHBondContact O-N 3.12Å; T68-E70 PolarHBondContact OG1-N 2.6Å; T68-E70 VanDerWaalsContact OG1-N 3.11Å; E70-D76 HydrophobicContact CB-CB 4.08Å
71G83.1Confident76.9Confident0 Ų061.5 Ų61.50%033%0.334CS..  trans158.7-156.6-17900000113.3L53 T68L53-G71 WeakPolarHBondContact O-CA 3.48Å; T68-G71 PolarHBondContact N-O 3.26Å; T68-G71 PolarHBondContact OG1-N 3.08Å; T68-G71 PolarHBondContact OG1-O 3.37Å
72W87.2Confident78.6Confident0 Ų059.5 Ų59.50%033%0.325CS..SBendtrans-99113.9173.2-175.6-81.4000110.1L53 V65 F67 F75 A132 I137 H138 W204L53-W72 HydrophobicContact CD2-CB 3.64Å; L53-W72 HydrophobicContact CD2-CG 3.94Å; L53-W72 PolarHBondContact O-N 3.01Å; V65-W72 WeakPolarHBondContact O-CZ3 3.36Å; F67-W72 HydrophobicContact CD1-CB 4.46Å; F67-W72 AromaticContact CD2-CE3 3.55Å; F67-W72 HydrophobicContact CD2-CE3 3.55Å; F67-W72 HydrophobicContact CD2-CZ3 4.18Å; F67-W72 HydrophobicContact CE1-CB 4.1Å; F67-W72 HydrophobicContact CE2-CB 4.25Å; F67-W72 HydrophobicContact CE2-CD2 4.35Å; F67-W72 AromaticContact CE2-CE3 3.5Å; F67-W72 HydrophobicContact CE2-CE3 3.5Å; F67-W72 HydrophobicContact CE2-CZ3 4.24Å; F67-W72 HydrophobicContact CG-CE3 4.44Å; F67-W72 HydrophobicContact CZ-CB 4Å; F67-W72 HydrophobicContact CZ-CE3 4.36Å; W72-F75 WeakPolarHBondContact O-CA 3.3Å; W72-F75 WeakPolarHBondContact O-CB 3.27Å; W72-F75 PolarHBondContact O-N 3.3Å; W72-A132 VanDerWaalsContact CZ2-O 3.25Å; W72-A132 WeakPolarHBondContact CZ2-O 3.49Å; W72-I137 PolarHBondContact NE1-O 3.3Å; W72-H138 AromaticContact CD2-CE1 3.88Å; W72-H138 AromaticContact CE2-CE1 3.52Å; W72-H138 AromaticContact CE2-ND1 3.61Å; W72-H138 AromaticContact CH2-CE1 3.98Å; W72-H138 AromaticContact CZ2-CE1 3.57Å; W72-H138 AromaticContact CZ2-ND1 3.94Å; W72-H138 AromaticContact NE1-CE1 3.92Å; W72-H138 AromaticContact NE1-ND1 3.51Å; W72-W204 AromaticContact CD2-CZ2 3.95Å; W72-W204 HydrophobicContact CD2-CZ2 3.95Å; W72-W204 AromaticContact CD2-NE1 3.94Å; W72-W204 AromaticContact CE2-CZ2 3.67Å; W72-W204 HydrophobicContact CE3-CZ2 4.32Å; W72-W204 AromaticContact CE3-NE1 3.53Å; W72-W204 HydrophobicContact CH2-CZ2 4.18Å; W72-W204 AromaticContact CZ2-CZ2 3.82Å; W72-W204 HydrophobicContact CZ2-CZ2 3.82Å; W72-W204 HydrophobicContact CZ3-CZ2 4.4Å; W72-W204 AromaticContact CZ3-NE1 3.64Å
73K89Confident80.3Confident107 Ų10757.8 Ų57.847%0.46531%0.312SS..THydrogen-bonded Turntrans-56.9132.4173.8-75.3-179177.3-179.70110.9D76 H138K73-D76 WeakPolarHBondContact CA-OD1 3.49Å; K73-D76 WeakPolarHBondContact CE-OD2 3.22Å; K73-D76 VanDerWaalsContact CG-CG 3.49Å; K73-D76 WeakPolarHBondContact CG-OD1 3.06Å; K73-D76 WeakPolarHBondContact CG-OD2 3.49Å; K73-H138 HydrophobicContact CB-CB 3.8Å; K73-H138 WeakPolarHBondContact O-CA 3.24Å; K73-H138 PolarHBondContact O-ND1 2.9Å
74P90.2Very high81.7Confident27 Ų2751.1 Ų51.118%0.17528%0.283CS..THydrogen-bonded Turncis-100.319.511.439.9-36.2000114.2S77 L83 H138 Y140P74-S77 PolarHBondContact O-OG 3.09Å; P74-L83 WeakPolarHBondContact O-CD1 3.26Å; P74-H138 WeakPolarHBondContact CD-O 3.48Å; P74-Y140 HydrophobicContact CG-CD2 4.1Å; P74-Y140 HydrophobicContact CG-CG 4.44Å
75F91Very high82.7Confident0 Ų050.5 Ų50.50%028%0.279CS..SBendtrans-95.25.3-175.1-50-64.8000113.4L53 H54 W72 S77 W80 L83 L84 L87 Y140 F143L53-F75 HydrophobicContact CB-CB 3.99Å; L53-F75 HydrophobicContact CB-CD2 4.19Å; L53-F75 HydrophobicContact CB-CG 4.37Å; L53-F75 HydrophobicContact CD1-CD2 3.8Å; L53-F75 HydrophobicContact CD1-CE2 4.06Å; L53-F75 HydrophobicContact CD1-CG 4.39Å; L53-F75 HydrophobicContact CD2-CD2 4.32Å; L53-F75 HydrophobicContact CG-CD2 4.33Å; H54-F75 VanDerWaalsContact CA-O 3.28Å; H54-F75 WeakPolarHBondContact CA-O 3.43Å; H54-F75 VanDerWaalsContact CB-O 3.3Å; H54-F75 WeakPolarHBondContact CB-O 3.29Å; W72-F75 WeakPolarHBondContact O-CA 3.3Å; W72-F75 WeakPolarHBondContact O-CB 3.27Å; W72-F75 PolarHBondContact O-N 3.3Å; F75-S77 VanDerWaalsContact C-N 3.33Å; F75-W80 WeakPolarHBondContact O-CB 3.28Å; F75-L83 HydrophobicContact CD1-CB 4.18Å; F75-L83 HydrophobicContact CE1-CB 4.44Å; F75-L84 HydrophobicContact CB-CD1 4.48Å; F75-L84 HydrophobicContact CD1-CD1 4.37Å; F75-L84 HydrophobicContact CD1-CD2 3.54Å; F75-L84 HydrophobicContact CD1-CG 3.69Å; F75-L84 HydrophobicContact CD2-CD2 4.45Å; F75-L84 HydrophobicContact CE1-CD2 3.51Å; F75-L84 HydrophobicContact CE1-CG 4.06Å; F75-L84 HydrophobicContact CE2-CD2 4.42Å; F75-L84 HydrophobicContact CG-CD2 4.03Å; F75-L84 HydrophobicContact CG-CG 4.28Å; F75-L84 HydrophobicContact CZ-CD2 3.97Å; F75-L87 HydrophobicContact CE1-CD1 3.64Å; F75-L87 HydrophobicContact CZ-CD1 3.65Å; F75-Y140 HydrophobicContact CE1-CD2 4.34Å; F75-Y140 HydrophobicContact CE1-CE2 4.39Å; F75-F143 HydrophobicContact CE2-CD2 4.09Å; F75-F143 HydrophobicContact CE2-CE1 4.25Å; F75-F143 AromaticContact CE2-CE2 3.8Å; F75-F143 HydrophobicContact CE2-CE2 3.8Å; F75-F143 HydrophobicContact CE2-CG 4.43Å; F75-F143 AromaticContact CE2-CZ 3.88Å; F75-F143 HydrophobicContact CE2-CZ 3.88Å; F75-F143 HydrophobicContact CZ-CD1 4.32Å; F75-F143 AromaticContact CZ-CD2 3.8Å; F75-F143 HydrophobicContact CZ-CD2 3.8Å; F75-F143 HydrophobicContact CZ-CE2 4.01Å; F75-F143 AromaticContact CZ-CG 3.95Å; F75-F143 HydrophobicContact CZ-CG 3.95Å; F75-F143 HydrophobicContact CZ-CZ 4.36Å
76D86.2Confident83.8Confident30 Ų3045.3 Ų45.316%0.1625%0.25CS..SBendtrans-83.6-4.4179.257.7-24.4000113.5E70 K73E70-D76 HydrophobicContact CB-CB 4.08Å; K73-D76 WeakPolarHBondContact CA-OD1 3.49Å; K73-D76 WeakPolarHBondContact CE-OD2 3.22Å; K73-D76 VanDerWaalsContact CG-CG 3.49Å; K73-D76 WeakPolarHBondContact CG-OD1 3.06Å; K73-D76 WeakPolarHBondContact CG-OD2 3.49Å
77S85.9Confident84.9Confident45 Ų4544.2 Ų44.232%0.31524%0.239SC..SBendtrans-88.2161.718052.90000114.2P74 F75 N79 W80P74-S77 PolarHBondContact O-OG 3.09Å; F75-S77 VanDerWaalsContact C-N 3.33Å; S77-N79 WeakPolarHBondContact CB-OD1 3.31Å; S77-N79 PolarHBondContact O-N 3.29Å; S77-N79 PolarHBondContact OG-OD1 3.18Å; S77-W80 WeakPolarHBondContact O-CB 3.47Å; S77-W80 PolarHBondContact O-N 3.29Å
78D85Confident85.6Confident166 Ų16643.4 Ų43.489%0.88824%0.235SC*.THydrogen-bonded Turntrans-55-28.4180-68.8-30.9000114.1W80D78-W80 VanDerWaalsContact C-N 3.31Å; D78-W80 PolarHBondContact O-N 2.9Å
79N87.5Confident86.8Confident66 Ų6644.8 Ų44.835%0.35324%0.236SC..THydrogen-bonded Turntrans-87.715.1178.168.2-19.4000114S77 S81 Q82 L83S77-N79 WeakPolarHBondContact CB-OD1 3.31Å; S77-N79 PolarHBondContact O-N 3.29Å; S77-N79 PolarHBondContact OG-OD1 3.18Å; N79-S81 PolarHBondContact O-N 2.8Å; N79-S81 VanDerWaalsContact O-N 3.09Å; N79-Q82 WeakPolarHBondContact O-CB 3.39Å; N79-Q82 PolarHBondContact O-N 3.39Å; N79-L83 PolarHBondContact O-N 3.33Å
80W88.6Confident88.2Confident38 Ų3841.7 Ų41.714%0.14421%0.211CC..Hα-helixtrans-49.8-38.218071.3-93.5000113.5H54 F75 S77 D78 Q82 L83 L84 W312H54-W80 HydrophobicContact CB-CB 3.71Å; H54-W80 HydrophobicContact CB-CD2 3.57Å; H54-W80 HydrophobicContact CB-CE3 4.01Å; H54-W80 HydrophobicContact CB-CG 3.43Å; H54-W80 VanDerWaalsContact CB-CG 3.43Å; H54-W80 AromaticContact CD2-CD2 3.51Å; H54-W80 AromaticContact CD2-CE2 3.66Å; H54-W80 AromaticContact CD2-CE3 3.36Å; H54-W80 AromaticContact CD2-CH2 3.52Å; H54-W80 AromaticContact CD2-CZ2 3.68Å; H54-W80 AromaticContact CD2-CZ3 3.37Å; H54-W80 WeakPolarHBondContact CD2-CZ3 3.11Å; H54-W80 AromaticContact CE1-CZ2 3.96Å; H54-W80 AromaticContact CG-CD2 3.51Å; H54-W80 AromaticContact CG-CE2 3.66Å; H54-W80 AromaticContact CG-CE3 3.83Å; H54-W80 AromaticContact CG-CG 3.89Å; H54-W80 AromaticContact ND1-CE2 3.96Å; H54-W80 AromaticContact NE2-CE2 4Å; H54-W80 AromaticContact NE2-CH2 3.51Å; H54-W80 AromaticContact NE2-CZ2 3.61Å; H54-W80 AromaticContact NE2-CZ3 3.86Å; F75-W80 WeakPolarHBondContact O-CB 3.28Å; S77-W80 WeakPolarHBondContact O-CB 3.47Å; S77-W80 PolarHBondContact O-N 3.29Å; D78-W80 VanDerWaalsContact C-N 3.31Å; D78-W80 PolarHBondContact O-N 2.9Å; W80-Q82 VanDerWaalsContact C-N 3.3Å; W80-Q82 PolarHBondContact O-N 3.5Å; W80-L83 PolarHBondContact O-N 3.46Å; W80-L84 HydrophobicContact CE3-CD1 3.7Å; W80-L84 HydrophobicContact CZ3-CD1 4.24Å; W80-L84 WeakPolarHBondContact O-CB 3.35Å; W80-L84 PolarHBondContact O-N 3.24Å; W80-W312 HydrophobicContact CH2-CZ3 4.44Å
81S86.2Confident89.3Confident10 Ų1035.9 Ų35.97%0.0718%0.184CC..Hα-helixtrans-65.6-36.7-178.256.20000111.4N79 G85N79-S81 PolarHBondContact O-N 2.8Å; N79-S81 VanDerWaalsContact O-N 3.09Å; S81-G85 PolarHBondContact O-N 3.16Å
82Q87.8Confident89.9Confident102 Ų10236 Ų3648%0.47718%0.184SC..Hα-helixtrans-74.5-38.6174.7-58.6177.716.500111.3N79 W80 G86N79-Q82 WeakPolarHBondContact O-CB 3.39Å; N79-Q82 PolarHBondContact O-N 3.39Å; W80-Q82 VanDerWaalsContact C-N 3.3Å; W80-Q82 PolarHBondContact O-N 3.5Å; Q82-G86 WeakPolarHBondContact O-CA 3.25Å; Q82-G86 PolarHBondContact O-N 3.08Å
83L91.4Very high90.3Very high29 Ų2940 Ų4015%0.15220%0.202CC..Hα-helixtrans-65.5-51177.9-66.2175.1000111.7P74 F75 N79 W80 G86 L87 Y140P74-L83 WeakPolarHBondContact O-CD1 3.26Å; F75-L83 HydrophobicContact CD1-CB 4.18Å; F75-L83 HydrophobicContact CE1-CB 4.44Å; N79-L83 PolarHBondContact O-N 3.33Å; W80-L83 PolarHBondContact O-N 3.46Å; L83-G86 PolarHBondContact O-N 2.73Å; L83-L87 WeakPolarHBondContact O-CG 3.16Å; L83-L87 PolarHBondContact O-N 3.36Å; L83-Y140 HydrophobicContact CB-CE2 4.1Å; L83-Y140 HydrophobicContact CD2-CD2 4.24Å; L83-Y140 HydrophobicContact CD2-CE1 4.44Å; L83-Y140 HydrophobicContact CD2-CE2 3.94Å; L83-Y140 PolarHBondContact O-OH 3.01Å
84L90.2Very high90.7Very high0 Ų036.1 Ų36.10%019%0.187CC..Hα-helixtrans-69.9-42.6-179.8-69.8166.8000111.7L46 K50 L53 F75 W80 G86 L87 E88L46-L84 HydrophobicContact CD1-CD2 4.03Å; K50-L84 HydrophobicContact CB-CD1 3.5Å; K50-L84 HydrophobicContact CB-CD2 4.46Å; K50-L84 HydrophobicContact CB-CG 4.41Å; L53-L84 HydrophobicContact CD1-CD2 3.99Å; F75-L84 HydrophobicContact CB-CD1 4.48Å; F75-L84 HydrophobicContact CD1-CD1 4.37Å; F75-L84 HydrophobicContact CD1-CD2 3.54Å; F75-L84 HydrophobicContact CD1-CG 3.69Å; F75-L84 HydrophobicContact CD2-CD2 4.45Å; F75-L84 HydrophobicContact CE1-CD2 3.51Å; F75-L84 HydrophobicContact CE1-CG 4.06Å; F75-L84 HydrophobicContact CE2-CD2 4.42Å; F75-L84 HydrophobicContact CG-CD2 4.03Å; F75-L84 HydrophobicContact CG-CG 4.28Å; F75-L84 HydrophobicContact CZ-CD2 3.97Å; W80-L84 HydrophobicContact CE3-CD1 3.7Å; W80-L84 HydrophobicContact CZ3-CD1 4.24Å; W80-L84 WeakPolarHBondContact O-CB 3.35Å; W80-L84 PolarHBondContact O-N 3.24Å; L84-G86 PolarHBondContact O-N 3Å; L84-L87 HydrophobicContact CD2-CD1 4.46Å; L84-L87 PolarHBondContact O-N 3.2Å; L84-E88 WeakPolarHBondContact O-CG 3.33Å; L84-E88 PolarHBondContact O-N 3.21Å
85G86.7Confident91Very high1 Ų134.9 Ų34.91%0.0118%0.179CC..Hα-helixtrans-61.4-34.4171.900000112.4S81 Y89S81-G85 PolarHBondContact O-N 3.16Å; G85-Y89 WeakPolarHBondContact O-CB 3.41Å; G85-Y89 PolarHBondContact O-N 3.25Å
86G91.1Very high91.2Very high12 Ų1235 Ų3512%0.12418%0.18CC..Hα-helixtrans-66-41.9173.600000113.2Q82 L83 L84 Y89 I90Q82-G86 WeakPolarHBondContact O-CA 3.25Å; Q82-G86 PolarHBondContact O-N 3.08Å; L83-G86 PolarHBondContact O-N 2.73Å; L84-G86 PolarHBondContact O-N 3Å; G86-Y89 WeakPolarHBondContact O-CB 3.36Å; G86-Y89 PolarHBondContact O-N 2.97Å; G86-I90 WeakPolarHBondContact O-CB 3.27Å; G86-I90 WeakPolarHBondContact O-CD1 3.36Å; G86-I90 WeakPolarHBondContact O-CG1 3.15Å; G86-I90 PolarHBondContact O-N 2.92Å
87L93Very high91.6Very high0 Ų036.9 Ų36.90%019%0.192CC..Hα-helixtrans-63.6-44174-72176.9000112.2F75 L83 L84 Y89 I90 Y91 Y140 F143 V144 Q147F75-L87 HydrophobicContact CE1-CD1 3.64Å; F75-L87 HydrophobicContact CZ-CD1 3.65Å; L83-L87 WeakPolarHBondContact O-CG 3.16Å; L83-L87 PolarHBondContact O-N 3.36Å; L84-L87 HydrophobicContact CD2-CD1 4.46Å; L84-L87 PolarHBondContact O-N 3.2Å; L87-Y89 VanDerWaalsContact C-N 3.32Å; L87-Y89 PolarHBondContact O-N 3.17Å; L87-I90 PolarHBondContact O-N 3.02Å; L87-Y91 WeakPolarHBondContact O-CB 3.36Å; L87-Y91 PolarHBondContact O-N 3.44Å; L87-Y140 HydrophobicContact CD1-CE2 4.05Å; L87-Y140 HydrophobicContact CD2-CE2 3.81Å; L87-Y140 HydrophobicContact CG-CE2 3.74Å; L87-F143 HydrophobicContact CD1-CB 3.73Å; L87-F143 HydrophobicContact CD1-CG 4.42Å; L87-F143 HydrophobicContact CD2-CB 3.84Å; L87-F143 HydrophobicContact CG-CB 4.48Å; L87-V144 HydrophobicContact CD2-CB 4.47Å; L87-V144 HydrophobicContact CD2-CG2 3.78Å; L87-Q147 HydrophobicContact CB-CG 4.24Å; L87-Q147 HydrophobicContact CD2-CG 4.14Å
88E91.4Very high92.1Very high1 Ų135.4 Ų35.41%0.00518%0.182CC..Hα-helixtrans-59.6-43.4174.4-68.7171.3169.300110.7L46 K50 L84 L92 Y311 W312 P456L46-E88 HydrophobicContact CD2-CG 3.92Å; K50-E88 IonicContact NZ-OE1 3.52Å; K50-E88 PolarHBondContact NZ-OE1 2.93Å; K50-E88 IonicContact NZ-OE2 3.07Å; L84-E88 WeakPolarHBondContact O-CG 3.33Å; L84-E88 PolarHBondContact O-N 3.21Å; E88-L92 WeakPolarHBondContact O-CB 3.04Å; E88-L92 WeakPolarHBondContact O-CG 3.43Å; E88-L92 PolarHBondContact O-N 3.4Å; E88-L92 VanDerWaalsContact O-N 3.1Å; E88-Y311 VanDerWaalsContact CD-CD1 3.46Å; E88-Y311 HydrophobicContact CG-CD1 3.79Å; E88-Y311 HydrophobicContact CG-CE1 4.06Å; E88-Y311 HydrophobicContact CG-CG 4.27Å; E88-Y311 VanDerWaalsContact OE1-CD1 3.26Å; E88-Y311 WeakPolarHBondContact OE1-CD1 3.37Å; E88-W312 PolarHBondContact OE2-NE1 3.44Å; E88-P456 HydrophobicContact CB-CB 4.34Å; E88-P456 WeakPolarHBondContact OE2-CB 3.09Å
89Y93Very high92.5Very high73 Ų7327.5 Ų27.529%0.28614%0.139SC..Hα-helixtrans-62.4-51175.2172-99.2000112.6G85 G86 L87 Y91 L92 F93 A453 L457G85-Y89 WeakPolarHBondContact O-CB 3.41Å; G85-Y89 PolarHBondContact O-N 3.25Å; G86-Y89 WeakPolarHBondContact O-CB 3.36Å; G86-Y89 PolarHBondContact O-N 2.97Å; L87-Y89 VanDerWaalsContact C-N 3.32Å; L87-Y89 PolarHBondContact O-N 3.17Å; Y89-Y91 VanDerWaalsContact C-N 3.31Å; Y89-Y91 PolarHBondContact O-N 3.42Å; Y89-L92 PolarHBondContact O-N 3.2Å; Y89-F93 HydrophobicContact CE1-CB 4.34Å; Y89-F93 HydrophobicContact CE2-CB 4.38Å; Y89-F93 HydrophobicContact CE2-CD2 4.42Å; Y89-F93 WeakPolarHBondContact O-CB 3.2Å; Y89-F93 PolarHBondContact O-N 3.37Å; Y89-A453 HydrophobicContact CD2-CB 3.81Å; Y89-A453 HydrophobicContact CE2-CB 4.14Å; Y89-L457 HydrophobicContact CD2-CB 3.99Å; Y89-L457 HydrophobicContact CD2-CD2 3.68Å; Y89-L457 HydrophobicContact CD2-CG 4.35Å; Y89-L457 HydrophobicContact CE2-CD2 3.83Å; Y89-L457 HydrophobicContact CG-CB 4.31Å; Y89-L457 HydrophobicContact CG-CD1 4.48Å; Y89-L457 HydrophobicContact CG-CD2 4.09Å
90I95.5Very high92.5Very high40 Ų4026.9 Ų26.921%0.20514%0.136CC..Hα-helixtrans-56.9-48.3-179-72.5163.1000109.9G86 L87 L92 V94 V144 Q147 V148G86-I90 WeakPolarHBondContact O-CB 3.27Å; G86-I90 WeakPolarHBondContact O-CD1 3.36Å; G86-I90 WeakPolarHBondContact O-CG1 3.15Å; G86-I90 PolarHBondContact O-N 2.92Å; L87-I90 PolarHBondContact O-N 3.02Å; I90-L92 PolarHBondContact O-N 3.38Å; I90-V94 HydrophobicContact CG2-CG2 4.48Å; I90-V94 WeakPolarHBondContact O-CB 3.15Å; I90-V94 VanDerWaalsContact O-CG2 3.23Å; I90-V94 WeakPolarHBondContact O-CG2 3.06Å; I90-V94 PolarHBondContact O-N 2.91Å; I90-V144 HydrophobicContact CD1-CG1 4.24Å; I90-V144 HydrophobicContact CD1-CG2 4.11Å; I90-Q147 HydrophobicContact CG2-CB 4.45Å; I90-V148 HydrophobicContact CG2-CG2 3.59Å
91Y96.2Very high92.7Very high7 Ų730.8 Ų30.83%0.02716%0.159CC..Hα-helixtrans-55.7-52.5177167.7-111.5000112.1R43 L87 Y89 Y95 Q147 Q154R43-Y91 HydrophobicContact CG-CE1 4.25Å; R43-Y91 WeakPolarHBondContact CG-OH 2.98Å; R43-Y91 PolarHBondContact NE-OH 2.91Å; L87-Y91 WeakPolarHBondContact O-CB 3.36Å; L87-Y91 PolarHBondContact O-N 3.44Å; Y89-Y91 VanDerWaalsContact C-N 3.31Å; Y89-Y91 PolarHBondContact O-N 3.42Å; Y91-Y95 VanDerWaalsContact O-CB 3.23Å; Y91-Y95 WeakPolarHBondContact O-CB 3.38Å; Y91-Y95 PolarHBondContact O-N 2.74Å; Y91-Q147 VanDerWaalsContact CB-OE1 3.31Å; Y91-Q154 HydrophobicContact CE2-CB 4.49Å; Y91-Q154 VanDerWaalsContact OH-CD 3.26Å; Y91-Q154 PolarHBondContact OH-OE1 3.05Å
92L95.1Very high93Very high3 Ų330.8 Ų30.82%0.01616%0.159CC..Hα-helixtrans-72.7-33-175.2-69.3167.8000113.1E88 Y89 I90 A96 Y307 Y311 A452 A453E88-L92 WeakPolarHBondContact O-CB 3.04Å; E88-L92 WeakPolarHBondContact O-CG 3.43Å; E88-L92 PolarHBondContact O-N 3.4Å; E88-L92 VanDerWaalsContact O-N 3.1Å; Y89-L92 PolarHBondContact O-N 3.2Å; I90-L92 PolarHBondContact O-N 3.38Å; L92-A96 VanDerWaalsContact O-CB 3.27Å; L92-A96 WeakPolarHBondContact O-CB 3.43Å; L92-A96 PolarHBondContact O-N 2.59Å; L92-Y307 HydrophobicContact CD1-CD1 3.97Å; L92-Y307 HydrophobicContact CD2-CD1 4Å; L92-Y307 HydrophobicContact CD2-CE1 3.72Å; L92-Y311 HydrophobicContact CD1-CD2 4.47Å; L92-Y311 HydrophobicContact CD1-CE2 3.65Å; L92-A452 HydrophobicContact CD1-CB 4.49Å; L92-A452 WeakPolarHBondContact CD1-O 3.34Å; L92-A453 HydrophobicContact CB-CB 3.51Å
93F95.5Very high93Very high84 Ų8426 Ų2637%0.36814%0.136SC..Hα-helixtrans-66.7-48.6175.2-178.4-96000110.8Y89 Y95 A96 V97 L450 A453Y89-F93 HydrophobicContact CE1-CB 4.34Å; Y89-F93 HydrophobicContact CE2-CB 4.38Å; Y89-F93 HydrophobicContact CE2-CD2 4.42Å; Y89-F93 WeakPolarHBondContact O-CB 3.2Å; Y89-F93 PolarHBondContact O-N 3.37Å; F93-Y95 VanDerWaalsContact C-N 3.32Å; F93-Y95 PolarHBondContact O-N 3.12Å; F93-A96 WeakPolarHBondContact O-CB 3.2Å; F93-A96 PolarHBondContact O-N 2.75Å; F93-V97 HydrophobicContact CE1-CG2 4.16Å; F93-V97 HydrophobicContact CZ-CG2 4.22Å; F93-V97 WeakPolarHBondContact O-CG2 3.38Å; F93-V97 PolarHBondContact O-N 3.17Å; F93-V97 VanDerWaalsContact O-N 3.08Å; F93-L450 HydrophobicContact CD2-CD2 3.91Å; F93-L450 HydrophobicContact CE2-CD2 4.08Å; F93-A453 HydrophobicContact CB-CB 4.44Å
94V97.1Very high92.9Very high25 Ų2528.8 Ų28.815%0.15215%0.147CC..Hα-helixtrans-63.2-41.4175.8176.10000110.6I90 A96 V97 S98 V148 L152I90-V94 HydrophobicContact CG2-CG2 4.48Å; I90-V94 WeakPolarHBondContact O-CB 3.15Å; I90-V94 VanDerWaalsContact O-CG2 3.23Å; I90-V94 WeakPolarHBondContact O-CG2 3.06Å; I90-V94 PolarHBondContact O-N 2.91Å; V94-A96 PolarHBondContact O-N 2.86Å; V94-V97 PolarHBondContact O-N 3Å; V94-S98 VanDerWaalsContact O-CB 3.23Å; V94-S98 WeakPolarHBondContact O-CB 3.27Å; V94-S98 PolarHBondContact O-N 3.44Å; V94-S98 PolarHBondContact O-OG 3.33Å; V94-V148 HydrophobicContact CG1-CG1 4.42Å; V94-V148 WeakPolarHBondContact CG1-O 3.34Å; V94-V148 HydrophobicContact CG2-CG1 4.39Å; V94-V148 HydrophobicContact CG2-CG2 4.31Å; V94-L152 HydrophobicContact CG1-CB 4.48Å; V94-L152 HydrophobicContact CG1-CD2 3.7Å; V94-L152 HydrophobicContact CG1-CG 3.67Å
95Y97Very high92.9Very high1 Ų132.7 Ų32.70%0.00417%0.168CC..Hα-helixtrans-56-48.6172.2178.1-84.6000111.4Y36 R43 Y91 F93 V97 S98 M99 G151 Q154 A155 D445 S449Y36-Y95 PolarHBondContact OH-OH 2.78Å; R43-Y95 PolarHBondContact NH2-OH 3.27Å; Y91-Y95 VanDerWaalsContact O-CB 3.23Å; Y91-Y95 WeakPolarHBondContact O-CB 3.38Å; Y91-Y95 PolarHBondContact O-N 2.74Å; F93-Y95 VanDerWaalsContact C-N 3.32Å; F93-Y95 PolarHBondContact O-N 3.12Å; Y95-V97 PolarHBondContact O-N 3.48Å; Y95-S98 PolarHBondContact O-N 3.25Å; Y95-M99 HydrophobicContact CE1-CB 4.42Å; Y95-M99 HydrophobicContact CE1-CG 4.4Å; Y95-M99 HydrophobicContact CE1-SD 4.23Å; Y95-M99 VanDerWaalsContact O-CB 3.23Å; Y95-M99 WeakPolarHBondContact O-CB 3.39Å; Y95-M99 PolarHBondContact O-N 3.45Å; Y95-G151 WeakPolarHBondContact CA-O 3.29Å; Y95-Q154 HydrophobicContact CD2-CB 4.06Å; Y95-Q154 HydrophobicContact CE2-CB 4.18Å; Y95-Q154 WeakPolarHBondContact CE2-O 3.46Å; Y95-A155 HydrophobicContact CD2-CB 4Å; Y95-A155 VanDerWaalsContact CE2-CA 3.46Å; Y95-A155 HydrophobicContact CE2-CB 4.15Å; Y95-A155 HydrophobicContact CG-CB 4.47Å; Y95-D445 PolarHBondContact OH-OD2 3.13Å; Y95-S449 WeakPolarHBondContact CD1-OG 3.34Å; Y95-S449 VanDerWaalsContact CE1-OG 3.26Å; Y95-S449 WeakPolarHBondContact CE1-OG 3.25Å
96A95.2Very high92.9Very high2 Ų232.8 Ų32.82%0.01717%0.168CC..Hα-helixtrans-60.8-45.8-177.700000113.1L92 F93 V94 M99 G446 L450L92-A96 VanDerWaalsContact O-CB 3.27Å; L92-A96 WeakPolarHBondContact O-CB 3.43Å; L92-A96 PolarHBondContact O-N 2.59Å; F93-A96 WeakPolarHBondContact O-CB 3.2Å; F93-A96 PolarHBondContact O-N 2.75Å; V94-A96 PolarHBondContact O-N 2.86Å; A96-M99 WeakPolarHBondContact O-CB 3.13Å; A96-M99 PolarHBondContact O-N 3.38Å; A96-G446 WeakPolarHBondContact CB-O 2.88Å; A96-L450 HydrophobicContact CB-CD2 3.53Å; A96-L450 HydrophobicContact CB-CG 3.74Å
97V93.8Very high92.6Very high70 Ų7033.1 Ų33.142%0.42417%0.167SC..Hα-helixtrans-65.3-43.9176.9176.20000110.5F93 V94 Y95 M99 I100F93-V97 HydrophobicContact CE1-CG2 4.16Å; F93-V97 HydrophobicContact CZ-CG2 4.22Å; F93-V97 WeakPolarHBondContact O-CG2 3.38Å; F93-V97 PolarHBondContact O-N 3.17Å; F93-V97 VanDerWaalsContact O-N 3.08Å; V94-V97 PolarHBondContact O-N 3Å; Y95-V97 PolarHBondContact O-N 3.48Å; V97-M99 VanDerWaalsContact C-N 3.29Å; V97-M99 PolarHBondContact O-N 3.16Å; V97-I100 PolarHBondContact O-N 2.97Å
98S96.2Very high92.1Very high13 Ų1338.4 Ų38.49%0.09119%0.187CC..Hα-helixtrans-66.9-31.3179.7-560000112.5V94 Y95 I100 L101 S102 L152 A155V94-S98 VanDerWaalsContact O-CB 3.23Å; V94-S98 WeakPolarHBondContact O-CB 3.27Å; V94-S98 PolarHBondContact O-N 3.44Å; V94-S98 PolarHBondContact O-OG 3.33Å; Y95-S98 PolarHBondContact O-N 3.25Å; S98-I100 VanDerWaalsContact C-N 3.28Å; S98-I100 PolarHBondContact O-N 3.03Å; S98-L101 PolarHBondContact O-N 3.29Å; S98-S102 WeakPolarHBondContact O-CB 3.39Å; S98-S102 PolarHBondContact O-N 3.31Å; S98-L152 VanDerWaalsContact OG-CD2 3.28Å; S98-L152 WeakPolarHBondContact OG-CD2 3.37Å; S98-A155 VanDerWaalsContact CB-CB 3.45Å
99M93.7Very high91.9Very high0 Ų040.9 Ų40.90%020%0.202CC..Hα-helixtrans-61-38.5-179.3-170.865.5-145.400111.6Y95 A96 V97 S102 G103 A155 W158 P159 S442 D445Y95-M99 HydrophobicContact CE1-CB 4.42Å; Y95-M99 HydrophobicContact CE1-CG 4.4Å; Y95-M99 HydrophobicContact CE1-SD 4.23Å; Y95-M99 VanDerWaalsContact O-CB 3.23Å; Y95-M99 WeakPolarHBondContact O-CB 3.39Å; Y95-M99 PolarHBondContact O-N 3.45Å; A96-M99 WeakPolarHBondContact O-CB 3.13Å; A96-M99 PolarHBondContact O-N 3.38Å; V97-M99 VanDerWaalsContact C-N 3.29Å; V97-M99 PolarHBondContact O-N 3.16Å; M99-S102 PolarHBondContact O-N 3.35Å; M99-G103 PolarHBondContact O-N 3.44Å; M99-A155 HydrophobicContact CB-CB 4.36Å; M99-A155 VanDerWaalsContact SD-O 3.39Å; M99-W158 HydrophobicContact CE-CB 3.67Å; M99-W158 HydrophobicContact CE-CG 3.97Å; M99-W158 HydrophobicContact SD-CB 4.06Å; M99-P159 HydrophobicContact CE-CB 4.03Å; M99-P159 HydrophobicContact CE-CG 3.67Å; M99-S442 VanDerWaalsContact CE-OG 3.23Å; M99-S442 WeakPolarHBondContact CE-OG 3.31Å; M99-S442 WeakPolarHBondContact O-CB 3.4Å; M99-S442 PolarHBondContact O-OG 3.31Å; M99-D445 HydrophobicContact CE-CB 4.44Å; M99-D445 HydrophobicContact CG-CB 4.46Å
100I87.7Confident91.7Very high54 Ų5438.2 Ų38.228%0.27719%0.193SC..Hα-helixtrans-62.3-49175.3-67.1169.6000110.7V97 S98 S102 F283V97-I100 PolarHBondContact O-N 2.97Å; S98-I100 VanDerWaalsContact C-N 3.28Å; S98-I100 PolarHBondContact O-N 3.03Å; I100-S102 VanDerWaalsContact C-N 3.35Å; I100-F283 HydrophobicContact CB-CE2 4.36Å; I100-F283 HydrophobicContact CD1-CE2 4.26Å; I100-F283 HydrophobicContact CD1-CZ 4.34Å; I100-F283 HydrophobicContact CG1-CE2 4.27Å; I100-F283 HydrophobicContact CG2-CD2 3.66Å; I100-F283 HydrophobicContact CG2-CE2 3.24Å; I100-F283 HydrophobicContact CG2-CZ 4.03Å
101L91.9Very high91.5Very high120 Ų12036.5 Ų36.563%0.62818%0.184SC*.Hα-helixtrans-66-39.1178.9-61.2176.8000111.9S98 G103 F104 L105S98-L101 PolarHBondContact O-N 3.29Å; L101-G103 PolarHBondContact O-N 2.92Å; L101-F104 WeakPolarHBondContact O-CB 3.35Å; L101-F104 PolarHBondContact O-N 2.93Å; L101-L105 WeakPolarHBondContact O-CB 3.43Å; L101-L105 PolarHBondContact O-N 3.32Å
102S92.8Very high91.4Very high10 Ų1036.5 Ų36.57%0.0718%0.184CC..Hα-helixtrans-60.3-41.8-179.21750000112.5S98 M99 I100 L105 A106 F114 A155 S156 P159S98-S102 WeakPolarHBondContact O-CB 3.39Å; S98-S102 PolarHBondContact O-N 3.31Å; M99-S102 PolarHBondContact O-N 3.35Å; I100-S102 VanDerWaalsContact C-N 3.35Å; S102-L105 PolarHBondContact O-N 3.5Å; S102-A106 VanDerWaalsContact O-CB 3.27Å; S102-A106 WeakPolarHBondContact O-CB 3.31Å; S102-A106 PolarHBondContact O-N 2.64Å; S102-F114 WeakPolarHBondContact OG-CZ 3.31Å; S102-A155 VanDerWaalsContact CB-O 3.27Å; S102-A155 WeakPolarHBondContact CB-O 3.22Å; S102-A155 PolarHBondContact OG-O 3.45Å; S102-S156 VanDerWaalsContact OG-CA 3.27Å; S102-S156 WeakPolarHBondContact OG-CA 3.38Å; S102-P159 WeakPolarHBondContact OG-CG 3.33Å
103G89.2Confident91.3Very high0 Ų040 Ų400%020%0.197CC..Hα-helixtrans-64-44.3177.200000112.9M99 L101 L105 A106 E107 S442M99-G103 PolarHBondContact O-N 3.44Å; L101-G103 PolarHBondContact O-N 2.92Å; G103-L105 VanDerWaalsContact C-N 3.31Å; G103-L105 PolarHBondContact O-N 3.16Å; G103-A106 PolarHBondContact O-N 3.05Å; G103-E107 PolarHBondContact O-N 2.91Å; G103-S442 WeakPolarHBondContact CA-OG 3.36Å; G103-S442 PolarHBondContact N-OG 3.18Å; G103-S442 VanDerWaalsContact N-OG 3.07Å
104F87.6Confident91.3Very high89 Ų8937.3 Ų37.339%0.3919%0.185SC..Hα-helixtrans-61.4-41.9175.2-175.3-91.2000111.2L101 R108L101-F104 WeakPolarHBondContact O-CB 3.35Å; L101-F104 PolarHBondContact O-N 2.93Å; F104-R108 VanDerWaalsContact CE1-NH1 3.34Å; F104-R108 PolarHBondContact O-NH1 3.03Å
105L90.4Very high91.2Very high82 Ų8236.2 Ų36.243%0.42918%0.179SC..Hα-helixtrans-67.3-44.3177.7-173.457000111.7L101 S102 G103 E107 R108 V109 F114L101-L105 WeakPolarHBondContact O-CB 3.43Å; L101-L105 PolarHBondContact O-N 3.32Å; S102-L105 PolarHBondContact O-N 3.5Å; G103-L105 VanDerWaalsContact C-N 3.31Å; G103-L105 PolarHBondContact O-N 3.16Å; L105-E107 PolarHBondContact O-N 2.98Å; L105-R108 PolarHBondContact O-N 3.19Å; L105-V109 HydrophobicContact CD1-CG1 3.57Å; L105-V109 HydrophobicContact CG-CG1 4.08Å; L105-V109 HydrophobicContact CG-CG2 4.46Å; L105-V109 WeakPolarHBondContact O-CG2 3.48Å; L105-V109 PolarHBondContact O-N 2.93Å; L105-V109 VanDerWaalsContact O-N 3.17Å; L105-F114 HydrophobicContact CB-CE2 4.37Å; L105-F114 HydrophobicContact CD2-CD2 4.32Å; L105-F114 HydrophobicContact CD2-CE2 3.7Å; L105-F114 HydrophobicContact CG-CD2 4.41Å; L105-F114 HydrophobicContact CG-CE2 3.97Å
106A87.9Confident91.2Very high3 Ų336.4 Ų36.43%0.02518%0.18CC..Hα-helixtrans-56.8-32.2-17800000113.6S102 G103 R108 L111 F114 P159 A438S102-A106 VanDerWaalsContact O-CB 3.27Å; S102-A106 WeakPolarHBondContact O-CB 3.31Å; S102-A106 PolarHBondContact O-N 2.64Å; G103-A106 PolarHBondContact O-N 3.05Å; A106-R108 VanDerWaalsContact C-N 3.27Å; A106-R108 PolarHBondContact O-N 3.42Å; A106-L111 HydrophobicContact CB-CD2 4.12Å; A106-L111 WeakPolarHBondContact O-CD2 3.2Å; A106-F114 HydrophobicContact CB-CD1 4.09Å; A106-F114 HydrophobicContact CB-CE1 3.72Å; A106-F114 HydrophobicContact CB-CZ 4.38Å; A106-P159 HydrophobicContact CB-CB 4.23Å; A106-P159 HydrophobicContact CB-CG 4.46Å; A106-A438 HydrophobicContact CB-CB 4.24Å
107E83.4Confident91.3Very high19 Ų1941 Ų419%0.08920%0.203CC..THydrogen-bonded Turntrans-72.5-18.8176.9-68.5-178.9-178.500114G103 L105 P280 A436 A438 T439G103-E107 PolarHBondContact O-N 2.91Å; L105-E107 PolarHBondContact O-N 2.98Å; E107-P280 WeakPolarHBondContact OE2-CB 3.41Å; E107-A436 WeakPolarHBondContact OE1-CA 3.4Å; E107-A438 HydrophobicContact CG-CB 3.67Å; E107-A438 PolarHBondContact OE1-N 3.46Å; E107-T439 PolarHBondContact OE1-N 2.86Å; E107-T439 PolarHBondContact OE1-OG1 3.49Å; E107-T439 PolarHBondContact OE2-OG1 2.65Å
108R84.2Confident91.4Very high111 Ų11138 Ų3842%0.41919%0.187SC..THydrogen-bonded Turntrans-107.3-20.9-171.3-66.6175.4174.4723.4113.7F104 L105 A106F104-R108 VanDerWaalsContact CE1-NH1 3.34Å; F104-R108 PolarHBondContact O-NH1 3.03Å; L105-R108 PolarHBondContact O-N 3.19Å; A106-R108 VanDerWaalsContact C-N 3.27Å; A106-R108 PolarHBondContact O-N 3.42Å
109V87.2Confident91.5Very high53 Ų5337.4 Ų37.432%0.32118%0.182SC..SBendtrans-104.7169.5-177.9-57.90000111.6L105 L111 F114L105-V109 HydrophobicContact CD1-CG1 3.57Å; L105-V109 HydrophobicContact CG-CG1 4.08Å; L105-V109 HydrophobicContact CG-CG2 4.46Å; L105-V109 WeakPolarHBondContact O-CG2 3.48Å; L105-V109 PolarHBondContact O-N 2.93Å; L105-V109 VanDerWaalsContact O-N 3.17Å; V109-L111 PolarHBondContact O-N 2.96Å; V109-F114 HydrophobicContact CG2-CB 3.6Å; V109-F114 HydrophobicContact CG2-CD2 3.85Å; V109-F114 HydrophobicContact CG2-CG 3.73Å
110N89.1Confident91.7Very high17 Ų1741.9 Ų41.99%0.09120%0.202CC..  trans-75.1117.2170.3174-80.1000108.7R112 Y113 F114 E228N110-R112 VanDerWaalsContact C-N 3.26Å; N110-R112 PolarHBondContact O-N 2.92Å; N110-R112 WeakPolarHBondContact OD1-CB 3.43Å; N110-R112 PolarHBondContact OD1-N 3.07Å; N110-Y113 HydrophobicContact CB-CD2 3.84Å; N110-Y113 HydrophobicContact CB-CE2 4.4Å; N110-Y113 PolarHBondContact O-N 3.18Å; N110-Y113 WeakPolarHBondContact OD1-CD2 3.36Å; N110-Y113 WeakPolarHBondContact OD1-CE2 3.34Å; N110-Y113 PolarHBondContact OD1-N 3.38Å; N110-F114 WeakPolarHBondContact O-CB 3.49Å; N110-F114 PolarHBondContact O-N 3.3Å; N110-E228 VanDerWaalsContact C-OE1 3.23Å; N110-E228 PolarHBondContact ND2-OE1 2.87Å; N110-E228 PolarHBondContact ND2-OE2 3.09Å; N110-E228 PolarHBondContact OD1-OE1 3.47Å
111L90.6Very high92.3Very high4 Ų442.1 Ų42.12%0.02120%0.204CC..Hα-helixtrans-60.9-30.8-174.2-70.7174.5000113A106 V109 F114 L115 A160 T163 L164 E228A106-L111 HydrophobicContact CB-CD2 4.12Å; A106-L111 WeakPolarHBondContact O-CD2 3.2Å; V109-L111 PolarHBondContact O-N 2.96Å; L111-F114 PolarHBondContact O-N 3.21Å; L111-L115 VanDerWaalsContact O-CB 3.27Å; L111-L115 WeakPolarHBondContact O-CB 3.19Å; L111-L115 PolarHBondContact O-N 3.07Å; L111-A160 HydrophobicContact CD2-CB 4.25Å; L111-T163 HydrophobicContact CD1-CG2 3.65Å; L111-L164 HydrophobicContact CB-CD2 4.39Å; L111-L164 HydrophobicContact CD1-CD2 4.17Å; L111-L164 HydrophobicContact CD1-CG 4.34Å; L111-E228 HydrophobicContact CB-CG 4.08Å; L111-E228 PolarHBondContact N-OE1 3.22Å
112R92.8Very high92.5Very high6 Ų636.4 Ų36.42%0.02317%0.174CC..Hα-helixtrans-59.7-54.5176.117217677.6-149.92.9110.6S4 L5 N110 S116 Y223 V226 E228S4-R112 PolarHBondContact O-NH1 3.17Å; S4-R112 PolarHBondContact OG-NH2 2.93Å; L5-R112 VanDerWaalsContact C-NH1 3.28Å; L5-R112 PolarHBondContact O-NH1 3.41Å; N110-R112 VanDerWaalsContact C-N 3.26Å; N110-R112 PolarHBondContact O-N 2.92Å; N110-R112 WeakPolarHBondContact OD1-CB 3.43Å; N110-R112 PolarHBondContact OD1-N 3.07Å; R112-S116 VanDerWaalsContact O-CB 3.26Å; R112-S116 WeakPolarHBondContact O-CB 3.41Å; R112-S116 PolarHBondContact O-N 3.28Å; R112-S116 PolarHBondContact O-OG 2.72Å; R112-Y223 WeakPolarHBondContact CD-O 3.46Å; R112-V226 HydrophobicContact CB-CG1 3.52Å; R112-V226 HydrophobicContact CG-CG1 3.49Å; R112-V226 VanDerWaalsContact CG-CG1 3.49Å; R112-E228 HydrophobicContact CB-CG 4.41Å; R112-E228 PolarHBondContact N-OE1 3.16Å
113Y94Very high92.8Very high76 Ų7635.9 Ų35.930%0.29817%0.17SC..Hα-helixtrans-66.8-42179.8-61-65.9000111.3N110 S116 I117 Y223N110-Y113 HydrophobicContact CB-CD2 3.84Å; N110-Y113 HydrophobicContact CB-CE2 4.4Å; N110-Y113 PolarHBondContact O-N 3.18Å; N110-Y113 WeakPolarHBondContact OD1-CD2 3.36Å; N110-Y113 WeakPolarHBondContact OD1-CE2 3.34Å; N110-Y113 PolarHBondContact OD1-N 3.38Å; Y113-S116 PolarHBondContact O-N 2.91Å; Y113-I117 VanDerWaalsContact O-CB 3.31Å; Y113-I117 WeakPolarHBondContact O-CB 3.34Å; Y113-I117 WeakPolarHBondContact O-CD1 3.31Å; Y113-I117 VanDerWaalsContact O-CG1 3.22Å; Y113-I117 WeakPolarHBondContact O-CG1 3.44Å; Y113-I117 PolarHBondContact O-N 3.47Å; Y113-Y223 HydrophobicContact CD1-CD2 4.34Å; Y113-Y223 AromaticContact CD1-CE2 3.84Å; Y113-Y223 HydrophobicContact CD1-CE2 3.84Å; Y113-Y223 HydrophobicContact CE1-CD2 4.47Å; Y113-Y223 AromaticContact CE1-CE2 3.63Å; Y113-Y223 HydrophobicContact CE1-CE2 3.63Å
114F94.8Very high93.2Very high29 Ų2938.5 Ų38.513%0.12719%0.186CC..Hα-helixtrans-59.4-50.7-179-176.3-111.6000112.6S102 L105 A106 V109 N110 L111 G118 S156 A160S102-F114 WeakPolarHBondContact OG-CZ 3.31Å; L105-F114 HydrophobicContact CB-CE2 4.37Å; L105-F114 HydrophobicContact CD2-CD2 4.32Å; L105-F114 HydrophobicContact CD2-CE2 3.7Å; L105-F114 HydrophobicContact CG-CD2 4.41Å; L105-F114 HydrophobicContact CG-CE2 3.97Å; A106-F114 HydrophobicContact CB-CD1 4.09Å; A106-F114 HydrophobicContact CB-CE1 3.72Å; A106-F114 HydrophobicContact CB-CZ 4.38Å; V109-F114 HydrophobicContact CG2-CB 3.6Å; V109-F114 HydrophobicContact CG2-CD2 3.85Å; V109-F114 HydrophobicContact CG2-CG 3.73Å; N110-F114 WeakPolarHBondContact O-CB 3.49Å; N110-F114 PolarHBondContact O-N 3.3Å; L111-F114 PolarHBondContact O-N 3.21Å; F114-G118 PolarHBondContact O-N 3.45Å; F114-S156 VanDerWaalsContact CE1-O 3.31Å; F114-S156 WeakPolarHBondContact CE1-O 3.41Å; F114-A160 HydrophobicContact CD1-CB 3.89Å; F114-A160 HydrophobicContact CE1-CB 4.18Å
115L95.8Very high93.7Very high1 Ų134.3 Ų34.31%0.00517%0.168CC..Hα-helixtrans-67.1-44.2178.1-179.257.9000111.7Y39 L111 G118 M119 A160 V161 L164 V222Y39-L115 HydrophobicContact CE2-CD1 4.2Å; L111-L115 VanDerWaalsContact O-CB 3.27Å; L111-L115 WeakPolarHBondContact O-CB 3.19Å; L111-L115 PolarHBondContact O-N 3.07Å; L115-G118 PolarHBondContact O-N 3.29Å; L115-M119 HydrophobicContact CD1-CG 3.96Å; L115-M119 HydrophobicContact CD1-SD 3.96Å; L115-M119 HydrophobicContact CG-CG 4.4Å; L115-M119 HydrophobicContact CG-SD 4.01Å; L115-M119 WeakPolarHBondContact O-CB 3.48Å; L115-M119 VanDerWaalsContact O-CG 3.31Å; L115-M119 WeakPolarHBondContact O-CG 3.36Å; L115-M119 PolarHBondContact O-N 3.01Å; L115-A160 HydrophobicContact CB-CB 4Å; L115-A160 HydrophobicContact CD1-CB 4.12Å; L115-A160 HydrophobicContact CG-CB 4.46Å; L115-V161 HydrophobicContact CD1-CG1 4.03Å; L115-V161 HydrophobicContact CD2-CG1 3.95Å; L115-L164 HydrophobicContact CD2-CD1 3.71Å; L115-V222 HydrophobicContact CB-CG1 4.39Å; L115-V222 HydrophobicContact CD2-CG1 3.81Å; L115-V222 HydrophobicContact CG-CG1 4.01Å
116S96.9Very high94Very high6 Ų630.7 Ų30.74%0.04215%0.149CC..Hα-helixtrans-65.9-46.3-176.5-51.80000112.1R112 Y113 G118 M119 F120 A219 V222 Y223R112-S116 VanDerWaalsContact O-CB 3.26Å; R112-S116 WeakPolarHBondContact O-CB 3.41Å; R112-S116 PolarHBondContact O-N 3.28Å; R112-S116 PolarHBondContact O-OG 2.72Å; Y113-S116 PolarHBondContact O-N 2.91Å; S116-G118 VanDerWaalsContact C-N 3.33Å; S116-M119 PolarHBondContact O-N 3.03Å; S116-F120 WeakPolarHBondContact O-CB 3.4Å; S116-F120 PolarHBondContact O-N 2.97Å; S116-A219 WeakPolarHBondContact O-CB 3.28Å; S116-V222 WeakPolarHBondContact OG-CG1 3.42Å; S116-Y223 VanDerWaalsContact OG-CA 3.26Å; S116-Y223 WeakPolarHBondContact OG-CA 3.46Å; S116-Y223 PolarHBondContact OG-N 3.05Å
117I97Very high94.5Very high98 Ų9833.9 Ų33.950%0.50316%0.162SC..Hα-helixtrans-64.3-43.5177.3-65.8167.4000109.7Y113 M119 F120 L121Y113-I117 VanDerWaalsContact O-CB 3.31Å; Y113-I117 WeakPolarHBondContact O-CB 3.34Å; Y113-I117 WeakPolarHBondContact O-CD1 3.31Å; Y113-I117 VanDerWaalsContact O-CG1 3.22Å; Y113-I117 WeakPolarHBondContact O-CG1 3.44Å; Y113-I117 PolarHBondContact O-N 3.47Å; I117-M119 PolarHBondContact O-N 3.36Å; I117-F120 PolarHBondContact O-N 3.08Å; I117-L121 HydrophobicContact CG2-CD1 3.84Å; I117-L121 HydrophobicContact CG2-CG 4.25Å; I117-L121 WeakPolarHBondContact O-CB 3.49Å; I117-L121 WeakPolarHBondContact O-CG 3.5Å; I117-L121 PolarHBondContact O-N 2.85Å
118G97.1Very high95.2Very high7 Ų733.8 Ų33.87%0.07217%0.165CC..Hα-helixtrans-56.4-49.1175.800000113.3F114 L115 S116 S122 S156F114-G118 PolarHBondContact O-N 3.45Å; L115-G118 PolarHBondContact O-N 3.29Å; S116-G118 VanDerWaalsContact C-N 3.33Å; G118-S122 VanDerWaalsContact O-CB 3.31Å; G118-S122 WeakPolarHBondContact O-CB 3.36Å; G118-S122 PolarHBondContact O-N 2.67Å; G118-S122 PolarHBondContact O-OG 3.46Å; G118-S156 WeakPolarHBondContact CA-OG 3.45Å
119M98Very high95.8Very high0 Ų028.7 Ų28.70%015%0.146CC..Hα-helixtrans-64.2-45.2177.6-75.5-17972.500111.5C35 F38 Y39 L115 S116 I117 S122 G123 M215 A219 V222C35-M119 HydrophobicContact CB-CE 3.91Å; C35-M119 HydrophobicContact CB-SD 3.85Å; F38-M119 HydrophobicContact CD2-CE 4.27Å; Y39-M119 HydrophobicContact CD2-CG 4.34Å; Y39-M119 HydrophobicContact CE1-CG 4.46Å; Y39-M119 HydrophobicContact CE2-CG 3.33Å; Y39-M119 HydrophobicContact CE2-SD 4.2Å; Y39-M119 VanDerWaalsContact CZ-CG 3.42Å; Y39-M119 WeakPolarHBondContact OH-CA 3.11Å; Y39-M119 WeakPolarHBondContact OH-CG 3.25Å; Y39-M119 PolarHBondContact OH-N 3.46Å; Y39-M119 VanDerWaalsContact OH-N 3.13Å; L115-M119 HydrophobicContact CD1-CG 3.96Å; L115-M119 HydrophobicContact CD1-SD 3.96Å; L115-M119 HydrophobicContact CG-CG 4.4Å; L115-M119 HydrophobicContact CG-SD 4.01Å; L115-M119 WeakPolarHBondContact O-CB 3.48Å; L115-M119 VanDerWaalsContact O-CG 3.31Å; L115-M119 WeakPolarHBondContact O-CG 3.36Å; L115-M119 PolarHBondContact O-N 3.01Å; S116-M119 PolarHBondContact O-N 3.03Å; I117-M119 PolarHBondContact O-N 3.36Å; M119-S122 WeakPolarHBondContact O-CB 3.27Å; M119-S122 PolarHBondContact O-N 3.35Å; M119-G123 PolarHBondContact O-N 3.16Å; M119-M215 HydrophobicContact CB-CG 4.43Å; M119-M215 WeakPolarHBondContact O-CG 3.24Å; M119-A219 HydrophobicContact CB-CB 3.55Å; M119-V222 HydrophobicContact CE-CG2 4.49Å; M119-V222 HydrophobicContact SD-CG2 3.84Å
120F98.4Very high96.1Very high94 Ų9426.2 Ų26.241%0.41213%0.131SC..Hα-helixtrans-61.5-50-178.8-177.8-94.9000111.5S116 I117 S122 G123 V124 M216 A219S116-F120 WeakPolarHBondContact O-CB 3.4Å; S116-F120 PolarHBondContact O-N 2.97Å; I117-F120 PolarHBondContact O-N 3.08Å; F120-S122 VanDerWaalsContact C-N 3.3Å; F120-S122 PolarHBondContact O-N 2.7Å; F120-G123 WeakPolarHBondContact O-CA 3.48Å; F120-G123 PolarHBondContact O-N 2.95Å; F120-V124 HydrophobicContact CD1-CG2 4.17Å; F120-V124 HydrophobicContact CE1-CG2 3.81Å; F120-V124 HydrophobicContact CZ-CG2 4.2Å; F120-V124 WeakPolarHBondContact O-CG2 3.3Å; F120-V124 PolarHBondContact O-N 2.78Å; F120-M216 HydrophobicContact CD2-CB 4.22Å; F120-M216 HydrophobicContact CD2-CE 4.22Å; F120-M216 HydrophobicContact CD2-CG 4.2Å; F120-M216 HydrophobicContact CE2-CB 4.42Å; F120-M216 HydrophobicContact CE2-CE 3.45Å; F120-M216 VanDerWaalsContact CE2-CE 3.45Å; F120-M216 HydrophobicContact CE2-CG 4.36Å; F120-M216 HydrophobicContact CZ-CE 3.72Å; F120-A219 HydrophobicContact CB-CB 3.85Å
121L98.2Very high96.4Very high59 Ų5927.6 Ų27.631%0.30914%0.138SC..Hα-helixtrans-64.9-33.8178.4-66.3179000112.4I117 G123 V124 S125 F149 V153I117-L121 HydrophobicContact CG2-CD1 3.84Å; I117-L121 HydrophobicContact CG2-CG 4.25Å; I117-L121 WeakPolarHBondContact O-CB 3.49Å; I117-L121 WeakPolarHBondContact O-CG 3.5Å; I117-L121 PolarHBondContact O-N 2.85Å; L121-G123 VanDerWaalsContact C-N 3.31Å; L121-V124 PolarHBondContact O-N 3.36Å; L121-S125 WeakPolarHBondContact O-CB 3.3Å; L121-S125 PolarHBondContact O-N 2.87Å; L121-F149 HydrophobicContact CB-CZ 4.33Å; L121-F149 HydrophobicContact CD2-CZ 4.41Å; L121-V153 HydrophobicContact CB-CB 4.03Å; L121-V153 HydrophobicContact CB-CG1 3.91Å; L121-V153 HydrophobicContact CB-CG2 4.31Å; L121-V153 HydrophobicContact CD1-CG1 4.19Å
122S98Very high96.5Very high0 Ų027.4 Ų27.40%014%0.137CC..Hα-helixtrans-64.4-36.9171.6-59.10000112.3Y39 G118 M119 F120 S125 T126 Q154 M215Y39-S122 WeakPolarHBondContact CE1-OG 3.38Å; G118-S122 VanDerWaalsContact O-CB 3.31Å; G118-S122 WeakPolarHBondContact O-CB 3.36Å; G118-S122 PolarHBondContact O-N 2.67Å; G118-S122 PolarHBondContact O-OG 3.46Å; M119-S122 WeakPolarHBondContact O-CB 3.27Å; M119-S122 PolarHBondContact O-N 3.35Å; F120-S122 VanDerWaalsContact C-N 3.3Å; F120-S122 PolarHBondContact O-N 2.7Å; S122-S125 PolarHBondContact O-N 2.84Å; S122-S125 PolarHBondContact O-OG 2.75Å; S122-T126 WeakPolarHBondContact O-CB 3.47Å; S122-T126 PolarHBondContact O-N 3.1Å; S122-T126 PolarHBondContact O-OG1 2.92Å; S122-Q154 WeakPolarHBondContact OG-CA 3.42Å; S122-Q154 VanDerWaalsContact OG-CG 3.28Å; S122-Q154 WeakPolarHBondContact OG-CG 3.5Å; S122-Q154 PolarHBondContact OG-N 3.17Å; S122-M215 VanDerWaalsContact CB-SD 3.59Å; S122-M215 VanDerWaalsContact O-CE 3.27Å; S122-M215 WeakPolarHBondContact O-CE 3.37Å
123G98.2Very high96.5Very high0 Ų028 Ų280%014%0.142CC..Hα-helixtrans-64.1-47.3174.100000111.4M119 F120 L121 S125 T126 F127 G212M119-G123 PolarHBondContact O-N 3.16Å; F120-G123 WeakPolarHBondContact O-CA 3.48Å; F120-G123 PolarHBondContact O-N 2.95Å; L121-G123 VanDerWaalsContact C-N 3.31Å; G123-S125 PolarHBondContact O-N 3.4Å; G123-T126 PolarHBondContact O-N 3.03Å; G123-F127 VanDerWaalsContact O-CB 3.25Å; G123-F127 WeakPolarHBondContact O-CB 3.36Å; G123-F127 PolarHBondContact O-N 3.25Å; G123-G212 WeakPolarHBondContact CA-O 3.42Å; G123-G212 WeakPolarHBondContact O-CA 3.47Å
124V98.2Very high96.3Very high55 Ų5532.6 Ų32.633%0.33316%0.16SC..Hα-helixtrans-59.3-44.3174.7172.90000111.3F120 L121 F127 A128 M216F120-V124 HydrophobicContact CD1-CG2 4.17Å; F120-V124 HydrophobicContact CE1-CG2 3.81Å; F120-V124 HydrophobicContact CZ-CG2 4.2Å; F120-V124 WeakPolarHBondContact O-CG2 3.3Å; F120-V124 PolarHBondContact O-N 2.78Å; L121-V124 PolarHBondContact O-N 3.36Å; V124-F127 PolarHBondContact O-N 3.16Å; V124-A128 WeakPolarHBondContact O-CB 3.21Å; V124-A128 PolarHBondContact O-N 3.45Å; V124-M216 HydrophobicContact CG2-CE 4.07Å; V124-M216 HydrophobicContact CG2-SD 4.16Å
125S97.7Very high96.2Very high1 Ų137.2 Ų37.21%0.00718%0.18CC..Hα-helixtrans-66.4-41.7-179.480.70000112.3L121 S122 G123 A128 F129 I146 S150L121-S125 WeakPolarHBondContact O-CB 3.3Å; L121-S125 PolarHBondContact O-N 2.87Å; S122-S125 PolarHBondContact O-N 2.84Å; S122-S125 PolarHBondContact O-OG 2.75Å; G123-S125 PolarHBondContact O-N 3.4Å; S125-A128 PolarHBondContact O-N 2.91Å; S125-F129 PolarHBondContact O-N 3.31Å; S125-I146 VanDerWaalsContact O-CG2 3.24Å; S125-I146 WeakPolarHBondContact O-CG2 3.08Å; S125-S150 WeakPolarHBondContact CB-OG 3.39Å; S125-S150 WeakPolarHBondContact OG-CB 3.45Å; S125-S150 PolarHBondContact OG-OG 3.38Å
126T97.4Very high95.9Very high5 Ų542.1 Ų42.13%0.03120%0.203CC..Hα-helixtrans-64.8-46.9175.8-520000110.6S42 S122 G123 A128 F129 G130 F208S42-T126 WeakPolarHBondContact CB-OG1 3.37Å; S122-T126 WeakPolarHBondContact O-CB 3.47Å; S122-T126 PolarHBondContact O-N 3.1Å; S122-T126 PolarHBondContact O-OG1 2.92Å; G123-T126 PolarHBondContact O-N 3.03Å; T126-A128 VanDerWaalsContact C-N 3.29Å; T126-A128 PolarHBondContact O-N 3.03Å; T126-F129 WeakPolarHBondContact O-CB 3.46Å; T126-F129 PolarHBondContact O-N 3.37Å; T126-F129 VanDerWaalsContact O-N 3.13Å; T126-G130 PolarHBondContact O-N 3.5Å; T126-F208 HydrophobicContact CG2-CB 4.47Å; T126-F208 HydrophobicContact CG2-CD1 4.4Å; T126-F208 WeakPolarHBondContact CG2-O 3.47Å
127F97.6Very high95.7Very high70 Ų7043.4 Ų43.431%0.30721%0.209SC..Hα-helixtrans-59.3-43.8176.8-168-76.8000110.8G123 V124 F129 G130 L131 Y209G123-F127 VanDerWaalsContact O-CB 3.25Å; G123-F127 WeakPolarHBondContact O-CB 3.36Å; G123-F127 PolarHBondContact O-N 3.25Å; V124-F127 PolarHBondContact O-N 3.16Å; F127-F129 VanDerWaalsContact C-N 3.34Å; F127-F129 PolarHBondContact O-N 2.93Å; F127-G130 PolarHBondContact O-N 2.96Å; F127-G130 VanDerWaalsContact O-N 3.15Å; F127-L131 HydrophobicContact CD1-CD1 4.1Å; F127-L131 HydrophobicContact CD1-CD2 4.37Å; F127-L131 HydrophobicContact CD1-CG 4.01Å; F127-L131 HydrophobicContact CE1-CD1 4.22Å; F127-L131 HydrophobicContact CE1-CD2 3.86Å; F127-L131 HydrophobicContact CE1-CG 4.02Å; F127-L131 PolarHBondContact O-N 3.46Å; F127-Y209 AromaticContact CD1-CD1 3.9Å; F127-Y209 HydrophobicContact CD1-CD1 3.9Å; F127-Y209 HydrophobicContact CD1-CE1 4.48Å; F127-Y209 HydrophobicContact CD2-CD1 4.17Å; F127-Y209 HydrophobicContact CD2-CG 4.48Å; F127-Y209 WeakPolarHBondContact CD2-O 2.89Å; F127-Y209 AromaticContact CE1-CD1 3.87Å; F127-Y209 HydrophobicContact CE1-CD1 3.87Å; F127-Y209 HydrophobicContact CE1-CE1 4.36Å; F127-Y209 HydrophobicContact CE2-CD1 4.16Å; F127-Y209 HydrophobicContact CE2-CG 4.26Å; F127-Y209 HydrophobicContact CG-CD1 4.04Å; F127-Y209 AromaticContact CZ-CD1 4Å; F127-Y209 HydrophobicContact CZ-CD1 4Å; F127-Y209 HydrophobicContact CZ-CG 4.33Å; F127-Y209 WeakPolarHBondContact O-CD1 3.42Å; F127-Y209 WeakPolarHBondContact O-CE1 3.45Å
128A97.1Very high95.4Very high17 Ų1741.7 Ų41.714%0.1420%0.199CC..Hα-helixtrans-60.6-40175.600000111.8V124 S125 T126 G130 L131 Y142 I146V124-A128 WeakPolarHBondContact O-CB 3.21Å; V124-A128 PolarHBondContact O-N 3.45Å; S125-A128 PolarHBondContact O-N 2.91Å; T126-A128 VanDerWaalsContact C-N 3.29Å; T126-A128 PolarHBondContact O-N 3.03Å; A128-G130 PolarHBondContact O-N 3.29Å; A128-L131 WeakPolarHBondContact O-CB 3.3Å; A128-L131 PolarHBondContact O-N 3.24Å; A128-Y142 PolarHBondContact O-OH 3.46Å; A128-I146 HydrophobicContact CB-CD1 3.68Å
129F96.5Very high95.2Very high5 Ų549.6 Ų49.62%0.02223%0.228CC..Hα-helixtrans-54.9-43175-165.3-79000112L46 S125 T126 F127 L131 F143 I146 Q147 W204 F208L46-F129 HydrophobicContact CD1-CE1 4.15Å; L46-F129 HydrophobicContact CD1-CZ 3.83Å; L46-F129 HydrophobicContact CD2-CZ 4.49Å; S125-F129 PolarHBondContact O-N 3.31Å; T126-F129 WeakPolarHBondContact O-CB 3.46Å; T126-F129 PolarHBondContact O-N 3.37Å; T126-F129 VanDerWaalsContact O-N 3.13Å; F127-F129 VanDerWaalsContact C-N 3.34Å; F127-F129 PolarHBondContact O-N 2.93Å; F129-L131 PolarHBondContact O-N 3.05Å; F129-F143 HydrophobicContact CD2-CD1 4.21Å; F129-F143 AromaticContact CE1-CD1 3.99Å; F129-F143 HydrophobicContact CE1-CD1 3.99Å; F129-F143 HydrophobicContact CE1-CE1 4.07Å; F129-F143 HydrophobicContact CE2-CB 4.31Å; F129-F143 AromaticContact CE2-CD1 3.62Å; F129-F143 HydrophobicContact CE2-CD1 3.62Å; F129-F143 HydrophobicContact CE2-CE1 4.49Å; F129-F143 HydrophobicContact CE2-CG 4.44Å; F129-F143 AromaticContact CZ-CD1 3.49Å; F129-F143 HydrophobicContact CZ-CD1 3.49Å; F129-F143 VanDerWaalsContact CZ-CD1 3.49Å; F129-F143 HydrophobicContact CZ-CE1 4.02Å; F129-F143 HydrophobicContact CZ-CG 4.48Å; F129-I146 HydrophobicContact CB-CG2 3.8Å; F129-I146 HydrophobicContact CD2-CB 4.44Å; F129-I146 HydrophobicContact CD2-CG2 3.91Å; F129-I146 HydrophobicContact CG-CG2 4.36Å; F129-Q147 HydrophobicContact CD2-CG 4.5Å; F129-Q147 HydrophobicContact CE2-CG 4.12Å; F129-W204 HydrophobicContact CD1-CZ3 4.41Å; F129-W204 HydrophobicContact CE1-CZ3 4.28Å; F129-F208 HydrophobicContact CB-CD1 4.09Å; F129-F208 HydrophobicContact CB-CG 4.49Å; F129-F208 AromaticContact CD1-CD1 3.62Å; F129-F208 HydrophobicContact CD1-CD1 3.62Å; F129-F208 HydrophobicContact CD1-CD2 4.01Å; F129-F208 AromaticContact CD1-CE1 3.37Å; F129-F208 HydrophobicContact CD1-CE1 3.37Å; F129-F208 AromaticContact CD1-CE2 3.78Å; F129-F208 HydrophobicContact CD1-CE2 3.78Å; F129-F208 AromaticContact CD1-CG 3.93Å; F129-F208 HydrophobicContact CD1-CG 3.93Å; F129-F208 AromaticContact CD1-CZ 3.45Å; F129-F208 HydrophobicContact CD1-CZ 3.45Å; F129-F208 VanDerWaalsContact CD1-CZ 3.45Å; F129-F208 HydrophobicContact CE1-CD1 4.41Å; F129-F208 AromaticContact CE1-CE1 3.73Å; F129-F208 HydrophobicContact CE1-CE1 3.73Å; F129-F208 AromaticContact CE1-CE2 3.88Å; F129-F208 HydrophobicContact CE1-CE2 3.88Å; F129-F208 AromaticContact CE1-CZ 3.42Å; F129-F208 HydrophobicContact CE1-CZ 3.42Å; F129-F208 VanDerWaalsContact CE1-CZ 3.42Å; F129-F208 HydrophobicContact CG-CD1 4.08Å; F129-F208 HydrophobicContact CG-CE1 4.01Å; F129-F208 HydrophobicContact CG-CZ 4.49Å; F129-F208 HydrophobicContact CZ-CZ 4.42Å
130G95.3Very high95Very high0 Ų052.9 Ų52.90%024%0.241CC..Hα-helixtrans-59.8-34.9174.700000112.3T126 F127 A128 A132 S133 Y209T126-G130 PolarHBondContact O-N 3.5Å; F127-G130 PolarHBondContact O-N 2.96Å; F127-G130 VanDerWaalsContact O-N 3.15Å; A128-G130 PolarHBondContact O-N 3.29Å; G130-A132 PolarHBondContact O-N 2.98Å; G130-S133 WeakPolarHBondContact O-CB 3.17Å; G130-S133 PolarHBondContact O-N 3.35Å; G130-Y209 VanDerWaalsContact CA-CE1 3.4Å; G130-Y209 WeakPolarHBondContact O-CE1 3.39Å; G130-Y209 PolarHBondContact O-OH 3.48Å
131L94.7Very high94.9Very high46 Ų4652.4 Ų52.424%0.24125%0.249CC..Hα-helixtrans-62.4-20.6-167.2-79.7177.4000112.2F127 A128 F129 S133 Y134 F135 Y209F127-L131 HydrophobicContact CD1-CD1 4.1Å; F127-L131 HydrophobicContact CD1-CD2 4.37Å; F127-L131 HydrophobicContact CD1-CG 4.01Å; F127-L131 HydrophobicContact CE1-CD1 4.22Å; F127-L131 HydrophobicContact CE1-CD2 3.86Å; F127-L131 HydrophobicContact CE1-CG 4.02Å; F127-L131 PolarHBondContact O-N 3.46Å; A128-L131 WeakPolarHBondContact O-CB 3.3Å; A128-L131 PolarHBondContact O-N 3.24Å; F129-L131 PolarHBondContact O-N 3.05Å; L131-S133 PolarHBondContact O-N 3.37Å; L131-Y134 PolarHBondContact O-N 2.63Å; L131-Y134 VanDerWaalsContact O-N 3.1Å; L131-F135 HydrophobicContact CB-CD2 4.01Å; L131-F135 HydrophobicContact CB-CE2 4.2Å; L131-F135 HydrophobicContact CD1-CE2 4.2Å; L131-F135 HydrophobicContact CD2-CD2 4.3Å; L131-F135 HydrophobicContact CD2-CE2 3.83Å; L131-F135 HydrophobicContact CG-CE2 4.3Å; L131-F135 WeakPolarHBondContact O-CD2 3.35Å; L131-F135 PolarHBondContact O-N 3.17Å; L131-Y209 VanDerWaalsContact CA-CE1 3.46Å; L131-Y209 VanDerWaalsContact CA-OH 3.23Å; L131-Y209 WeakPolarHBondContact CA-OH 3.3Å; L131-Y209 HydrophobicContact CB-CE1 4.16Å; L131-Y209 HydrophobicContact CD2-CD1 4.49Å; L131-Y209 HydrophobicContact CD2-CE1 3.68Å; L131-Y209 HydrophobicContact CG-CE1 3.77Å; L131-Y209 PolarHBondContact N-OH 3.29Å
132A93.4Very high94.8Very high0 Ų051.9 Ų51.90%024%0.243CC..Hα-helixtrans-52.9-38.7167.900000113.3W72 G130 Y134 E136 I137 Y142 F143 W204W72-A132 VanDerWaalsContact CZ2-O 3.25Å; W72-A132 WeakPolarHBondContact CZ2-O 3.49Å; G130-A132 PolarHBondContact O-N 2.98Å; A132-Y134 VanDerWaalsContact C-N 3.35Å; A132-Y134 PolarHBondContact O-N 2.91Å; A132-E136 WeakPolarHBondContact O-CA 3.33Å; A132-E136 PolarHBondContact O-N 3.44Å; A132-I137 HydrophobicContact CB-CB 3.96Å; A132-I137 PolarHBondContact O-N 3.13Å; A132-Y142 HydrophobicContact CB-CD1 4.16Å; A132-Y142 HydrophobicContact CB-CE1 3.68Å; A132-F143 HydrophobicContact CB-CE1 3.65Å; A132-F143 HydrophobicContact CB-CZ 3.58Å; A132-W204 HydrophobicContact CB-CH2 3.93Å; A132-W204 HydrophobicContact CB-CZ2 4.44Å
133S91.1Very high94.8Very high18 Ų1851.9 Ų51.913%0.12624%0.243CC..Hα-helixtrans-64.8-37.2177.1-170.80000112.9G130 L131 W204G130-S133 WeakPolarHBondContact O-CB 3.17Å; G130-S133 PolarHBondContact O-N 3.35Å; L131-S133 PolarHBondContact O-N 3.37Å; S133-W204 VanDerWaalsContact CB-CE2 3.47Å; S133-W204 PolarHBondContact OG-NE1 2.85Å
134Y90.6Very high94.7Very high173 Ų17353.7 Ų53.768%0.67825%0.254SS*.Hα-helixtrans-82.7-38.1-175.7179.6-95.6000112.2L131 A132 Y209L131-Y134 PolarHBondContact O-N 2.63Å; L131-Y134 VanDerWaalsContact O-N 3.1Å; A132-Y134 VanDerWaalsContact C-N 3.35Å; A132-Y134 PolarHBondContact O-N 2.91Å; Y134-Y209 WeakPolarHBondContact CB-OH 3.44Å; Y134-Y209 PolarHBondContact N-OH 3.49Å
135F92.6Very high94.7Very high127 Ų12757.7 Ų57.756%0.55727%0.267SS*.THydrogen-bonded Turntrans-94.78.1179.4-65.7-62.9000113.8L131 I137L131-F135 HydrophobicContact CB-CD2 4.01Å; L131-F135 HydrophobicContact CB-CE2 4.2Å; L131-F135 HydrophobicContact CD1-CE2 4.2Å; L131-F135 HydrophobicContact CD2-CD2 4.3Å; L131-F135 HydrophobicContact CD2-CE2 3.83Å; L131-F135 HydrophobicContact CG-CE2 4.3Å; L131-F135 WeakPolarHBondContact O-CD2 3.35Å; L131-F135 PolarHBondContact O-N 3.17Å; F135-I137 VanDerWaalsContact C-N 3.32Å; F135-I137 HydrophobicContact CB-CD1 4.07Å; F135-I137 HydrophobicContact CB-CG1 3.86Å; F135-I137 PolarHBondContact O-N 2.94Å
136E90.1Very high94.7Very high104 Ų10458.1 Ų58.149%0.48627%0.269SS..THydrogen-bonded Turntrans51.946.9-178.9-59.7-175.9172.600113.1V65 A132 H138V65-E136 WeakPolarHBondContact CG1-OE1 3.45Å; A132-E136 WeakPolarHBondContact O-CA 3.33Å; A132-E136 PolarHBondContact O-N 3.44Å; E136-H138 PolarHBondContact O-CD2 3.05Å; E136-H138 PolarHBondContact O-N 3.14Å; E136-H138 PolarHBondContact O-NE2 3.48Å
137I92.1Very high94.7Very high33 Ų3358.6 Ų58.617%0.16927%0.271CS..  trans-83.1117.8-178.7-54.9174.7000109.9W72 A132 F135 Y139 Y142W72-I137 PolarHBondContact NE1-O 3.3Å; A132-I137 HydrophobicContact CB-CB 3.96Å; A132-I137 PolarHBondContact O-N 3.13Å; F135-I137 VanDerWaalsContact C-N 3.32Å; F135-I137 HydrophobicContact CB-CD1 4.07Å; F135-I137 HydrophobicContact CB-CG1 3.86Å; F135-I137 PolarHBondContact O-N 2.94Å; I137-Y139 HydrophobicContact CG2-CD2 4.21Å; I137-Y142 HydrophobicContact CB-CD1 4.47Å; I137-Y142 HydrophobicContact CD1-CD2 4.03Å; I137-Y142 HydrophobicContact CD1-CE1 4.18Å; I137-Y142 HydrophobicContact CD1-CE2 3.63Å; I137-Y142 HydrophobicContact CD1-CG 4.42Å; I137-Y142 HydrophobicContact CG2-CD1 3.9Å; I137-Y142 HydrophobicContact CG2-CD2 4.11Å; I137-Y142 HydrophobicContact CG2-CG 3.65Å
138H91.4Very high94.7Very high61 Ų6157.7 Ų57.728%0.28227%0.271SS..  trans-112.57.6-176.5-63.4-62.1000114.7W72 K73 P74 E136W72-H138 AromaticContact CD2-CE1 3.88Å; W72-H138 AromaticContact CE2-CE1 3.52Å; W72-H138 AromaticContact CE2-ND1 3.61Å; W72-H138 AromaticContact CH2-CE1 3.98Å; W72-H138 AromaticContact CZ2-CE1 3.57Å; W72-H138 AromaticContact CZ2-ND1 3.94Å; W72-H138 AromaticContact NE1-CE1 3.92Å; W72-H138 AromaticContact NE1-ND1 3.51Å; K73-H138 HydrophobicContact CB-CB 3.8Å; K73-H138 WeakPolarHBondContact O-CA 3.24Å; K73-H138 PolarHBondContact O-ND1 2.9Å; P74-H138 WeakPolarHBondContact CD-O 3.48Å; E136-H138 PolarHBondContact O-CD2 3.05Å; E136-H138 PolarHBondContact O-N 3.14Å; E136-H138 PolarHBondContact O-NE2 3.48Å
139Y93Very high94.7Very high174 Ų17460 Ų6068%0.68228%0.278SS*.  trans-85.7125.2-179.5-58.2-72.9000111.8I137 S141 Y142 F143I137-Y139 HydrophobicContact CG2-CD2 4.21Å; Y139-S141 PolarHBondContact O-N 3.13Å; Y139-Y142 VanDerWaalsContact O-CB 3.31Å; Y139-Y142 WeakPolarHBondContact O-CB 3.31Å; Y139-Y142 PolarHBondContact O-N 3.41Å; Y139-Y142 VanDerWaalsContact O-N 3.13Å; Y139-F143 WeakPolarHBondContact O-CD2 3.39Å
140Y94.2Very high94.8Very high69 Ų6959.9 Ų59.927%0.27128%0.278SS..Hα-helixtrans-58.5-36.2176.3-174.2-114.7000112.7P74 F75 L83 L87 Y142 F143 V144P74-Y140 HydrophobicContact CG-CD2 4.1Å; P74-Y140 HydrophobicContact CG-CG 4.44Å; F75-Y140 HydrophobicContact CE1-CD2 4.34Å; F75-Y140 HydrophobicContact CE1-CE2 4.39Å; L83-Y140 HydrophobicContact CB-CE2 4.1Å; L83-Y140 HydrophobicContact CD2-CD2 4.24Å; L83-Y140 HydrophobicContact CD2-CE1 4.44Å; L83-Y140 HydrophobicContact CD2-CE2 3.94Å; L83-Y140 PolarHBondContact O-OH 3.01Å; L87-Y140 HydrophobicContact CD1-CE2 4.05Å; L87-Y140 HydrophobicContact CD2-CE2 3.81Å; L87-Y140 HydrophobicContact CG-CE2 3.74Å; Y140-Y142 PolarHBondContact O-N 2.8Å; Y140-F143 PolarHBondContact O-N 2.95Å; Y140-F143 VanDerWaalsContact O-N 3.14Å; Y140-V144 HydrophobicContact CD1-CG2 3.76Å; Y140-V144 HydrophobicContact CE1-CG2 3.41Å; Y140-V144 VanDerWaalsContact CE1-CG2 3.41Å; Y140-V144 HydrophobicContact CE2-CG2 4.38Å; Y140-V144 HydrophobicContact CG-CG2 4.38Å; Y140-V144 WeakPolarHBondContact O-CG2 3.32Å; Y140-V144 PolarHBondContact O-N 3.35Å
141S95.6Very high94.9Very high84 Ų8459.9 Ų59.959%0.58728%0.278SS*.Hα-helixtrans-59-31.4178.354.30000113.4Y139 V144 F145Y139-S141 PolarHBondContact O-N 3.13Å; S141-V144 PolarHBondContact O-N 3.37Å; S141-F145 WeakPolarHBondContact O-CB 3.37Å; S141-F145 PolarHBondContact O-N 3.16Å
142Y96.8Very high95Very high47 Ų4762 Ų6218%0.18429%0.29CS..Hα-helixtrans-61.9-52.3174.2174.4-98.1000111A128 A132 I137 Y139 Y140 V144 F145 I146A128-Y142 PolarHBondContact O-OH 3.46Å; A132-Y142 HydrophobicContact CB-CD1 4.16Å; A132-Y142 HydrophobicContact CB-CE1 3.68Å; I137-Y142 HydrophobicContact CB-CD1 4.47Å; I137-Y142 HydrophobicContact CD1-CD2 4.03Å; I137-Y142 HydrophobicContact CD1-CE1 4.18Å; I137-Y142 HydrophobicContact CD1-CE2 3.63Å; I137-Y142 HydrophobicContact CD1-CG 4.42Å; I137-Y142 HydrophobicContact CG2-CD1 3.9Å; I137-Y142 HydrophobicContact CG2-CD2 4.11Å; I137-Y142 HydrophobicContact CG2-CG 3.65Å; Y139-Y142 VanDerWaalsContact O-CB 3.31Å; Y139-Y142 WeakPolarHBondContact O-CB 3.31Å; Y139-Y142 PolarHBondContact O-N 3.41Å; Y139-Y142 VanDerWaalsContact O-N 3.13Å; Y140-Y142 PolarHBondContact O-N 2.8Å; Y142-V144 VanDerWaalsContact C-N 3.3Å; Y142-V144 PolarHBondContact O-N 2.9Å; Y142-F145 PolarHBondContact O-N 2.88Å; Y142-I146 HydrophobicContact CD1-CG1 4.44Å; Y142-I146 HydrophobicContact CE1-CG1 4.07Å; Y142-I146 HydrophobicContact CE2-CD1 4.47Å; Y142-I146 HydrophobicContact CE2-CG1 4.23Å; Y142-I146 WeakPolarHBondContact O-CG1 3.47Å; Y142-I146 PolarHBondContact O-N 3.29Å
143F96.2Very high95.1Very high0 Ų062.9 Ų62.90%030%0.295CS..Hα-helixtrans-62.9-39.3179.6-62.4-75.9000111.5F75 L87 F129 A132 Y139 Y140 I146 Q147 W204F75-F143 HydrophobicContact CE2-CD2 4.09Å; F75-F143 HydrophobicContact CE2-CE1 4.25Å; F75-F143 AromaticContact CE2-CE2 3.8Å; F75-F143 HydrophobicContact CE2-CE2 3.8Å; F75-F143 HydrophobicContact CE2-CG 4.43Å; F75-F143 AromaticContact CE2-CZ 3.88Å; F75-F143 HydrophobicContact CE2-CZ 3.88Å; F75-F143 HydrophobicContact CZ-CD1 4.32Å; F75-F143 AromaticContact CZ-CD2 3.8Å; F75-F143 HydrophobicContact CZ-CD2 3.8Å; F75-F143 HydrophobicContact CZ-CE2 4.01Å; F75-F143 AromaticContact CZ-CG 3.95Å; F75-F143 HydrophobicContact CZ-CG 3.95Å; F75-F143 HydrophobicContact CZ-CZ 4.36Å; L87-F143 HydrophobicContact CD1-CB 3.73Å; L87-F143 HydrophobicContact CD1-CG 4.42Å; L87-F143 HydrophobicContact CD2-CB 3.84Å; L87-F143 HydrophobicContact CG-CB 4.48Å; F129-F143 HydrophobicContact CD2-CD1 4.21Å; F129-F143 AromaticContact CE1-CD1 3.99Å; F129-F143 HydrophobicContact CE1-CD1 3.99Å; F129-F143 HydrophobicContact CE1-CE1 4.07Å; F129-F143 HydrophobicContact CE2-CB 4.31Å; F129-F143 AromaticContact CE2-CD1 3.62Å; F129-F143 HydrophobicContact CE2-CD1 3.62Å; F129-F143 HydrophobicContact CE2-CE1 4.49Å; F129-F143 HydrophobicContact CE2-CG 4.44Å; F129-F143 AromaticContact CZ-CD1 3.49Å; F129-F143 HydrophobicContact CZ-CD1 3.49Å; F129-F143 VanDerWaalsContact CZ-CD1 3.49Å; F129-F143 HydrophobicContact CZ-CE1 4.02Å; F129-F143 HydrophobicContact CZ-CG 4.48Å; A132-F143 HydrophobicContact CB-CE1 3.65Å; A132-F143 HydrophobicContact CB-CZ 3.58Å; Y139-F143 WeakPolarHBondContact O-CD2 3.39Å; Y140-F143 PolarHBondContact O-N 2.95Å; Y140-F143 VanDerWaalsContact O-N 3.14Å; F143-I146 PolarHBondContact O-N 3.34Å; F143-Q147 WeakPolarHBondContact O-CB 3.35Å; F143-Q147 VanDerWaalsContact O-CG 3.23Å; F143-Q147 WeakPolarHBondContact O-CG 3.27Å; F143-Q147 PolarHBondContact O-N 3.32Å; F143-W204 HydrophobicContact CE1-CH2 4.3Å
144V97.1Very high95.4Very high38 Ų3862.2 Ų62.223%0.2329%0.29CS..Hα-helixtrans-60-49.2173.8172.10000111L87 I90 Y140 S141 Y142 I146 Q147 V148L87-V144 HydrophobicContact CD2-CB 4.47Å; L87-V144 HydrophobicContact CD2-CG2 3.78Å; I90-V144 HydrophobicContact CD1-CG1 4.24Å; I90-V144 HydrophobicContact CD1-CG2 4.11Å; Y140-V144 HydrophobicContact CD1-CG2 3.76Å; Y140-V144 HydrophobicContact CE1-CG2 3.41Å; Y140-V144 VanDerWaalsContact CE1-CG2 3.41Å; Y140-V144 HydrophobicContact CE2-CG2 4.38Å; Y140-V144 HydrophobicContact CG-CG2 4.38Å; Y140-V144 WeakPolarHBondContact O-CG2 3.32Å; Y140-V144 PolarHBondContact O-N 3.35Å; S141-V144 PolarHBondContact O-N 3.37Å; Y142-V144 VanDerWaalsContact C-N 3.3Å; Y142-V144 PolarHBondContact O-N 2.9Å; V144-I146 PolarHBondContact O-N 2.89Å; V144-Q147 PolarHBondContact O-N 3.02Å; V144-V148 HydrophobicContact CG1-CG2 4.34Å; V144-V148 WeakPolarHBondContact O-CG2 3.19Å; V144-V148 PolarHBondContact O-N 3.05Å
145F97.7Very high95.6Very high139 Ų13954 Ų5461%0.6126%0.257SS*.Hα-helixtrans-59.1-46.5179.3176.5-95.7000111.9S141 Y142 Q147 V148 F149S141-F145 WeakPolarHBondContact O-CB 3.37Å; S141-F145 PolarHBondContact O-N 3.16Å; Y142-F145 PolarHBondContact O-N 2.88Å; F145-Q147 VanDerWaalsContact C-N 3.33Å; F145-Q147 PolarHBondContact O-N 3.12Å; F145-V148 PolarHBondContact O-N 3.39Å; F145-F149 WeakPolarHBondContact O-CB 3.48Å; F145-F149 PolarHBondContact O-N 3.3Å
146I97.7Very high95.7Very high10 Ų1048.4 Ų48.45%0.05123%0.234CC..Hα-helixtrans-63.5-38.6178-64.1-58.1000111.6S125 A128 F129 Y142 F143 V144 S150S125-I146 VanDerWaalsContact O-CG2 3.24Å; S125-I146 WeakPolarHBondContact O-CG2 3.08Å; A128-I146 HydrophobicContact CB-CD1 3.68Å; F129-I146 HydrophobicContact CB-CG2 3.8Å; F129-I146 HydrophobicContact CD2-CB 4.44Å; F129-I146 HydrophobicContact CD2-CG2 3.91Å; F129-I146 HydrophobicContact CG-CG2 4.36Å; Y142-I146 HydrophobicContact CD1-CG1 4.44Å; Y142-I146 HydrophobicContact CE1-CG1 4.07Å; Y142-I146 HydrophobicContact CE2-CD1 4.47Å; Y142-I146 HydrophobicContact CE2-CG1 4.23Å; Y142-I146 WeakPolarHBondContact O-CG1 3.47Å; Y142-I146 PolarHBondContact O-N 3.29Å; F143-I146 PolarHBondContact O-N 3.34Å; V144-I146 PolarHBondContact O-N 2.89Å; I146-S150 WeakPolarHBondContact O-CB 3.35Å; I146-S150 PolarHBondContact O-N 3.07Å; I146-S150 PolarHBondContact O-OG 3.01Å
147Q97Very high95.9Very high16 Ų1643.4 Ų43.48%0.07521%0.211CC..Hα-helixtrans-70.4-39.6178-72.3-65.415.700112.8L87 I90 Y91 F129 F143 V144 F145 S150 G151L87-Q147 HydrophobicContact CB-CG 4.24Å; L87-Q147 HydrophobicContact CD2-CG 4.14Å; I90-Q147 HydrophobicContact CG2-CB 4.45Å; Y91-Q147 VanDerWaalsContact CB-OE1 3.31Å; F129-Q147 HydrophobicContact CD2-CG 4.5Å; F129-Q147 HydrophobicContact CE2-CG 4.12Å; F143-Q147 WeakPolarHBondContact O-CB 3.35Å; F143-Q147 VanDerWaalsContact O-CG 3.23Å; F143-Q147 WeakPolarHBondContact O-CG 3.27Å; F143-Q147 PolarHBondContact O-N 3.32Å; V144-Q147 PolarHBondContact O-N 3.02Å; F145-Q147 VanDerWaalsContact C-N 3.33Å; F145-Q147 PolarHBondContact O-N 3.12Å; Q147-S150 PolarHBondContact O-N 2.89Å; Q147-G151 PolarHBondContact O-N 3.34Å
148V97.9Very high96Very high50 Ų5041.9 Ų41.930%0.30320%0.203SC..Hα-helixtrans-60.1-50.9172.2171.60000109.8I90 V94 V144 F145 S150 G151 L152I90-V148 HydrophobicContact CG2-CG2 3.59Å; V94-V148 HydrophobicContact CG1-CG1 4.42Å; V94-V148 WeakPolarHBondContact CG1-O 3.34Å; V94-V148 HydrophobicContact CG2-CG1 4.39Å; V94-V148 HydrophobicContact CG2-CG2 4.31Å; V144-V148 HydrophobicContact CG1-CG2 4.34Å; V144-V148 WeakPolarHBondContact O-CG2 3.19Å; V144-V148 PolarHBondContact O-N 3.05Å; F145-V148 PolarHBondContact O-N 3.39Å; V148-S150 VanDerWaalsContact C-N 3.33Å; V148-S150 PolarHBondContact O-N 3.16Å; V148-G151 PolarHBondContact O-N 2.93Å; V148-L152 HydrophobicContact CG1-CD1 4.37Å; V148-L152 WeakPolarHBondContact O-CG 3.16Å; V148-L152 PolarHBondContact O-N 2.86Å; V148-L152 VanDerWaalsContact O-N 3.08Å
149F98Very high96Very high65 Ų6539 Ų3929%0.28519%0.189SC..Hα-helixtrans-59.8-45.1178.7-175.9-114.5000111.6L121 F145 G151 L152 V153L121-F149 HydrophobicContact CB-CZ 4.33Å; L121-F149 HydrophobicContact CD2-CZ 4.41Å; F145-F149 WeakPolarHBondContact O-CB 3.48Å; F145-F149 PolarHBondContact O-N 3.3Å; F149-G151 PolarHBondContact O-N 3.42Å; F149-L152 PolarHBondContact O-N 2.68Å; F149-V153 HydrophobicContact CD2-CG1 4.22Å; F149-V153 HydrophobicContact CE1-CG1 4.3Å; F149-V153 HydrophobicContact CE2-CG1 3.76Å; F149-V153 HydrophobicContact CZ-CG1 3.8Å; F149-V153 WeakPolarHBondContact O-CG2 3.48Å; F149-V153 PolarHBondContact O-N 3.13Å; F149-V153 VanDerWaalsContact O-N 3.07Å
150S97.5Very high96Very high4 Ų430.7 Ų30.73%0.02816%0.157CC..Hα-helixtrans-58.5-44.4176.2-63.60000112.3S125 I146 Q147 V148 V153 Q154S125-S150 WeakPolarHBondContact CB-OG 3.39Å; S125-S150 WeakPolarHBondContact OG-CB 3.45Å; S125-S150 PolarHBondContact OG-OG 3.38Å; I146-S150 WeakPolarHBondContact O-CB 3.35Å; I146-S150 PolarHBondContact O-N 3.07Å; I146-S150 PolarHBondContact O-OG 3.01Å; Q147-S150 PolarHBondContact O-N 2.89Å; V148-S150 VanDerWaalsContact C-N 3.33Å; V148-S150 PolarHBondContact O-N 3.16Å; S150-V153 PolarHBondContact O-N 3.49Å; S150-Q154 WeakPolarHBondContact O-CB 3.44Å; S150-Q154 VanDerWaalsContact O-CG 3.3Å; S150-Q154 WeakPolarHBondContact O-CG 3.3Å; S150-Q154 PolarHBondContact O-N 3.39Å
151G97.3Very high96.1Very high0 Ų027.4 Ų27.40%014%0.144CC..Hα-helixtrans-61.1-44.6177.900000112Y95 Q147 V148 F149 A155Y95-G151 WeakPolarHBondContact CA-O 3.29Å; Q147-G151 PolarHBondContact O-N 3.34Å; V148-G151 PolarHBondContact O-N 2.93Å; F149-G151 PolarHBondContact O-N 3.42Å; G151-A155 PolarHBondContact O-N 3.24Å
152L97.2Very high95.8Very high91 Ų9123.5 Ų23.548%0.47612%0.116SC..Hα-helixtrans-59.7-51.5178.1-68.9172.9000111.5V94 S98 V148 F149V94-L152 HydrophobicContact CG1-CB 4.48Å; V94-L152 HydrophobicContact CG1-CD2 3.7Å; V94-L152 HydrophobicContact CG1-CG 3.67Å; S98-L152 VanDerWaalsContact OG-CD2 3.28Å; S98-L152 WeakPolarHBondContact OG-CD2 3.37Å; V148-L152 HydrophobicContact CG1-CD1 4.37Å; V148-L152 WeakPolarHBondContact O-CG 3.16Å; V148-L152 PolarHBondContact O-N 2.86Å; V148-L152 VanDerWaalsContact O-N 3.08Å; F149-L152 PolarHBondContact O-N 2.68Å
153V96.7Very high95.4Very high17 Ų1722 Ų2210%0.10311%0.112CC..Hα-helixtrans-79.4-34.5-172.1-58.40000112.6L121 F149 S150 A155 S156L121-V153 HydrophobicContact CB-CB 4.03Å; L121-V153 HydrophobicContact CB-CG1 3.91Å; L121-V153 HydrophobicContact CB-CG2 4.31Å; L121-V153 HydrophobicContact CD1-CG1 4.19Å; F149-V153 HydrophobicContact CD2-CG1 4.22Å; F149-V153 HydrophobicContact CE1-CG1 4.3Å; F149-V153 HydrophobicContact CE2-CG1 3.76Å; F149-V153 HydrophobicContact CZ-CG1 3.8Å; F149-V153 WeakPolarHBondContact O-CG2 3.48Å; F149-V153 PolarHBondContact O-N 3.13Å; F149-V153 VanDerWaalsContact O-N 3.07Å; S150-V153 PolarHBondContact O-N 3.49Å; V153-A155 VanDerWaalsContact C-N 3.27Å; V153-A155 PolarHBondContact O-N 2.87Å; V153-S156 WeakPolarHBondContact O-CB 3.4Å; V153-S156 PolarHBondContact O-N 3.47Å; V153-S156 PolarHBondContact O-OG 3.48Å
154Q96.4Very high95.1Very high5 Ų522 Ų222%0.02311%0.112CC..Hα-helixtrans-70.3-23.6-179.4-75-165.746.300113.3Y39 Y91 Y95 S122 S150 S156 G157Y39-Q154 HydrophobicContact CD1-CB 4.38Å; Y39-Q154 HydrophobicContact CD1-CG 4.12Å; Y39-Q154 HydrophobicContact CE1-CB 4.37Å; Y39-Q154 HydrophobicContact CE1-CG 4.22Å; Y91-Q154 HydrophobicContact CE2-CB 4.49Å; Y91-Q154 VanDerWaalsContact OH-CD 3.26Å; Y91-Q154 PolarHBondContact OH-OE1 3.05Å; Y95-Q154 HydrophobicContact CD2-CB 4.06Å; Y95-Q154 HydrophobicContact CE2-CB 4.18Å; Y95-Q154 WeakPolarHBondContact CE2-O 3.46Å; S122-Q154 WeakPolarHBondContact OG-CA 3.42Å; S122-Q154 VanDerWaalsContact OG-CG 3.28Å; S122-Q154 WeakPolarHBondContact OG-CG 3.5Å; S122-Q154 PolarHBondContact OG-N 3.17Å; S150-Q154 WeakPolarHBondContact O-CB 3.44Å; S150-Q154 VanDerWaalsContact O-CG 3.3Å; S150-Q154 WeakPolarHBondContact O-CG 3.3Å; S150-Q154 PolarHBondContact O-N 3.39Å; Q154-S156 PolarHBondContact O-N 3.42Å; Q154-S156 VanDerWaalsContact O-N 3.17Å; Q154-G157 PolarHBondContact O-N 2.86Å
155A95.8Very high94.8Very high0 Ų020.2 Ų20.20%010%0.101CC..THydrogen-bonded Turntrans-63.7-15.8175.700000114Y95 S98 M99 S102 G151 V153 G157 P159Y95-A155 HydrophobicContact CD2-CB 4Å; Y95-A155 VanDerWaalsContact CE2-CA 3.46Å; Y95-A155 HydrophobicContact CE2-CB 4.15Å; Y95-A155 HydrophobicContact CG-CB 4.47Å; S98-A155 VanDerWaalsContact CB-CB 3.45Å; M99-A155 HydrophobicContact CB-CB 4.36Å; M99-A155 VanDerWaalsContact SD-O 3.39Å; S102-A155 VanDerWaalsContact CB-O 3.27Å; S102-A155 WeakPolarHBondContact CB-O 3.22Å; S102-A155 PolarHBondContact OG-O 3.45Å; G151-A155 PolarHBondContact O-N 3.24Å; V153-A155 VanDerWaalsContact C-N 3.27Å; V153-A155 PolarHBondContact O-N 2.87Å; A155-G157 VanDerWaalsContact C-N 3.32Å; A155-G157 PolarHBondContact O-N 2.8Å; A155-P159 WeakPolarHBondContact O-CD 3.23Å
156S93.3Very high94.2Very high9 Ų913.6 Ų13.66%0.0637%0.072CC..THydrogen-bonded Turntrans-67.2-27.4175.162.40000114.1Y39 S102 F114 G118 V153 Q154 P159 A160Y39-S156 PolarHBondContact OH-OG 2.9Å; S102-S156 VanDerWaalsContact OG-CA 3.27Å; S102-S156 WeakPolarHBondContact OG-CA 3.38Å; F114-S156 VanDerWaalsContact CE1-O 3.31Å; F114-S156 WeakPolarHBondContact CE1-O 3.41Å; G118-S156 WeakPolarHBondContact CA-OG 3.45Å; V153-S156 WeakPolarHBondContact O-CB 3.4Å; V153-S156 PolarHBondContact O-N 3.47Å; V153-S156 PolarHBondContact O-OG 3.48Å; Q154-S156 PolarHBondContact O-N 3.42Å; Q154-S156 VanDerWaalsContact O-N 3.17Å; S156-P159 WeakPolarHBondContact O-CD 3.31Å; S156-A160 WeakPolarHBondContact O-CB 3.46Å
157G94.8Very high93.5Very high0 Ų013.4 Ų13.40%07%0.072CC..Hα-helixtrans-67.9-55.1-16800000113.1Y39 Q154 A155 A160 V161Y39-G157 WeakPolarHBondContact OH-CA 3.46Å; Q154-G157 PolarHBondContact O-N 2.86Å; A155-G157 VanDerWaalsContact C-N 3.32Å; A155-G157 PolarHBondContact O-N 2.8Å; G157-A160 PolarHBondContact O-N 2.95Å; G157-V161 WeakPolarHBondContact O-CG2 3.02Å; G157-V161 PolarHBondContact O-N 3.06Å
158W94Very high92.9Very high1 Ų112.7 Ų12.70%0.0047%0.068CC..Hα-helixtrans-61.6-49.9-169.4-174.8-121.8000115.9Y36 M99 A160 V161 V162 W181 H184 T417 T418Y36-W158 AromaticContact CD1-CE3 3.92Å; Y36-W158 HydrophobicContact CD1-CE3 3.92Å; Y36-W158 AromaticContact CD1-CZ3 3.82Å; Y36-W158 HydrophobicContact CD1-CZ3 3.82Å; Y36-W158 HydrophobicContact CD2-CE3 4.01Å; Y36-W158 HydrophobicContact CE1-CD2 4.37Å; Y36-W158 AromaticContact CE1-CE3 3.43Å; Y36-W158 HydrophobicContact CE1-CE3 3.43Å; Y36-W158 VanDerWaalsContact CE1-CE3 3.43Å; Y36-W158 AromaticContact CE1-CZ3 3.58Å; Y36-W158 HydrophobicContact CE1-CZ3 3.58Å; Y36-W158 HydrophobicContact CE2-CB 3.81Å; Y36-W158 HydrophobicContact CE2-CD2 4.36Å; Y36-W158 AromaticContact CE2-CE3 3.61Å; Y36-W158 HydrophobicContact CE2-CE3 3.61Å; Y36-W158 HydrophobicContact CE2-CZ3 4.46Å; Y36-W158 HydrophobicContact CG-CE3 4.17Å; Y36-W158 HydrophobicContact CG-CZ3 4.29Å; Y36-W158 AromaticContact CZ-CD2 3.96Å; Y36-W158 AromaticContact CZ-CE3 3.29Å; Y36-W158 AromaticContact CZ-CZ3 3.96Å; Y36-W158 WeakPolarHBondContact OH-CB 3.48Å; M99-W158 HydrophobicContact CE-CB 3.67Å; M99-W158 HydrophobicContact CE-CG 3.97Å; M99-W158 HydrophobicContact SD-CB 4.06Å; W158-A160 PolarHBondContact O-N 2.81Å; W158-V161 HydrophobicContact CE3-CG2 3.86Å; W158-V161 HydrophobicContact CZ3-CG2 4.41Å; W158-V161 WeakPolarHBondContact O-CG2 3.41Å; W158-V161 PolarHBondContact O-N 3.46Å; W158-V162 HydrophobicContact CD2-CG2 3.71Å; W158-V162 HydrophobicContact CE3-CG2 3.94Å; W158-V162 HydrophobicContact CG-CG2 4.37Å; W158-V162 HydrophobicContact CH2-CG2 4.08Å; W158-V162 HydrophobicContact CZ2-CG2 3.76Å; W158-V162 HydrophobicContact CZ3-CG2 4.13Å; W158-V162 WeakPolarHBondContact O-CB 3.45Å; W158-V162 VanDerWaalsContact O-CG2 3.31Å; W158-V162 WeakPolarHBondContact O-CG2 3.46Å; W158-V162 PolarHBondContact O-N 2.93Å; W158-W181 HydrophobicContact CE3-CH2 4.21Å; W158-W181 HydrophobicContact CH2-CH2 4.01Å; W158-W181 AromaticContact CH2-CZ3 3.59Å; W158-W181 HydrophobicContact CH2-CZ3 3.59Å; W158-W181 AromaticContact CZ3-CH2 3.52Å; W158-W181 HydrophobicContact CZ3-CH2 3.52Å; W158-W181 AromaticContact CZ3-CZ3 3.59Å; W158-W181 HydrophobicContact CZ3-CZ3 3.59Å; W158-H184 AromaticContact CZ3-CE1 3.73Å; W158-H184 AromaticContact CZ3-NE2 3.78Å; W158-T417 HydrophobicContact CH2-CG2 4.15Å; W158-T417 HydrophobicContact CZ2-CG2 3.91Å; W158-T417 VanDerWaalsContact CZ2-O 3.31Å; W158-T417 WeakPolarHBondContact CZ2-O 3.16Å; W158-T417 WeakPolarHBondContact CZ2-OG1 3.31Å; W158-T418 HydrophobicContact CH2-CG2 3.63Å; W158-T418 HydrophobicContact CZ2-CG2 4.05Å
159P92.6Very high92.2Very high0 Ų012 Ų120%06%0.06CC..Hα-helixtrans-68.1-29.4-178.425-20.5000111.1M99 S102 A106 A155 S156 T163 A438 S442M99-P159 HydrophobicContact CE-CB 4.03Å; M99-P159 HydrophobicContact CE-CG 3.67Å; S102-P159 WeakPolarHBondContact OG-CG 3.33Å; A106-P159 HydrophobicContact CB-CB 4.23Å; A106-P159 HydrophobicContact CB-CG 4.46Å; A155-P159 WeakPolarHBondContact O-CD 3.23Å; S156-P159 WeakPolarHBondContact O-CD 3.31Å; P159-T163 VanDerWaalsContact O-CB 3.24Å; P159-T163 WeakPolarHBondContact O-CB 3.26Å; P159-T163 PolarHBondContact O-N 2.7Å; P159-T163 VanDerWaalsContact O-N 3.12Å; P159-T163 PolarHBondContact O-OG1 3.32Å; P159-A438 HydrophobicContact CB-CB 4.19Å; P159-S442 WeakPolarHBondContact CB-OG 3.36Å
160A93Very high90.9Very high0 Ų09.2 Ų9.20%05%0.05CC..Hα-helixtrans-68.4-51.2176.400000111.8L111 F114 L115 S156 G157 W158 V162 T163 L164L111-A160 HydrophobicContact CD2-CB 4.25Å; F114-A160 HydrophobicContact CD1-CB 3.89Å; F114-A160 HydrophobicContact CE1-CB 4.18Å; L115-A160 HydrophobicContact CB-CB 4Å; L115-A160 HydrophobicContact CD1-CB 4.12Å; L115-A160 HydrophobicContact CG-CB 4.46Å; S156-A160 WeakPolarHBondContact O-CB 3.46Å; G157-A160 PolarHBondContact O-N 2.95Å; W158-A160 PolarHBondContact O-N 2.81Å; A160-V162 PolarHBondContact O-N 3.37Å; A160-T163 PolarHBondContact O-N 3.26Å; A160-L164 VanDerWaalsContact O-CG 3.3Å; A160-L164 WeakPolarHBondContact O-CG 3.44Å; A160-L164 PolarHBondContact O-N 3.45Å
161V94.3Very high89.8Confident0 Ų011.1 Ų11.10%06%0.057CC..Hα-helixtrans-66.7-38.6-178.4-65.70000112.6T32 C35 Y36 L115 G157 W158 L164 V165 W181T32-V161 HydrophobicContact CG2-CB 4.1Å; T32-V161 HydrophobicContact CG2-CG1 4.16Å; C35-V161 HydrophobicContact CB-CG1 4.25Å; Y36-V161 HydrophobicContact CD2-CG2 3.89Å; Y36-V161 HydrophobicContact CE2-CG2 4.44Å; Y36-V161 HydrophobicContact CG-CG2 4.39Å; L115-V161 HydrophobicContact CD1-CG1 4.03Å; L115-V161 HydrophobicContact CD2-CG1 3.95Å; G157-V161 WeakPolarHBondContact O-CG2 3.02Å; G157-V161 PolarHBondContact O-N 3.06Å; W158-V161 HydrophobicContact CE3-CG2 3.86Å; W158-V161 HydrophobicContact CZ3-CG2 4.41Å; W158-V161 WeakPolarHBondContact O-CG2 3.41Å; W158-V161 PolarHBondContact O-N 3.46Å; V161-L164 WeakPolarHBondContact O-CB 3.48Å; V161-L164 PolarHBondContact O-N 3.08Å; V161-V165 WeakPolarHBondContact O-CG2 3.38Å; V161-V165 PolarHBondContact O-N 3.46Å; V161-W181 HydrophobicContact CB-CH2 4.26Å; V161-W181 HydrophobicContact CB-CZ2 4.02Å; V161-W181 HydrophobicContact CG2-CH2 3.73Å; V161-W181 HydrophobicContact CG2-CZ2 3.93Å
162V90.9Very high88.7Confident1 Ų114.2 Ų14.21%0.0068%0.079CC..Hα-helixtrans-67.1-39.7177.51730000110.6W158 A160 V165 G166 W181 L437 T441W158-V162 HydrophobicContact CD2-CG2 3.71Å; W158-V162 HydrophobicContact CE3-CG2 3.94Å; W158-V162 HydrophobicContact CG-CG2 4.37Å; W158-V162 HydrophobicContact CH2-CG2 4.08Å; W158-V162 HydrophobicContact CZ2-CG2 3.76Å; W158-V162 HydrophobicContact CZ3-CG2 4.13Å; W158-V162 WeakPolarHBondContact O-CB 3.45Å; W158-V162 VanDerWaalsContact O-CG2 3.31Å; W158-V162 WeakPolarHBondContact O-CG2 3.46Å; W158-V162 PolarHBondContact O-N 2.93Å; A160-V162 PolarHBondContact O-N 3.37Å; V162-V165 PolarHBondContact O-N 3.46Å; V162-G166 PolarHBondContact O-N 3.28Å; V162-W181 HydrophobicContact CG2-CH2 4.03Å; V162-W181 HydrophobicContact CG2-CZ3 4.19Å; V162-L437 HydrophobicContact CG1-CD1 4.28Å; V162-L437 HydrophobicContact CG1-CG 4.49Å; V162-T441 HydrophobicContact CB-CG2 4.06Å; V162-T441 HydrophobicContact CG1-CG2 3.91Å; V162-T441 HydrophobicContact CG2-CG2 3.91Å
163T87.9Confident87.9Confident16 Ų1618.1 Ų18.110%0.0989%0.088CC..Hα-helixtrans-65.2-41.6175.2-570000111.3L111 P159 A160 G166 N167 A438L111-T163 HydrophobicContact CD1-CG2 3.65Å; P159-T163 VanDerWaalsContact O-CB 3.24Å; P159-T163 WeakPolarHBondContact O-CB 3.26Å; P159-T163 PolarHBondContact O-N 2.7Å; P159-T163 VanDerWaalsContact O-N 3.12Å; P159-T163 PolarHBondContact O-OG1 3.32Å; A160-T163 PolarHBondContact O-N 3.26Å; T163-G166 PolarHBondContact O-N 3.25Å; T163-N167 PolarHBondContact O-N 2.67Å; T163-N167 PolarHBondContact O-ND2 2.62Å; T163-N167 PolarHBondContact O-OD1 2.84Å; T163-A438 VanDerWaalsContact OG1-CB 3.29Å; T163-A438 WeakPolarHBondContact OG1-CB 3.16Å
164L90.7Very high87.5Confident1 Ų117.5 Ų17.51%0.0058%0.084CC..Hα-helixtrans-58.8-51.2173.9-73.6170.5000111.1I28 T32 L111 L115 A160 V161 G166 N167 W168 V226 E228I28-L164 HydrophobicContact CG2-CB 4.28Å; T32-L164 HydrophobicContact CG2-CB 3.85Å; T32-L164 HydrophobicContact CG2-CD1 3.93Å; L111-L164 HydrophobicContact CB-CD2 4.39Å; L111-L164 HydrophobicContact CD1-CD2 4.17Å; L111-L164 HydrophobicContact CD1-CG 4.34Å; L115-L164 HydrophobicContact CD2-CD1 3.71Å; A160-L164 VanDerWaalsContact O-CG 3.3Å; A160-L164 WeakPolarHBondContact O-CG 3.44Å; A160-L164 PolarHBondContact O-N 3.45Å; V161-L164 WeakPolarHBondContact O-CB 3.48Å; V161-L164 PolarHBondContact O-N 3.08Å; L164-G166 VanDerWaalsContact C-N 3.31Å; L164-G166 PolarHBondContact O-N 2.68Å; L164-N167 PolarHBondContact O-N 3Å; L164-W168 VanDerWaalsContact O-CD1 3.26Å; L164-W168 PolarHBondContact O-N 3.19Å; L164-V226 HydrophobicContact CD1-CG2 3.88Å; L164-V226 HydrophobicContact CD2-CG2 4.09Å; L164-E228 HydrophobicContact CD2-CB 4.18Å
165V90.2Very high87.2Confident0 Ų017.3 Ų17.30%08%0.083CC..Hα-helixtrans-59.7-43.8177.5174.90000110.9L29 T32 V161 V162 N167 W168 W169 M178 W181L29-V165 HydrophobicContact CD1-CG1 4Å; L29-V165 HydrophobicContact CD1-CG2 4.2Å; T32-V165 HydrophobicContact CG2-CG2 4.27Å; T32-V165 VanDerWaalsContact OG1-CG2 3.27Å; T32-V165 WeakPolarHBondContact OG1-CG2 3.28Å; V161-V165 WeakPolarHBondContact O-CG2 3.38Å; V161-V165 PolarHBondContact O-N 3.46Å; V162-V165 PolarHBondContact O-N 3.46Å; V165-N167 VanDerWaalsContact C-N 3.31Å; V165-N167 PolarHBondContact O-N 3.32Å; V165-W168 PolarHBondContact O-N 3.47Å; V165-W169 HydrophobicContact CG1-CB 4.45Å; V165-W169 WeakPolarHBondContact O-CB 3.25Å; V165-W169 PolarHBondContact O-N 3.25Å; V165-M178 HydrophobicContact CB-CE 4.49Å; V165-M178 HydrophobicContact CG1-CE 3.66Å; V165-M178 HydrophobicContact CG1-SD 4.25Å; V165-W181 HydrophobicContact CG2-CD2 4.38Å; V165-W181 HydrophobicContact CG2-CZ2 3.9Å
166G84.4Confident87.1Confident0 Ų019.1 Ų19.10%09%0.092CC..Hα-helixtrans-63.4-30.917800000114.4V162 T163 L164 W168 L271V162-G166 PolarHBondContact O-N 3.28Å; T163-G166 PolarHBondContact O-N 3.25Å; L164-G166 VanDerWaalsContact C-N 3.31Å; L164-G166 PolarHBondContact O-N 2.68Å; G166-W168 VanDerWaalsContact C-N 3.27Å; G166-W168 PolarHBondContact O-N 2.91Å; G166-L271 WeakPolarHBondContact O-CB 3.36Å; G166-L271 WeakPolarHBondContact O-CD1 3.48Å
167N84.2Confident87Confident6 Ų620.4 Ų20.43%0.03210%0.098CC..Hα-helixtrans-69-27.7176.5-68.6-16.5000112.5T163 L164 V165 E228T163-N167 PolarHBondContact O-N 2.67Å; T163-N167 PolarHBondContact O-ND2 2.62Å; T163-N167 PolarHBondContact O-OD1 2.84Å; L164-N167 PolarHBondContact O-N 3Å; V165-N167 VanDerWaalsContact C-N 3.31Å; V165-N167 PolarHBondContact O-N 3.32Å; N167-E228 WeakPolarHBondContact CB-O 3.16Å; N167-E228 PolarHBondContact ND2-O 3.32Å
168W84.3Confident86.9Confident0 Ų020.7 Ų20.70%010%0.099CC..Hα-helixtrans-103.5-28.2-173.6-73.489.2000114.1F21 L24 A25 I28 L164 V165 G166 I227 P230 L233F21-W168 HydrophobicContact CD2-CE3 4.45Å; F21-W168 HydrophobicContact CD2-CZ3 4.09Å; F21-W168 HydrophobicContact CE2-CE3 4.02Å; F21-W168 HydrophobicContact CE2-CZ3 4.03Å; F21-W168 HydrophobicContact CZ-CE3 4.27Å; L24-W168 HydrophobicContact CB-CE3 4.25Å; L24-W168 HydrophobicContact CB-CH2 3.72Å; L24-W168 HydrophobicContact CB-CZ3 3.4Å; L24-W168 VanDerWaalsContact CB-CZ3 3.4Å; L24-W168 HydrophobicContact CD1-CH2 4.32Å; L24-W168 HydrophobicContact CD1-CZ3 4.38Å; L24-W168 HydrophobicContact CD2-CH2 4.16Å; L24-W168 HydrophobicContact CG-CH2 4.32Å; L24-W168 HydrophobicContact CG-CZ3 4.37Å; A25-W168 HydrophobicContact CB-CB 4.31Å; A25-W168 HydrophobicContact CB-CE3 4.05Å; I28-W168 HydrophobicContact CB-CG 4.26Å; I28-W168 HydrophobicContact CG1-CD2 4.13Å; I28-W168 HydrophobicContact CG1-CG 4.29Å; I28-W168 HydrophobicContact CG1-CZ2 4.17Å; I28-W168 HydrophobicContact CG2-CG 4.22Å; L164-W168 VanDerWaalsContact O-CD1 3.26Å; L164-W168 PolarHBondContact O-N 3.19Å; V165-W168 PolarHBondContact O-N 3.47Å; G166-W168 VanDerWaalsContact C-N 3.27Å; G166-W168 PolarHBondContact O-N 2.91Å; W168-I227 HydrophobicContact CH2-CG2 4.38Å; W168-I227 HydrophobicContact CZ2-CB 3.92Å; W168-I227 HydrophobicContact CZ2-CG2 3.73Å; W168-I227 PolarHBondContact NE1-O 3.48Å; W168-P230 HydrophobicContact CE3-CB 4.42Å; W168-P230 HydrophobicContact CH2-CB 4.12Å; W168-P230 HydrophobicContact CZ2-CB 4.49Å; W168-P230 HydrophobicContact CZ3-CB 4.06Å; W168-L233 HydrophobicContact CH2-CD1 4.18Å
169W82.3Confident86.8Confident35 Ų3520.8 Ų20.813%0.13310%0.101CC..  trans-116.6132.8-173.4-72.883.6000112.9A25 I26 L29 V165 I177 L268 L271A25-W169 HydrophobicContact CB-CZ2 4.32Å; A25-W169 PolarHBondContact O-NE1 3.09Å; I26-W169 HydrophobicContact CG1-CH2 4.4Å; I26-W169 HydrophobicContact CG1-CZ2 4.02Å; L29-W169 HydrophobicContact CB-CZ2 4.47Å; L29-W169 HydrophobicContact CD2-CZ2 3.89Å; V165-W169 HydrophobicContact CG1-CB 4.45Å; V165-W169 WeakPolarHBondContact O-CB 3.25Å; V165-W169 PolarHBondContact O-N 3.25Å; W169-I177 HydrophobicContact CE3-CD1 3.73Å; W169-I177 HydrophobicContact CE3-CG2 4.34Å; W169-I177 HydrophobicContact CZ3-CD1 3.72Å; W169-I177 HydrophobicContact CZ3-CG1 4.49Å; W169-L268 HydrophobicContact CE3-CD1 3.91Å; W169-L268 HydrophobicContact CE3-CG 4.43Å; W169-L268 HydrophobicContact CH2-CD1 4.21Å; W169-L268 HydrophobicContact CZ3-CD1 3.62Å; W169-L268 HydrophobicContact CZ3-CG 4.49Å; W169-L271 WeakPolarHBondContact O-CD1 3.45Å; W169-L271 WeakPolarHBondContact O-CG 3.27Å
170G72.1Confident87Confident7 Ų725 Ų257%0.07212%0.123CC..  trans-74.4-171.9179.900000115.1R269G170-R269 WeakPolarHBondContact CA-O 3.33Å
171K73.3Confident87.1Confident44 Ų4425.2 Ų25.219%0.19112%0.124CC..SBendtrans-82.1-15.4178.4-68.2-165.1178.5-178.80114.2R173 R174 L271 Q357 D362 T426K171-R173 PolarHBondContact O-N 3.46Å; K171-R174 WeakPolarHBondContact O-CB 3.45Å; K171-R174 PolarHBondContact O-N 2.85Å; K171-L271 HydrophobicContact CG-CD2 3.75Å; K171-Q357 HydrophobicContact CD-CG 4.27Å; K171-D362 IonicContact NZ-OD1 2.76Å; K171-D362 PolarHBondContact NZ-OD1 3.46Å; K171-D362 VanDerWaalsContact NZ-OD1 3.12Å; K171-T426 WeakPolarHBondContact CE-O 2.94Å; K171-T426 WeakPolarHBondContact CE-OG1 3.47Å; K171-T426 PolarHBondContact NZ-O 3.46Å
172S73.6Confident87.1Confident66 Ų6625.5 Ų25.546%0.46213%0.125SC..THydrogen-bonded Turntrans-69130.5-175.9-169.80000111.1R174S172-R174 PolarHBondContact O-N 2.96Å; S172-R174 VanDerWaalsContact O-N 3.09Å
173R81.4Confident87.4Confident172 Ų17226.1 Ų26.165%0.64913%0.129SC*.THydrogen-bonded Turntrans49.532-176.8-61.1-171.5175.6-168.6-0.5114.5K171 G175 L176 I177 D351K171-R173 PolarHBondContact O-N 3.46Å; R173-G175 PolarHBondContact O-N 2.83Å; R173-L176 PolarHBondContact O-N 3.29Å; R173-I177 HydrophobicContact CB-CD1 4.43Å; R173-I177 WeakPolarHBondContact O-CG1 3.31Å; R173-I177 PolarHBondContact O-N 3.47Å; R173-I177 VanDerWaalsContact O-N 3.07Å; R173-D351 WeakPolarHBondContact CA-OD2 3.42Å
174R88Confident87.8Confident5 Ų525.3 Ų25.32%0.01913%0.125CC..Hα-helixtrans-59.7-36.7-175.7-170.3-175.7-152.7154.310.2111.9K171 S172 M178 D351 A422 D423 T426K171-R174 WeakPolarHBondContact O-CB 3.45Å; K171-R174 PolarHBondContact O-N 2.85Å; S172-R174 PolarHBondContact O-N 2.96Å; S172-R174 VanDerWaalsContact O-N 3.09Å; R174-M178 HydrophobicContact CG-CE 4.46Å; R174-M178 HydrophobicContact CG-CG 3.79Å; R174-M178 WeakPolarHBondContact O-CB 3.41Å; R174-M178 WeakPolarHBondContact O-CG 3.49Å; R174-M178 PolarHBondContact O-N 3.04Å; R174-D351 PolarHBondContact N-OD1 3.35Å; R174-A422 VanDerWaalsContact CZ-C 3.44Å; R174-A422 PolarHBondContact NH1-O 3.08Å; R174-A422 PolarHBondContact NH2-O 3.11Å; R174-D423 WeakPolarHBondContact CD-OD1 3.33Å; R174-D423 IonicContact CZ-OD1 3.7Å; R174-D423 IonicContact NE-OD1 2.71Å; R174-D423 IonicContact NH1-OD1 3.72Å; R174-D423 PolarHBondContact NH1-OD1 3.29Å; R174-T426 PolarHBondContact NH1-OG1 3.4Å
175G90.5Very high88Confident0 Ų025.6 Ų25.60%013%0.126CC..Hα-helixtrans-58.1-52.8177.100000112R173 G179 G347 D351R173-G175 PolarHBondContact O-N 2.83Å; G175-G179 PolarHBondContact O-N 3.15Å; G175-G347 VanDerWaalsContact C-C 3.46Å; G175-G347 CarbonylContact C-O 3.57Å; G175-G347 WeakPolarHBondContact CA-O 3.28Å; G175-G347 WeakPolarHBondContact O-CA 3.33Å; G175-D351 WeakPolarHBondContact CA-OD1 3.45Å; G175-D351 PolarHBondContact N-OD1 2.95Å
176L92.6Very high88.3Confident38 Ų3825.9 Ų25.920%0.19913%0.128CC..Hα-helixtrans-63.7-47.5178.1177.464.8000112.4R173 M178 G179 L180 V344 G347 W348 D351R173-L176 PolarHBondContact O-N 3.29Å; L176-M178 VanDerWaalsContact C-N 3.34Å; L176-M178 PolarHBondContact O-N 3.37Å; L176-G179 PolarHBondContact O-N 3.27Å; L176-L180 HydrophobicContact CD1-CD1 4.14Å; L176-L180 HydrophobicContact CD1-CG 4.35Å; L176-L180 HydrophobicContact CG-CD1 4.14Å; L176-L180 WeakPolarHBondContact O-CG 3.27Å; L176-L180 PolarHBondContact O-N 2.98Å; L176-V344 HydrophobicContact CD1-CG1 4.14Å; L176-G347 PolarHBondContact N-O 3.14Å; L176-W348 HydrophobicContact CD1-CB 4.12Å; L176-D351 VanDerWaalsContact CB-OD2 3.25Å; L176-D351 WeakPolarHBondContact CB-OD2 3.46Å; L176-D351 PolarHBondContact N-OD2 3.1Å
177I91.8Very high88.9Confident37 Ų3728.3 Ų28.319%0.1914%0.141CC..Hα-helixtrans-61.8-45.7-178.2-66.3163.8000110.3L29 W169 R173 L180 W181L29-I177 HydrophobicContact CD1-CG2 4.36Å; L29-I177 HydrophobicContact CD2-CG2 4.33Å; W169-I177 HydrophobicContact CE3-CD1 3.73Å; W169-I177 HydrophobicContact CE3-CG2 4.34Å; W169-I177 HydrophobicContact CZ3-CD1 3.72Å; W169-I177 HydrophobicContact CZ3-CG1 4.49Å; R173-I177 HydrophobicContact CB-CD1 4.43Å; R173-I177 WeakPolarHBondContact O-CG1 3.31Å; R173-I177 PolarHBondContact O-N 3.47Å; R173-I177 VanDerWaalsContact O-N 3.07Å; I177-L180 PolarHBondContact O-N 3Å; I177-W181 VanDerWaalsContact O-CB 3.27Å; I177-W181 WeakPolarHBondContact O-CB 3.46Å; I177-W181 PolarHBondContact O-N 2.96Å
178M92.5Very high89.5Confident5 Ų528 Ų283%0.02514%0.139CC..Hα-helixtrans-70.7-32.4177.8-72.7-65.1-173.200112.7V165 R174 L176 W181 N182 T418 A419 A422V165-M178 HydrophobicContact CB-CE 4.49Å; V165-M178 HydrophobicContact CG1-CE 3.66Å; V165-M178 HydrophobicContact CG1-SD 4.25Å; R174-M178 HydrophobicContact CG-CE 4.46Å; R174-M178 HydrophobicContact CG-CG 3.79Å; R174-M178 WeakPolarHBondContact O-CB 3.41Å; R174-M178 WeakPolarHBondContact O-CG 3.49Å; R174-M178 PolarHBondContact O-N 3.04Å; L176-M178 VanDerWaalsContact C-N 3.34Å; L176-M178 PolarHBondContact O-N 3.37Å; M178-W181 PolarHBondContact O-N 3.45Å; M178-W181 HydrophobicContact SD-CE3 3.93Å; M178-W181 HydrophobicContact SD-CZ3 4.46Å; M178-N182 WeakPolarHBondContact O-CB 3.27Å; M178-N182 PolarHBondContact O-N 2.88Å; M178-T418 WeakPolarHBondContact CB-OG1 3.15Å; M178-A419 HydrophobicContact CB-CB 3.98Å; M178-A419 HydrophobicContact CG-CB 4.24Å; M178-A422 HydrophobicContact CE-CB 4.29Å
179G93.6Very high90.1Very high3 Ų328.3 Ų28.33%0.03114%0.141CC..Hα-helixtrans-65-44173.600000112.3G175 L176 G343G175-G179 PolarHBondContact O-N 3.15Å; L176-G179 PolarHBondContact O-N 3.27Å; G179-G343 WeakPolarHBondContact CA-O 3.14Å
180L95Very high90.8Very high89 Ų8928.1 Ų28.147%0.46614%0.142SC..Hα-helixtrans-63.8-47171.8-75.3166.2000111.3L176 I177 N182 S183 V344L176-L180 HydrophobicContact CD1-CD1 4.14Å; L176-L180 HydrophobicContact CD1-CG 4.35Å; L176-L180 HydrophobicContact CG-CD1 4.14Å; L176-L180 WeakPolarHBondContact O-CG 3.27Å; L176-L180 PolarHBondContact O-N 2.98Å; I177-L180 PolarHBondContact O-N 3Å; L180-N182 PolarHBondContact O-N 2.76Å; L180-S183 VanDerWaalsContact O-CB 3.3Å; L180-S183 WeakPolarHBondContact O-CB 3.1Å; L180-S183 PolarHBondContact O-N 2.78Å; L180-S183 PolarHBondContact O-OG 2.93Å; L180-V344 HydrophobicContact CD2-CG1 4.19Å; L180-V344 HydrophobicContact CD2-CG2 3.69Å; L180-V344 HydrophobicContact CG-CG1 4.5Å; L180-V344 HydrophobicContact CG-CG2 4.15Å
181W94.9Very high91.9Very high5 Ų530.6 Ų30.62%0.01915%0.153CC..Hα-helixtrans-60.9-44.6178.6-17772.6000111.2L29 T32 Y33 W158 V161 V162 V165 I177 M178 S183 H184 T418L29-W181 HydrophobicContact CD1-CB 4.14Å; L29-W181 VanDerWaalsContact CD1-CD1 3.47Å; L29-W181 HydrophobicContact CD1-CG 3.88Å; L29-W181 PolarHBondContact O-NE1 2.95Å; T32-W181 PolarHBondContact OG1-NE1 3.44Å; Y33-W181 WeakPolarHBondContact CD2-O 3.25Å; Y33-W181 WeakPolarHBondContact CE2-O 3.43Å; W158-W181 HydrophobicContact CE3-CH2 4.21Å; W158-W181 HydrophobicContact CH2-CH2 4.01Å; W158-W181 AromaticContact CH2-CZ3 3.59Å; W158-W181 HydrophobicContact CH2-CZ3 3.59Å; W158-W181 AromaticContact CZ3-CH2 3.52Å; W158-W181 HydrophobicContact CZ3-CH2 3.52Å; W158-W181 AromaticContact CZ3-CZ3 3.59Å; W158-W181 HydrophobicContact CZ3-CZ3 3.59Å; V161-W181 HydrophobicContact CB-CH2 4.26Å; V161-W181 HydrophobicContact CB-CZ2 4.02Å; V161-W181 HydrophobicContact CG2-CH2 3.73Å; V161-W181 HydrophobicContact CG2-CZ2 3.93Å; V162-W181 HydrophobicContact CG2-CH2 4.03Å; V162-W181 HydrophobicContact CG2-CZ3 4.19Å; V165-W181 HydrophobicContact CG2-CD2 4.38Å; V165-W181 HydrophobicContact CG2-CZ2 3.9Å; I177-W181 VanDerWaalsContact O-CB 3.27Å; I177-W181 WeakPolarHBondContact O-CB 3.46Å; I177-W181 PolarHBondContact O-N 2.96Å; M178-W181 PolarHBondContact O-N 3.45Å; M178-W181 HydrophobicContact SD-CE3 3.93Å; M178-W181 HydrophobicContact SD-CZ3 4.46Å; W181-S183 PolarHBondContact O-N 3.48Å; W181-H184 AromaticContact CD2-CD2 3.66Å; W181-H184 AromaticContact CD2-NE2 3.59Å; W181-H184 AromaticContact CE2-CD2 3.62Å; W181-H184 AromaticContact CE2-NE2 3.73Å; W181-H184 AromaticContact CE3-NE2 3.43Å; W181-H184 AromaticContact CH2-NE2 3.54Å; W181-H184 AromaticContact CZ2-CD2 3.91Å; W181-H184 AromaticContact CZ2-NE2 3.71Å; W181-H184 AromaticContact CZ3-NE2 3.41Å; W181-H184 WeakPolarHBondContact CZ3-NE2 3.44Å; W181-H184 WeakPolarHBondContact O-CB 3.44Å; W181-H184 PolarHBondContact O-CD2 2.62Å; W181-H184 PolarHBondContact O-N 3.39Å; W181-T418 HydrophobicContact CE3-CG2 3.95Å; W181-T418 HydrophobicContact CZ3-CG2 3.92Å
182N95.3Very high93Very high5 Ų528.5 Ų28.53%0.02714%0.144CC..Hα-helixtrans-60.8-17.5179.1-169.179.3000114M178 L180 H184 T185 A414 T417 T418M178-N182 WeakPolarHBondContact O-CB 3.27Å; M178-N182 PolarHBondContact O-N 2.88Å; L180-N182 PolarHBondContact O-N 2.76Å; N182-H184 PolarHBondContact O-N 2.78Å; N182-H184 PolarHBondContact O-ND1 2.94Å; N182-T185 WeakPolarHBondContact O-CB 3.23Å; N182-T185 PolarHBondContact O-N 3.44Å; N182-T185 PolarHBondContact O-OG1 3.25Å; N182-A414 HydrophobicContact CB-CB 4.23Å; N182-A414 WeakPolarHBondContact ND2-CA 2.94Å; N182-A414 WeakPolarHBondContact ND2-CB 3.34Å; N182-T417 WeakPolarHBondContact OD1-CG2 3.38Å; N182-T418 HydrophobicContact CB-CG2 3.82Å
183S96.5Very high94Very high14 Ų1425.4 Ų25.410%0.09812%0.122CC..Hα-helixtrans-57.5-15.4172.672.10000112.9Y33 L180 W181 T185 S186 L187Y33-S183 WeakPolarHBondContact CE2-OG 3.39Å; Y33-S183 PolarHBondContact OH-OG 3.32Å; L180-S183 VanDerWaalsContact O-CB 3.3Å; L180-S183 WeakPolarHBondContact O-CB 3.1Å; L180-S183 PolarHBondContact O-N 2.78Å; L180-S183 PolarHBondContact O-OG 2.93Å; W181-S183 PolarHBondContact O-N 3.48Å; S183-T185 PolarHBondContact O-N 2.9Å; S183-T185 VanDerWaalsContact O-N 3.15Å; S183-S186 PolarHBondContact O-N 3.2Å; S183-L187 WeakPolarHBondContact O-CB 3.26Å; S183-L187 PolarHBondContact O-N 3.44Å
184H96.8Very high94.7Very high0 Ų020.6 Ų20.60%011%0.112CC..Hα-helixtrans-51.2-34168.757.750.5000113.2Y33 Y36 T37 W158 W181 N182 G188Y33-H184 HydrophobicContact CD1-CB 4.33Å; Y33-H184 HydrophobicContact CD2-CB 3.7Å; Y33-H184 HydrophobicContact CE1-CB 4.38Å; Y33-H184 HydrophobicContact CE2-CB 3.76Å; Y33-H184 HydrophobicContact CG-CB 3.98Å; Y33-H184 VanDerWaalsContact O-CB 3.27Å; Y33-H184 WeakPolarHBondContact O-CB 3.32Å; Y36-H184 AromaticContact CD1-CE1 3.31Å; Y36-H184 WeakPolarHBondContact CD1-CE1 3.39Å; Y36-H184 AromaticContact CD1-ND1 3.45Å; Y36-H184 WeakPolarHBondContact CD1-ND1 3.45Å; T37-H184 WeakPolarHBondContact CA-O 3.25Å; T37-H184 WeakPolarHBondContact OG1-CA 3.5Å; T37-H184 WeakPolarHBondContact OG1-CB 3.45Å; T37-H184 PolarHBondContact OG1-O 2.93Å; W158-H184 AromaticContact CZ3-CE1 3.73Å; W158-H184 AromaticContact CZ3-NE2 3.78Å; W181-H184 AromaticContact CD2-CD2 3.66Å; W181-H184 AromaticContact CD2-NE2 3.59Å; W181-H184 AromaticContact CE2-CD2 3.62Å; W181-H184 AromaticContact CE2-NE2 3.73Å; W181-H184 AromaticContact CE3-NE2 3.43Å; W181-H184 AromaticContact CH2-NE2 3.54Å; W181-H184 AromaticContact CZ2-CD2 3.91Å; W181-H184 AromaticContact CZ2-NE2 3.71Å; W181-H184 AromaticContact CZ3-NE2 3.41Å; W181-H184 WeakPolarHBondContact CZ3-NE2 3.44Å; W181-H184 WeakPolarHBondContact O-CB 3.44Å; W181-H184 PolarHBondContact O-CD2 2.62Å; W181-H184 PolarHBondContact O-N 3.39Å; N182-H184 PolarHBondContact O-N 2.78Å; N182-H184 PolarHBondContact O-ND1 2.94Å; H184-G188 PolarHBondContact O-N 3.33Å
185T95.4Very high95Very high6 Ų621.3 Ų21.34%0.03712%0.116CC..Hα-helixtrans-68.2-54.6-176.8-61.80000109.3H40 N182 S183 G188 N189 Y413H40-T185 WeakPolarHBondContact CE1-CG2 3.33Å; H40-T185 WeakPolarHBondContact ND1-CG2 3.45Å; N182-T185 WeakPolarHBondContact O-CB 3.23Å; N182-T185 PolarHBondContact O-N 3.44Å; N182-T185 PolarHBondContact O-OG1 3.25Å; S183-T185 PolarHBondContact O-N 2.9Å; S183-T185 VanDerWaalsContact O-N 3.15Å; T185-G188 PolarHBondContact O-N 3.39Å; T185-N189 PolarHBondContact O-N 3.13Å; T185-N189 PolarHBondContact O-ND2 3Å; T185-N189 PolarHBondContact O-OD1 3.47Å; T185-Y413 HydrophobicContact CG2-CE1 4.06Å
186S95.9Very high95.2Very high6 Ų621.3 Ų21.34%0.04212%0.116CC..Hα-helixtrans-61.7-44.8175.5-68.10000111.5S183 G188 N189 I190 D336S183-S186 PolarHBondContact O-N 3.2Å; S186-G188 VanDerWaalsContact C-N 3.3Å; S186-G188 PolarHBondContact O-N 3.45Å; S186-N189 PolarHBondContact O-N 2.98Å; S186-I190 WeakPolarHBondContact O-CG1 3.18Å; S186-I190 PolarHBondContact O-N 3.37Å; S186-D336 WeakPolarHBondContact CB-O 3.36Å; S186-D336 PolarHBondContact OG-O 3.3Å
187L97.1Very high95.1Very high51 Ų5119.8 Ų19.827%0.26711%0.109SC..Hα-helixtrans-59.6-43178.1-178.563.6000111.5Y33 T37 S183 I190 I191Y33-L187 HydrophobicContact CE1-CD2 3.62Å; T37-L187 HydrophobicContact CG2-CB 4.39Å; T37-L187 HydrophobicContact CG2-CD2 4.07Å; T37-L187 HydrophobicContact CG2-CG 4Å; S183-L187 WeakPolarHBondContact O-CB 3.26Å; S183-L187 PolarHBondContact O-N 3.44Å; L187-I190 PolarHBondContact O-N 2.89Å; L187-I191 HydrophobicContact CD1-CD1 4.2Å; L187-I191 HydrophobicContact CD1-CG1 4.43Å; L187-I191 HydrophobicContact CG-CD1 3.98Å; L187-I191 WeakPolarHBondContact O-CG1 3.12Å; L187-I191 PolarHBondContact O-N 3.02Å
188G97.3Very high95.1Very high0 Ų022.7 Ų22.70%012%0.124CC..Hα-helixtrans-60.8-48.5175.700000111.5T37 A41 H184 T185 S186 I190 I191 G192T37-G188 WeakPolarHBondContact O-CA 3.09Å; A41-G188 WeakPolarHBondContact CA-O 3.43Å; A41-G188 WeakPolarHBondContact CB-O 3.25Å; A41-G188 PolarHBondContact N-O 3.27Å; H184-G188 PolarHBondContact O-N 3.33Å; T185-G188 PolarHBondContact O-N 3.39Å; S186-G188 VanDerWaalsContact C-N 3.3Å; S186-G188 PolarHBondContact O-N 3.45Å; G188-I190 VanDerWaalsContact C-N 3.3Å; G188-I190 PolarHBondContact O-N 2.85Å; G188-I191 PolarHBondContact O-N 3.38Å; G188-G192 PolarHBondContact O-N 3.26Å
189N96.2Very high95.1Very high7 Ų726.4 Ų26.44%0.03714%0.139CC..Hα-helixtrans-58.6-41.2176.2-62.3-17.2000111.9H40 K44 T185 S186 G192 S193 L310 D336H40-N189 PolarHBondContact ND1-OD1 3.23Å; K44-N189 HydrophobicContact CD-CB 4.26Å; K44-N189 WeakPolarHBondContact CG-O 3.37Å; T185-N189 PolarHBondContact O-N 3.13Å; T185-N189 PolarHBondContact O-ND2 3Å; T185-N189 PolarHBondContact O-OD1 3.47Å; S186-N189 PolarHBondContact O-N 2.98Å; N189-G192 PolarHBondContact O-N 2.91Å; N189-S193 WeakPolarHBondContact O-CB 3.46Å; N189-S193 PolarHBondContact O-N 2.58Å; N189-S193 PolarHBondContact O-OG 3.15Å; N189-L310 HydrophobicContact CB-CD1 4.16Å; N189-L310 VanDerWaalsContact CG-CD1 3.44Å; N189-L310 VanDerWaalsContact ND2-CD1 3.26Å; N189-L310 WeakPolarHBondContact ND2-CD1 3.41Å; N189-D336 HydrophobicContact CB-CB 4.5Å; N189-D336 VanDerWaalsContact CB-CG 3.49Å; N189-D336 VanDerWaalsContact CB-OD1 3.27Å; N189-D336 WeakPolarHBondContact CB-OD1 3.4Å; N189-D336 WeakPolarHBondContact CB-OD2 3.32Å; N189-D336 PolarHBondContact ND2-OD1 3.04Å
190I96.3Very high94.9Very high31 Ų3126.3 Ų26.316%0.15914%0.138CC..Hα-helixtrans-63.1-50.5177.4-67.3169.7000110.5S186 L187 G188 G192 S193 V194 V333 D336 V337 I340S186-I190 WeakPolarHBondContact O-CG1 3.18Å; S186-I190 PolarHBondContact O-N 3.37Å; L187-I190 PolarHBondContact O-N 2.89Å; G188-I190 VanDerWaalsContact C-N 3.3Å; G188-I190 PolarHBondContact O-N 2.85Å; I190-G192 VanDerWaalsContact C-N 3.31Å; I190-G192 PolarHBondContact O-N 3.25Å; I190-S193 PolarHBondContact O-N 2.92Å; I190-V194 HydrophobicContact CG2-CG2 4.38Å; I190-V194 WeakPolarHBondContact O-CB 3.25Å; I190-V194 VanDerWaalsContact O-CG2 3.29Å; I190-V194 WeakPolarHBondContact O-CG2 3.41Å; I190-V194 PolarHBondContact O-N 3.42Å; I190-V333 HydrophobicContact CD1-CG1 4.09Å; I190-V333 HydrophobicContact CG1-CB 4.45Å; I190-V333 HydrophobicContact CG1-CG1 3.86Å; I190-V333 HydrophobicContact CG1-CG2 4.33Å; I190-V333 HydrophobicContact CG2-CG1 4.05Å; I190-V333 HydrophobicContact CG2-CG2 4.15Å; I190-D336 HydrophobicContact CD1-CB 4.03Å; I190-D336 HydrophobicContact CG1-CB 3.65Å; I190-V337 HydrophobicContact CD1-CG2 4.05Å; I190-I340 HydrophobicContact CD1-CD1 4.35Å
191I96.8Very high94.3Very high59 Ų5924.8 Ų24.830%0.30313%0.128SC..Hα-helixtrans-58.5-46.2177.8-69.2169000110.3T37 A41 L187 G188 V194 I195T37-I191 HydrophobicContact CG2-CD1 3.81Å; A41-I191 HydrophobicContact CB-CB 4.34Å; A41-I191 HydrophobicContact CB-CG2 4.13Å; L187-I191 HydrophobicContact CD1-CD1 4.2Å; L187-I191 HydrophobicContact CD1-CG1 4.43Å; L187-I191 HydrophobicContact CG-CD1 3.98Å; L187-I191 WeakPolarHBondContact O-CG1 3.12Å; L187-I191 PolarHBondContact O-N 3.02Å; G188-I191 PolarHBondContact O-N 3.38Å; I191-V194 PolarHBondContact O-N 3.26Å; I191-I195 HydrophobicContact CG2-CD1 3.67Å; I191-I195 HydrophobicContact CG2-CG1 4.4Å; I191-I195 WeakPolarHBondContact O-CB 3.47Å; I191-I195 VanDerWaalsContact O-CG1 3.3Å; I191-I195 WeakPolarHBondContact O-CG1 3.36Å; I191-I195 PolarHBondContact O-N 3.39Å
192G96.2Very high93.7Very high0 Ų029 Ų290%015%0.154CC..Hα-helixtrans-63.1-40.4177.900000113.1A41 G188 N189 I190 A196A41-G192 WeakPolarHBondContact O-CA 3.49Å; G188-G192 PolarHBondContact O-N 3.26Å; N189-G192 PolarHBondContact O-N 2.91Å; I190-G192 VanDerWaalsContact C-N 3.31Å; I190-G192 PolarHBondContact O-N 3.25Å; G192-A196 WeakPolarHBondContact O-CB 3.44Å; G192-A196 PolarHBondContact O-N 3.44Å
193S94.8Very high93.4Very high0 Ų032.1 Ų32.10%017%0.171CC..Hα-helixtrans-64.2-44.4174.5-82.60000112.2K44 N189 I190 G197K44-S193 WeakPolarHBondContact CE-OG 3.44Å; K44-S193 WeakPolarHBondContact CG-OG 3.31Å; N189-S193 WeakPolarHBondContact O-CB 3.46Å; N189-S193 PolarHBondContact O-N 2.58Å; N189-S193 PolarHBondContact O-OG 3.15Å; I190-S193 PolarHBondContact O-N 2.92Å; S193-G197 PolarHBondContact O-N 3.08Å
194V94.4Very high93.2Very high71 Ų7131.4 Ų31.443%0.4317%0.166SC..Hα-helixtrans-66.6-48.1-179.2170.40000110.3I190 I191 A196 G197 I198I190-V194 HydrophobicContact CG2-CG2 4.38Å; I190-V194 WeakPolarHBondContact O-CB 3.25Å; I190-V194 VanDerWaalsContact O-CG2 3.29Å; I190-V194 WeakPolarHBondContact O-CG2 3.41Å; I190-V194 PolarHBondContact O-N 3.42Å; I191-V194 PolarHBondContact O-N 3.26Å; V194-A196 PolarHBondContact O-N 3.21Å; V194-G197 PolarHBondContact O-N 2.89Å; V194-I198 HydrophobicContact CG1-CD1 4.03Å; V194-I198 VanDerWaalsContact O-CG1 3.31Å; V194-I198 WeakPolarHBondContact O-CG1 3.26Å; V194-I198 PolarHBondContact O-N 2.86Å; V194-I198 VanDerWaalsContact O-N 3.07Å
195I95.7Very high93Very high20 Ų2031.4 Ų31.410%0.10317%0.166CC..Hα-helixtrans-58.7-50176.8-70170.7000110.1I191 G197 I198 Y199 L210 P211 I214I191-I195 HydrophobicContact CG2-CD1 3.67Å; I191-I195 HydrophobicContact CG2-CG1 4.4Å; I191-I195 WeakPolarHBondContact O-CB 3.47Å; I191-I195 VanDerWaalsContact O-CG1 3.3Å; I191-I195 WeakPolarHBondContact O-CG1 3.36Å; I191-I195 PolarHBondContact O-N 3.39Å; I195-G197 PolarHBondContact O-N 2.98Å; I195-I198 PolarHBondContact O-N 2.95Å; I195-Y199 HydrophobicContact CG2-CD2 4.16Å; I195-Y199 HydrophobicContact CG2-CE2 4.4Å; I195-Y199 VanDerWaalsContact O-CD2 3.27Å; I195-Y199 WeakPolarHBondContact O-CD2 3.4Å; I195-Y199 PolarHBondContact O-N 2.99Å; I195-L210 HydrophobicContact CD1-CD2 4.22Å; I195-L210 HydrophobicContact CD1-CG 4.4Å; I195-L210 HydrophobicContact CG1-CD2 4.3Å; I195-L210 HydrophobicContact CG2-CB 4.33Å; I195-L210 HydrophobicContact CG2-CD2 3.96Å; I195-L210 HydrophobicContact CG2-CG 4.45Å; I195-P211 HydrophobicContact CD1-CG 4.18Å; I195-P211 HydrophobicContact CG2-CG 4.06Å; I195-I214 HydrophobicContact CD1-CD1 4.18Å
196A94.3Very high93Very high0 Ų031.8 Ų31.80%017%0.17CC..Hα-helixtrans-64.5-40.1179.800000112P45 I48 G192 V194 I198 Y199 V200P45-A196 HydrophobicContact CB-CB 4.22Å; I48-A196 HydrophobicContact CB-CB 3.7Å; I48-A196 HydrophobicContact CG1-CB 3.87Å; I48-A196 HydrophobicContact CG2-CB 3.92Å; G192-A196 WeakPolarHBondContact O-CB 3.44Å; G192-A196 PolarHBondContact O-N 3.44Å; V194-A196 PolarHBondContact O-N 3.21Å; A196-I198 VanDerWaalsContact C-N 3.3Å; A196-I198 PolarHBondContact O-N 3.37Å; A196-Y199 PolarHBondContact O-N 3.29Å; A196-V200 WeakPolarHBondContact O-CA 3.13Å; A196-V200 WeakPolarHBondContact O-CB 3.18Å; A196-V200 PolarHBondContact O-N 2.98Å
197G90.8Very high93Very high6 Ų631.5 Ų31.56%0.06217%0.168CC..Hα-helixtrans-60.7-34.3177.400000113.8S193 V194 I195S193-G197 PolarHBondContact O-N 3.08Å; V194-G197 PolarHBondContact O-N 2.89Å; I195-G197 PolarHBondContact O-N 2.98Å
198I91.6Very high93Very high99 Ų9929.4 Ų29.451%0.50816%0.157SC..Hα-helixtrans-68.5-40.1176.5-68.7163000111.5V194 I195 A196V194-I198 HydrophobicContact CG1-CD1 4.03Å; V194-I198 VanDerWaalsContact O-CG1 3.31Å; V194-I198 WeakPolarHBondContact O-CG1 3.26Å; V194-I198 PolarHBondContact O-N 2.86Å; V194-I198 VanDerWaalsContact O-N 3.07Å; I195-I198 PolarHBondContact O-N 2.95Å; A196-I198 VanDerWaalsContact C-N 3.3Å; A196-I198 PolarHBondContact O-N 3.37Å
199Y92.1Very high92.9Very high83 Ų8331 Ų3133%0.32516%0.163SC..Hα-helixtrans-101.4-13.5-170.2-68.7-65.7000114.5I195 A196 E201 T202 N203 W204 A206 L210I195-Y199 HydrophobicContact CG2-CD2 4.16Å; I195-Y199 HydrophobicContact CG2-CE2 4.4Å; I195-Y199 VanDerWaalsContact O-CD2 3.27Å; I195-Y199 WeakPolarHBondContact O-CD2 3.4Å; I195-Y199 PolarHBondContact O-N 2.99Å; A196-Y199 PolarHBondContact O-N 3.29Å; Y199-E201 VanDerWaalsContact C-N 3.28Å; Y199-E201 PolarHBondContact O-N 3.29Å; Y199-E201 VanDerWaalsContact O-N 3.17Å; Y199-T202 PolarHBondContact O-N 3.08Å; Y199-T202 VanDerWaalsContact O-N 3.15Å; Y199-N203 WeakPolarHBondContact CB-O 3.33Å; Y199-N203 CarbonylContact O-C 3.1Å; Y199-N203 PolarHBondContact O-N 3.37Å; Y199-W204 PolarHBondContact O-N 3.47Å; Y199-A206 HydrophobicContact CD1-CB 3.72Å; Y199-A206 HydrophobicContact CD2-CB 4.04Å; Y199-A206 HydrophobicContact CE1-CB 4.18Å; Y199-A206 HydrophobicContact CE2-CB 4.48Å; Y199-A206 HydrophobicContact CG-CB 3.65Å; Y199-L210 HydrophobicContact CE2-CD2 4.1Å
200V88.4Confident92.9Very high1 Ų133.7 Ų33.71%0.00618%0.177CC..THydrogen-bonded Turntrans-55.3-39-171.262.30000113.3I48 V49 V52 A196 A325I48-V200 HydrophobicContact CG2-CB 4.13Å; I48-V200 HydrophobicContact CG2-CG1 4.3Å; I48-V200 HydrophobicContact CG2-CG2 4.2Å; V49-V200 HydrophobicContact CG2-CG2 4.4Å; V52-V200 HydrophobicContact CB-CG2 4.29Å; V52-V200 HydrophobicContact CG1-CG2 3.75Å; V52-V200 HydrophobicContact CG2-CG2 3.52Å; A196-V200 WeakPolarHBondContact O-CA 3.13Å; A196-V200 WeakPolarHBondContact O-CB 3.18Å; A196-V200 PolarHBondContact O-N 2.98Å; V200-A325 HydrophobicContact CG1-CB 4.02Å; V200-A325 HydrophobicContact CG2-CB 4.42Å
201E82.3Confident92.9Very high56 Ų5632.3 Ų32.326%0.26217%0.17SC..THydrogen-bonded Turntrans-88.6-15.3-177.1-58.5-165.4173.700114.8K63 Y199K63-E201 VanDerWaalsContact CB-O 3.23Å; K63-E201 WeakPolarHBondContact CB-O 3.41Å; K63-E201 HydrophobicContact CD-CB 4.31Å; K63-E201 IonicContact NZ-OE2 3.12Å; K63-E201 PolarHBondContact NZ-OE2 3.39Å; Y199-E201 VanDerWaalsContact C-N 3.28Å; Y199-E201 PolarHBondContact O-N 3.29Å; Y199-E201 VanDerWaalsContact O-N 3.17Å
202T84.2Confident92.9Very high94 Ų9429.5 Ų29.558%0.57716%0.156SC*.THydrogen-bonded Turntrans-116.3-41.6-170.153.50000113.3T64 Y199T64-T202 VanDerWaalsContact CG2-C 3.4Å; T64-T202 WeakPolarHBondContact CG2-O 3.05Å; Y199-T202 PolarHBondContact O-N 3.08Å; Y199-T202 VanDerWaalsContact O-N 3.15Å
203N88.4Confident93Very high70 Ų7033.7 Ų33.737%0.37418%0.178SC..  trans-154.680178.2-179.5-8.2000108.5Y199 G205 A206Y199-N203 WeakPolarHBondContact CB-O 3.33Å; Y199-N203 CarbonylContact O-C 3.1Å; Y199-N203 PolarHBondContact O-N 3.37Å; N203-G205 PolarHBondContact O-N 3.2Å; N203-G205 PolarHBondContact OD1-N 2.91Å; N203-A206 HydrophobicContact CB-CB 4.31Å; N203-A206 WeakPolarHBondContact O-CB 3.39Å; N203-A206 PolarHBondContact O-N 2.86Å; N203-A206 PolarHBondContact OD1-N 3.38Å
204W91.6Very high93.1Very high0 Ų036.4 Ų36.40%019%0.191CC..THydrogen-bonded Turntrans-56.8-29.2-175.270.8-91.5000112.9V49 L53 F67 W72 F129 A132 S133 F143 Y199 A206 S207 F208V49-W204 HydrophobicContact CG1-CB 3.82Å; V49-W204 HydrophobicContact CG1-CD2 4.11Å; V49-W204 HydrophobicContact CG1-CE3 3.78Å; V49-W204 HydrophobicContact CG1-CG 4.18Å; V49-W204 HydrophobicContact CG2-CB 4.23Å; L53-W204 HydrophobicContact CD2-CD2 4.29Å; F67-W204 AromaticContact CE2-CD1 3.46Å; F67-W204 VanDerWaalsContact CE2-CD1 3.46Å; F67-W204 AromaticContact CE2-NE1 3.59Å; F67-W204 AromaticContact CZ-CD1 3.91Å; W72-W204 AromaticContact CD2-CZ2 3.95Å; W72-W204 HydrophobicContact CD2-CZ2 3.95Å; W72-W204 AromaticContact CD2-NE1 3.94Å; W72-W204 AromaticContact CE2-CZ2 3.67Å; W72-W204 HydrophobicContact CE3-CZ2 4.32Å; W72-W204 AromaticContact CE3-NE1 3.53Å; W72-W204 HydrophobicContact CH2-CZ2 4.18Å; W72-W204 AromaticContact CZ2-CZ2 3.82Å; W72-W204 HydrophobicContact CZ2-CZ2 3.82Å; W72-W204 HydrophobicContact CZ3-CZ2 4.4Å; W72-W204 AromaticContact CZ3-NE1 3.64Å; F129-W204 HydrophobicContact CD1-CZ3 4.41Å; F129-W204 HydrophobicContact CE1-CZ3 4.28Å; A132-W204 HydrophobicContact CB-CH2 3.93Å; A132-W204 HydrophobicContact CB-CZ2 4.44Å; S133-W204 VanDerWaalsContact CB-CE2 3.47Å; S133-W204 PolarHBondContact OG-NE1 2.85Å; F143-W204 HydrophobicContact CE1-CH2 4.3Å; Y199-W204 PolarHBondContact O-N 3.47Å; W204-A206 VanDerWaalsContact C-N 3.3Å; W204-A206 PolarHBondContact O-N 3.46Å; W204-S207 WeakPolarHBondContact O-CB 3.16Å; W204-S207 PolarHBondContact O-N 3.06Å; W204-S207 VanDerWaalsContact O-N 3.1Å; W204-S207 PolarHBondContact O-OG 3.17Å; W204-F208 HydrophobicContact CE3-CD2 4.03Å; W204-F208 AromaticContact CE3-CE2 3.8Å; W204-F208 HydrophobicContact CE3-CE2 3.8Å; W204-F208 HydrophobicContact CZ3-CD2 4.1Å; W204-F208 AromaticContact CZ3-CE2 3.9Å; W204-F208 HydrophobicContact CZ3-CE2 3.9Å
205G93.9Very high93.3Very high0 Ų033 Ų330%017%0.171CC..THydrogen-bonded Turntrans-59.6-36.4175.500000113.3N203 S207 F208 Y209N203-G205 PolarHBondContact O-N 3.2Å; N203-G205 PolarHBondContact OD1-N 2.91Å; G205-S207 PolarHBondContact O-N 2.79Å; G205-F208 PolarHBondContact O-N 3.02Å; G205-Y209 WeakPolarHBondContact O-CD2 3.44Å; G205-Y209 WeakPolarHBondContact O-CE2 3.36Å; G205-Y209 PolarHBondContact O-N 3.01Å; G205-Y209 VanDerWaalsContact O-N 3.1Å
206A94.3Very high93.4Very high14 Ų1434.2 Ų34.212%0.11618%0.177CC..Hα-helixtrans-61.5-24.7176.500000113.3Y199 N203 W204 F208 Y209 L210Y199-A206 HydrophobicContact CD1-CB 3.72Å; Y199-A206 HydrophobicContact CD2-CB 4.04Å; Y199-A206 HydrophobicContact CE1-CB 4.18Å; Y199-A206 HydrophobicContact CE2-CB 4.48Å; Y199-A206 HydrophobicContact CG-CB 3.65Å; N203-A206 HydrophobicContact CB-CB 4.31Å; N203-A206 WeakPolarHBondContact O-CB 3.39Å; N203-A206 PolarHBondContact O-N 2.86Å; N203-A206 PolarHBondContact OD1-N 3.38Å; W204-A206 VanDerWaalsContact C-N 3.3Å; W204-A206 PolarHBondContact O-N 3.46Å; A206-F208 PolarHBondContact O-N 2.91Å; A206-Y209 HydrophobicContact CB-CD2 4.5Å; A206-L210 PolarHBondContact O-N 2.65Å
207S95.6Very high93.6Very high0 Ų038.2 Ų38.20%020%0.201CC..Hα-helixtrans-59.7-23.4171.3-460000112.8P45 W204 G205 P211P45-S207 VanDerWaalsContact CB-O 3.32Å; P45-S207 WeakPolarHBondContact CB-O 3.49Å; P45-S207 WeakPolarHBondContact CG-O 3.49Å; W204-S207 WeakPolarHBondContact O-CB 3.16Å; W204-S207 PolarHBondContact O-N 3.06Å; W204-S207 VanDerWaalsContact O-N 3.1Å; W204-S207 PolarHBondContact O-OG 3.17Å; G205-S207 PolarHBondContact O-N 2.79Å; S207-P211 VanDerWaalsContact O-CD 3.23Å; S207-P211 WeakPolarHBondContact O-CD 3.13Å; S207-P211 VanDerWaalsContact O-CG 3.28Å; S207-P211 WeakPolarHBondContact O-CG 3.42Å
208F97.2Very high93.9Very high7 Ų738.2 Ų38.23%0.03120%0.201CC..Hα-helixtrans-107.4-42-178.3-66.5-88.6000113P45 L46 V49 T126 F129 W204 G205 A206 L210 P211 G212P45-F208 HydrophobicContact CB-CD1 3.84Å; P45-F208 HydrophobicContact CB-CD2 4.37Å; P45-F208 HydrophobicContact CB-CE1 3.7Å; P45-F208 HydrophobicContact CB-CE2 4.23Å; P45-F208 HydrophobicContact CB-CG 4.19Å; P45-F208 HydrophobicContact CB-CZ 3.9Å; P45-F208 HydrophobicContact CG-CD1 4.44Å; L46-F208 HydrophobicContact CB-CE1 4.18Å; L46-F208 HydrophobicContact CB-CZ 4.06Å; L46-F208 HydrophobicContact CD1-CZ 4.32Å; V49-F208 HydrophobicContact CB-CE2 4.12Å; V49-F208 HydrophobicContact CB-CZ 4.45Å; V49-F208 HydrophobicContact CG1-CE2 4.18Å; V49-F208 HydrophobicContact CG2-CE2 3.85Å; V49-F208 HydrophobicContact CG2-CZ 4.46Å; T126-F208 HydrophobicContact CG2-CB 4.47Å; T126-F208 HydrophobicContact CG2-CD1 4.4Å; T126-F208 WeakPolarHBondContact CG2-O 3.47Å; F129-F208 HydrophobicContact CB-CD1 4.09Å; F129-F208 HydrophobicContact CB-CG 4.49Å; F129-F208 AromaticContact CD1-CD1 3.62Å; F129-F208 HydrophobicContact CD1-CD1 3.62Å; F129-F208 HydrophobicContact CD1-CD2 4.01Å; F129-F208 AromaticContact CD1-CE1 3.37Å; F129-F208 HydrophobicContact CD1-CE1 3.37Å; F129-F208 AromaticContact CD1-CE2 3.78Å; F129-F208 HydrophobicContact CD1-CE2 3.78Å; F129-F208 AromaticContact CD1-CG 3.93Å; F129-F208 HydrophobicContact CD1-CG 3.93Å; F129-F208 AromaticContact CD1-CZ 3.45Å; F129-F208 HydrophobicContact CD1-CZ 3.45Å; F129-F208 VanDerWaalsContact CD1-CZ 3.45Å; F129-F208 HydrophobicContact CE1-CD1 4.41Å; F129-F208 AromaticContact CE1-CE1 3.73Å; F129-F208 HydrophobicContact CE1-CE1 3.73Å; F129-F208 AromaticContact CE1-CE2 3.88Å; F129-F208 HydrophobicContact CE1-CE2 3.88Å; F129-F208 AromaticContact CE1-CZ 3.42Å; F129-F208 HydrophobicContact CE1-CZ 3.42Å; F129-F208 VanDerWaalsContact CE1-CZ 3.42Å; F129-F208 HydrophobicContact CG-CD1 4.08Å; F129-F208 HydrophobicContact CG-CE1 4.01Å; F129-F208 HydrophobicContact CG-CZ 4.49Å; F129-F208 HydrophobicContact CZ-CZ 4.42Å; W204-F208 HydrophobicContact CE3-CD2 4.03Å; W204-F208 AromaticContact CE3-CE2 3.8Å; W204-F208 HydrophobicContact CE3-CE2 3.8Å; W204-F208 HydrophobicContact CZ3-CD2 4.1Å; W204-F208 AromaticContact CZ3-CE2 3.9Å; W204-F208 HydrophobicContact CZ3-CE2 3.9Å; G205-F208 PolarHBondContact O-N 3.02Å; A206-F208 PolarHBondContact O-N 2.91Å; F208-L210 VanDerWaalsContact C-N 3.31Å; F208-L210 PolarHBondContact O-N 3.42Å; F208-P211 WeakPolarHBondContact O-CD 3.3Å; F208-G212 PolarHBondContact O-N 2.6Å
209Y94.6Very high94.2Very high34 Ų3433.7 Ų33.713%0.13318%0.178CC..Hα-helixtrans-58.7-44.1179.3-51.3-51.5000112.1F127 G130 L131 Y134 G205 A206 G212 L213F127-Y209 AromaticContact CD1-CD1 3.9Å; F127-Y209 HydrophobicContact CD1-CD1 3.9Å; F127-Y209 HydrophobicContact CD1-CE1 4.48Å; F127-Y209 HydrophobicContact CD2-CD1 4.17Å; F127-Y209 HydrophobicContact CD2-CG 4.48Å; F127-Y209 WeakPolarHBondContact CD2-O 2.89Å; F127-Y209 AromaticContact CE1-CD1 3.87Å; F127-Y209 HydrophobicContact CE1-CD1 3.87Å; F127-Y209 HydrophobicContact CE1-CE1 4.36Å; F127-Y209 HydrophobicContact CE2-CD1 4.16Å; F127-Y209 HydrophobicContact CE2-CG 4.26Å; F127-Y209 HydrophobicContact CG-CD1 4.04Å; F127-Y209 AromaticContact CZ-CD1 4Å; F127-Y209 HydrophobicContact CZ-CD1 4Å; F127-Y209 HydrophobicContact CZ-CG 4.33Å; F127-Y209 WeakPolarHBondContact O-CD1 3.42Å; F127-Y209 WeakPolarHBondContact O-CE1 3.45Å; G130-Y209 VanDerWaalsContact CA-CE1 3.4Å; G130-Y209 WeakPolarHBondContact O-CE1 3.39Å; G130-Y209 PolarHBondContact O-OH 3.48Å; L131-Y209 VanDerWaalsContact CA-CE1 3.46Å; L131-Y209 VanDerWaalsContact CA-OH 3.23Å; L131-Y209 WeakPolarHBondContact CA-OH 3.3Å; L131-Y209 HydrophobicContact CB-CE1 4.16Å; L131-Y209 HydrophobicContact CD2-CD1 4.49Å; L131-Y209 HydrophobicContact CD2-CE1 3.68Å; L131-Y209 HydrophobicContact CG-CE1 3.77Å; L131-Y209 PolarHBondContact N-OH 3.29Å; Y134-Y209 WeakPolarHBondContact CB-OH 3.44Å; Y134-Y209 PolarHBondContact N-OH 3.49Å; G205-Y209 WeakPolarHBondContact O-CD2 3.44Å; G205-Y209 WeakPolarHBondContact O-CE2 3.36Å; G205-Y209 PolarHBondContact O-N 3.01Å; G205-Y209 VanDerWaalsContact O-N 3.1Å; A206-Y209 HydrophobicContact CB-CD2 4.5Å; Y209-G212 PolarHBondContact O-N 3.46Å; Y209-L213 WeakPolarHBondContact O-CB 3.49Å; Y209-L213 PolarHBondContact O-N 3.35Å
210L96.1Very high94.4Very high63 Ų6334.5 Ų34.533%0.3319%0.188SC..Hα-helixtrans-67.6-50.7-174.1179.762.7000111.9I195 Y199 A206 F208 G212 L213 I214I195-L210 HydrophobicContact CD1-CD2 4.22Å; I195-L210 HydrophobicContact CD1-CG 4.4Å; I195-L210 HydrophobicContact CG1-CD2 4.3Å; I195-L210 HydrophobicContact CG2-CB 4.33Å; I195-L210 HydrophobicContact CG2-CD2 3.96Å; I195-L210 HydrophobicContact CG2-CG 4.45Å; Y199-L210 HydrophobicContact CE2-CD2 4.1Å; A206-L210 PolarHBondContact O-N 2.65Å; F208-L210 VanDerWaalsContact C-N 3.31Å; F208-L210 PolarHBondContact O-N 3.42Å; L210-G212 VanDerWaalsContact C-N 3.28Å; L210-G212 PolarHBondContact O-N 3.26Å; L210-L213 PolarHBondContact O-N 3.49Å; L210-I214 HydrophobicContact CD1-CD1 4.22Å; L210-I214 HydrophobicContact CD1-CG1 4.44Å; L210-I214 HydrophobicContact CG-CD1 4.11Å; L210-I214 VanDerWaalsContact O-CG1 3.3Å; L210-I214 WeakPolarHBondContact O-CG1 3.29Å; L210-I214 PolarHBondContact O-N 3.31Å
211P97.2Very high94.7Very high2 Ų237.5 Ų37.51%0.01321%0.206CC..Hα-helixtrans-60.5-36.3172-25.737000113.3P45 I195 S207 F208 I214 M215P45-P211 HydrophobicContact CG-CG 4.19Å; I195-P211 HydrophobicContact CD1-CG 4.18Å; I195-P211 HydrophobicContact CG2-CG 4.06Å; S207-P211 VanDerWaalsContact O-CD 3.23Å; S207-P211 WeakPolarHBondContact O-CD 3.13Å; S207-P211 VanDerWaalsContact O-CG 3.28Å; S207-P211 WeakPolarHBondContact O-CG 3.42Å; F208-P211 WeakPolarHBondContact O-CD 3.3Å; P211-I214 PolarHBondContact O-N 2.93Å; P211-M215 WeakPolarHBondContact O-CB 3.42Å; P211-M215 PolarHBondContact O-N 3.07Å
212G97.8Very high95.3Very high0 Ų034.9 Ų34.90%019%0.193CC..Hα-helixtrans-59.6-48.3174.900000112.5G123 F208 Y209 L210 M215 M216G123-G212 WeakPolarHBondContact CA-O 3.42Å; G123-G212 WeakPolarHBondContact O-CA 3.47Å; F208-G212 PolarHBondContact O-N 2.6Å; Y209-G212 PolarHBondContact O-N 3.46Å; L210-G212 VanDerWaalsContact C-N 3.28Å; L210-G212 PolarHBondContact O-N 3.26Å; G212-M215 PolarHBondContact O-N 2.8Å; G212-M216 WeakPolarHBondContact O-CG 3.39Å; G212-M216 PolarHBondContact O-N 3.44Å
213L97.5Very high95.8Very high88 Ų8834.7 Ų34.746%0.46118%0.183SC..Hα-helixtrans-63.9-43.9177.3-178.964.4000111.9Y209 L210 M215 M216 V217Y209-L213 WeakPolarHBondContact O-CB 3.49Å; Y209-L213 PolarHBondContact O-N 3.35Å; L210-L213 PolarHBondContact O-N 3.49Å; L213-M215 VanDerWaalsContact C-N 3.27Å; L213-M215 PolarHBondContact O-N 3.17Å; L213-M216 PolarHBondContact O-N 2.71Å; L213-M216 VanDerWaalsContact O-N 3.16Å; L213-V217 WeakPolarHBondContact O-CG2 3.23Å; L213-V217 PolarHBondContact O-N 3.29Å
214I97.4Very high96.1Very high56 Ų5633.8 Ų33.829%0.28718%0.178SC..Hα-helixtrans-57.6-43.8175.9-68.9166.4000110.3F38 I195 L210 P211 V217 G218F38-I214 HydrophobicContact CD1-CG2 3.51Å; F38-I214 HydrophobicContact CD2-CG2 4.45Å; F38-I214 HydrophobicContact CE1-CG2 3.56Å; F38-I214 HydrophobicContact CE2-CG2 4.49Å; F38-I214 HydrophobicContact CG-CG2 4Å; F38-I214 HydrophobicContact CZ-CG2 4.07Å; I195-I214 HydrophobicContact CD1-CD1 4.18Å; L210-I214 HydrophobicContact CD1-CD1 4.22Å; L210-I214 HydrophobicContact CD1-CG1 4.44Å; L210-I214 HydrophobicContact CG-CD1 4.11Å; L210-I214 VanDerWaalsContact O-CG1 3.3Å; L210-I214 WeakPolarHBondContact O-CG1 3.29Å; L210-I214 PolarHBondContact O-N 3.31Å; P211-I214 PolarHBondContact O-N 2.93Å; I214-V217 PolarHBondContact O-N 3.04Å; I214-G218 PolarHBondContact O-N 3.22Å
215M97.6Very high96.1Very high0 Ų034.6 Ų34.60%018%0.183CC..Hα-helixtrans-66.3-37.3177.8-176163.139.600112.5F38 Y39 S42 M119 S122 P211 G212 L213 G218 A219F38-M215 HydrophobicContact CB-CB 4.2Å; F38-M215 HydrophobicContact CB-CG 4.37Å; Y39-M215 HydrophobicContact CD1-SD 3.69Å; Y39-M215 HydrophobicContact CE1-SD 4Å; Y39-M215 HydrophobicContact CG-SD 4.11Å; S42-M215 VanDerWaalsContact CB-CE 3.48Å; S42-M215 VanDerWaalsContact OG-CE 3.26Å; S42-M215 WeakPolarHBondContact OG-CE 3.02Å; M119-M215 HydrophobicContact CB-CG 4.43Å; M119-M215 WeakPolarHBondContact O-CG 3.24Å; S122-M215 VanDerWaalsContact CB-SD 3.59Å; S122-M215 VanDerWaalsContact O-CE 3.27Å; S122-M215 WeakPolarHBondContact O-CE 3.37Å; P211-M215 WeakPolarHBondContact O-CB 3.42Å; P211-M215 PolarHBondContact O-N 3.07Å; G212-M215 PolarHBondContact O-N 2.8Å; L213-M215 VanDerWaalsContact C-N 3.27Å; L213-M215 PolarHBondContact O-N 3.17Å; M215-G218 PolarHBondContact O-N 3.39Å; M215-A219 PolarHBondContact O-N 3.4Å
216M98.4Very high95.9Very high46 Ų4634.7 Ų34.723%0.22718%0.183CC..Hα-helixtrans-64.2-41.5173.7-67.3170.66800112.3F120 V124 G212 L213 A219 L220F120-M216 HydrophobicContact CD2-CB 4.22Å; F120-M216 HydrophobicContact CD2-CE 4.22Å; F120-M216 HydrophobicContact CD2-CG 4.2Å; F120-M216 HydrophobicContact CE2-CB 4.42Å; F120-M216 HydrophobicContact CE2-CE 3.45Å; F120-M216 VanDerWaalsContact CE2-CE 3.45Å; F120-M216 HydrophobicContact CE2-CG 4.36Å; F120-M216 HydrophobicContact CZ-CE 3.72Å; V124-M216 HydrophobicContact CG2-CE 4.07Å; V124-M216 HydrophobicContact CG2-SD 4.16Å; G212-M216 WeakPolarHBondContact O-CG 3.39Å; G212-M216 PolarHBondContact O-N 3.44Å; L213-M216 PolarHBondContact O-N 2.71Å; L213-M216 VanDerWaalsContact O-N 3.16Å; M216-A219 WeakPolarHBondContact O-CB 3.26Å; M216-A219 PolarHBondContact O-N 3.03Å; M216-L220 PolarHBondContact O-N 2.9Å; M216-L220 VanDerWaalsContact O-N 3.16Å
217V97.7Very high95.6Very high84 Ų8434 Ų3451%0.50918%0.178SC..Hα-helixtrans-64.6-43.2174.3174.60000110.4L213 I214 A219 L220 V221L213-V217 WeakPolarHBondContact O-CG2 3.23Å; L213-V217 PolarHBondContact O-N 3.29Å; I214-V217 PolarHBondContact O-N 3.04Å; V217-A219 VanDerWaalsContact C-N 3.29Å; V217-A219 PolarHBondContact O-N 3.45Å; V217-L220 WeakPolarHBondContact O-CB 3.37Å; V217-L220 PolarHBondContact O-N 3.27Å; V217-L220 VanDerWaalsContact O-N 3.16Å; V217-V221 WeakPolarHBondContact O-CG2 3.25Å; V217-V221 PolarHBondContact O-N 3.48Å
218G97.5Very high95.1Very high6 Ų634.1 Ų34.16%0.06218%0.178CC..Hα-helixtrans-57.7-40.6173.300000112.7I214 M215 L220 V221 V222I214-G218 PolarHBondContact O-N 3.22Å; M215-G218 PolarHBondContact O-N 3.39Å; G218-L220 VanDerWaalsContact C-N 3.33Å; G218-L220 PolarHBondContact O-N 2.94Å; G218-V221 PolarHBondContact O-N 3.07Å; G218-V222 WeakPolarHBondContact O-CG2 3.46Å; G218-V222 PolarHBondContact O-N 3.18Å
219A97.8Very high94.3Very high3 Ų333.9 Ų33.93%0.02518%0.177CC..Hα-helixtrans-60.3-41.7175.600000112.4S116 M119 F120 M215 M216 V217 V222 Y223S116-A219 WeakPolarHBondContact O-CB 3.28Å; M119-A219 HydrophobicContact CB-CB 3.55Å; F120-A219 HydrophobicContact CB-CB 3.85Å; M215-A219 PolarHBondContact O-N 3.4Å; M216-A219 WeakPolarHBondContact O-CB 3.26Å; M216-A219 PolarHBondContact O-N 3.03Å; V217-A219 VanDerWaalsContact C-N 3.29Å; V217-A219 PolarHBondContact O-N 3.45Å; A219-V222 PolarHBondContact O-N 3.2Å; A219-Y223 WeakPolarHBondContact O-CB 3.48Å; A219-Y223 PolarHBondContact O-N 2.87Å
220L96.8Very high93.4Very high101 Ų10132.8 Ų32.853%0.52917%0.174SC..Hα-helixtrans-64.4-43.7175.6179.762.4000111.4M216 V217 G218 V222 Y223 L224M216-L220 PolarHBondContact O-N 2.9Å; M216-L220 VanDerWaalsContact O-N 3.16Å; V217-L220 WeakPolarHBondContact O-CB 3.37Å; V217-L220 PolarHBondContact O-N 3.27Å; V217-L220 VanDerWaalsContact O-N 3.16Å; G218-L220 VanDerWaalsContact C-N 3.33Å; G218-L220 PolarHBondContact O-N 2.94Å; L220-V222 PolarHBondContact O-N 3.33Å; L220-Y223 WeakPolarHBondContact O-CB 3.47Å; L220-Y223 PolarHBondContact O-N 3.29Å; L220-L224 HydrophobicContact CD1-CD1 3.95Å; L220-L224 HydrophobicContact CD1-CG 4.11Å; L220-L224 HydrophobicContact CG-CD1 3.92Å; L220-L224 HydrophobicContact CG-CG 4.45Å; L220-L224 WeakPolarHBondContact O-CB 3.39Å; L220-L224 VanDerWaalsContact O-CG 3.25Å; L220-L224 WeakPolarHBondContact O-CG 3.47Å; L220-L224 PolarHBondContact O-N 3.37Å
221V95.3Very high92.4Very high63 Ų6332 Ų3238%0.38217%0.17SC..Hα-helixtrans-58.1-50.11761750000110.2L31 V217 G218 Y223 L224 T225L31-V221 HydrophobicContact CD1-CG1 4.11Å; V217-V221 WeakPolarHBondContact O-CG2 3.25Å; V217-V221 PolarHBondContact O-N 3.48Å; G218-V221 PolarHBondContact O-N 3.07Å; V221-Y223 VanDerWaalsContact C-N 3.33Å; V221-Y223 PolarHBondContact O-N 2.8Å; V221-L224 PolarHBondContact O-N 3.27Å; V221-L224 VanDerWaalsContact O-N 3.11Å; V221-T225 PolarHBondContact O-N 3.45Å; V221-T225 PolarHBondContact O-OG1 3.36Å
222V95.1Very high91.2Very high1 Ų132.3 Ų32.31%0.00617%0.172CC..Hα-helixtrans-56-48177.4173.40000111.4L31 C35 L115 S116 M119 G218 A219 L220 L224 T225 V226L31-V222 HydrophobicContact CD1-CG2 4.2Å; L31-V222 HydrophobicContact CG-CG2 4.42Å; C35-V222 WeakPolarHBondContact SG-CG2 3.27Å; L115-V222 HydrophobicContact CB-CG1 4.39Å; L115-V222 HydrophobicContact CD2-CG1 3.81Å; L115-V222 HydrophobicContact CG-CG1 4.01Å; S116-V222 WeakPolarHBondContact OG-CG1 3.42Å; M119-V222 HydrophobicContact CE-CG2 4.49Å; M119-V222 HydrophobicContact SD-CG2 3.84Å; G218-V222 WeakPolarHBondContact O-CG2 3.46Å; G218-V222 PolarHBondContact O-N 3.18Å; A219-V222 PolarHBondContact O-N 3.2Å; L220-V222 PolarHBondContact O-N 3.33Å; V222-L224 PolarHBondContact O-N 3.37Å; V222-T225 PolarHBondContact O-N 3.45Å; V222-V226 HydrophobicContact CG1-CB 3.98Å; V222-V226 HydrophobicContact CG1-CG1 3.87Å; V222-V226 VanDerWaalsContact O-CB 3.27Å; V222-V226 WeakPolarHBondContact O-CB 3.46Å; V222-V226 WeakPolarHBondContact O-CG1 3.35Å; V222-V226 PolarHBondContact O-N 2.92Å
223Y95.1Very high89.9Confident90 Ų9034.2 Ų34.235%0.35318%0.182SC..Hα-helixtrans-56.7-41.2178.7178-96.1000112.2P7 R112 Y113 S116 A219 L220 V221P7-Y223 HydrophobicContact CG-CE1 4.15Å; R112-Y223 WeakPolarHBondContact CD-O 3.46Å; Y113-Y223 HydrophobicContact CD1-CD2 4.34Å; Y113-Y223 AromaticContact CD1-CE2 3.84Å; Y113-Y223 HydrophobicContact CD1-CE2 3.84Å; Y113-Y223 HydrophobicContact CE1-CD2 4.47Å; Y113-Y223 AromaticContact CE1-CE2 3.63Å; Y113-Y223 HydrophobicContact CE1-CE2 3.63Å; S116-Y223 VanDerWaalsContact OG-CA 3.26Å; S116-Y223 WeakPolarHBondContact OG-CA 3.46Å; S116-Y223 PolarHBondContact OG-N 3.05Å; A219-Y223 WeakPolarHBondContact O-CB 3.48Å; A219-Y223 PolarHBondContact O-N 2.87Å; L220-Y223 WeakPolarHBondContact O-CB 3.47Å; L220-Y223 PolarHBondContact O-N 3.29Å; V221-Y223 VanDerWaalsContact C-N 3.33Å; V221-Y223 PolarHBondContact O-N 2.8Å
224L93Very high88.5Confident51 Ų5135 Ų3527%0.26719%0.19SC..Hα-helixtrans-78.8-25.4-175.7-68.4176000113.8P6 P7 C8 L220 V221 V222P6-L224 WeakPolarHBondContact CB-O 3.42Å; P7-L224 HydrophobicContact CB-CD2 4.27Å; P7-L224 HydrophobicContact CG-CD2 4.43Å; C8-L224 HydrophobicContact CB-CB 4.29Å; C8-L224 VanDerWaalsContact CB-O 3.26Å; C8-L224 WeakPolarHBondContact CB-O 3.4Å; C8-L224 PolarHBondContact N-O 3.36Å; L220-L224 HydrophobicContact CD1-CD1 3.95Å; L220-L224 HydrophobicContact CD1-CG 4.11Å; L220-L224 HydrophobicContact CG-CD1 3.92Å; L220-L224 HydrophobicContact CG-CG 4.45Å; L220-L224 WeakPolarHBondContact O-CB 3.39Å; L220-L224 VanDerWaalsContact O-CG 3.25Å; L220-L224 WeakPolarHBondContact O-CG 3.47Å; L220-L224 PolarHBondContact O-N 3.37Å; V221-L224 PolarHBondContact O-N 3.27Å; V221-L224 VanDerWaalsContact O-N 3.11Å; V222-L224 PolarHBondContact O-N 3.37Å
225T91.5Very high86.8Confident17 Ų1739.1 Ų39.110%0.10420%0.203CC..Hα-helixtrans-129.9-16.3-165.567.60000116.4C8 Y27 V221 V222C8-T225 HydrophobicContact CB-CG2 4.49Å; Y27-T225 WeakPolarHBondContact OH-CB 3.26Å; Y27-T225 PolarHBondContact OH-OG1 2.69Å; V221-T225 PolarHBondContact O-N 3.45Å; V221-T225 PolarHBondContact O-OG1 3.36Å; V222-T225 PolarHBondContact O-N 3.45Å
226V91.4Very high85.2Confident2 Ų242.8 Ų42.81%0.01222%0.222CC..  trans-70.5134.4-173.2750000112.5P6 I28 L31 R112 L164 V222P6-V226 WeakPolarHBondContact CG-O 3.37Å; I28-V226 HydrophobicContact CD1-CG2 4.29Å; L31-V226 HydrophobicContact CD2-CB 3.91Å; L31-V226 HydrophobicContact CD2-CG2 3.95Å; R112-V226 HydrophobicContact CB-CG1 3.52Å; R112-V226 HydrophobicContact CG-CG1 3.49Å; R112-V226 VanDerWaalsContact CG-CG1 3.49Å; L164-V226 HydrophobicContact CD1-CG2 3.88Å; L164-V226 HydrophobicContact CD2-CG2 4.09Å; V222-V226 HydrophobicContact CG1-CB 3.98Å; V222-V226 HydrophobicContact CG1-CG1 3.87Å; V222-V226 VanDerWaalsContact O-CB 3.27Å; V222-V226 WeakPolarHBondContact O-CB 3.46Å; V222-V226 WeakPolarHBondContact O-CG1 3.35Å; V222-V226 PolarHBondContact O-N 2.92Å
227I86.9Confident83.4Confident1 Ų142.7 Ų42.71%0.00523%0.226CC..  trans-114.9110.8176.1-52.7161.2000107.9P6 Y9 L17 L24 I28 W168 H229 M232 L233P6-I227 HydrophobicContact CG-CG1 4.09Å; Y9-I227 HydrophobicContact CD2-CD1 3.62Å; Y9-I227 HydrophobicContact CD2-CG1 4.05Å; Y9-I227 HydrophobicContact CE2-CD1 3.49Å; Y9-I227 VanDerWaalsContact CE2-CD1 3.49Å; Y9-I227 HydrophobicContact CE2-CG1 4.33Å; L17-I227 HydrophobicContact CD1-CD1 4.49Å; L24-I227 HydrophobicContact CD2-CD1 3.49Å; L24-I227 VanDerWaalsContact CD2-CD1 3.49Å; I28-I227 HydrophobicContact CD1-CB 4.39Å; W168-I227 HydrophobicContact CH2-CG2 4.38Å; W168-I227 HydrophobicContact CZ2-CB 3.92Å; W168-I227 HydrophobicContact CZ2-CG2 3.73Å; W168-I227 PolarHBondContact NE1-O 3.48Å; I227-H229 PolarHBondContact O-N 3.43Å; I227-M232 HydrophobicContact CG2-CE 4.16Å; I227-L233 HydrophobicContact CG2-CD2 4.33Å
228E84.6Confident81.2Confident2 Ų244.4 Ų44.41%0.00924%0.239CC..  trans-68-35.4-170.8-45.1175.215900114.4R3 N110 L111 R112 L164 N167 M232R3-E228 WeakPolarHBondContact CD-OE2 3.2Å; R3-E228 IonicContact NE-OE2 2.85Å; R3-E228 PolarHBondContact NE-OE2 3.04Å; N110-E228 VanDerWaalsContact C-OE1 3.23Å; N110-E228 PolarHBondContact ND2-OE1 2.87Å; N110-E228 PolarHBondContact ND2-OE2 3.09Å; N110-E228 PolarHBondContact OD1-OE1 3.47Å; L111-E228 HydrophobicContact CB-CG 4.08Å; L111-E228 PolarHBondContact N-OE1 3.22Å; R112-E228 HydrophobicContact CB-CG 4.41Å; R112-E228 PolarHBondContact N-OE1 3.16Å; L164-E228 HydrophobicContact CD2-CB 4.18Å; N167-E228 WeakPolarHBondContact CB-O 3.16Å; N167-E228 PolarHBondContact ND2-O 3.32Å; E228-M232 HydrophobicContact CB-CE 3.37Å; E228-M232 HydrophobicContact CG-CE 3.72Å
229H80.2Confident78.9Confident2 Ų248.7 Ų48.71%0.00927%0.268CS..  trans-149.2139.6-172.4-156.3-84.5000110.1I227 N231 M232 I272I227-H229 PolarHBondContact O-N 3.43Å; H229-N231 VanDerWaalsContact CE1-CG 3.48Å; H229-N231 PolarHBondContact CE1-OD1 2.9Å; H229-N231 WeakPolarHBondContact ND1-CB 3.22Å; H229-N231 VanDerWaalsContact ND1-CG 3.3Å; H229-N231 PolarHBondContact ND1-N 3.15Å; H229-N231 PolarHBondContact ND1-OD1 2.96Å; H229-N231 PolarHBondContact O-N 3.32Å; H229-M232 HydrophobicContact CB-CE 4.3Å; H229-M232 WeakPolarHBondContact O-CB 3.39Å; H229-M232 PolarHBondContact O-N 2.98Å; H229-M232 VanDerWaalsContact O-N 3.13Å; H229-I272 PolarHBondContact CE1-O 3.42Å; H229-I272 PolarHBondContact NE2-O 2.87Å
230P77.7Confident76.6Confident10 Ų1051.6 Ų51.67%0.06529%0.288CS..THydrogen-bonded Turntrans-60.9-32.117922.8-34.7000113.4F21 W168 M232 L233 P270F21-P230 HydrophobicContact CD2-CB 4.19Å; F21-P230 HydrophobicContact CE2-CB 3.55Å; F21-P230 HydrophobicContact CE2-CG 3.97Å; W168-P230 HydrophobicContact CE3-CB 4.42Å; W168-P230 HydrophobicContact CH2-CB 4.12Å; W168-P230 HydrophobicContact CZ2-CB 4.49Å; W168-P230 HydrophobicContact CZ3-CB 4.06Å; P230-M232 PolarHBondContact O-N 2.94Å; P230-L233 VanDerWaalsContact O-CB 3.23Å; P230-L233 WeakPolarHBondContact O-CB 3.3Å; P230-L233 WeakPolarHBondContact O-CG 3.19Å; P230-L233 PolarHBondContact O-N 3.49Å; P230-P270 HydrophobicContact CG-CB 4.14Å
231N74Confident74Confident47 Ų4754 Ų5425%0.25130%0.301SS..Hα-helixtrans-58.4-22.7177.2-60.29.6000113.6H229 L233 V234 Y235H229-N231 VanDerWaalsContact CE1-CG 3.48Å; H229-N231 PolarHBondContact CE1-OD1 2.9Å; H229-N231 WeakPolarHBondContact ND1-CB 3.22Å; H229-N231 VanDerWaalsContact ND1-CG 3.3Å; H229-N231 PolarHBondContact ND1-N 3.15Å; H229-N231 PolarHBondContact ND1-OD1 2.96Å; H229-N231 PolarHBondContact O-N 3.32Å; N231-L233 PolarHBondContact O-N 3.36Å; N231-V234 PolarHBondContact O-N 3.23Å; N231-V234 VanDerWaalsContact O-N 3.09Å; N231-Y235 HydrophobicContact CB-CD2 4.22Å; N231-Y235 HydrophobicContact CB-CE2 4.03Å; N231-Y235 WeakPolarHBondContact O-CD2 3.48Å; N231-Y235 PolarHBondContact O-N 2.88Å
232M71.5Confident71.4Confident8 Ų859.8 Ų59.84%0.03932%0.322CS..Hα-helixtrans-63.1-24.3173.4-76.7-168-85.700112.9R3 L5 I227 E228 H229 P230 N236R3-M232 HydrophobicContact CB-CG 4.05Å; R3-M232 HydrophobicContact CB-SD 3.54Å; R3-M232 VanDerWaalsContact CB-SD 3.54Å; L5-M232 HydrophobicContact CD2-CB 4.26Å; I227-M232 HydrophobicContact CG2-CE 4.16Å; E228-M232 HydrophobicContact CB-CE 3.37Å; E228-M232 HydrophobicContact CG-CE 3.72Å; H229-M232 HydrophobicContact CB-CE 4.3Å; H229-M232 WeakPolarHBondContact O-CB 3.39Å; H229-M232 PolarHBondContact O-N 2.98Å; H229-M232 VanDerWaalsContact O-N 3.13Å; P230-M232 PolarHBondContact O-N 2.94Å; M232-N236 WeakPolarHBondContact O-CB 3.23Å; M232-N236 PolarHBondContact O-N 3.28Å; M232-N236 PolarHBondContact O-ND2 3.33Å
233L71.6Confident68.6Low41 Ų4165.2 Ų65.222%0.21536%0.355CS..Hα-helixtrans-72.5-33.5175.1-53.7-176.2000111.5L5 Y9 L24 W168 I227 P230 N231 S237L5-L233 HydrophobicContact CD2-CD2 4.03Å; Y9-L233 HydrophobicContact CE1-CD2 4.41Å; Y9-L233 HydrophobicContact CE2-CD2 3.64Å; Y9-L233 VanDerWaalsContact CZ-CD2 3.49Å; Y9-L233 WeakPolarHBondContact OH-CD2 3.45Å; L24-L233 HydrophobicContact CD1-CD1 3.48Å; L24-L233 VanDerWaalsContact CD1-CD1 3.48Å; W168-L233 HydrophobicContact CH2-CD1 4.18Å; I227-L233 HydrophobicContact CG2-CD2 4.33Å; P230-L233 VanDerWaalsContact O-CB 3.23Å; P230-L233 WeakPolarHBondContact O-CB 3.3Å; P230-L233 WeakPolarHBondContact O-CG 3.19Å; P230-L233 PolarHBondContact O-N 3.49Å; N231-L233 PolarHBondContact O-N 3.36Å; L233-S237 PolarHBondContact O-N 3.37Å
234V67.7Low65.5Low103 Ų10365.4 Ų65.462%0.62438%0.384SS*.Hα-helixtrans-74.8-50178.8-176.50000110.4N231 N236 S237N231-V234 PolarHBondContact O-N 3.23Å; N231-V234 VanDerWaalsContact O-N 3.09Å; V234-N236 VanDerWaalsContact C-N 3.3Å; V234-N236 PolarHBondContact O-N 2.94Å; V234-S237 WeakPolarHBondContact O-CB 3.26Å; V234-S237 PolarHBondContact O-N 3.32Å
235Y62.1Low62.6Low143 Ų14368.2 Ų68.256%0.56140%0.404SS*.Hα-helixtrans-64.8-31.8-176.7-74.2-61.9000114N231 S240N231-Y235 HydrophobicContact CB-CD2 4.22Å; N231-Y235 HydrophobicContact CB-CE2 4.03Å; N231-Y235 WeakPolarHBondContact O-CD2 3.48Å; N231-Y235 PolarHBondContact O-N 2.88Å; Y235-S240 PolarHBondContact O-OG 3.21Å; Y235-S240 VanDerWaalsContact O-OG 3.07Å
236N64Low59.5Low78 Ų7876.1 Ų76.142%0.41744%0.439SS..THydrogen-bonded Turntrans-97.710.6179.9-62.8-73.3000112.9L5 M232 V234L5-N236 HydrophobicContact CD1-CB 3.49Å; L5-N236 VanDerWaalsContact CD1-CB 3.49Å; L5-N236 HydrophobicContact CG-CB 4.09Å; M232-N236 WeakPolarHBondContact O-CB 3.23Å; M232-N236 PolarHBondContact O-N 3.28Å; M232-N236 PolarHBondContact O-ND2 3.33Å; V234-N236 VanDerWaalsContact C-N 3.3Å; V234-N236 PolarHBondContact O-N 2.94Å
237S60.2Low56.6Low43 Ų4382.7 Ų82.730%0.30147%0.473SS..SBendtrans-68.5132.8170.6-1790000109.1L233 V234 S239 S240L233-S237 PolarHBondContact O-N 3.37Å; V234-S237 WeakPolarHBondContact O-CB 3.26Å; V234-S237 PolarHBondContact O-N 3.32Å; S237-S239 PolarHBondContact O-N 3.31Å; S237-S239 PolarHBondContact OG-OG 2.87Å; S237-S239 VanDerWaalsContact OG-OG 3.06Å; S237-S240 PolarHBondContact O-N 2.86Å; S237-S240 VanDerWaalsContact O-N 3.1Å; S237-S240 PolarHBondContact O-OG 2.87Å; S237-S240 VanDerWaalsContact O-OG 3.06Å
238P51.9Low53.8Low121 Ų12187.9 Ų87.979%0.78651%0.507SS*.THydrogen-bonded Turntrans-61.6-1.7-175.921.2-31000115.3
239S49.2Very low51.1Low95 Ų9596.8 Ų96.866%0.66455%0.551SS**THydrogen-bonded Turntrans-83.6-13.6173.745.30000114.7S237S237-S239 PolarHBondContact O-N 3.31Å; S237-S239 PolarHBondContact OG-OG 2.87Å; S237-S239 VanDerWaalsContact OG-OG 3.06Å
240S48Very low48.7Very low64 Ų64102 Ų10245%0.44859%0.587SS.*THydrogen-bonded Turntrans-79.9-14.5-176.756.90000114.9Y235 S237Y235-S240 PolarHBondContact O-OG 3.21Å; Y235-S240 VanDerWaalsContact O-OG 3.07Å; S237-S240 PolarHBondContact O-N 2.86Å; S237-S240 VanDerWaalsContact O-N 3.1Å; S237-S240 PolarHBondContact O-OG 2.87Å; S237-S240 VanDerWaalsContact O-OG 3.06Å
241D43.4Very low46.3Very low151 Ų151104.9 Ų104.981%0.80762%0.619SS**THydrogen-bonded Turntrans-100.914-170.2-90.4-20.7000115.4
242K41Very low44Very low186 Ų186108 Ų10881%0.80965%0.645SS**SBendtrans-114.92-174.6-75.5-166.9177.7-178.40118.4
243T34.8Very low41.8Very low114 Ų114115 Ų11570%0.69968%0.681SS**  trans-142.5103.5172.1410000110.9T245T243-T245 PolarHBondContact O-N 3.3Å
244G31.4Very low39.9Very low95 Ų95123.9 Ų123.998%0.97971%0.713SS**  trans-7055.3172.800000113.3
245T31.2Very low37.9Very low110 Ų110122.2 Ų122.268%0.67572%0.717SS**  trans-114.1114.8175.6-35.60000108.1T243 I247T243-T245 PolarHBondContact O-N 3.3Å; T245-I247 PolarHBondContact O-N 3.15Å
246Q27.8Very low36.3Very low182 Ų182123.8 Ų123.885%0.8573%0.729SS**  trans-48.5112.1171.5-63.2176-300108.9P248Q246-P248 WeakPolarHBondContact O-CD 3.46Å
247I30.3Very low34.5Very low141 Ų141127.2 Ų127.272%0.72375%0.747SS**  trans-73.1113.5169.5-60.1176.7000106.2T245 M249T245-I247 PolarHBondContact O-N 3.15Å; I247-M249 PolarHBondContact O-N 2.98Å
248P27.6Very low33.3Very low109 Ų109132.3 Ų132.371%0.70877%0.77SS**  trans-68.6134177.2-11.528000109.3Q246 S250Q246-P248 WeakPolarHBondContact O-CD 3.46Å; P248-S250 VanDerWaalsContact C-N 3.3Å; P248-S250 PolarHBondContact O-N 3.36Å
249M28.3Very low32.1Very low189 Ų189133.4 Ų133.493%0.93177%0.769SS**SBendtrans-68.784.6169.3-72.2-166.2-68.700110.1I247I247-M249 PolarHBondContact O-N 2.98Å
250S29.5Very low31.5Very low111 Ų111133.1 Ų133.178%0.77677%0.766SS**  trans-158141.7158.4-96.40000110.2P248P248-S250 VanDerWaalsContact C-N 3.3Å; P248-S250 PolarHBondContact O-N 3.36Å
251G26.4Very low30.7Very low71 Ų71138.5 Ų138.573%0.73278%0.784SS**SBendtrans-58.4165.3-165.400000115.5
252S25.4Very low30.2Very low114 Ų114141.1 Ų141.180%0.79778%0.783SS**  trans77.397.6179.976.40000114.6
253I26.7Very low30.3Very low155 Ų155133.2 Ų133.280%0.79575%0.751SS**  trans159.686.3144.9-75.5151.6000106
254Y30.5Very low30.7Very low227 Ų227132.1 Ų132.189%0.8974%0.74SS**  trans-142.566.8150.3-91.9-76.3000105.9
255G26.6Very low31.1Very low68 Ų68136.9 Ų136.970%0.70173%0.734SS**  trans-96.9105.4156.500000107
256E28.6Very low31.7Very low176 Ų176135.9 Ų135.982%0.82273%0.725SS**SBendtrans169.697.9142.3-99.2-177150.300109.1I258E256-I258 PolarHBondContact O-N 3.48Å
257N26.5Very low32.8Very low150 Ų150128.4 Ų128.480%0.80270%0.696SS**  trans42.271.6136.2-56.2-25.6000117.8
258I34.1Very low33.9Very low149 Ų149122.6 Ų122.676%0.76467%0.667SS**  trans-106.6130.1139.3-62.9174.1000104.9E256 C260E256-I258 PolarHBondContact O-N 3.48Å; I258-C260 PolarHBondContact O-N 3.03Å
259D27.7Very low35.3Very low144 Ų144124.8 Ų124.877%0.7766%0.661SS**SBendtrans-53.744.5-170.2-66.2-50.4000117.6E261 R262D259-E261 VanDerWaalsContact C-N 3.28Å; D259-E261 PolarHBondContact O-N 2.99Å; D259-R262 PolarHBondContact O-N 3.5Å
260C35.5Very low36.6Very low89 Ų89118 Ų11860%0.60163%0.631SS**G310 helixtrans-70.5-23.4173.6-71.90000112I258 R262 S263 D264I258-C260 PolarHBondContact O-N 3.03Å; C260-R262 PolarHBondContact O-N 3.47Å; C260-S263 WeakPolarHBondContact O-CB 3.31Å; C260-S263 PolarHBondContact O-N 2.92Å; C260-D264 PolarHBondContact O-N 3.42Å
261E31.1Very low37.8Very low178 Ų178113.8 Ų113.883%0.83260%0.599SS**G310 helixtrans-65.4-23.1175.3-79.9-169.6149.800112.9D259D259-E261 VanDerWaalsContact C-N 3.28Å; D259-E261 PolarHBondContact O-N 2.99Å
262R33.1Very low39.2Very low206 Ų206112.3 Ų112.378%0.77757%0.574SS**G310 helixtrans-83.4-15.6172.7-132.4175-173.4175.42.2113.1R22 D259 C260R22-R262 PolarHBondContact NH2-O 3.15Å; D259-R262 PolarHBondContact O-N 3.5Å; C260-R262 PolarHBondContact O-N 3.47Å
263S43.7Very low40.5Very low20 Ų20111.1 Ų111.114%0.1457%0.566CS.*THydrogen-bonded Turntrans-79.3-21.5174.5-156.80000112.5C260 K265 D266 L268C260-S263 WeakPolarHBondContact O-CB 3.31Å; C260-S263 PolarHBondContact O-N 2.92Å; S263-K265 VanDerWaalsContact C-N 3.26Å; S263-K265 PolarHBondContact O-N 3.46Å; S263-D266 PolarHBondContact O-N 3.49Å; S263-D266 VanDerWaalsContact O-N 3.14Å; S263-L268 PolarHBondContact OG-O 3.06Å
264D42.3Very low41.7Very low90 Ų90109.7 Ų109.748%0.48156%0.56SS.*THydrogen-bonded Turntrans-70.5-16.8-172.6-108.31.1000114.7C260 R269C260-D264 PolarHBondContact O-N 3.42Å; D264-R269 IonicContact OD1-CZ 2.67Å; D264-R269 IonicContact OD1-NE 2.7Å; D264-R269 PolarHBondContact OD1-NE 2.81Å; D264-R269 IonicContact OD1-NH2 3.9Å; D264-R269 PolarHBondContact OD1-NH2 3.26Å; D264-R269 IonicContact OD2-NH2 3.22Å; D264-R269 PolarHBondContact OD2-NH2 3.3Å
265K40.2Very low42.8Very low196 Ų19699.4 Ų99.485%0.85252%0.521SS*.THydrogen-bonded Turntrans-81.8-16.9173.3-69.8-169.2176.9-177.40114.3S263S263-K265 VanDerWaalsContact C-N 3.26Å; S263-K265 PolarHBondContact O-N 3.46Å
266D44.3Very low44.1Very low88 Ų88103.7 Ų103.747%0.47152%0.523SS..THydrogen-bonded Turntrans-118.46.5-168.5-65.5-30.2000114.4R22 S263 L268R22-D266 IonicContact CZ-OD2 3.08Å; R22-D266 IonicContact NH1-OD2 2.73Å; R22-D266 PolarHBondContact NH1-OD2 3.42Å; R22-D266 IonicContact NH2-OD2 2.69Å; R22-D266 PolarHBondContact NH2-OD2 3.4Å; S263-D266 PolarHBondContact O-N 3.49Å; S263-D266 VanDerWaalsContact O-N 3.14Å; D266-L268 PolarHBondContact O-N 2.97Å
267G50Low45.5Very low25 Ų2599.9 Ų99.926%0.25852%0.521SS..THydrogen-bonded Turntrans72.78.7170.800000116R269G267-R269 PolarHBondContact O-N 3.37Å
268L53.8Low47.6Very low19 Ų1993.8 Ų93.810%0.09949%0.489CS..  trans-82.381.3170.7-96.776.5000109.8F21 R22 A25 W169 S263 D266F21-L268 HydrophobicContact CD1-CD2 3.94Å; F21-L268 HydrophobicContact CE1-CB 4.16Å; F21-L268 HydrophobicContact CE1-CD2 3.83Å; F21-L268 HydrophobicContact CE1-CG 4.33Å; R22-L268 HydrophobicContact CG-CD2 4.19Å; A25-L268 HydrophobicContact CB-CD2 3.92Å; W169-L268 HydrophobicContact CE3-CD1 3.91Å; W169-L268 HydrophobicContact CE3-CG 4.43Å; W169-L268 HydrophobicContact CH2-CD1 4.21Å; W169-L268 HydrophobicContact CZ3-CD1 3.62Å; W169-L268 HydrophobicContact CZ3-CG 4.49Å; S263-L268 PolarHBondContact OG-O 3.06Å; D266-L268 PolarHBondContact O-N 2.97Å
269R57.3Low50Low156 Ų15696.3 Ų96.359%0.58949%0.49SS*.  trans-108126.8161.1-70.9-174.8179.4-169.6-1.3108.4G170 D264 G267 L271G170-R269 WeakPolarHBondContact CA-O 3.33Å; D264-R269 IonicContact OD1-CZ 2.67Å; D264-R269 IonicContact OD1-NE 2.7Å; D264-R269 PolarHBondContact OD1-NE 2.81Å; D264-R269 IonicContact OD1-NH2 3.9Å; D264-R269 PolarHBondContact OD1-NH2 3.26Å; D264-R269 IonicContact OD2-NH2 3.22Å; D264-R269 PolarHBondContact OD2-NH2 3.3Å; G267-R269 PolarHBondContact O-N 3.37Å; R269-L271 PolarHBondContact O-N 3.36Å
270P55.9Low52.6Low47 Ų4791.9 Ų91.931%0.30547%0.468SS..  trans-57.9127.4173.522.5-30.3000109.3P230 I272P230-P270 HydrophobicContact CG-CB 4.14Å; P270-I272 PolarHBondContact O-N 2.92Å
271L54.6Low55Low21 Ų2187.9 Ų87.911%0.1144%0.441CS..SBendtrans-68-17.7-170.2-72.2175.5000114G166 W169 K171 R269 T426G166-L271 WeakPolarHBondContact O-CB 3.36Å; G166-L271 WeakPolarHBondContact O-CD1 3.48Å; W169-L271 WeakPolarHBondContact O-CD1 3.45Å; W169-L271 WeakPolarHBondContact O-CG 3.27Å; K171-L271 HydrophobicContact CG-CD2 3.75Å; R269-L271 PolarHBondContact O-N 3.36Å; L271-T426 HydrophobicContact CD1-CG2 4.16Å
272I55.7Low57.6Low40 Ų4081.6 Ų81.621%0.20542%0.417CS..  trans-130.683.6-171.4-48.5179.8000108.6H229 P270 N274 T275H229-I272 PolarHBondContact CE1-O 3.42Å; H229-I272 PolarHBondContact NE2-O 2.87Å; P270-I272 PolarHBondContact O-N 2.92Å; I272-N274 VanDerWaalsContact C-N 3.31Å; I272-N274 PolarHBondContact O-N 3.5Å; I272-T275 HydrophobicContact CG2-CG2 3.75Å
273S51.4Low60.1Low89 Ų8975.6 Ų75.662%0.62240%0.396SS*.SBendtrans-75.8-13.5-17757.90000114.3
274N52Low62.3Low125 Ų12580.2 Ų80.267%0.66842%0.418SS*.  trans-145.479.7175.9-85.1-33.6000111.1I272I272-N274 VanDerWaalsContact C-N 3.31Å; I272-N274 PolarHBondContact O-N 3.5Å
275T53.9Low64.5Low12 Ų1281.2 Ų81.27%0.07442%0.42CS..  trans-67.3-40.6-177.7-15.50000110.7I272 A277 T278 R435I272-T275 HydrophobicContact CG2-CG2 3.75Å; T275-A277 VanDerWaalsContact C-N 3.3Å; T275-A277 PolarHBondContact O-N 2.98Å; T275-A277 VanDerWaalsContact O-N 3.08Å; T275-T278 PolarHBondContact O-N 3.27Å; T275-T278 PolarHBondContact O-OG1 3.31Å; T275-T278 VanDerWaalsContact O-OG1 3.12Å; T275-R435 VanDerWaalsContact CG2-NE 3.25Å; T275-R435 PolarHBondContact O-NE 3.25Å; T275-R435 PolarHBondContact O-NH2 2.74Å
276E54.7Low66.8Low158 Ų15871.9 Ų71.974%0.73838%0.38SS*.THydrogen-bonded Turntrans-63.7-22.3-163-64.2-168.4164.900116.2
277A58.2Low69Low95 Ų9570 Ų7079%0.78537%0.369SS*.THydrogen-bonded Turntrans-96.7-10.5-17600000115.7T275T275-A277 VanDerWaalsContact C-N 3.3Å; T275-A277 PolarHBondContact O-N 2.98Å; T275-A277 VanDerWaalsContact O-N 3.08Å
278T71Confident71Confident22 Ų2275.1 Ų75.114%0.13539%0.39CS..PPolyproline II helixtrans-93.9137.1-17156.90000112.7T275 R435T275-T278 PolarHBondContact O-N 3.27Å; T275-T278 PolarHBondContact O-OG1 3.31Å; T275-T278 VanDerWaalsContact O-OG1 3.12Å; T278-R435 WeakPolarHBondContact OG1-CG 3.5Å; T278-R435 PolarHBondContact OG1-NE 3.02Å
279R82.7Confident72.6Confident203 Ų20375.6 Ų75.677%0.76639%0.392SS*.EExtended strand (participates in β ladder)trans-74.2141.6176.9-66.3-178.9179.7-179.5-0.4111.1T434 R435R279-T434 CarbonylContact O-C 3.39Å; R279-T434 WeakPolarHBondContact O-CA 3.22Å; R279-T434 VanDerWaalsContact O-CB 3.28Å; R279-T434 WeakPolarHBondContact O-CB 3.39Å; R279-R435 PolarHBondContact O-N 3.09Å
280P82.2Confident74.1Confident50 Ų5070.8 Ų70.833%0.32538%0.381SS..EExtended strand (participates in β ladder)trans-65.3141.2169.828.1-33.3000110E107E107-P280 WeakPolarHBondContact OE2-CB 3.41Å
281I86.1Confident75.8Confident5 Ų568.8 Ų68.83%0.02637%0.368CS..PPolyproline II helixtrans-66.5146.8177.5-163.5168000110.6E285 A286 L289 L430 R435 A436 T439I281-E285 HydrophobicContact CD1-CB 4.27Å; I281-E285 HydrophobicContact CG1-CB 3.9Å; I281-A286 HydrophobicContact CD1-CB 3.94Å; I281-A286 HydrophobicContact CG1-CB 4.26Å; I281-A286 HydrophobicContact CG2-CB 4.11Å; I281-L289 HydrophobicContact CD1-CD1 3.87Å; I281-L430 HydrophobicContact CD1-CD2 4.33Å; I281-R435 PolarHBondContact N-O 3.13Å; I281-A436 HydrophobicContact CB-CB 3.93Å; I281-A436 HydrophobicContact CD1-CB 3.97Å; I281-A436 HydrophobicContact CG2-CB 3.63Å; I281-T439 HydrophobicContact CG2-CG2 3.91Å
282S87.2Confident77.6Confident46 Ų4667.8 Ų67.832%0.32236%0.363SS..PPolyproline II helixtrans-78.2156.9169.372.90000111.4I284 E285 A286S282-I284 PolarHBondContact O-N 3.11Å; S282-E285 WeakPolarHBondContact CB-OE2 3.21Å; S282-E285 PolarHBondContact N-OE2 3.45Å; S282-E285 VanDerWaalsContact N-OE2 3.08Å; S282-E285 PolarHBondContact O-N 3.46Å; S282-E285 VanDerWaalsContact OG-CB 3.3Å; S282-E285 WeakPolarHBondContact OG-CB 3.47Å; S282-E285 WeakPolarHBondContact OG-CG 3.24Å; S282-E285 PolarHBondContact OG-N 2.99Å; S282-E285 PolarHBondContact OG-OE2 3.5Å; S282-A286 WeakPolarHBondContact O-CB 3.36Å; S282-A286 PolarHBondContact O-N 3.33Å
283F85.7Confident79.5Confident81 Ų8170.8 Ų70.836%0.35538%0.375SS..Hα-helixtrans-60.8-44.3-179.7176.2-101.9000112.9I100 A286 I287 I443I100-F283 HydrophobicContact CB-CE2 4.36Å; I100-F283 HydrophobicContact CD1-CE2 4.26Å; I100-F283 HydrophobicContact CD1-CZ 4.34Å; I100-F283 HydrophobicContact CG1-CE2 4.27Å; I100-F283 HydrophobicContact CG2-CD2 3.66Å; I100-F283 HydrophobicContact CG2-CE2 3.24Å; I100-F283 HydrophobicContact CG2-CZ 4.03Å; F283-A286 PolarHBondContact O-N 2.85Å; F283-I287 HydrophobicContact CD1-CD1 4.13Å; F283-I287 HydrophobicContact CD2-CD1 4.47Å; F283-I287 HydrophobicContact CE1-CD1 3.42Å; F283-I287 VanDerWaalsContact CE1-CD1 3.42Å; F283-I287 HydrophobicContact CE1-CG1 4.48Å; F283-I287 HydrophobicContact CE2-CD1 3.8Å; F283-I287 HydrophobicContact CE2-CG1 4.43Å; F283-I287 HydrophobicContact CZ-CD1 3.24Å; F283-I287 HydrophobicContact CZ-CG1 4.29Å; F283-I287 PolarHBondContact O-N 3.46Å; F283-I443 HydrophobicContact CD2-CD1 3.92Å; F283-I443 HydrophobicContact CD2-CG1 3.92Å; F283-I443 HydrophobicContact CE2-CD1 4.13Å; F283-I443 HydrophobicContact CE2-CG1 3.7Å
284I88.6Confident81.6Confident117 Ų11767 Ų6760%0.635%0.348SS*.Hα-helixtrans-65.9-45.5-178.9-63.2175.1000110.3S282 A286 I287 L288S282-I284 PolarHBondContact O-N 3.11Å; I284-A286 VanDerWaalsContact C-N 3.27Å; I284-A286 PolarHBondContact O-N 3.42Å; I284-I287 PolarHBondContact O-N 2.96Å; I284-L288 HydrophobicContact CG2-CD1 3.7Å; I284-L288 HydrophobicContact CG2-CG 4.31Å; I284-L288 WeakPolarHBondContact O-CB 3.2Å; I284-L288 VanDerWaalsContact O-CG 3.26Å; I284-L288 WeakPolarHBondContact O-CG 3.17Å; I284-L288 PolarHBondContact O-N 3.3Å
285E88.8Confident83.8Confident111 Ų11161 Ų6152%0.51932%0.316SS..Hα-helixtrans-58.2-42.6175.1-72.2166156.100111.2I281 S282 L288 L289I281-E285 HydrophobicContact CD1-CB 4.27Å; I281-E285 HydrophobicContact CG1-CB 3.9Å; S282-E285 WeakPolarHBondContact CB-OE2 3.21Å; S282-E285 PolarHBondContact N-OE2 3.45Å; S282-E285 VanDerWaalsContact N-OE2 3.08Å; S282-E285 PolarHBondContact O-N 3.46Å; S282-E285 VanDerWaalsContact OG-CB 3.3Å; S282-E285 WeakPolarHBondContact OG-CB 3.47Å; S282-E285 WeakPolarHBondContact OG-CG 3.24Å; S282-E285 PolarHBondContact OG-N 2.99Å; S282-E285 PolarHBondContact OG-OE2 3.5Å; E285-L288 PolarHBondContact O-N 3.39Å; E285-L289 WeakPolarHBondContact O-CG 3.44Å; E285-L289 PolarHBondContact O-N 3.34Å
286A89.5Confident85.8Confident0 Ų060.6 Ų60.60%031%0.313CS..Hα-helixtrans-65-40.2-179.500000113.2I281 S282 F283 I284 L289 V292 T439 I440 I443I281-A286 HydrophobicContact CD1-CB 3.94Å; I281-A286 HydrophobicContact CG1-CB 4.26Å; I281-A286 HydrophobicContact CG2-CB 4.11Å; S282-A286 WeakPolarHBondContact O-CB 3.36Å; S282-A286 PolarHBondContact O-N 3.33Å; F283-A286 PolarHBondContact O-N 2.85Å; I284-A286 VanDerWaalsContact C-N 3.27Å; I284-A286 PolarHBondContact O-N 3.42Å; A286-L289 WeakPolarHBondContact O-CB 3.23Å; A286-L289 PolarHBondContact O-N 2.92Å; A286-V292 WeakPolarHBondContact O-CG1 3.23Å; A286-T439 HydrophobicContact CB-CG2 4.15Å; A286-I440 HydrophobicContact CB-CG1 4.02Å; A286-I443 HydrophobicContact CB-CD1 3.39Å
287I90.1Very high87.9Confident47 Ų4755 Ų5524%0.24129%0.288CS..Hα-helixtrans-68.4-39.8176.1-74-177.9000111.9F283 I284 L289 F293 I443F283-I287 HydrophobicContact CD1-CD1 4.13Å; F283-I287 HydrophobicContact CD2-CD1 4.47Å; F283-I287 HydrophobicContact CE1-CD1 3.42Å; F283-I287 VanDerWaalsContact CE1-CD1 3.42Å; F283-I287 HydrophobicContact CE1-CG1 4.48Å; F283-I287 HydrophobicContact CE2-CD1 3.8Å; F283-I287 HydrophobicContact CE2-CG1 4.43Å; F283-I287 HydrophobicContact CZ-CD1 3.24Å; F283-I287 HydrophobicContact CZ-CG1 4.29Å; F283-I287 PolarHBondContact O-N 3.46Å; I284-I287 PolarHBondContact O-N 2.96Å; I287-L289 PolarHBondContact O-N 3.3Å; I287-F293 HydrophobicContact CG2-CD2 4.27Å; I287-I443 HydrophobicContact CD1-CG2 4.38Å; I287-I443 HydrophobicContact CG1-CD1 3.94Å; I287-I443 HydrophobicContact CG1-CG1 4.33Å; I287-I443 HydrophobicContact CG1-CG2 3.77Å
288L91.2Very high89.8Confident134 Ų13450.5 Ų50.570%0.70225%0.251SS*.Hα-helixtrans-72.9-8.6-178.8-68.3176000113I284 E285I284-L288 HydrophobicContact CG2-CD1 3.7Å; I284-L288 HydrophobicContact CG2-CG 4.31Å; I284-L288 WeakPolarHBondContact O-CB 3.2Å; I284-L288 VanDerWaalsContact O-CG 3.26Å; I284-L288 WeakPolarHBondContact O-CG 3.17Å; I284-L288 PolarHBondContact O-N 3.3Å; E285-L288 PolarHBondContact O-N 3.39Å
289L88.7Confident91Very high28 Ų2849.4 Ų49.415%0.14725%0.245CC..SBendtrans-60140.6175.2-78.5170.6000111.2I281 E285 A286 I287 S291 V292 L430 I440I281-L289 HydrophobicContact CD1-CD1 3.87Å; E285-L289 WeakPolarHBondContact O-CG 3.44Å; E285-L289 PolarHBondContact O-N 3.34Å; A286-L289 WeakPolarHBondContact O-CB 3.23Å; A286-L289 PolarHBondContact O-N 2.92Å; I287-L289 PolarHBondContact O-N 3.3Å; L289-S291 PolarHBondContact O-N 3.42Å; L289-V292 HydrophobicContact CB-CB 4.35Å; L289-V292 HydrophobicContact CB-CG2 3.57Å; L289-V292 HydrophobicContact CD1-CG2 4.46Å; L289-V292 PolarHBondContact O-N 3.02Å; L289-L430 HydrophobicContact CD1-CD1 3.87Å; L289-L430 HydrophobicContact CD1-CD2 4.29Å; L289-L430 HydrophobicContact CD2-CD2 4.22Å; L289-I440 HydrophobicContact CD1-CD1 3.45Å; L289-I440 VanDerWaalsContact CD1-CD1 3.45Å; L289-I440 HydrophobicContact CD1-CG1 4.28Å
290P87.4Confident91.8Very high55 Ų5541.4 Ų41.436%0.35722%0.215SC..THydrogen-bonded Turntrans-54.6130-179.1-21.930.7000111.7V292 R495P290-V292 PolarHBondContact O-N 3Å; P290-V292 VanDerWaalsContact O-N 3.17Å; P290-R495 VanDerWaalsContact CB-CZ 3.48Å
291S91.1Very high92.5Very high6 Ų640.9 Ų40.94%0.04221%0.208CC..THydrogen-bonded Turntrans73.6-14.3177.1-46.80000116.5L289 T294 Y295 R495L289-S291 PolarHBondContact O-N 3.42Å; S291-T294 WeakPolarHBondContact CA-OG1 3.43Å; S291-T294 PolarHBondContact O-N 3.06Å; S291-T294 PolarHBondContact O-OG1 2.93Å; S291-T294 VanDerWaalsContact O-OG1 3.13Å; S291-Y295 WeakPolarHBondContact O-CB 3.42Å; S291-Y295 VanDerWaalsContact O-CD2 3.24Å; S291-Y295 WeakPolarHBondContact O-CD2 3.36Å; S291-Y295 PolarHBondContact O-N 2.9Å; S291-R495 PolarHBondContact OG-NH1 3.33Å
292V94Very high93Very high0 Ų040.7 Ų40.70%021%0.207CC..Hα-helixtrans-59-54.5177.8175.10000110.5A286 L289 P290 T294 Y295 S296 L424 I440 I443 I444A286-V292 WeakPolarHBondContact O-CG1 3.23Å; L289-V292 HydrophobicContact CB-CB 4.35Å; L289-V292 HydrophobicContact CB-CG2 3.57Å; L289-V292 HydrophobicContact CD1-CG2 4.46Å; L289-V292 PolarHBondContact O-N 3.02Å; P290-V292 PolarHBondContact O-N 3Å; P290-V292 VanDerWaalsContact O-N 3.17Å; V292-T294 VanDerWaalsContact C-N 3.34Å; V292-T294 PolarHBondContact O-N 3.38Å; V292-Y295 PolarHBondContact O-N 3.34Å; V292-S296 WeakPolarHBondContact O-CB 3.41Å; V292-S296 PolarHBondContact O-N 2.93Å; V292-S296 PolarHBondContact O-OG 3.3Å; V292-L424 HydrophobicContact CG2-CB 4.23Å; V292-L424 HydrophobicContact CG2-CD1 4.1Å; V292-I440 HydrophobicContact CG1-CG2 4.47Å; V292-I440 HydrophobicContact CG2-CG2 4.27Å; V292-I443 HydrophobicContact CG1-CG2 4.13Å; V292-I444 HydrophobicContact CG1-CD1 4.4Å; V292-I444 HydrophobicContact CG1-CG1 4.18Å
293F95Very high93.5Very high102 Ų10238.5 Ų38.545%0.44719%0.192SC..Hα-helixtrans-59.3-42.2-179-177.7-107.3000112.9I287 S296 L297I287-F293 HydrophobicContact CG2-CD2 4.27Å; F293-S296 VanDerWaalsContact O-CB 3.26Å; F293-S296 WeakPolarHBondContact O-CB 3.28Å; F293-S296 PolarHBondContact O-N 3.13Å; F293-L297 HydrophobicContact CD1-CD1 4.17Å; F293-L297 HydrophobicContact CE1-CD1 3.58Å; F293-L297 HydrophobicContact CE1-CG 4.21Å; F293-L297 HydrophobicContact CZ-CD1 3.96Å; F293-L297 HydrophobicContact CZ-CD2 4.46Å; F293-L297 HydrophobicContact CZ-CG 4.25Å; F293-L297 PolarHBondContact O-N 3.38Å
294T96Very high94Very high10 Ų1035 Ų356%0.06118%0.177CC..Hα-helixtrans-75.1-33.4-177.852.90000113.5S291 V292 S296 L297 L298 W487S291-T294 WeakPolarHBondContact CA-OG1 3.43Å; S291-T294 PolarHBondContact O-N 3.06Å; S291-T294 PolarHBondContact O-OG1 2.93Å; S291-T294 VanDerWaalsContact O-OG1 3.13Å; V292-T294 VanDerWaalsContact C-N 3.34Å; V292-T294 PolarHBondContact O-N 3.38Å; T294-S296 VanDerWaalsContact C-N 3.28Å; T294-L297 PolarHBondContact O-N 3.24Å; T294-L298 PolarHBondContact O-N 2.97Å; T294-W487 HydrophobicContact CG2-CD2 4.03Å; T294-W487 HydrophobicContact CG2-CE3 3.48Å; T294-W487 VanDerWaalsContact CG2-CE3 3.48Å; T294-W487 HydrophobicContact CG2-CH2 3.33Å; T294-W487 HydrophobicContact CG2-CZ2 3.84Å; T294-W487 HydrophobicContact CG2-CZ3 3.15Å; T294-W487 VanDerWaalsContact OG1-CZ3 3.24Å; T294-W487 WeakPolarHBondContact OG1-CZ3 3.48Å
295Y97.2Very high94.4Very high0 Ų029.4 Ų29.40%015%0.148CC..Hα-helixtrans-67.6-32.3167.6-86.4-66000112.1S291 V292 L297 L298 L299 I366 A370 V416 V420 L424 I488S291-Y295 WeakPolarHBondContact O-CB 3.42Å; S291-Y295 VanDerWaalsContact O-CD2 3.24Å; S291-Y295 WeakPolarHBondContact O-CD2 3.36Å; S291-Y295 PolarHBondContact O-N 2.9Å; V292-Y295 PolarHBondContact O-N 3.34Å; Y295-L297 VanDerWaalsContact C-N 3.34Å; Y295-L298 HydrophobicContact CD1-CD1 4.34Å; Y295-L298 PolarHBondContact O-N 3.31Å; Y295-L299 WeakPolarHBondContact O-CB 3.48Å; Y295-L299 PolarHBondContact O-N 2.92Å; Y295-I366 HydrophobicContact CE2-CG2 3.89Å; Y295-I366 PolarHBondContact OH-O 3.39Å; Y295-A370 PolarHBondContact OH-N 3Å; Y295-V416 HydrophobicContact CD1-CG1 4.07Å; Y295-V416 HydrophobicContact CD1-CG2 4.11Å; Y295-V416 HydrophobicContact CE1-CG2 4.35Å; Y295-V420 HydrophobicContact CD1-CG1 3.7Å; Y295-V420 HydrophobicContact CD1-CG2 4.46Å; Y295-V420 HydrophobicContact CD2-CG1 3.58Å; Y295-V420 HydrophobicContact CE1-CG1 3.77Å; Y295-V420 HydrophobicContact CE1-CG2 3.99Å; Y295-V420 HydrophobicContact CE2-CG1 3.64Å; Y295-V420 HydrophobicContact CG-CG1 3.59Å; Y295-L424 HydrophobicContact CD2-CD1 3.81Å; Y295-L424 HydrophobicContact CE2-CD1 4.47Å; Y295-L424 HydrophobicContact CG-CD1 4.45Å; Y295-I488 HydrophobicContact CD1-CD1 3.65Å; Y295-I488 HydrophobicContact CD2-CD1 3.99Å; Y295-I488 HydrophobicContact CE1-CD1 3.74Å; Y295-I488 HydrophobicContact CE2-CD1 4.08Å; Y295-I488 HydrophobicContact CE2-CG2 3.92Å; Y295-I488 HydrophobicContact CG-CD1 3.8Å
296S97Very high94.8Very high2 Ų224.5 Ų24.51%0.01413%0.126CC..Hα-helixtrans-63.1-41.4173.7-54.80000111V292 F293 T294 L299 F300 I444 M447V292-S296 WeakPolarHBondContact O-CB 3.41Å; V292-S296 PolarHBondContact O-N 2.93Å; V292-S296 PolarHBondContact O-OG 3.3Å; F293-S296 VanDerWaalsContact O-CB 3.26Å; F293-S296 WeakPolarHBondContact O-CB 3.28Å; F293-S296 PolarHBondContact O-N 3.13Å; T294-S296 VanDerWaalsContact C-N 3.28Å; S296-L299 PolarHBondContact O-N 3.42Å; S296-F300 WeakPolarHBondContact O-CB 3.42Å; S296-F300 PolarHBondContact O-N 3.35Å; S296-I444 WeakPolarHBondContact OG-CG1 3.16Å; S296-M447 WeakPolarHBondContact O-CG 3.48Å
297L97.3Very high95Very high41 Ų4124.7 Ų24.722%0.21513%0.127CC..Hα-helixtrans-68.4-40.4173.1-70.2178.3000113.1F293 T294 Y295 L299 F300 F301 M484F293-L297 HydrophobicContact CD1-CD1 4.17Å; F293-L297 HydrophobicContact CE1-CD1 3.58Å; F293-L297 HydrophobicContact CE1-CG 4.21Å; F293-L297 HydrophobicContact CZ-CD1 3.96Å; F293-L297 HydrophobicContact CZ-CD2 4.46Å; F293-L297 HydrophobicContact CZ-CG 4.25Å; F293-L297 PolarHBondContact O-N 3.38Å; T294-L297 PolarHBondContact O-N 3.24Å; Y295-L297 VanDerWaalsContact C-N 3.34Å; L297-L299 VanDerWaalsContact C-N 3.3Å; L297-L299 PolarHBondContact O-N 3.48Å; L297-F300 WeakPolarHBondContact O-CB 3.18Å; L297-F300 PolarHBondContact O-N 2.89Å; L297-F301 WeakPolarHBondContact O-CD2 3.32Å; L297-F301 PolarHBondContact O-N 2.68Å; L297-F301 VanDerWaalsContact O-N 3.15Å; L297-M484 HydrophobicContact CB-CG 4.06Å; L297-M484 HydrophobicContact CB-SD 4.03Å; L297-M484 HydrophobicContact CD1-SD 4.01Å
298L98Very high95.3Very high0 Ų022.7 Ų22.70%012%0.117CC..Hα-helixtrans-59.4-44.8172.9-174.7164.5000110.4T294 Y295 F301 T302 C373 V416 M484 I488T294-L298 PolarHBondContact O-N 2.97Å; Y295-L298 HydrophobicContact CD1-CD1 4.34Å; Y295-L298 PolarHBondContact O-N 3.31Å; L298-F301 PolarHBondContact O-N 3.26Å; L298-T302 HydrophobicContact CD2-CG2 3.96Å; L298-T302 WeakPolarHBondContact O-CG2 3.42Å; L298-T302 PolarHBondContact O-N 2.71Å; L298-T302 PolarHBondContact O-OG1 3.13Å; L298-C373 HydrophobicContact CD1-CB 4.42Å; L298-V416 HydrophobicContact CD2-CG2 3.66Å; L298-M484 HydrophobicContact CB-CB 3.89Å; L298-M484 HydrophobicContact CG-CB 4.47Å; L298-I488 HydrophobicContact CD1-CD1 4.11Å
299L97.8Very high95.3Very high0 Ų016.8 Ų16.80%09%0.085CC..Hα-helixtrans-65.6-38176.5-16958.6000112.1Y295 S296 L297 F301 T302 K303 Y413 V416 I444Y295-L299 WeakPolarHBondContact O-CB 3.48Å; Y295-L299 PolarHBondContact O-N 2.92Å; S296-L299 PolarHBondContact O-N 3.42Å; L297-L299 VanDerWaalsContact C-N 3.3Å; L297-L299 PolarHBondContact O-N 3.48Å; L299-F301 PolarHBondContact O-N 3.39Å; L299-T302 WeakPolarHBondContact CA-OG1 3.07Å; L299-T302 PolarHBondContact O-N 2.92Å; L299-T302 PolarHBondContact O-OG1 3.43Å; L299-K303 HydrophobicContact CD1-CB 4.47Å; L299-K303 WeakPolarHBondContact O-CB 3.15Å; L299-K303 PolarHBondContact O-N 3.24Å; L299-Y413 HydrophobicContact CD1-CD2 3.73Å; L299-Y413 HydrophobicContact CD1-CE2 4.44Å; L299-V416 HydrophobicContact CB-CG1 3.84Å; L299-V416 HydrophobicContact CD1-CB 4.24Å; L299-V416 HydrophobicContact CD1-CG1 4.26Å; L299-V416 HydrophobicContact CD2-CG1 4.35Å; L299-V416 HydrophobicContact CG-CG1 4.37Å; L299-I444 HydrophobicContact CB-CG2 4.45Å; L299-I444 HydrophobicContact CD2-CG2 3.55Å; L299-I444 WeakPolarHBondContact CD2-O 3.35Å
300F97.8Very high95.4Very high35 Ų3515.7 Ų15.715%0.1548%0.08CC..Hα-helixtrans-52-55174.1177.3-79.5000110.9S296 L297 L304 M447 L450 G451 L454S296-F300 WeakPolarHBondContact O-CB 3.42Å; S296-F300 PolarHBondContact O-N 3.35Å; L297-F300 WeakPolarHBondContact O-CB 3.18Å; L297-F300 PolarHBondContact O-N 2.89Å; F300-L304 HydrophobicContact CE1-CD1 4.27Å; F300-L304 WeakPolarHBondContact O-CB 3.31Å; F300-L304 PolarHBondContact O-N 3.44Å; F300-M447 HydrophobicContact CB-CG 4.25Å; F300-M447 HydrophobicContact CD2-CG 4.45Å; F300-M447 WeakPolarHBondContact CD2-O 3.43Å; F300-M447 HydrophobicContact CD2-SD 4.1Å; F300-L450 HydrophobicContact CD2-CB 4.1Å; F300-L450 HydrophobicContact CE2-CB 3.9Å; F300-G451 VanDerWaalsContact CD2-CA 3.48Å; F300-G451 VanDerWaalsContact CE2-CA 3.42Å; F300-L454 HydrophobicContact CE1-CD2 4.41Å; F300-L454 HydrophobicContact CZ-CD2 3.86Å
301F97.9Very high95.5Very high38 Ų3813.2 Ų13.217%0.1676%0.063CC..Hα-helixtrans-72.1-37.5-175.8-69.8-60.6000113.3L297 L298 L299 L304 V305 S477 L480 A481 M484L297-F301 WeakPolarHBondContact O-CD2 3.32Å; L297-F301 PolarHBondContact O-N 2.68Å; L297-F301 VanDerWaalsContact O-N 3.15Å; L298-F301 PolarHBondContact O-N 3.26Å; L299-F301 PolarHBondContact O-N 3.39Å; F301-L304 WeakPolarHBondContact O-CB 3.18Å; F301-V305 WeakPolarHBondContact O-CG2 2.94Å; F301-V305 PolarHBondContact O-N 3.13Å; F301-S477 WeakPolarHBondContact CA-OG 3.17Å; F301-S477 WeakPolarHBondContact CB-O 3.45Å; F301-S477 PolarHBondContact O-OG 3.22Å; F301-L480 HydrophobicContact CD1-CB 3.92Å; F301-L480 HydrophobicContact CD1-CD1 4.05Å; F301-L480 HydrophobicContact CD2-CB 3.85Å; F301-L480 HydrophobicContact CE1-CB 3.95Å; F301-L480 HydrophobicContact CE1-CD1 3.49Å; F301-L480 VanDerWaalsContact CE1-CD1 3.49Å; F301-L480 HydrophobicContact CE1-CG 4.35Å; F301-L480 HydrophobicContact CE2-CB 3.88Å; F301-L480 HydrophobicContact CG-CB 3.89Å; F301-L480 HydrophobicContact CZ-CB 3.93Å; F301-L480 HydrophobicContact CZ-CD1 3.81Å; F301-L480 HydrophobicContact CZ-CG 4.4Å; F301-A481 HydrophobicContact CB-CB 3.75Å; F301-M484 HydrophobicContact CD2-CG 4.39Å; F301-M484 HydrophobicContact CE2-CG 4.47Å
302T97.3Very high95.6Very high1 Ų113.1 Ų13.11%0.0066%0.062CC..Hα-helixtrans-70-40.9176.751.50000112.4L298 L299 L304 V305 S306 L377 P412 A481L298-T302 HydrophobicContact CD2-CG2 3.96Å; L298-T302 WeakPolarHBondContact O-CG2 3.42Å; L298-T302 PolarHBondContact O-N 2.71Å; L298-T302 PolarHBondContact O-OG1 3.13Å; L299-T302 WeakPolarHBondContact CA-OG1 3.07Å; L299-T302 PolarHBondContact O-N 2.92Å; L299-T302 PolarHBondContact O-OG1 3.43Å; T302-L304 VanDerWaalsContact C-N 3.33Å; T302-V305 PolarHBondContact O-N 3.41Å; T302-S306 WeakPolarHBondContact O-CB 3.36Å; T302-S306 PolarHBondContact O-N 2.8Å; T302-L377 HydrophobicContact CG2-CD1 4.32Å; T302-L377 HydrophobicContact CG2-CD2 3.69Å; T302-P412 HydrophobicContact CG2-CB 4.21Å; T302-A481 HydrophobicContact CG2-CB 3.63Å
303K96.7Very high95.5Very high0 Ų013.4 Ų13.40%06%0.063CC..Hα-helixtrans-70.8-30177.2-157174.5178.6-178.70111.4L299 Y307 Y413 D445 G448 S449 A452L299-K303 HydrophobicContact CD1-CB 4.47Å; L299-K303 WeakPolarHBondContact O-CB 3.15Å; L299-K303 PolarHBondContact O-N 3.24Å; K303-Y307 HydrophobicContact CD-CE2 4.16Å; K303-Y307 VanDerWaalsContact CE-CE2 3.49Å; K303-Y307 VanDerWaalsContact CE-OH 3.29Å; K303-Y307 WeakPolarHBondContact CE-OH 3.27Å; K303-Y307 HydrophobicContact CG-CD2 3.65Å; K303-Y307 HydrophobicContact CG-CE2 3.65Å; K303-Y307 HydrophobicContact CG-CG 4.31Å; K303-Y307 VanDerWaalsContact O-CB 3.27Å; K303-Y307 WeakPolarHBondContact O-CB 3.46Å; K303-Y307 PolarHBondContact O-N 3.33Å; K303-Y413 HydrophobicContact CB-CD2 4.24Å; K303-Y413 HydrophobicContact CD-CD2 4.35Å; K303-Y413 HydrophobicContact CD-CE2 3.88Å; K303-Y413 HydrophobicContact CG-CD2 4Å; K303-Y413 HydrophobicContact CG-CE2 3.85Å; K303-D445 IonicContact NZ-OD1 2.69Å; K303-D445 PolarHBondContact NZ-OD1 3.3Å; K303-D445 IonicContact NZ-OD2 2.63Å; K303-G448 WeakPolarHBondContact CD-O 3.48Å; K303-S449 PolarHBondContact NZ-OG 3.1Å; K303-A452 HydrophobicContact CB-CB 4.39Å; K303-A452 HydrophobicContact CD-CB 3.92Å; K303-A452 HydrophobicContact CG-CB 3.71Å
304L96.9Very high95.3Very high7 Ų78.6 Ų8.64%0.0374%0.042CC..Hα-helixtrans-55.9-53.6168.7-172.7158.1000110.8F300 F301 T302 T308 G451 L454F300-L304 HydrophobicContact CE1-CD1 4.27Å; F300-L304 WeakPolarHBondContact O-CB 3.31Å; F300-L304 PolarHBondContact O-N 3.44Å; F301-L304 WeakPolarHBondContact O-CB 3.18Å; T302-L304 VanDerWaalsContact C-N 3.33Å; L304-T308 PolarHBondContact O-N 2.96Å; L304-T308 PolarHBondContact O-OG1 3.35Å; L304-T308 VanDerWaalsContact O-OG1 3.13Å; L304-G451 WeakPolarHBondContact CA-O 3.48Å; L304-G451 VanDerWaalsContact CB-O 3.31Å; L304-G451 WeakPolarHBondContact CB-O 3.29Å; L304-G451 WeakPolarHBondContact CG-O 3.49Å; L304-L454 HydrophobicContact CD1-CB 4.35Å; L304-L454 HydrophobicContact CD1-CD2 4.25Å; L304-L454 HydrophobicContact CD1-CG 4.39Å
305V97.1Very high95Very high1 Ų18.1 Ų8.11%0.0064%0.04CC..Hα-helixtrans-62.2-51.1179.1-178.80000110.7F301 T302 Y307 T308 F309 L384 I409 L474F301-V305 WeakPolarHBondContact O-CG2 2.94Å; F301-V305 PolarHBondContact O-N 3.13Å; T302-V305 PolarHBondContact O-N 3.41Å; V305-Y307 VanDerWaalsContact C-N 3.35Å; V305-Y307 PolarHBondContact O-N 2.66Å; V305-T308 PolarHBondContact O-N 2.83Å; V305-F309 HydrophobicContact CG1-CD2 4.27Å; V305-F309 HydrophobicContact CG1-CE2 4.23Å; V305-F309 WeakPolarHBondContact O-CD2 3.37Å; V305-F309 PolarHBondContact O-N 3.5Å; V305-L384 HydrophobicContact CG1-CD1 4.43Å; V305-I409 HydrophobicContact CB-CG2 4.13Å; V305-I409 HydrophobicContact CG1-CD1 3.79Å; V305-I409 HydrophobicContact CG1-CG1 4.18Å; V305-I409 HydrophobicContact CG1-CG2 3.81Å; V305-L474 HydrophobicContact CB-CD2 4.28Å; V305-L474 HydrophobicContact CG1-CB 4.43Å; V305-L474 HydrophobicContact CG1-CD2 4.05Å; V305-L474 HydrophobicContact CG2-CD2 4.32Å; V305-L474 WeakPolarHBondContact CG2-O 3.41Å
306S96.3Very high94.6Very high8 Ų89 Ų96%0.0564%0.043CC..Hα-helixtrans-56.9-45-178.9177.90000112.4T302 F309 L310 N410T302-S306 WeakPolarHBondContact O-CB 3.36Å; T302-S306 PolarHBondContact O-N 2.8Å; S306-F309 WeakPolarHBondContact O-CB 3.11Å; S306-F309 PolarHBondContact O-N 2.81Å; S306-L310 PolarHBondContact O-N 3.04Å; S306-N410 WeakPolarHBondContact CB-OD1 3.35Å; S306-N410 PolarHBondContact OG-OD1 3.48Å
307Y94.8Very high94.3Very high4 Ų49 Ų92%0.0164%0.043CC..Hα-helixtrans-77.9-27.1-177.3-84.3-135.8000112.7L92 K303 V305 F309 L310 Y311 A452L92-Y307 HydrophobicContact CD1-CD1 3.97Å; L92-Y307 HydrophobicContact CD2-CD1 4Å; L92-Y307 HydrophobicContact CD2-CE1 3.72Å; K303-Y307 HydrophobicContact CD-CE2 4.16Å; K303-Y307 VanDerWaalsContact CE-CE2 3.49Å; K303-Y307 VanDerWaalsContact CE-OH 3.29Å; K303-Y307 WeakPolarHBondContact CE-OH 3.27Å; K303-Y307 HydrophobicContact CG-CD2 3.65Å; K303-Y307 HydrophobicContact CG-CE2 3.65Å; K303-Y307 HydrophobicContact CG-CG 4.31Å; K303-Y307 VanDerWaalsContact O-CB 3.27Å; K303-Y307 WeakPolarHBondContact O-CB 3.46Å; K303-Y307 PolarHBondContact O-N 3.33Å; V305-Y307 VanDerWaalsContact C-N 3.35Å; V305-Y307 PolarHBondContact O-N 2.66Å; Y307-F309 VanDerWaalsContact C-N 3.32Å; Y307-L310 HydrophobicContact CD1-CD2 4.08Å; Y307-L310 HydrophobicContact CD2-CD2 4.25Å; Y307-L310 HydrophobicContact CE1-CD2 4.13Å; Y307-L310 HydrophobicContact CE2-CD2 4.3Å; Y307-L310 HydrophobicContact CG-CD2 4.13Å; Y307-L310 WeakPolarHBondContact O-CB 3.2Å; Y307-L310 PolarHBondContact O-N 2.81Å; Y307-Y311 HydrophobicContact CD1-CD2 4.4Å; Y307-Y311 AromaticContact CD1-CE2 3.66Å; Y307-Y311 HydrophobicContact CD1-CE2 3.66Å; Y307-Y311 HydrophobicContact CE1-CE2 4.35Å; Y307-Y311 HydrophobicContact CG-CE2 4.35Å; Y307-Y311 VanDerWaalsContact O-CD2 3.24Å; Y307-Y311 WeakPolarHBondContact O-CD2 3.4Å; Y307-Y311 PolarHBondContact O-N 3.43Å; Y307-A452 HydrophobicContact CD1-CB 3.42Å; Y307-A452 VanDerWaalsContact CD1-CB 3.42Å; Y307-A452 HydrophobicContact CD2-CB 4.27Å; Y307-A452 HydrophobicContact CE1-CB 3.92Å; Y307-A452 HydrophobicContact CG-CB 3.64Å
308T94.9Very high93.7Very high4 Ų48.2 Ų8.23%0.0254%0.04CC..Hα-helixtrans-59.7-45.7166.7-65.40000110.8L304 V305 W312 G455 T459 V470 M473 L474L304-T308 PolarHBondContact O-N 2.96Å; L304-T308 PolarHBondContact O-OG1 3.35Å; L304-T308 VanDerWaalsContact O-OG1 3.13Å; V305-T308 PolarHBondContact O-N 2.83Å; T308-W312 WeakPolarHBondContact O-CA 3.27Å; T308-W312 VanDerWaalsContact O-CB 3.3Å; T308-W312 WeakPolarHBondContact O-CB 3.19Å; T308-W312 PolarHBondContact O-N 2.71Å; T308-G455 WeakPolarHBondContact OG1-CA 3.37Å; T308-G455 PolarHBondContact OG1-O 3.23Å; T308-T459 HydrophobicContact CG2-CG2 4.22Å; T308-T459 WeakPolarHBondContact CG2-OG1 3.35Å; T308-V470 HydrophobicContact CG2-CG1 4.42Å; T308-M473 HydrophobicContact CG2-CE 4.44Å; T308-L474 HydrophobicContact CG2-CD1 4.26Å; T308-L474 HydrophobicContact CG2-CD2 3.73Å; T308-L474 HydrophobicContact CG2-CG 4.44Å
309F92.7Very high93.1Very high10 Ų1010.4 Ų10.44%0.0445%0.051CC..Hα-helixtrans-61.8-45.8172-84.3-89.4000111.6V305 S306 Y307 Y311 L313 F335 L384 L402 I409 L474V305-F309 HydrophobicContact CG1-CD2 4.27Å; V305-F309 HydrophobicContact CG1-CE2 4.23Å; V305-F309 WeakPolarHBondContact O-CD2 3.37Å; V305-F309 PolarHBondContact O-N 3.5Å; S306-F309 WeakPolarHBondContact O-CB 3.11Å; S306-F309 PolarHBondContact O-N 2.81Å; Y307-F309 VanDerWaalsContact C-N 3.32Å; F309-Y311 VanDerWaalsContact C-N 3.29Å; F309-Y311 PolarHBondContact O-N 3.25Å; F309-L313 HydrophobicContact CD1-CB 4.28Å; F309-L313 HydrophobicContact CD1-CD1 4.05Å; F309-L313 HydrophobicContact CD1-CD2 4.19Å; F309-L313 HydrophobicContact CD1-CG 4.41Å; F309-L313 HydrophobicContact CE1-CD1 4.32Å; F309-L313 WeakPolarHBondContact O-CB 3.21Å; F309-L313 PolarHBondContact O-N 3.39Å; F309-F335 HydrophobicContact CB-CD1 4.03Å; F309-F335 HydrophobicContact CB-CD2 4.26Å; F309-F335 HydrophobicContact CB-CE1 3.56Å; F309-F335 HydrophobicContact CB-CE2 3.82Å; F309-F335 HydrophobicContact CB-CG 4.36Å; F309-F335 HydrophobicContact CB-CZ 3.45Å; F309-F335 VanDerWaalsContact CB-CZ 3.45Å; F309-F335 AromaticContact CD1-CD2 3.78Å; F309-F335 HydrophobicContact CD1-CD2 3.78Å; F309-F335 AromaticContact CD1-CE2 3.66Å; F309-F335 HydrophobicContact CD1-CE2 3.66Å; F309-F335 HydrophobicContact CD1-CG 4.4Å; F309-F335 HydrophobicContact CD1-CZ 4.22Å; F309-F335 AromaticContact CD2-CE2 3.92Å; F309-F335 HydrophobicContact CD2-CE2 3.92Å; F309-F335 AromaticContact CD2-CZ 3.97Å; F309-F335 HydrophobicContact CD2-CZ 3.97Å; F309-F335 HydrophobicContact CE1-CD2 4.33Å; F309-F335 HydrophobicContact CE1-CE2 4.19Å; F309-F335 HydrophobicContact CE2-CE2 4.42Å; F309-F335 HydrophobicContact CG-CD2 4.05Å; F309-F335 HydrophobicContact CG-CE1 4.22Å; F309-F335 AromaticContact CG-CE2 3.52Å; F309-F335 HydrophobicContact CG-CE2 3.52Å; F309-F335 AromaticContact CG-CZ 3.63Å; F309-F335 HydrophobicContact CG-CZ 3.63Å; F309-L384 HydrophobicContact CE2-CD2 3.53Å; F309-L384 HydrophobicContact CZ-CD2 3.49Å; F309-L384 VanDerWaalsContact CZ-CD2 3.49Å; F309-L402 HydrophobicContact CE1-CD1 4.33Å; F309-I409 HydrophobicContact CD2-CD1 4.45Å; F309-I409 HydrophobicContact CE2-CD1 4.09Å; F309-L474 HydrophobicContact CD2-CD1 4.48Å; F309-L474 HydrophobicContact CE2-CD1 3.88Å; F309-L474 HydrophobicContact CZ-CD1 4.45Å
310L89.6Confident92.5Very high5 Ų513 Ų133%0.0267%0.066CC..Hα-helixtrans-52.2-47.3-179.6-175.769.9000112.5K44 S47 N189 S306 Y307K44-L310 HydrophobicContact CD-CD1 3.68Å; K44-L310 HydrophobicContact CD-CG 4.34Å; K44-L310 PolarHBondContact NZ-O 3.38Å; S47-L310 WeakPolarHBondContact CB-O 3.42Å; N189-L310 HydrophobicContact CB-CD1 4.16Å; N189-L310 VanDerWaalsContact CG-CD1 3.44Å; N189-L310 VanDerWaalsContact ND2-CD1 3.26Å; N189-L310 WeakPolarHBondContact ND2-CD1 3.41Å; S306-L310 PolarHBondContact O-N 3.04Å; Y307-L310 HydrophobicContact CD1-CD2 4.08Å; Y307-L310 HydrophobicContact CD2-CD2 4.25Å; Y307-L310 HydrophobicContact CE1-CD2 4.13Å; Y307-L310 HydrophobicContact CE2-CD2 4.3Å; Y307-L310 HydrophobicContact CG-CD2 4.13Å; Y307-L310 WeakPolarHBondContact O-CB 3.2Å; Y307-L310 PolarHBondContact O-N 2.81Å
311Y91.2Very high91.7Very high4 Ų412.8 Ų12.82%0.0167%0.066CC..Hα-helixtrans-90-39-175.3-71.8-71000113.3S47 K50 E88 L92 Y307 F309 P456S47-Y311 WeakPolarHBondContact CB-O 3.47Å; K50-Y311 WeakPolarHBondContact CE-O 3.37Å; K50-Y311 PolarHBondContact NZ-O 2.76Å; E88-Y311 VanDerWaalsContact CD-CD1 3.46Å; E88-Y311 HydrophobicContact CG-CD1 3.79Å; E88-Y311 HydrophobicContact CG-CE1 4.06Å; E88-Y311 HydrophobicContact CG-CG 4.27Å; E88-Y311 VanDerWaalsContact OE1-CD1 3.26Å; E88-Y311 WeakPolarHBondContact OE1-CD1 3.37Å; L92-Y311 HydrophobicContact CD1-CD2 4.47Å; L92-Y311 HydrophobicContact CD1-CE2 3.65Å; Y307-Y311 HydrophobicContact CD1-CD2 4.4Å; Y307-Y311 AromaticContact CD1-CE2 3.66Å; Y307-Y311 HydrophobicContact CD1-CE2 3.66Å; Y307-Y311 HydrophobicContact CE1-CE2 4.35Å; Y307-Y311 HydrophobicContact CG-CE2 4.35Å; Y307-Y311 VanDerWaalsContact O-CD2 3.24Å; Y307-Y311 WeakPolarHBondContact O-CD2 3.4Å; Y307-Y311 PolarHBondContact O-N 3.43Å; F309-Y311 VanDerWaalsContact C-N 3.29Å; F309-Y311 PolarHBondContact O-N 3.25Å; Y311-P456 HydrophobicContact CD2-CB 4.4Å; Y311-P456 HydrophobicContact CD2-CG 3.59Å; Y311-P456 HydrophobicContact CE2-CG 4.35Å; Y311-P456 HydrophobicContact CG-CG 4.24Å
312W92.6Very high91Very high4 Ų418.9 Ų18.92%0.01510%0.095CC..Hα-helixtrans-103.7-13.8-169.3-71.484000114.9W80 E88 T308 N315 Y316 P456 T459 G460 V463 W467W80-W312 HydrophobicContact CH2-CZ3 4.44Å; E88-W312 PolarHBondContact OE2-NE1 3.44Å; T308-W312 WeakPolarHBondContact O-CA 3.27Å; T308-W312 VanDerWaalsContact O-CB 3.3Å; T308-W312 WeakPolarHBondContact O-CB 3.19Å; T308-W312 PolarHBondContact O-N 2.71Å; W312-N315 HydrophobicContact CE3-CB 4.47Å; W312-N315 PolarHBondContact O-N 3.27Å; W312-Y316 WeakPolarHBondContact O-CB 3.49Å; W312-Y316 PolarHBondContact O-N 2.98Å; W312-P456 PolarHBondContact NE1-O 2.87Å; W312-T459 HydrophobicContact CB-CG2 3.98Å; W312-T459 HydrophobicContact CD2-CG2 3.45Å; W312-T459 VanDerWaalsContact CD2-CG2 3.45Å; W312-T459 HydrophobicContact CE3-CG2 3.91Å; W312-T459 HydrophobicContact CG-CG2 3.46Å; W312-T459 VanDerWaalsContact CG-CG2 3.46Å; W312-G460 VanDerWaalsContact CZ2-CA 3.49Å; W312-V463 HydrophobicContact CE3-CG2 4.13Å; W312-V463 HydrophobicContact CZ3-CG2 3.91Å; W312-W467 HydrophobicContact CB-CH2 4.48Å; W312-W467 HydrophobicContact CE3-CH2 4.07Å
313L92.5Very high90.5Very high5 Ų519.5 Ų19.53%0.02610%0.098CC..Hα-helixtrans-58.2-45.9179.2178.964.7000113.5F309 N315 Y316 L317 F335 L402F309-L313 HydrophobicContact CD1-CB 4.28Å; F309-L313 HydrophobicContact CD1-CD1 4.05Å; F309-L313 HydrophobicContact CD1-CD2 4.19Å; F309-L313 HydrophobicContact CD1-CG 4.41Å; F309-L313 HydrophobicContact CE1-CD1 4.32Å; F309-L313 WeakPolarHBondContact O-CB 3.21Å; F309-L313 PolarHBondContact O-N 3.39Å; L313-N315 VanDerWaalsContact C-N 3.3Å; L313-N315 PolarHBondContact O-N 3.24Å; L313-Y316 HydrophobicContact CD1-CD1 4.27Å; L313-Y316 WeakPolarHBondContact O-CB 3.47Å; L313-Y316 PolarHBondContact O-N 3.41Å; L313-L317 HydrophobicContact CD1-CD1 4.14Å; L313-L317 HydrophobicContact CD1-CD2 4.48Å; L313-L317 HydrophobicContact CD1-CG 4.08Å; L313-L317 HydrophobicContact CG-CD1 4.05Å; L313-L317 HydrophobicContact CG-CG 4.42Å; L313-L317 VanDerWaalsContact O-CG 3.29Å; L313-L317 WeakPolarHBondContact O-CG 3.38Å; L313-L317 PolarHBondContact O-N 3.41Å; L313-F335 HydrophobicContact CD2-CB 3.72Å; L313-F335 HydrophobicContact CD2-CG 4.24Å; L313-L402 HydrophobicContact CD1-CD1 4.01Å; L313-L402 HydrophobicContact CD2-CD1 3.92Å; L313-L402 HydrophobicContact CD2-CD2 4.25Å
314P90.7Very high90Very high1 Ų121.5 Ų21.51%0.00611%0.113CC..Hα-helixtrans-60.8-40.1177.9-21.833.7000112.4I48 L317 T318 A328I48-P314 HydrophobicContact CD1-CB 3.63Å; I48-P314 HydrophobicContact CD1-CG 3.44Å; I48-P314 VanDerWaalsContact CD1-CG 3.44Å; P314-L317 PolarHBondContact O-N 3.42Å; P314-T318 WeakPolarHBondContact O-CB 3.47Å; P314-T318 PolarHBondContact O-N 3.43Å; P314-T318 PolarHBondContact O-OG1 2.82Å; P314-A328 HydrophobicContact CB-CB 4.49Å; P314-A328 WeakPolarHBondContact O-CB 3.44Å
315N88.5Confident89.5Confident1 Ų121.6 Ų21.61%0.00511%0.114CC..Hα-helixtrans-67.9-41.9176.5-17561.6000112.3T51 W312 L313 L317 T318 I319T51-N315 HydrophobicContact CG2-CB 4.47Å; W312-N315 HydrophobicContact CE3-CB 4.47Å; W312-N315 PolarHBondContact O-N 3.27Å; L313-N315 VanDerWaalsContact C-N 3.3Å; L313-N315 PolarHBondContact O-N 3.24Å; N315-L317 PolarHBondContact O-N 2.79Å; N315-T318 PolarHBondContact O-N 3.46Å; N315-I319 WeakPolarHBondContact ND2-CD1 3.29Å; N315-I319 WeakPolarHBondContact O-CB 3.49Å; N315-I319 WeakPolarHBondContact O-CG1 3.26Å; N315-I319 PolarHBondContact O-N 3.08Å
316Y90Very high89.1Confident18 Ų1824.9 Ų24.97%0.07113%0.13CC..Hα-helixtrans-55.5-50.8173.6171-100000111.3W312 L313 T318 I319 V320 Y387 W467 F471W312-Y316 WeakPolarHBondContact O-CB 3.49Å; W312-Y316 PolarHBondContact O-N 2.98Å; L313-Y316 HydrophobicContact CD1-CD1 4.27Å; L313-Y316 WeakPolarHBondContact O-CB 3.47Å; L313-Y316 PolarHBondContact O-N 3.41Å; Y316-T318 PolarHBondContact O-N 3.49Å; Y316-I319 PolarHBondContact O-N 3.08Å; Y316-V320 HydrophobicContact CD2-CB 4.46Å; Y316-V320 HydrophobicContact CD2-CG2 3.75Å; Y316-V320 HydrophobicContact CE2-CB 4.15Å; Y316-V320 HydrophobicContact CE2-CG1 4.37Å; Y316-V320 HydrophobicContact CE2-CG2 3.57Å; Y316-V320 WeakPolarHBondContact O-CB 3.47Å; Y316-V320 PolarHBondContact O-N 3.4Å; Y316-Y387 HydrophobicContact CD1-CE1 4.48Å; Y316-Y387 AromaticContact CE1-CE1 3.7Å; Y316-Y387 HydrophobicContact CE1-CE1 3.7Å; Y316-W467 HydrophobicContact CD2-CB 4.49Å; Y316-W467 AromaticContact CD2-CD2 3.46Å; Y316-W467 HydrophobicContact CD2-CD2 3.46Å; Y316-W467 VanDerWaalsContact CD2-CD2 3.46Å; Y316-W467 AromaticContact CD2-CE2 3.67Å; Y316-W467 AromaticContact CD2-CE3 3.6Å; Y316-W467 HydrophobicContact CD2-CE3 3.6Å; Y316-W467 AromaticContact CD2-CG 3.86Å; Y316-W467 HydrophobicContact CD2-CG 3.86Å; Y316-W467 HydrophobicContact CD2-CH2 4.13Å; Y316-W467 HydrophobicContact CD2-CZ2 4.02Å; Y316-W467 AromaticContact CD2-CZ3 3.94Å; Y316-W467 HydrophobicContact CD2-CZ3 3.94Å; Y316-W467 HydrophobicContact CE2-CB 4.19Å; Y316-W467 HydrophobicContact CE2-CD2 4.04Å; Y316-W467 HydrophobicContact CE2-CE3 4.32Å; Y316-W467 AromaticContact CE2-CG 3.96Å; Y316-W467 HydrophobicContact CE2-CG 3.96Å; Y316-W467 HydrophobicContact CG-CE3 4.47Å; Y316-W467 HydrophobicContact CG-CH2 4.4Å; Y316-W467 HydrophobicContact CG-CZ2 4.48Å; Y316-W467 HydrophobicContact CG-CZ3 4.4Å; Y316-F471 AromaticContact CE2-CE2 3.84Å; Y316-F471 HydrophobicContact CE2-CE2 3.84Å; Y316-F471 HydrophobicContact CE2-CZ 4.39Å
317L89.1Confident88.7Confident2 Ų229.2 Ų29.21%0.0115%0.149CC..Hα-helixtrans-61.3-45.3179.1-66.5172000111.3L313 P314 N315 I319 E321 V323 A328 L331 T393L313-L317 HydrophobicContact CD1-CD1 4.14Å; L313-L317 HydrophobicContact CD1-CD2 4.48Å; L313-L317 HydrophobicContact CD1-CG 4.08Å; L313-L317 HydrophobicContact CG-CD1 4.05Å; L313-L317 HydrophobicContact CG-CG 4.42Å; L313-L317 VanDerWaalsContact O-CG 3.29Å; L313-L317 WeakPolarHBondContact O-CG 3.38Å; L313-L317 PolarHBondContact O-N 3.41Å; P314-L317 PolarHBondContact O-N 3.42Å; N315-L317 PolarHBondContact O-N 2.79Å; L317-I319 VanDerWaalsContact C-N 3.32Å; L317-I319 PolarHBondContact O-N 3.27Å; L317-E321 HydrophobicContact CD2-CG 4.36Å; L317-E321 WeakPolarHBondContact O-CA 3.33Å; L317-E321 WeakPolarHBondContact O-CB 3.46Å; L317-E321 PolarHBondContact O-N 2.95Å; L317-V323 HydrophobicContact CB-CG2 4.24Å; L317-A328 HydrophobicContact CB-CB 4.01Å; L317-L331 HydrophobicContact CD1-CB 3.7Å; L317-T393 HydrophobicContact CD2-CG2 3.68Å
318T85.7Confident88.4Confident24 Ų2429 Ų2915%0.14715%0.148CC..Hα-helixtrans-59.3-42.3177.9-55.20000112.1P314 N315 Y316 H322 A328P314-T318 WeakPolarHBondContact O-CB 3.47Å; P314-T318 PolarHBondContact O-N 3.43Å; P314-T318 PolarHBondContact O-OG1 2.82Å; N315-T318 PolarHBondContact O-N 3.46Å; Y316-T318 PolarHBondContact O-N 3.49Å; T318-H322 WeakPolarHBondContact O-CA 3.36Å; T318-H322 PolarHBondContact O-N 2.93Å; T318-A328 VanDerWaalsContact OG1-CB 3.31Å; T318-A328 WeakPolarHBondContact OG1-CB 3.29Å
319I85.2Confident88.2Confident46 Ų4629 Ų2924%0.23615%0.148CC..Hα-helixtrans-79.8-46.7-175-68173.4000112.3N315 Y316 L317 H322 W467N315-I319 WeakPolarHBondContact ND2-CD1 3.29Å; N315-I319 WeakPolarHBondContact O-CB 3.49Å; N315-I319 WeakPolarHBondContact O-CG1 3.26Å; N315-I319 PolarHBondContact O-N 3.08Å; Y316-I319 PolarHBondContact O-N 3.08Å; L317-I319 VanDerWaalsContact C-N 3.32Å; L317-I319 PolarHBondContact O-N 3.27Å; I319-H322 PolarHBondContact O-CE1 3.47Å; I319-W467 HydrophobicContact CD1-CZ2 4.5Å
320V85.2Confident88.1Confident54 Ų5434.5 Ų34.533%0.32717%0.172SC..Hα-helixtrans-84.2-31.7-171.9176.70000111.9Y316 W467Y316-V320 HydrophobicContact CD2-CB 4.46Å; Y316-V320 HydrophobicContact CD2-CG2 3.75Å; Y316-V320 HydrophobicContact CE2-CB 4.15Å; Y316-V320 HydrophobicContact CE2-CG1 4.37Å; Y316-V320 HydrophobicContact CE2-CG2 3.57Å; Y316-V320 WeakPolarHBondContact O-CB 3.47Å; Y316-V320 PolarHBondContact O-N 3.4Å; V320-W467 HydrophobicContact CG2-CG 4.36Å
321E81.4Confident88.2Confident31 Ų3135.6 Ų35.615%0.14518%0.178CC..SBendtrans-107.5-3-174-56.9-75.7153.300112.8L317 V323 T393L317-E321 HydrophobicContact CD2-CG 4.36Å; L317-E321 WeakPolarHBondContact O-CA 3.33Å; L317-E321 WeakPolarHBondContact O-CB 3.46Å; L317-E321 PolarHBondContact O-N 2.95Å; E321-V323 HydrophobicContact CB-CG1 4.16Å; E321-V323 HydrophobicContact CB-CG2 4.49Å; E321-V323 PolarHBondContact O-N 2.68Å; E321-V323 VanDerWaalsContact O-N 3.13Å; E321-T393 WeakPolarHBondContact CB-OG1 3.24Å; E321-T393 VanDerWaalsContact CD-CB 3.44Å; E321-T393 VanDerWaalsContact CD-N 3.33Å; E321-T393 HydrophobicContact CG-CG2 3.44Å; E321-T393 VanDerWaalsContact CG-CG2 3.44Å; E321-T393 WeakPolarHBondContact CG-OG1 3.27Å; E321-T393 VanDerWaalsContact OE1-CG2 3.25Å; E321-T393 WeakPolarHBondContact OE1-CG2 3.44Å; E321-T393 PolarHBondContact OE1-N 2.97Å; E321-T393 WeakPolarHBondContact OE2-CB 3.47Å; E321-T393 PolarHBondContact OE2-N 2.81Å; E321-T393 PolarHBondContact OE2-OG1 3.02Å
322H83.2Confident88.3Confident166 Ų16635.4 Ų35.477%0.76918%0.177SC*.  trans55.930178.2-52.4-66.3000113.6T318 I319T318-H322 WeakPolarHBondContact O-CA 3.36Å; T318-H322 PolarHBondContact O-N 2.93Å; I319-H322 PolarHBondContact O-CE1 3.47Å
323V85.8Confident88.3Confident14 Ų1436.4 Ų36.49%0.08518%0.183CC..  trans-85.7155.6174.9-62.70000111L317 E321 Q327 A328 L331L317-V323 HydrophobicContact CB-CG2 4.24Å; E321-V323 HydrophobicContact CB-CG1 4.16Å; E321-V323 HydrophobicContact CB-CG2 4.49Å; E321-V323 PolarHBondContact O-N 2.68Å; E321-V323 VanDerWaalsContact O-N 3.13Å; V323-Q327 HydrophobicContact CB-CB 4Å; V323-Q327 HydrophobicContact CG2-CB 4.49Å; V323-A328 HydrophobicContact CG2-CB 3.98Å; V323-L331 HydrophobicContact CG1-CD1 4.42Å; V323-L331 HydrophobicContact CG2-CD1 4.42Å
324S87.5Confident88.4Confident43 Ų4338.3 Ų38.330%0.30119%0.193SC..  trans-63.7159.8174.158.90000112.3E326 Q327 A328S324-E326 VanDerWaalsContact C-N 3.28Å; S324-E326 PolarHBondContact O-N 3.47Å; S324-Q327 PolarHBondContact O-N 3.13Å; S324-Q327 VanDerWaalsContact O-N 3.13Å; S324-Q327 WeakPolarHBondContact OG-CB 3.07Å; S324-Q327 VanDerWaalsContact OG-CD 3.24Å; S324-Q327 WeakPolarHBondContact OG-CG 3.32Å; S324-Q327 PolarHBondContact OG-N 3.07Å; S324-Q327 PolarHBondContact OG-OE1 3.38Å; S324-A328 WeakPolarHBondContact O-CB 3.35Å; S324-A328 PolarHBondContact O-N 3.32Å
325A85.8Confident88.6Confident8 Ų838.4 Ų38.47%0.06619%0.194CC..Hα-helixtrans-57.4-41.1177.100000112.3T51 V52 V200 A328 A329T51-A325 VanDerWaalsContact OG1-CB 3.22Å; T51-A325 WeakPolarHBondContact OG1-CB 3.07Å; V52-A325 HydrophobicContact CG1-CB 4.23Å; V200-A325 HydrophobicContact CG1-CB 4.02Å; V200-A325 HydrophobicContact CG2-CB 4.42Å; A325-A328 PolarHBondContact O-N 3.03Å; A325-A329 WeakPolarHBondContact O-CB 3.33Å; A325-A329 PolarHBondContact O-N 2.88Å
326E87.6Confident89Confident71 Ų7138.5 Ų38.533%0.33219%0.194SC..Hα-helixtrans-63.3-45175.4-175.2-172.5165.700111.6S324 A329 K330S324-E326 VanDerWaalsContact C-N 3.28Å; S324-E326 PolarHBondContact O-N 3.47Å; E326-A329 WeakPolarHBondContact O-CB 3.46Å; E326-A329 PolarHBondContact O-N 3.29Å; E326-K330 WeakPolarHBondContact O-CG 3.09Å; E326-K330 PolarHBondContact O-N 3.04Å; E326-K330 VanDerWaalsContact OE1-CE 3.25Å; E326-K330 WeakPolarHBondContact OE1-CE 3.41Å; E326-K330 IonicContact OE1-NZ 3.45Å; E326-K330 PolarHBondContact OE1-NZ 2.83Å
327Q88.7Confident89.3Confident99 Ų9940.1 Ų40.146%0.46321%0.206SC..Hα-helixtrans-65.2-42.3177.3-75.7168.7-17.300111.7V323 S324 A329 K330 L331V323-Q327 HydrophobicContact CB-CB 4Å; V323-Q327 HydrophobicContact CG2-CB 4.49Å; S324-Q327 PolarHBondContact O-N 3.13Å; S324-Q327 VanDerWaalsContact O-N 3.13Å; S324-Q327 WeakPolarHBondContact OG-CB 3.07Å; S324-Q327 VanDerWaalsContact OG-CD 3.24Å; S324-Q327 WeakPolarHBondContact OG-CG 3.32Å; S324-Q327 PolarHBondContact OG-N 3.07Å; S324-Q327 PolarHBondContact OG-OE1 3.38Å; Q327-A329 VanDerWaalsContact C-N 3.3Å; Q327-A329 PolarHBondContact O-N 3Å; Q327-K330 PolarHBondContact O-N 3.4Å; Q327-L331 WeakPolarHBondContact O-CB 3.46Å; Q327-L331 WeakPolarHBondContact O-CG 3.4Å; Q327-L331 PolarHBondContact O-N 3.34Å
328A89.3Confident89.7Confident0 Ų040 Ų400%021%0.206CC..Hα-helixtrans-60.1-40.2174.800000112P314 L317 T318 V323 S324 A325 L331 S332P314-A328 HydrophobicContact CB-CB 4.49Å; P314-A328 WeakPolarHBondContact O-CB 3.44Å; L317-A328 HydrophobicContact CB-CB 4.01Å; T318-A328 VanDerWaalsContact OG1-CB 3.31Å; T318-A328 WeakPolarHBondContact OG1-CB 3.29Å; V323-A328 HydrophobicContact CG2-CB 3.98Å; S324-A328 WeakPolarHBondContact O-CB 3.35Å; S324-A328 PolarHBondContact O-N 3.32Å; A325-A328 PolarHBondContact O-N 3.03Å; A328-L331 PolarHBondContact O-N 3.35Å; A328-S332 WeakPolarHBondContact O-CB 3.24Å; A328-S332 PolarHBondContact O-N 2.99Å
329A90.1Very high90.2Very high2 Ų239 Ų392%0.01720%0.2CC..Hα-helixtrans-59.8-47.8173.900000111.3I48 A325 E326 Q327 S332I48-A329 HydrophobicContact CD1-CB 3.67Å; I48-A329 HydrophobicContact CG1-CB 4.26Å; I48-A329 HydrophobicContact CG2-CB 4.02Å; A325-A329 WeakPolarHBondContact O-CB 3.33Å; A325-A329 PolarHBondContact O-N 2.88Å; E326-A329 WeakPolarHBondContact O-CB 3.46Å; E326-A329 PolarHBondContact O-N 3.29Å; Q327-A329 VanDerWaalsContact C-N 3.3Å; Q327-A329 PolarHBondContact O-N 3Å; A329-S332 PolarHBondContact O-N 3.29Å; A329-S332 PolarHBondContact O-OG 2.84Å
330K91Very high90.8Very high126 Ų12639.2 Ų39.255%0.54820%0.201SC..Hα-helixtrans-63.7-42.2177.4-71.2173.9-175.41700112.8E326 Q327 V333E326-K330 WeakPolarHBondContact O-CG 3.09Å; E326-K330 PolarHBondContact O-N 3.04Å; E326-K330 VanDerWaalsContact OE1-CE 3.25Å; E326-K330 WeakPolarHBondContact OE1-CE 3.41Å; E326-K330 IonicContact OE1-NZ 3.45Å; E326-K330 PolarHBondContact OE1-NZ 2.83Å; Q327-K330 PolarHBondContact O-N 3.4Å; K330-V333 WeakPolarHBondContact O-CB 3.46Å; K330-V333 PolarHBondContact O-N 2.91Å
331L91.7Very high91.4Very high28 Ų2840.3 Ų40.315%0.14720%0.204CC..Hα-helixtrans-67.4-37.2178.1-73.2172.9000111.7L317 V323 Q327 A328 V333 L334 L399L317-L331 HydrophobicContact CD1-CB 3.7Å; V323-L331 HydrophobicContact CG1-CD1 4.42Å; V323-L331 HydrophobicContact CG2-CD1 4.42Å; Q327-L331 WeakPolarHBondContact O-CB 3.46Å; Q327-L331 WeakPolarHBondContact O-CG 3.4Å; Q327-L331 PolarHBondContact O-N 3.34Å; A328-L331 PolarHBondContact O-N 3.35Å; L331-V333 PolarHBondContact O-N 2.98Å; L331-L334 WeakPolarHBondContact O-CB 3.19Å; L331-L334 PolarHBondContact O-N 3.4Å; L331-L334 VanDerWaalsContact O-N 3.14Å; L331-L399 HydrophobicContact CD2-CD2 3.61Å
332S92.3Very high92.2Very high0 Ų038.9 Ų38.90%020%0.197CC..Hα-helixtrans-62.2-24.7179.577.30000113.8A328 A329 L334 F335A328-S332 WeakPolarHBondContact O-CB 3.24Å; A328-S332 PolarHBondContact O-N 2.99Å; A329-S332 PolarHBondContact O-N 3.29Å; A329-S332 PolarHBondContact O-OG 2.84Å; S332-L334 PolarHBondContact O-N 3.26Å; S332-F335 WeakPolarHBondContact O-CB 3.26Å; S332-F335 PolarHBondContact O-N 3.45Å; S332-F335 VanDerWaalsContact O-N 3.16Å
333V94.2Very high92.8Very high25 Ų2531 Ų3115%0.15216%0.161CC..Hα-helixtrans-57.7-30.1175.8162.20000112I190 K330 L331 F335 D336 V337I190-V333 HydrophobicContact CD1-CG1 4.09Å; I190-V333 HydrophobicContact CG1-CB 4.45Å; I190-V333 HydrophobicContact CG1-CG1 3.86Å; I190-V333 HydrophobicContact CG1-CG2 4.33Å; I190-V333 HydrophobicContact CG2-CG1 4.05Å; I190-V333 HydrophobicContact CG2-CG2 4.15Å; K330-V333 WeakPolarHBondContact O-CB 3.46Å; K330-V333 PolarHBondContact O-N 2.91Å; L331-V333 PolarHBondContact O-N 2.98Å; V333-F335 PolarHBondContact O-N 3.36Å; V333-D336 WeakPolarHBondContact O-CB 2.9Å; V333-D336 PolarHBondContact O-N 3.04Å; V333-V337 HydrophobicContact CG1-CG2 3.95Å; V333-V337 WeakPolarHBondContact O-CG2 3.48Å; V333-V337 PolarHBondContact O-N 3.26Å
334L94.1Very high93.3Very high45 Ų4532.1 Ų32.124%0.23617%0.168CC..Hα-helixtrans-61.2-34.1179.5-67.9174.2000112.7L331 S332 V337 G338 L399 L402L331-L334 WeakPolarHBondContact O-CB 3.19Å; L331-L334 PolarHBondContact O-N 3.4Å; L331-L334 VanDerWaalsContact O-N 3.14Å; S332-L334 PolarHBondContact O-N 3.26Å; L334-V337 PolarHBondContact O-N 3.3Å; L334-G338 PolarHBondContact O-N 3.48Å; L334-L399 HydrophobicContact CD1-CB 3.76Å; L334-L399 HydrophobicContact CD1-CD2 3.52Å; L334-L399 HydrophobicContact CD1-CG 4.13Å; L334-L402 HydrophobicContact CB-CD2 4.12Å; L334-L402 HydrophobicContact CB-CG 4.37Å
335F95.1Very high93.8Very high4 Ų433.7 Ų33.72%0.01817%0.172CC..Hα-helixtrans-65-41.1174-175.6-95.9000111.5F309 L313 S332 V333 G338 G339 L402 C405 G406 I409 N410F309-F335 HydrophobicContact CB-CD1 4.03Å; F309-F335 HydrophobicContact CB-CD2 4.26Å; F309-F335 HydrophobicContact CB-CE1 3.56Å; F309-F335 HydrophobicContact CB-CE2 3.82Å; F309-F335 HydrophobicContact CB-CG 4.36Å; F309-F335 HydrophobicContact CB-CZ 3.45Å; F309-F335 VanDerWaalsContact CB-CZ 3.45Å; F309-F335 AromaticContact CD1-CD2 3.78Å; F309-F335 HydrophobicContact CD1-CD2 3.78Å; F309-F335 AromaticContact CD1-CE2 3.66Å; F309-F335 HydrophobicContact CD1-CE2 3.66Å; F309-F335 HydrophobicContact CD1-CG 4.4Å; F309-F335 HydrophobicContact CD1-CZ 4.22Å; F309-F335 AromaticContact CD2-CE2 3.92Å; F309-F335 HydrophobicContact CD2-CE2 3.92Å; F309-F335 AromaticContact CD2-CZ 3.97Å; F309-F335 HydrophobicContact CD2-CZ 3.97Å; F309-F335 HydrophobicContact CE1-CD2 4.33Å; F309-F335 HydrophobicContact CE1-CE2 4.19Å; F309-F335 HydrophobicContact CE2-CE2 4.42Å; F309-F335 HydrophobicContact CG-CD2 4.05Å; F309-F335 HydrophobicContact CG-CE1 4.22Å; F309-F335 AromaticContact CG-CE2 3.52Å; F309-F335 HydrophobicContact CG-CE2 3.52Å; F309-F335 AromaticContact CG-CZ 3.63Å; F309-F335 HydrophobicContact CG-CZ 3.63Å; L313-F335 HydrophobicContact CD2-CB 3.72Å; L313-F335 HydrophobicContact CD2-CG 4.24Å; S332-F335 WeakPolarHBondContact O-CB 3.26Å; S332-F335 PolarHBondContact O-N 3.45Å; S332-F335 VanDerWaalsContact O-N 3.16Å; V333-F335 PolarHBondContact O-N 3.36Å; F335-G338 PolarHBondContact O-N 3.07Å; F335-G339 PolarHBondContact O-N 3.35Å; F335-L402 HydrophobicContact CB-CD1 4.13Å; F335-L402 HydrophobicContact CB-CG 4.23Å; F335-L402 HydrophobicContact CD2-CD1 4.08Å; F335-C405 HydrophobicContact CE2-CB 4.38Å; F335-G406 VanDerWaalsContact CD2-CA 3.47Å; F335-G406 VanDerWaalsContact CE2-CA 3.49Å; F335-G406 WeakPolarHBondContact O-CA 3.23Å; F335-I409 HydrophobicContact CE2-CD1 4.22Å; F335-I409 HydrophobicContact CZ-CG2 4.49Å; F335-N410 WeakPolarHBondContact CE1-ND2 3.38Å
336D96.2Very high94.3Very high3 Ų333.3 Ų33.32%0.01617%0.17CC..Hα-helixtrans-69.3-39.9177.5-71-59.3000111.8K44 S186 N189 I190 V333 G338 G339 I340K44-D336 IonicContact NZ-OD2 2.84Å; S186-D336 WeakPolarHBondContact CB-O 3.36Å; S186-D336 PolarHBondContact OG-O 3.3Å; N189-D336 HydrophobicContact CB-CB 4.5Å; N189-D336 VanDerWaalsContact CB-CG 3.49Å; N189-D336 VanDerWaalsContact CB-OD1 3.27Å; N189-D336 WeakPolarHBondContact CB-OD1 3.4Å; N189-D336 WeakPolarHBondContact CB-OD2 3.32Å; N189-D336 PolarHBondContact ND2-OD1 3.04Å; I190-D336 HydrophobicContact CD1-CB 4.03Å; I190-D336 HydrophobicContact CG1-CB 3.65Å; V333-D336 WeakPolarHBondContact O-CB 2.9Å; V333-D336 PolarHBondContact O-N 3.04Å; D336-G338 VanDerWaalsContact C-N 3.34Å; D336-G339 WeakPolarHBondContact O-CA 3.44Å; D336-G339 PolarHBondContact O-N 3.24Å; D336-I340 PolarHBondContact O-N 2.82Å; D336-I340 VanDerWaalsContact O-N 3.07Å
337V96.6Very high94.7Very high52 Ų5230 Ų3032%0.31515%0.154SC..Hα-helixtrans-59.1-46.2172171.50000110.6I190 V333 L334 G339 I340 I341I190-V337 HydrophobicContact CD1-CG2 4.05Å; V333-V337 HydrophobicContact CG1-CG2 3.95Å; V333-V337 WeakPolarHBondContact O-CG2 3.48Å; V333-V337 PolarHBondContact O-N 3.26Å; L334-V337 PolarHBondContact O-N 3.3Å; V337-G339 PolarHBondContact O-N 3.41Å; V337-I340 WeakPolarHBondContact O-CB 3.4Å; V337-I340 PolarHBondContact O-N 3.36Å; V337-I340 VanDerWaalsContact O-N 3.13Å; V337-I341 HydrophobicContact CG1-CD1 4.33Å; V337-I341 PolarHBondContact O-N 3.01Å
338G97Very high94.9Very high0 Ų032.3 Ų32.30%016%0.158CC..Hα-helixtrans-52-45.4170.700000111.5L334 F335 D336 I340 I341 G342 T403 G406 S407L334-G338 PolarHBondContact O-N 3.48Å; F335-G338 PolarHBondContact O-N 3.07Å; D336-G338 VanDerWaalsContact C-N 3.34Å; G338-I340 VanDerWaalsContact C-N 3.34Å; G338-I340 PolarHBondContact O-N 3.47Å; G338-I341 WeakPolarHBondContact O-CB 3.45Å; G338-I341 PolarHBondContact O-N 3.38Å; G338-I341 VanDerWaalsContact O-N 3.16Å; G338-G342 PolarHBondContact O-N 3.24Å; G338-T403 WeakPolarHBondContact CA-O 3.44Å; G338-G406 VanDerWaalsContact C-C 3.48Å; G338-S407 VanDerWaalsContact C-N 3.3Å; G338-S407 WeakPolarHBondContact O-CA 3.21Å; G338-S407 WeakPolarHBondContact O-CB 3.48Å; G338-S407 PolarHBondContact O-N 2.88Å
339G97Very high95.1Very high2 Ų238.2 Ų38.22%0.02118%0.184CC..Hα-helixtrans-64.2-31.4178.800000115.5F335 D336 V337 G343 G406F335-G339 PolarHBondContact O-N 3.35Å; D336-G339 WeakPolarHBondContact O-CA 3.44Å; D336-G339 PolarHBondContact O-N 3.24Å; V337-G339 PolarHBondContact O-N 3.41Å; G339-G343 PolarHBondContact O-N 3.06Å; G339-G406 WeakPolarHBondContact CA-O 3.35Å
340I97.3Very high95.3Very high50 Ų5038.1 Ų38.126%0.25618%0.184SC..Hα-helixtrans-62.6-50.5171.2-61.5175.7000109.5I190 D336 V337 G338 G342 G343 V344I190-I340 HydrophobicContact CD1-CD1 4.35Å; D336-I340 PolarHBondContact O-N 2.82Å; D336-I340 VanDerWaalsContact O-N 3.07Å; V337-I340 WeakPolarHBondContact O-CB 3.4Å; V337-I340 PolarHBondContact O-N 3.36Å; V337-I340 VanDerWaalsContact O-N 3.13Å; G338-I340 VanDerWaalsContact C-N 3.34Å; G338-I340 PolarHBondContact O-N 3.47Å; I340-G342 PolarHBondContact O-N 2.64Å; I340-G343 PolarHBondContact O-N 2.96Å; I340-V344 WeakPolarHBondContact O-CG2 3.23Å; I340-V344 PolarHBondContact O-N 3.42Å; I340-V344 VanDerWaalsContact O-N 3.09Å
341I97.6Very high95.3Very high78 Ų7833.5 Ų33.540%0.417%0.165SC..Hα-helixtrans-59.8-50.5-179.6-62.9167.7000109.8V337 G338 G343 V344 L345 T403V337-I341 HydrophobicContact CG1-CD1 4.33Å; V337-I341 PolarHBondContact O-N 3.01Å; G338-I341 WeakPolarHBondContact O-CB 3.45Å; G338-I341 PolarHBondContact O-N 3.38Å; G338-I341 VanDerWaalsContact O-N 3.16Å; I341-G343 PolarHBondContact O-N 2.93Å; I341-V344 PolarHBondContact O-N 2.71Å; I341-L345 HydrophobicContact CG2-CD1 3.63Å; I341-L345 HydrophobicContact CG2-CG 4.18Å; I341-L345 WeakPolarHBondContact O-CB 3.32Å; I341-L345 VanDerWaalsContact O-CG 3.25Å; I341-L345 WeakPolarHBondContact O-CG 3.23Å; I341-L345 PolarHBondContact O-N 3.46Å; I341-T403 HydrophobicContact CD1-CG2 4.34Å
342G97.4Very high94.7Very high0 Ų033.4 Ų33.40%017%0.167CC..Hα-helixtrans-60.4-44.1-179.600000113.1G338 I340 I346 S407G338-G342 PolarHBondContact O-N 3.24Å; I340-G342 PolarHBondContact O-N 2.64Å; G342-I346 WeakPolarHBondContact O-CB 3.39Å; G342-I346 VanDerWaalsContact O-CG2 3.25Å; G342-I346 WeakPolarHBondContact O-CG2 3.49Å; G342-I346 PolarHBondContact O-N 2.96Å; G342-S407 WeakPolarHBondContact CA-OG 3.46Å; G342-S407 PolarHBondContact N-OG 3.32Å
343G97Very high93.8Very high2 Ų241.7 Ų41.72%0.02121%0.205CC..Hα-helixtrans-63.7-40.8178.400000113.4G179 G339 I340 I341 I346 G347G179-G343 WeakPolarHBondContact CA-O 3.14Å; G339-G343 PolarHBondContact O-N 3.06Å; I340-G343 PolarHBondContact O-N 2.96Å; I341-G343 PolarHBondContact O-N 2.93Å; G343-I346 WeakPolarHBondContact O-CG2 3.41Å; G343-G347 PolarHBondContact O-N 3.46Å; G343-G347 VanDerWaalsContact O-N 3.15Å
344V96.8Very high92.6Very high37 Ų3743.4 Ų43.422%0.22422%0.218CC..Hα-helixtrans-70.5-47.2176.8175.80000111.1L176 L180 I340 I341 G347 W348L176-V344 HydrophobicContact CD1-CG1 4.14Å; L180-V344 HydrophobicContact CD2-CG1 4.19Å; L180-V344 HydrophobicContact CD2-CG2 3.69Å; L180-V344 HydrophobicContact CG-CG1 4.5Å; L180-V344 HydrophobicContact CG-CG2 4.15Å; I340-V344 WeakPolarHBondContact O-CG2 3.23Å; I340-V344 PolarHBondContact O-N 3.42Å; I340-V344 VanDerWaalsContact O-N 3.09Å; I341-V344 PolarHBondContact O-N 2.71Å; V344-G347 PolarHBondContact O-N 3.38Å; V344-W348 WeakPolarHBondContact O-CB 3.43Å; V344-W348 PolarHBondContact O-N 2.79Å
345L96.8Very high91.3Very high75 Ų7548.3 Ų48.339%0.39325%0.245SC..Hα-helixtrans-60.7-49.7-179.4-73.4178000111.6I341 G347 W348 F349I341-L345 HydrophobicContact CG2-CD1 3.63Å; I341-L345 HydrophobicContact CG2-CG 4.18Å; I341-L345 WeakPolarHBondContact O-CB 3.32Å; I341-L345 VanDerWaalsContact O-CG 3.25Å; I341-L345 WeakPolarHBondContact O-CG 3.23Å; I341-L345 PolarHBondContact O-N 3.46Å; L345-G347 VanDerWaalsContact C-N 3.3Å; L345-G347 PolarHBondContact O-N 3.45Å; L345-W348 PolarHBondContact O-N 3.22Å; L345-F349 HydrophobicContact CB-CD2 4.41Å; L345-F349 HydrophobicContact CB-CE2 4.45Å; L345-F349 HydrophobicContact CD2-CE2 4.5Å; L345-F349 WeakPolarHBondContact O-CB 3.4Å; L345-F349 WeakPolarHBondContact O-CD2 3.41Å; L345-F349 PolarHBondContact O-N 3.34Å
346I96.9Very high90.1Very high1 Ų149.8 Ų49.81%0.00526%0.262CS..Hα-helixtrans-65.7-37.1-179.8-154.9-177.4000111.6G342 G343 F349 S350 A372 M376 G411 P412 L415G342-I346 WeakPolarHBondContact O-CB 3.39Å; G342-I346 VanDerWaalsContact O-CG2 3.25Å; G342-I346 WeakPolarHBondContact O-CG2 3.49Å; G342-I346 PolarHBondContact O-N 2.96Å; G343-I346 WeakPolarHBondContact O-CG2 3.41Å; I346-F349 PolarHBondContact O-N 3.21Å; I346-S350 WeakPolarHBondContact O-CB 3.12Å; I346-S350 PolarHBondContact O-N 2.9Å; I346-S350 PolarHBondContact O-OG 3.03Å; I346-A372 HydrophobicContact CD1-CB 4.31Å; I346-A372 HydrophobicContact CG1-CB 3.81Å; I346-M376 HydrophobicContact CB-SD 3.44Å; I346-M376 WeakPolarHBondContact CB-SD 3.47Å; I346-M376 HydrophobicContact CD1-CG 4.44Å; I346-M376 HydrophobicContact CD1-SD 3.57Å; I346-M376 VanDerWaalsContact CD1-SD 3.57Å; I346-M376 HydrophobicContact CG1-SD 3.47Å; I346-M376 WeakPolarHBondContact CG1-SD 3.27Å; I346-M376 HydrophobicContact CG2-SD 4.5Å; I346-G411 WeakPolarHBondContact CG2-O 3.41Å; I346-P412 HydrophobicContact CD1-CB 4.48Å; I346-P412 HydrophobicContact CD1-CG 4.17Å; I346-L415 HydrophobicContact CD1-CB 3.98Å; I346-L415 HydrophobicContact CD1-CD2 3.77Å; I346-L415 HydrophobicContact CD1-CG 4.46Å; I346-L415 HydrophobicContact CG1-CB 4.49Å; I346-L415 HydrophobicContact CG1-CD2 3.97Å; I346-L415 HydrophobicContact CG2-CB 3.85Å; I346-L415 HydrophobicContact CG2-CD1 4.39Å
347G95.2Very high89Confident0 Ų054.7 Ų54.70%028%0.284CS..Hα-helixtrans-57.4-52175.500000110.4G175 L176 G343 V344 L345 S350 D351G175-G347 VanDerWaalsContact C-C 3.46Å; G175-G347 CarbonylContact C-O 3.57Å; G175-G347 WeakPolarHBondContact CA-O 3.28Å; G175-G347 WeakPolarHBondContact O-CA 3.33Å; L176-G347 PolarHBondContact N-O 3.14Å; G343-G347 PolarHBondContact O-N 3.46Å; G343-G347 VanDerWaalsContact O-N 3.15Å; V344-G347 PolarHBondContact O-N 3.38Å; L345-G347 VanDerWaalsContact C-N 3.3Å; L345-G347 PolarHBondContact O-N 3.45Å; G347-S350 PolarHBondContact O-N 3.33Å; G347-S350 PolarHBondContact O-OG 3.43Å; G347-D351 PolarHBondContact O-N 3.07Å
348W94.1Very high88.5Confident148 Ų14855.1 Ų55.156%0.56129%0.285SS*.Hα-helixtrans-60.9-50.4176.8-177.369.8000113.1L176 V344 L345 S350 D351L176-W348 HydrophobicContact CD1-CB 4.12Å; V344-W348 WeakPolarHBondContact O-CB 3.43Å; V344-W348 PolarHBondContact O-N 2.79Å; L345-W348 PolarHBondContact O-N 3.22Å; W348-S350 PolarHBondContact O-N 2.82Å; W348-D351 PolarHBondContact O-N 3.3Å
349F94Very high87.9Confident124 Ų12458.6 Ų58.654%0.54430%0.303SS..Hα-helixtrans-62.7-31.8179.5-80.6-60.3000112.6L345 I346 K368L345-F349 HydrophobicContact CB-CD2 4.41Å; L345-F349 HydrophobicContact CB-CE2 4.45Å; L345-F349 HydrophobicContact CD2-CE2 4.5Å; L345-F349 WeakPolarHBondContact O-CB 3.4Å; L345-F349 WeakPolarHBondContact O-CD2 3.41Å; L345-F349 PolarHBondContact O-N 3.34Å; I346-F349 PolarHBondContact O-N 3.21Å; F349-K368 WeakPolarHBondContact O-CE 3.45Å; F349-K368 PolarHBondContact O-NZ 3.1Å
350S94.1Very high87.4Confident1 Ų160 Ų601%0.00731%0.31CS..Hα-helixtrans-78.4-18.6-178.978.10000114.2I346 G347 W348 S352 K368 R369 L415I346-S350 WeakPolarHBondContact O-CB 3.12Å; I346-S350 PolarHBondContact O-N 2.9Å; I346-S350 PolarHBondContact O-OG 3.03Å; G347-S350 PolarHBondContact O-N 3.33Å; G347-S350 PolarHBondContact O-OG 3.43Å; W348-S350 PolarHBondContact O-N 2.82Å; S350-S352 PolarHBondContact O-N 3.19Å; S350-K368 VanDerWaalsContact O-CD 3.31Å; S350-K368 WeakPolarHBondContact O-CD 3.44Å; S350-K368 WeakPolarHBondContact O-CE 3.45Å; S350-R369 PolarHBondContact OG-NH1 3.32Å; S350-R369 VanDerWaalsContact OG-NH1 3.14Å; S350-L415 VanDerWaalsContact OG-CD1 3.32Å; S350-L415 WeakPolarHBondContact OG-CD1 3.25Å
351D91.1Very high86.9Confident28 Ų2859 Ų5915%0.1530%0.304CS..  trans-67.1120.8-175.7-88.1-26.1000111.7R173 R174 G175 L176 G347 W348 K368R173-D351 WeakPolarHBondContact CA-OD2 3.42Å; R174-D351 PolarHBondContact N-OD1 3.35Å; G175-D351 WeakPolarHBondContact CA-OD1 3.45Å; G175-D351 PolarHBondContact N-OD1 2.95Å; L176-D351 VanDerWaalsContact CB-OD2 3.25Å; L176-D351 WeakPolarHBondContact CB-OD2 3.46Å; L176-D351 PolarHBondContact N-OD2 3.1Å; G347-D351 PolarHBondContact O-N 3.07Å; W348-D351 PolarHBondContact O-N 3.3Å; D351-K368 PolarHBondContact O-NZ 3.37Å
352S79Confident86.5Confident26 Ų2656.1 Ų56.118%0.18229%0.29CS..  trans-94.8142.6172-172.50000110S350 S354S350-S352 PolarHBondContact O-N 3.19Å; S352-S354 PolarHBondContact O-N 3.17Å
353Q73.3Confident86.2Confident174 Ų17456.6 Ų56.681%0.81329%0.292SS*.  trans-64.3104.9158.1-68.2179.9-8.500106.6
354S69.1Low85.9Confident61 Ų6160.6 Ų60.643%0.42731%0.309SS..  trans-99.7123.3179.1178.50000108.3S352 G356S352-S354 PolarHBondContact O-N 3.17Å; S354-G356 PolarHBondContact O-N 3.38Å; S354-G356 PolarHBondContact OG-O 2.95Å
355N65.1Low85.7Confident148 Ų14859.7 Ų59.779%0.79130%0.303SS*.  trans-88.124.3-178.6-70.5-12000112.8
356G71.4Confident85.5Confident36 Ų3656.6 Ų56.637%0.37129%0.287SS..SBendtrans130.4177178.100000113.6S354 N358S354-G356 PolarHBondContact O-N 3.38Å; S354-G356 PolarHBondContact OG-O 2.95Å; G356-N358 PolarHBondContact O-N 3.36Å
357Q73.4Confident85.4Confident105 Ų10559.9 Ų59.949%0.49130%0.301SS..SBendtrans-88.9100.2-180-69.3-177.9-26.300110.3K171 L431K171-Q357 HydrophobicContact CD-CG 4.27Å; Q357-L431 HydrophobicContact CB-CD1 4.22Å; Q357-L431 HydrophobicContact CG-CD1 4.45Å; Q357-L431 VanDerWaalsContact OE1-CD1 3.24Å
358N84.6Confident85.4Confident62 Ų6263.5 Ų63.533%0.33232%0.317SS..  trans-145.5162.7168.769.564.5000111.1G356 N360 E361 D362 S428G356-N358 PolarHBondContact O-N 3.36Å; N358-N360 PolarHBondContact O-N 3.05Å; N358-N360 VanDerWaalsContact O-N 3.16Å; N358-N360 WeakPolarHBondContact OD1-CB 3.42Å; N358-N360 PolarHBondContact OD1-N 2.91Å; N358-E361 PolarHBondContact O-N 2.93Å; N358-E361 PolarHBondContact OD1-N 2.82Å; N358-D362 PolarHBondContact O-N 3.45Å; N358-D362 VanDerWaalsContact O-N 3.1Å; N358-S428 VanDerWaalsContact C-OG 3.3Å; N358-S428 WeakPolarHBondContact CA-OG 3.34Å; N358-S428 PolarHBondContact N-OG 2.9Å
359L85.1Confident85.4Confident72 Ų7256.7 Ų56.738%0.37729%0.292SS..Hα-helixtrans-58.4-29.6-175.4-73170.9000114.4E363 A429 R499L359-E363 PolarHBondContact O-N 3.42Å; L359-A429 HydrophobicContact CD2-CB 4.03Å; L359-R499 PolarHBondContact O-NH1 2.88Å
360N86.4Confident85.5Confident31 Ų3150.8 Ų50.817%0.16627%0.266CS..Hα-helixtrans-78.2-38.7179.9-75.1-2.1000111.5N358 D362 E363 K364 R503N358-N360 PolarHBondContact O-N 3.05Å; N358-N360 VanDerWaalsContact O-N 3.16Å; N358-N360 WeakPolarHBondContact OD1-CB 3.42Å; N358-N360 PolarHBondContact OD1-N 2.91Å; N360-D362 VanDerWaalsContact C-N 3.32Å; N360-E363 PolarHBondContact O-N 3.1Å; N360-K364 WeakPolarHBondContact O-CB 3.47Å; N360-K364 PolarHBondContact O-N 3.43Å; N360-R503 PolarHBondContact ND2-NH1 3.13Å; N360-R503 VanDerWaalsContact ND2-NH1 3.16Å; N360-R503 PolarHBondContact ND2-NH2 3.25Å
361E87.9Confident85.7Confident29 Ų2954.8 Ų54.814%0.13629%0.286CS..Hα-helixtrans-65.2-36.8174.4-69.6-59.3139.800111.6N358 K364 T365N358-E361 PolarHBondContact O-N 2.93Å; N358-E361 PolarHBondContact OD1-N 2.82Å; E361-K364 PolarHBondContact O-N 3.25Å; E361-T365 WeakPolarHBondContact O-CB 3.33Å; E361-T365 PolarHBondContact O-N 2.87Å; E361-T365 PolarHBondContact O-OG1 3.37Å
362D88.6Confident85.9Confident19 Ų1954.1 Ų54.110%0.10229%0.285CS..Hα-helixtrans-62.5-47.6174-65.9-39.6000111.3K171 N358 N360 K364 T365 I366 S428K171-D362 IonicContact NZ-OD1 2.76Å; K171-D362 PolarHBondContact NZ-OD1 3.46Å; K171-D362 VanDerWaalsContact NZ-OD1 3.12Å; N358-D362 PolarHBondContact O-N 3.45Å; N358-D362 VanDerWaalsContact O-N 3.1Å; N360-D362 VanDerWaalsContact C-N 3.32Å; D362-K364 PolarHBondContact O-N 3.36Å; D362-T365 PolarHBondContact O-N 2.99Å; D362-I366 VanDerWaalsContact O-CG1 3.29Å; D362-I366 WeakPolarHBondContact O-CG1 3.34Å; D362-I366 PolarHBondContact O-N 3.39Å; D362-S428 WeakPolarHBondContact OD2-CA 3.38Å; D362-S428 WeakPolarHBondContact OD2-CB 3.4Å; D362-S428 PolarHBondContact OD2-N 3.41Å; D362-S428 PolarHBondContact OD2-OG 3.49Å
363E90.4Very high86.8Confident9 Ų952.9 Ų52.94%0.04228%0.276CS..Hα-helixtrans-65.5-38177.9-75.3-71.5-179.800112.7L359 N360 T365 I366 K367 S492 R495 R499L359-E363 PolarHBondContact O-N 3.42Å; N360-E363 PolarHBondContact O-N 3.1Å; E363-T365 VanDerWaalsContact C-N 3.32Å; E363-I366 PolarHBondContact O-N 2.54Å; E363-K367 WeakPolarHBondContact O-CB 3.43Å; E363-K367 PolarHBondContact O-N 2.83Å; E363-S492 WeakPolarHBondContact OE2-CB 3.3Å; E363-S492 PolarHBondContact OE2-OG 3.45Å; E363-R495 VanDerWaalsContact OE1-CD 3.23Å; E363-R495 WeakPolarHBondContact OE1-CD 3.01Å; E363-R495 IonicContact OE1-NH1 3.96Å; E363-R499 IonicContact OE1-NH2 2.95Å
364K91.2Very high88Confident86 Ų8646.2 Ų46.237%0.37425%0.246SC..Hα-helixtrans-61.6-43.2174-178.5-176.3173.6-169.80110.9N360 E361 D362 K367 K368N360-K364 WeakPolarHBondContact O-CB 3.47Å; N360-K364 PolarHBondContact O-N 3.43Å; E361-K364 PolarHBondContact O-N 3.25Å; D362-K364 PolarHBondContact O-N 3.36Å; K364-K367 PolarHBondContact O-N 2.94Å; K364-K368 WeakPolarHBondContact O-CB 3.34Å; K364-K368 PolarHBondContact O-N 3.39Å
365T92Very high89.3Confident18 Ų1846.8 Ų46.811%0.1125%0.246CC..Hα-helixtrans-65-47.3177.6-580000110.9E361 D362 E363 K367 K368 R369 D423E361-T365 WeakPolarHBondContact O-CB 3.33Å; E361-T365 PolarHBondContact O-N 2.87Å; E361-T365 PolarHBondContact O-OG1 3.37Å; D362-T365 PolarHBondContact O-N 2.99Å; E363-T365 VanDerWaalsContact C-N 3.32Å; T365-K367 PolarHBondContact O-N 3.19Å; T365-K368 PolarHBondContact O-N 2.86Å; T365-R369 HydrophobicContact CG2-CG 4.47Å; T365-R369 WeakPolarHBondContact O-CG 3.33Å; T365-R369 PolarHBondContact O-N 3.41Å; T365-D423 WeakPolarHBondContact CG2-OD2 3.29Å
366I93.3Very high90.8Very high11 Ų1141 Ų416%0.05622%0.215CC..Hα-helixtrans-54.5-52.4174.4-72.7165000110.5Y295 D362 E363 K368 R369 A370 L424 I488 S492Y295-I366 HydrophobicContact CE2-CG2 3.89Å; Y295-I366 PolarHBondContact OH-O 3.39Å; D362-I366 VanDerWaalsContact O-CG1 3.29Å; D362-I366 WeakPolarHBondContact O-CG1 3.34Å; D362-I366 PolarHBondContact O-N 3.39Å; E363-I366 PolarHBondContact O-N 2.54Å; I366-K368 VanDerWaalsContact C-N 3.33Å; I366-K368 PolarHBondContact O-N 3.18Å; I366-R369 PolarHBondContact O-N 2.96Å; I366-A370 PolarHBondContact O-N 3.29Å; I366-L424 HydrophobicContact CD1-CD2 3.84Å; I366-L424 HydrophobicContact CG1-CD2 4.2Å; I366-I488 HydrophobicContact CG2-CG2 3.95Å; I366-S492 WeakPolarHBondContact CG2-OG 3.16Å
367K94.3Very high92Very high69 Ų6939.3 Ų39.330%0.320%0.198SC..Hα-helixtrans-57.8-45.1178.7178.8177171.9170.70112E363 K364 T365 A370 L371 V489 S493E363-K367 WeakPolarHBondContact O-CB 3.43Å; E363-K367 PolarHBondContact O-N 2.83Å; K364-K367 PolarHBondContact O-N 2.94Å; T365-K367 PolarHBondContact O-N 3.19Å; K367-A370 PolarHBondContact O-N 3.33Å; K367-L371 WeakPolarHBondContact O-CB 3.2Å; K367-L371 PolarHBondContact O-N 3.22Å; K367-V489 HydrophobicContact CG-CG1 4.47Å; K367-S493 VanDerWaalsContact CE-OG 3.26Å; K367-S493 WeakPolarHBondContact CE-OG 3.42Å; K367-S493 PolarHBondContact NZ-OG 3.15Å
368K94.4Very high93.2Very high76 Ų7636.6 Ų36.633%0.3319%0.193SC..Hα-helixtrans-64.9-41.8-178.8-173.5171.8175.9178.20111.9F349 S350 D351 K364 T365 I366 L371 A372F349-K368 WeakPolarHBondContact O-CE 3.45Å; F349-K368 PolarHBondContact O-NZ 3.1Å; S350-K368 VanDerWaalsContact O-CD 3.31Å; S350-K368 WeakPolarHBondContact O-CD 3.44Å; S350-K368 WeakPolarHBondContact O-CE 3.45Å; D351-K368 PolarHBondContact O-NZ 3.37Å; K364-K368 WeakPolarHBondContact O-CB 3.34Å; K364-K368 PolarHBondContact O-N 3.39Å; T365-K368 PolarHBondContact O-N 2.86Å; I366-K368 VanDerWaalsContact C-N 3.33Å; I366-K368 PolarHBondContact O-N 3.18Å; K368-L371 PolarHBondContact O-N 3.12Å; K368-A372 PolarHBondContact O-N 3.26Å
369R95.4Very high93.7Very high6 Ų639.9 Ų39.92%0.02320%0.204CC..Hα-helixtrans-63.1-43.8174.9-68.7-175.9-172.2-69.25.2111.8S350 T365 I366 L371 A372 C373 L415 A419 V420 D423S350-R369 PolarHBondContact OG-NH1 3.32Å; S350-R369 VanDerWaalsContact OG-NH1 3.14Å; T365-R369 HydrophobicContact CG2-CG 4.47Å; T365-R369 WeakPolarHBondContact O-CG 3.33Å; T365-R369 PolarHBondContact O-N 3.41Å; I366-R369 PolarHBondContact O-N 2.96Å; R369-L371 VanDerWaalsContact C-N 3.35Å; R369-L371 PolarHBondContact O-N 3.49Å; R369-A372 PolarHBondContact O-N 2.67Å; R369-C373 PolarHBondContact O-N 2.95Å; R369-C373 PolarHBondContact O-SG 3.1Å; R369-L415 HydrophobicContact CB-CD2 3.93Å; R369-L415 HydrophobicContact CG-CD2 4.25Å; R369-A419 VanDerWaalsContact CZ-CB 3.48Å; R369-V420 HydrophobicContact CB-CG2 3.94Å; R369-V420 VanDerWaalsContact CD-CG2 3.49Å; R369-V420 HydrophobicContact CG-CG2 4.3Å; R369-D423 IonicContact CZ-OD2 3.67Å; R369-D423 IonicContact NE-OD2 3.72Å; R369-D423 PolarHBondContact NE-OD2 3.05Å; R369-D423 IonicContact NH2-OD1 3.96Å; R369-D423 IonicContact NH2-OD2 2.84Å; R369-D423 PolarHBondContact NH2-OD2 3.1Å
370A96.6Very high94.2Very high0 Ų036.4 Ų36.40%019%0.186CC..Hα-helixtrans-64-37.9175.300000112.7Y295 I366 K367 C373 L374 S485 I488 V489Y295-A370 PolarHBondContact OH-N 3Å; I366-A370 PolarHBondContact O-N 3.29Å; K367-A370 PolarHBondContact O-N 3.33Å; A370-C373 PolarHBondContact O-N 2.87Å; A370-L374 WeakPolarHBondContact O-CB 2.88Å; A370-L374 PolarHBondContact O-N 3.46Å; A370-S485 PolarHBondContact O-OG 3.29Å; A370-I488 HydrophobicContact CB-CB 3.9Å; A370-I488 HydrophobicContact CB-CG2 3.58Å; A370-V489 HydrophobicContact CB-CG2 3.65Å
371L96.7Very high94.5Very high84 Ų8435.6 Ų35.644%0.4418%0.184SC..Hα-helixtrans-65-41.1174.9-177.262.1000111.7K367 K368 R369 L374 V375 V489K367-L371 WeakPolarHBondContact O-CB 3.2Å; K367-L371 PolarHBondContact O-N 3.22Å; K368-L371 PolarHBondContact O-N 3.12Å; R369-L371 VanDerWaalsContact C-N 3.35Å; R369-L371 PolarHBondContact O-N 3.49Å; L371-L374 HydrophobicContact CD1-CD2 4.33Å; L371-L374 WeakPolarHBondContact O-CB 3.38Å; L371-L374 PolarHBondContact O-N 2.85Å; L371-V375 WeakPolarHBondContact O-CG2 3.45Å; L371-V375 PolarHBondContact O-N 2.83Å; L371-V489 HydrophobicContact CB-CG2 4.35Å
372A96.9Very high94.9Very high14 Ų1437.8 Ų37.812%0.11620%0.201CC..Hα-helixtrans-61.3-43.9175.500000111.8I346 K368 R369 V375 M376 L415I346-A372 HydrophobicContact CD1-CB 4.31Å; I346-A372 HydrophobicContact CG1-CB 3.81Å; K368-A372 PolarHBondContact O-N 3.26Å; R369-A372 PolarHBondContact O-N 2.67Å; A372-V375 PolarHBondContact O-N 3.43Å; A372-M376 PolarHBondContact O-N 3.22Å; A372-L415 HydrophobicContact CB-CD2 4.37Å
373C97.5Very high95.2Very high0 Ų038.6 Ų38.60%021%0.205CC..Hα-helixtrans-59.9-46.4173.1-68.20000111.8L298 R369 A370 V375 M376 L377 P412L298-C373 HydrophobicContact CD1-CB 4.42Å; R369-C373 PolarHBondContact O-N 2.95Å; R369-C373 PolarHBondContact O-SG 3.1Å; A370-C373 PolarHBondContact O-N 2.87Å; C373-V375 VanDerWaalsContact C-N 3.34Å; C373-V375 PolarHBondContact O-N 3.48Å; C373-M376 PolarHBondContact O-N 3.19Å; C373-L377 HydrophobicContact CB-CD1 4.46Å; C373-L377 WeakPolarHBondContact O-CB 3.16Å; C373-L377 WeakPolarHBondContact O-CG 3.44Å; C373-L377 PolarHBondContact O-N 3.46Å; C373-P412 HydrophobicContact CB-CB 4.15Å
374L97.3Very high95.3Very high35 Ų3538.2 Ų38.218%0.18320%0.203CC..Hα-helixtrans-56.7-46.3-179.9173.356.8000111.8A370 L371 L377 A378 M482 S485 I486A370-L374 WeakPolarHBondContact O-CB 2.88Å; A370-L374 PolarHBondContact O-N 3.46Å; L371-L374 HydrophobicContact CD1-CD2 4.33Å; L371-L374 WeakPolarHBondContact O-CB 3.38Å; L371-L374 PolarHBondContact O-N 2.85Å; L374-L377 PolarHBondContact O-N 3.44Å; L374-A378 WeakPolarHBondContact O-CB 3.49Å; L374-A378 PolarHBondContact O-N 3.2Å; L374-M482 HydrophobicContact CD1-CG 3.38Å; L374-M482 HydrophobicContact CD1-SD 4.2Å; L374-S485 PolarHBondContact N-OG 2.98Å; L374-I486 HydrophobicContact CD1-CD1 4.12Å; L374-I486 HydrophobicContact CD1-CG1 3.65Å; L374-I486 HydrophobicContact CD2-CG1 3.91Å; L374-I486 HydrophobicContact CG-CG1 4.43Å
375V96.9Very high95.4Very high72 Ų7237.5 Ų37.544%0.43620%0.203SC..Hα-helixtrans-61.2-47.1179.7172.40000111L371 A372 C373 A378 F379L371-V375 WeakPolarHBondContact O-CG2 3.45Å; L371-V375 PolarHBondContact O-N 2.83Å; A372-V375 PolarHBondContact O-N 3.43Å; C373-V375 VanDerWaalsContact C-N 3.34Å; C373-V375 PolarHBondContact O-N 3.48Å; V375-A378 PolarHBondContact O-N 2.92Å; V375-F379 HydrophobicContact CG1-CD2 4.18Å; V375-F379 HydrophobicContact CG1-CE2 3.83Å; V375-F379 WeakPolarHBondContact O-CD2 3.46Å; V375-F379 PolarHBondContact O-N 3.23Å
376M97Very high95.4Very high27 Ų2738.5 Ų38.513%0.13321%0.213CC..Hα-helixtrans-68.9-39.3-179.3-70.6-172.36900113.2I346 A372 C373 A378 F379 A380 S407 P412I346-M376 HydrophobicContact CB-SD 3.44Å; I346-M376 WeakPolarHBondContact CB-SD 3.47Å; I346-M376 HydrophobicContact CD1-CG 4.44Å; I346-M376 HydrophobicContact CD1-SD 3.57Å; I346-M376 VanDerWaalsContact CD1-SD 3.57Å; I346-M376 HydrophobicContact CG1-SD 3.47Å; I346-M376 WeakPolarHBondContact CG1-SD 3.27Å; I346-M376 HydrophobicContact CG2-SD 4.5Å; A372-M376 PolarHBondContact O-N 3.22Å; C373-M376 PolarHBondContact O-N 3.19Å; M376-A378 VanDerWaalsContact C-N 3.33Å; M376-A378 PolarHBondContact O-N 2.84Å; M376-F379 PolarHBondContact O-N 2.79Å; M376-A380 PolarHBondContact O-N 2.99Å; M376-S407 WeakPolarHBondContact CE-O 3.31Å; M376-P412 HydrophobicContact CB-CG 3.8Å
377L96.9Very high95.3Very high1 Ų138.1 Ų38.11%0.00521%0.211CC..Hα-helixtrans-65-37.2175.2-65.4169.5000111.5T302 C373 L374 F379 A380 A381 P412 D478 A481 M482T302-L377 HydrophobicContact CG2-CD1 4.32Å; T302-L377 HydrophobicContact CG2-CD2 3.69Å; C373-L377 HydrophobicContact CB-CD1 4.46Å; C373-L377 WeakPolarHBondContact O-CB 3.16Å; C373-L377 WeakPolarHBondContact O-CG 3.44Å; C373-L377 PolarHBondContact O-N 3.46Å; L374-L377 PolarHBondContact O-N 3.44Å; L377-F379 PolarHBondContact O-N 3.4Å; L377-A380 WeakPolarHBondContact O-CB 3.5Å; L377-A380 PolarHBondContact O-N 3.38Å; L377-A381 PolarHBondContact O-N 2.87Å; L377-P412 HydrophobicContact CD2-CB 4.12Å; L377-P412 HydrophobicContact CD2-CG 3.87Å; L377-P412 HydrophobicContact CG-CB 4.22Å; L377-P412 HydrophobicContact CG-CG 3.85Å; L377-D478 WeakPolarHBondContact CD2-OD1 3.42Å; L377-A481 HydrophobicContact CD1-CB 3.88Å; L377-A481 HydrophobicContact CD2-CB 4.3Å; L377-M482 HydrophobicContact CB-CB 4.29Å
378A96.8Very high94.9Very high47 Ų4739 Ų3939%0.38821%0.212SC..Hα-helixtrans-61.4-29.7174.700000113L374 V375 M376 P382 M482L374-A378 WeakPolarHBondContact O-CB 3.49Å; L374-A378 PolarHBondContact O-N 3.2Å; V375-A378 PolarHBondContact O-N 2.92Å; M376-A378 VanDerWaalsContact C-N 3.33Å; M376-A378 PolarHBondContact O-N 2.84Å; A378-P382 WeakPolarHBondContact O-CD 3.5Å; A378-M482 HydrophobicContact CB-SD 4.31Å
379F96.1Very high94.5Very high131 Ų13142 Ų4258%0.57523%0.226SC*.Hα-helixtrans-81.4-28.2171.8-73.3-68.3000113.2V375 M376 L377 P382 L383V375-F379 HydrophobicContact CG1-CD2 4.18Å; V375-F379 HydrophobicContact CG1-CE2 3.83Å; V375-F379 WeakPolarHBondContact O-CD2 3.46Å; V375-F379 PolarHBondContact O-N 3.23Å; M376-F379 PolarHBondContact O-N 2.79Å; L377-F379 PolarHBondContact O-N 3.4Å; F379-P382 WeakPolarHBondContact O-CD 3.49Å; F379-L383 HydrophobicContact CB-CD1 4.45Å; F379-L383 WeakPolarHBondContact O-CB 3.43Å; F379-L383 WeakPolarHBondContact O-CD1 3.44Å; F379-L383 WeakPolarHBondContact O-CG 3.16Å; F379-L383 PolarHBondContact O-N 2.82Å
380A96.3Very high93.8Very high0 Ų043.7 Ų43.70%023%0.234CC..Hα-helixtrans-62.9-46.7-176.600000112.6M376 L377 L383 L384 A408 I409 D478M376-A380 PolarHBondContact O-N 2.99Å; L377-A380 WeakPolarHBondContact O-CB 3.5Å; L377-A380 PolarHBondContact O-N 3.38Å; A380-L383 PolarHBondContact O-N 3.33Å; A380-L384 WeakPolarHBondContact O-CG 3.38Å; A380-L384 PolarHBondContact O-N 2.9Å; A380-A408 HydrophobicContact CB-CB 3.93Å; A380-I409 HydrophobicContact CB-CG1 4Å; A380-D478 WeakPolarHBondContact CB-OD1 3.36Å
381A92.3Very high92.1Very high13 Ų1350.3 Ų50.311%0.10728%0.275CS..Hα-helixtrans-58.1-50179.300000114.1L377 L383 L384 L385 I475 D478 L479L377-A381 PolarHBondContact O-N 2.87Å; A381-L383 VanDerWaalsContact C-N 3.32Å; A381-L383 PolarHBondContact O-N 2.63Å; A381-L384 PolarHBondContact O-N 3.45Å; A381-L385 PolarHBondContact O-N 2.84Å; A381-I475 HydrophobicContact CB-CG2 4.42Å; A381-D478 WeakPolarHBondContact CB-OD2 3.28Å; A381-D478 PolarHBondContact N-OD2 3.2Å; A381-D478 VanDerWaalsContact N-OD2 3.15Å; A381-L479 HydrophobicContact CB-CD2 4.41Å
382P95Very high90.7Very high76 Ų7648.8 Ų48.849%0.49427%0.271SS..Hα-helixtrans-58.7-38.9172.7-26.133.3000113.8A378 F379 L385 A386A378-P382 WeakPolarHBondContact O-CD 3.5Å; F379-P382 WeakPolarHBondContact O-CD 3.49Å; P382-L385 PolarHBondContact O-N 3.42Å; P382-A386 WeakPolarHBondContact O-CB 3.38Å; P382-A386 PolarHBondContact O-N 3.16Å
383L95.4Very high89Confident36 Ų3648.3 Ų48.319%0.18827%0.267CS..Hα-helixtrans-66.8-41.5178.8-70.6169.6000111.9F379 A380 A381 A386 Y387 L401 C404 A408F379-L383 HydrophobicContact CB-CD1 4.45Å; F379-L383 WeakPolarHBondContact O-CB 3.43Å; F379-L383 WeakPolarHBondContact O-CD1 3.44Å; F379-L383 WeakPolarHBondContact O-CG 3.16Å; F379-L383 PolarHBondContact O-N 2.82Å; A380-L383 PolarHBondContact O-N 3.33Å; A381-L383 VanDerWaalsContact C-N 3.32Å; A381-L383 PolarHBondContact O-N 2.63Å; L383-A386 PolarHBondContact O-N 3.14Å; L383-Y387 WeakPolarHBondContact O-CB 3.39Å; L383-Y387 PolarHBondContact O-N 2.94Å; L383-L401 HydrophobicContact CD2-CD2 3.63Å; L383-C404 HydrophobicContact CD1-CB 4.01Å; L383-C404 HydrophobicContact CD2-CB 3.95Å; L383-A408 HydrophobicContact CD1-CB 3.82Å
384L93.5Very high87.4Confident0 Ų053.7 Ų53.70%030%0.296CS..Hα-helixtrans-62.2-42.3174.7-74173000111.9V305 F309 A380 A381 R388 I409 L474 I475V305-L384 HydrophobicContact CG1-CD1 4.43Å; F309-L384 HydrophobicContact CE2-CD2 3.53Å; F309-L384 HydrophobicContact CZ-CD2 3.49Å; F309-L384 VanDerWaalsContact CZ-CD2 3.49Å; A380-L384 WeakPolarHBondContact O-CG 3.38Å; A380-L384 PolarHBondContact O-N 2.9Å; A381-L384 PolarHBondContact O-N 3.45Å; L384-R388 PolarHBondContact O-N 3.47Å; L384-R388 VanDerWaalsContact O-N 3.09Å; L384-I409 HydrophobicContact CD1-CD1 4.35Å; L384-I409 HydrophobicContact CD2-CD1 3.88Å; L384-I409 HydrophobicContact CG-CD1 4.24Å; L384-L474 HydrophobicContact CD1-CB 4.4Å; L384-I475 HydrophobicContact CB-CD1 4.48Å; L384-I475 HydrophobicContact CB-CG1 3.94Å; L384-I475 HydrophobicContact CD1-CG1 4.18Å
385L92.6Very high86.4Confident71 Ų7153.9 Ų53.937%0.37230%0.3SS..Hα-helixtrans-63.3-47.2174.3-76.7169.7000111.4A381 P382 Y387 R388 F389 I475A381-L385 PolarHBondContact O-N 2.84Å; P382-L385 PolarHBondContact O-N 3.42Å; L385-Y387 PolarHBondContact O-N 3.31Å; L385-R388 WeakPolarHBondContact O-CB 3.49Å; L385-R388 PolarHBondContact O-N 3.35Å; L385-F389 HydrophobicContact CD2-CE2 4.49Å; L385-F389 WeakPolarHBondContact O-CD2 3.35Å; L385-F389 PolarHBondContact O-N 3.25Å; L385-I475 HydrophobicContact CD2-CD1 3.43Å; L385-I475 VanDerWaalsContact CD2-CD1 3.43Å; L385-I475 HydrophobicContact CG-CD1 3.64Å
386A92.4Very high85.8Confident40 Ų4056.5 Ų56.533%0.33131%0.311SS..Hα-helixtrans-59-47.6178.400000111.3P382 L383 R388 F389 M390 L401P382-A386 WeakPolarHBondContact O-CB 3.38Å; P382-A386 PolarHBondContact O-N 3.16Å; L383-A386 PolarHBondContact O-N 3.14Å; A386-R388 VanDerWaalsContact C-N 3.31Å; A386-R388 PolarHBondContact O-N 2.89Å; A386-F389 PolarHBondContact O-N 3.21Å; A386-F389 VanDerWaalsContact O-N 3.15Å; A386-M390 WeakPolarHBondContact O-CG 3.26Å; A386-M390 PolarHBondContact O-N 3.18Å; A386-L401 HydrophobicContact CB-CD1 4.37Å; A386-L401 HydrophobicContact CB-CD2 4.23Å
387Y90.3Very high85.3Confident3 Ų360.7 Ų60.71%0.01233%0.332CS..Hα-helixtrans-60.8-39178.6-171.3-100000112.3Y316 L383 L385 F389 M390 S398 L401 L402 F471Y316-Y387 HydrophobicContact CD1-CE1 4.48Å; Y316-Y387 AromaticContact CE1-CE1 3.7Å; Y316-Y387 HydrophobicContact CE1-CE1 3.7Å; L383-Y387 WeakPolarHBondContact O-CB 3.39Å; L383-Y387 PolarHBondContact O-N 2.94Å; L385-Y387 PolarHBondContact O-N 3.31Å; Y387-F389 VanDerWaalsContact C-N 3.32Å; Y387-F389 PolarHBondContact O-N 3.44Å; Y387-M390 PolarHBondContact O-N 2.95Å; Y387-S398 WeakPolarHBondContact CE2-OG 3.36Å; Y387-L401 HydrophobicContact CD2-CB 4.21Å; Y387-L402 HydrophobicContact CE2-CB 3.91Å; Y387-L402 HydrophobicContact CE2-CD1 4.2Å; Y387-F471 AromaticContact CD1-CE1 3.98Å; Y387-F471 HydrophobicContact CD1-CE1 3.98Å; Y387-F471 AromaticContact CD1-CZ 3.79Å; Y387-F471 HydrophobicContact CD1-CZ 3.79Å; Y387-F471 HydrophobicContact CE1-CZ 4.19Å
388R87.2Confident84.8Confident87 Ų8760.8 Ų60.833%0.32833%0.332SS..Hα-helixtrans-59.4-39.4175.1172.2-178.6172.4-106.8-0.7113L384 L385 A386 S468 F471L384-R388 PolarHBondContact O-N 3.47Å; L384-R388 VanDerWaalsContact O-N 3.09Å; L385-R388 WeakPolarHBondContact O-CB 3.49Å; L385-R388 PolarHBondContact O-N 3.35Å; A386-R388 VanDerWaalsContact C-N 3.31Å; A386-R388 PolarHBondContact O-N 2.89Å; R388-S468 PolarHBondContact NE-OG 3.35Å; R388-S468 PolarHBondContact NH2-OG 3.3Å; R388-F471 HydrophobicContact CB-CD1 4.05Å; R388-F471 HydrophobicContact CB-CD2 4.24Å; R388-F471 HydrophobicContact CB-CE1 4.31Å; R388-F471 HydrophobicContact CB-CG 4.02Å; R388-F471 HydrophobicContact CG-CB 4.49Å; R388-F471 HydrophobicContact CG-CD2 4.25Å; R388-F471 HydrophobicContact CG-CG 4.27Å
389F85.1Confident84.4Confident138 Ų13861 Ų6161%0.60533%0.326SS*.Hα-helixtrans-85.7-9.8-175.9-72.2-66.1000113.7L385 A386 Y387L385-F389 HydrophobicContact CD2-CE2 4.49Å; L385-F389 WeakPolarHBondContact O-CD2 3.35Å; L385-F389 PolarHBondContact O-N 3.25Å; A386-F389 PolarHBondContact O-N 3.21Å; A386-F389 VanDerWaalsContact O-N 3.15Å; Y387-F389 VanDerWaalsContact C-N 3.32Å; Y387-F389 PolarHBondContact O-N 3.44Å
390M81.1Confident84.3Confident42 Ų4258.8 Ų58.821%0.20732%0.32CS..  trans-67.4134.8174.3-72.5-157.578.900111.6A386 Y387 S395 M397 S398 L401A386-M390 WeakPolarHBondContact O-CG 3.26Å; A386-M390 PolarHBondContact O-N 3.18Å; Y387-M390 PolarHBondContact O-N 2.95Å; M390-S395 VanDerWaalsContact CE-OG 3.28Å; M390-S395 WeakPolarHBondContact CE-OG 3.34Å; M390-M397 HydrophobicContact CE-CB 3.64Å; M390-M397 HydrophobicContact CE-CG 3.44Å; M390-M397 VanDerWaalsContact CE-CG 3.44Å; M390-M397 HydrophobicContact SD-CG 4.04Å; M390-S398 WeakPolarHBondContact SD-CA 3.45Å; M390-L401 HydrophobicContact CE-CD1 4.44Å; M390-L401 HydrophobicContact CG-CD1 3.98Å; M390-L401 HydrophobicContact SD-CB 4.33Å; M390-L401 HydrophobicContact SD-CD1 3.18Å; M390-L401 WeakPolarHBondContact SD-CD1 3.25Å; M390-L401 HydrophobicContact SD-CG 4.3Å
391T60.1Low84.1Confident139 Ų13959.9 Ų59.985%0.85333%0.325SS*.SBendtrans-93.1-7.5-174-34.40000113.6
392S68.8Low84.2Confident52 Ų5259.4 Ų59.436%0.36432%0.321SS..  trans-154.4123.6-178.6-178.70000113.3S395 S398S392-S395 PolarHBondContact O-N 3.18Å; S392-S395 PolarHBondContact O-OG 3.4Å; S392-S398 VanDerWaalsContact O-CB 3.26Å; S392-S398 WeakPolarHBondContact O-CB 3.13Å
393T60.5Low84.2Confident4 Ų457.2 Ų57.23%0.02531%0.306CS..THydrogen-bonded Turntrans-75.7-22.7175.959.50000115.1L317 E321 S395 S398 L399L317-T393 HydrophobicContact CD2-CG2 3.68Å; E321-T393 WeakPolarHBondContact CB-OG1 3.24Å; E321-T393 VanDerWaalsContact CD-CB 3.44Å; E321-T393 VanDerWaalsContact CD-N 3.33Å; E321-T393 HydrophobicContact CG-CG2 3.44Å; E321-T393 VanDerWaalsContact CG-CG2 3.44Å; E321-T393 WeakPolarHBondContact CG-OG1 3.27Å; E321-T393 VanDerWaalsContact OE1-CG2 3.25Å; E321-T393 WeakPolarHBondContact OE1-CG2 3.44Å; E321-T393 PolarHBondContact OE1-N 2.97Å; E321-T393 WeakPolarHBondContact OE2-CB 3.47Å; E321-T393 PolarHBondContact OE2-N 2.81Å; E321-T393 PolarHBondContact OE2-OG1 3.02Å; T393-S395 PolarHBondContact O-N 3.5Å; T393-S398 WeakPolarHBondContact CA-OG 3.41Å; T393-L399 WeakPolarHBondContact O-CD2 3.2Å
394N64Low84.2Confident114 Ų11457.8 Ų57.861%0.6131%0.313SS*.THydrogen-bonded Turntrans-77-4.6174.9-70-25.4000112.8
395S76.3Confident84.3Confident38 Ų3857.8 Ų57.827%0.26631%0.313SS..SBendtrans-71.4135.1168.471.20000109.9M390 S392 T393 M397 S398 L399M390-S395 VanDerWaalsContact CE-OG 3.28Å; M390-S395 WeakPolarHBondContact CE-OG 3.34Å; S392-S395 PolarHBondContact O-N 3.18Å; S392-S395 PolarHBondContact O-OG 3.4Å; T393-S395 PolarHBondContact O-N 3.5Å; S395-M397 PolarHBondContact O-N 3.27Å; S395-S398 PolarHBondContact O-N 3.35Å; S395-S398 PolarHBondContact OG-N 3.38Å; S395-L399 PolarHBondContact O-N 3.04Å
396L85.2Confident84.5Confident128 Ų12854.4 Ų54.467%0.6730%0.295SS*.Hα-helixtrans-48-36.5173177.764.2000111.8S398 L399 I400L396-S398 PolarHBondContact O-N 2.93Å; L396-L399 PolarHBondContact O-N 3.48Å; L396-I400 HydrophobicContact CD1-CD1 4.24Å; L396-I400 HydrophobicContact CD1-CG1 4.49Å; L396-I400 HydrophobicContact CG-CD1 3.89Å; L396-I400 VanDerWaalsContact O-CG1 3.27Å; L396-I400 WeakPolarHBondContact O-CG1 3.33Å; L396-I400 PolarHBondContact O-N 2.91Å
397M85.6Confident84.7Confident115 Ų11553.5 Ų53.557%0.56729%0.287SS*.Hα-helixtrans-61.4-39.5177.4-179.564.887.600112.9M390 S395 I400 L401M390-M397 HydrophobicContact CE-CB 3.64Å; M390-M397 HydrophobicContact CE-CG 3.44Å; M390-M397 VanDerWaalsContact CE-CG 3.44Å; M390-M397 HydrophobicContact SD-CG 4.04Å; S395-M397 PolarHBondContact O-N 3.27Å; M397-I400 PolarHBondContact O-N 3.38Å; M397-L401 HydrophobicContact CG-CD1 4.03Å; M397-L401 WeakPolarHBondContact O-CB 3.46Å; M397-L401 WeakPolarHBondContact O-CG 3.31Å; M397-L401 PolarHBondContact O-N 3.37Å; M397-L401 HydrophobicContact SD-CD1 4.2Å; M397-L401 HydrophobicContact SD-CG 4.46Å
398S86.2Confident85.1Confident2 Ų253.6 Ų53.61%0.01429%0.288CS..Hα-helixtrans-72.8-37.4179.6-174.60000111.8Y387 M390 S392 T393 S395 L396 I400 L401 L402Y387-S398 WeakPolarHBondContact CE2-OG 3.36Å; M390-S398 WeakPolarHBondContact SD-CA 3.45Å; S392-S398 VanDerWaalsContact O-CB 3.26Å; S392-S398 WeakPolarHBondContact O-CB 3.13Å; T393-S398 WeakPolarHBondContact CA-OG 3.41Å; S395-S398 PolarHBondContact O-N 3.35Å; S395-S398 PolarHBondContact OG-N 3.38Å; L396-S398 PolarHBondContact O-N 2.93Å; S398-I400 VanDerWaalsContact C-N 3.32Å; S398-I400 PolarHBondContact O-N 2.93Å; S398-L401 PolarHBondContact O-N 3.12Å; S398-L402 WeakPolarHBondContact O-CB 3.33Å; S398-L402 PolarHBondContact O-N 3.33Å
399L89.1Confident85.5Confident51 Ų5149.6 Ų49.627%0.26727%0.273SS..Hα-helixtrans-60.7-42.9172.5-54.5-178.4000111.4L331 L334 T393 S395 L396 T403L331-L399 HydrophobicContact CD2-CD2 3.61Å; L334-L399 HydrophobicContact CD1-CB 3.76Å; L334-L399 HydrophobicContact CD1-CD2 3.52Å; L334-L399 HydrophobicContact CD1-CG 4.13Å; T393-L399 WeakPolarHBondContact O-CD2 3.2Å; S395-L399 PolarHBondContact O-N 3.04Å; L396-L399 PolarHBondContact O-N 3.48Å; L399-T403 PolarHBondContact O-N 2.73Å; L399-T403 VanDerWaalsContact O-N 3.17Å; L399-T403 PolarHBondContact O-OG1 2.96Å
400I92.9Very high86Confident85 Ų8543.3 Ų43.344%0.43625%0.246SC..Hα-helixtrans-64.2-47.9174.7-68.8167.5000110.3L396 M397 S398 L402 T403 C404L396-I400 HydrophobicContact CD1-CD1 4.24Å; L396-I400 HydrophobicContact CD1-CG1 4.49Å; L396-I400 HydrophobicContact CG-CD1 3.89Å; L396-I400 VanDerWaalsContact O-CG1 3.27Å; L396-I400 WeakPolarHBondContact O-CG1 3.33Å; L396-I400 PolarHBondContact O-N 2.91Å; M397-I400 PolarHBondContact O-N 3.38Å; S398-I400 VanDerWaalsContact C-N 3.32Å; S398-I400 PolarHBondContact O-N 2.93Å; I400-L402 PolarHBondContact O-N 3.19Å; I400-T403 WeakPolarHBondContact O-CB 3.36Å; I400-T403 PolarHBondContact O-N 2.92Å; I400-C404 PolarHBondContact O-N 3.24Å; I400-C404 PolarHBondContact O-SG 2.86Å; I400-C404 VanDerWaalsContact O-SG 3.33Å
401L93.3Very high86.8Confident23 Ų2341.3 Ų41.312%0.1224%0.236CC..Hα-helixtrans-63.4-40.1-179.2-84.6167000112.6L383 A386 Y387 M390 M397 S398 T403 C404 C405L383-L401 HydrophobicContact CD2-CD2 3.63Å; A386-L401 HydrophobicContact CB-CD1 4.37Å; A386-L401 HydrophobicContact CB-CD2 4.23Å; Y387-L401 HydrophobicContact CD2-CB 4.21Å; M390-L401 HydrophobicContact CE-CD1 4.44Å; M390-L401 HydrophobicContact CG-CD1 3.98Å; M390-L401 HydrophobicContact SD-CB 4.33Å; M390-L401 HydrophobicContact SD-CD1 3.18Å; M390-L401 WeakPolarHBondContact SD-CD1 3.25Å; M390-L401 HydrophobicContact SD-CG 4.3Å; M397-L401 HydrophobicContact CG-CD1 4.03Å; M397-L401 WeakPolarHBondContact O-CB 3.46Å; M397-L401 WeakPolarHBondContact O-CG 3.31Å; M397-L401 PolarHBondContact O-N 3.37Å; M397-L401 HydrophobicContact SD-CD1 4.2Å; M397-L401 HydrophobicContact SD-CG 4.46Å; S398-L401 PolarHBondContact O-N 3.12Å; L401-T403 VanDerWaalsContact C-N 3.31Å; L401-T403 PolarHBondContact O-N 3.21Å; L401-C404 PolarHBondContact O-N 2.86Å; L401-C405 WeakPolarHBondContact O-CB 3.44Å; L401-C405 PolarHBondContact O-N 3.24Å; L401-C405 PolarHBondContact O-SG 3.46Å
402L93Very high88.5Confident4 Ų434.7 Ų34.72%0.02120%0.195CC..Hα-helixtrans-61.9-40.5175-175.159.2000111.7F309 L313 L334 F335 Y387 S398 I400 C405 G406F309-L402 HydrophobicContact CE1-CD1 4.33Å; L313-L402 HydrophobicContact CD1-CD1 4.01Å; L313-L402 HydrophobicContact CD2-CD1 3.92Å; L313-L402 HydrophobicContact CD2-CD2 4.25Å; L334-L402 HydrophobicContact CB-CD2 4.12Å; L334-L402 HydrophobicContact CB-CG 4.37Å; F335-L402 HydrophobicContact CB-CD1 4.13Å; F335-L402 HydrophobicContact CB-CG 4.23Å; F335-L402 HydrophobicContact CD2-CD1 4.08Å; Y387-L402 HydrophobicContact CE2-CB 3.91Å; Y387-L402 HydrophobicContact CE2-CD1 4.2Å; S398-L402 WeakPolarHBondContact O-CB 3.33Å; S398-L402 PolarHBondContact O-N 3.33Å; I400-L402 PolarHBondContact O-N 3.19Å; L402-C405 PolarHBondContact O-N 3.17Å; L402-G406 PolarHBondContact O-N 2.8Å
403T95.2Very high89.8Confident29 Ų2932.6 Ų32.618%0.17818%0.18CC..Hα-helixtrans-65.1-42.4174.3-530000111.1G338 I341 L399 I400 L401 G406 S407G338-T403 WeakPolarHBondContact CA-O 3.44Å; I341-T403 HydrophobicContact CD1-CG2 4.34Å; L399-T403 PolarHBondContact O-N 2.73Å; L399-T403 VanDerWaalsContact O-N 3.17Å; L399-T403 PolarHBondContact O-OG1 2.96Å; I400-T403 WeakPolarHBondContact O-CB 3.36Å; I400-T403 PolarHBondContact O-N 2.92Å; L401-T403 VanDerWaalsContact C-N 3.31Å; L401-T403 PolarHBondContact O-N 3.21Å; T403-G406 PolarHBondContact O-N 3.33Å; T403-S407 PolarHBondContact O-N 2.6Å
404C96.4Very high91.5Very high49 Ų4932.5 Ų32.533%0.33118%0.179SC..Hα-helixtrans-64.4-42.5175.9-71.10000112.4L383 I400 L401 S407 A408L383-C404 HydrophobicContact CD1-CB 4.01Å; L383-C404 HydrophobicContact CD2-CB 3.95Å; I400-C404 PolarHBondContact O-N 3.24Å; I400-C404 PolarHBondContact O-SG 2.86Å; I400-C404 VanDerWaalsContact O-SG 3.33Å; L401-C404 PolarHBondContact O-N 2.86Å; C404-S407 PolarHBondContact O-N 2.85Å; C404-A408 WeakPolarHBondContact O-CB 3.39Å; C404-A408 PolarHBondContact O-N 3.3Å
405C95.7Very high93Very high0 Ų027.2 Ų27.20%015%0.151CC..Hα-helixtrans-57.6-48.7172.2-74.30000110.7F335 L401 L402 S407 A408 I409F335-C405 HydrophobicContact CE2-CB 4.38Å; L401-C405 WeakPolarHBondContact O-CB 3.44Å; L401-C405 PolarHBondContact O-N 3.24Å; L401-C405 PolarHBondContact O-SG 3.46Å; L402-C405 PolarHBondContact O-N 3.17Å; C405-S407 VanDerWaalsContact C-N 3.29Å; C405-S407 PolarHBondContact O-N 2.96Å; C405-A408 PolarHBondContact O-N 2.83Å; C405-I409 HydrophobicContact CB-CD1 4.32Å; C405-I409 WeakPolarHBondContact O-CB 3.49Å; C405-I409 WeakPolarHBondContact O-CD1 3.19Å; C405-I409 WeakPolarHBondContact O-CG1 3.47Å; C405-I409 PolarHBondContact O-N 3.01Å
406G96.3Very high94Very high0 Ų025.4 Ų25.40%014%0.138CC..Hα-helixtrans-55.6-43.817600000112.4F335 G338 G339 L402 T403 N410F335-G406 VanDerWaalsContact CD2-CA 3.47Å; F335-G406 VanDerWaalsContact CE2-CA 3.49Å; F335-G406 WeakPolarHBondContact O-CA 3.23Å; G338-G406 VanDerWaalsContact C-C 3.48Å; G339-G406 WeakPolarHBondContact CA-O 3.35Å; L402-G406 PolarHBondContact O-N 2.8Å; T403-G406 PolarHBondContact O-N 3.33Å; G406-N410 WeakPolarHBondContact O-CB 3.48Å; G406-N410 PolarHBondContact O-N 3.29Å; G406-N410 PolarHBondContact O-ND2 3.37Å
407S97.4Very high94.5Very high21 Ų2119.4 Ų19.415%0.14711%0.107CC..Hα-helixtrans-63.9-55176.5-178.50000112.3G338 G342 M376 T403 C404 C405 I409 G411G338-S407 VanDerWaalsContact C-N 3.3Å; G338-S407 WeakPolarHBondContact O-CA 3.21Å; G338-S407 WeakPolarHBondContact O-CB 3.48Å; G338-S407 PolarHBondContact O-N 2.88Å; G342-S407 WeakPolarHBondContact CA-OG 3.46Å; G342-S407 PolarHBondContact N-OG 3.32Å; M376-S407 WeakPolarHBondContact CE-O 3.31Å; T403-S407 PolarHBondContact O-N 2.6Å; C404-S407 PolarHBondContact O-N 2.85Å; C405-S407 VanDerWaalsContact C-N 3.29Å; C405-S407 PolarHBondContact O-N 2.96Å; S407-I409 VanDerWaalsContact C-N 3.34Å; S407-I409 PolarHBondContact O-N 3.18Å; S407-G411 PolarHBondContact O-N 3.29Å
408A97.3Very high94.9Very high5 Ų514 Ų144%0.0418%0.08CC..Hα-helixtrans-62.4-37-175.300000113.3A380 L383 C404 C405 P412A380-A408 HydrophobicContact CB-CB 3.93Å; L383-A408 HydrophobicContact CD1-CB 3.82Å; C404-A408 WeakPolarHBondContact O-CB 3.39Å; C404-A408 PolarHBondContact O-N 3.3Å; C405-A408 PolarHBondContact O-N 2.83Å; A408-P412 WeakPolarHBondContact O-CD 3.33Å; A408-P412 WeakPolarHBondContact O-CG 3.27Å
409I96Very high95.2Very high2 Ų213.9 Ų13.91%0.018%0.079CC..Hα-helixtrans-85.2-48.2-177.2-64.3161.1000111.3V305 F309 F335 A380 L384 C405 S407 G411V305-I409 HydrophobicContact CB-CG2 4.13Å; V305-I409 HydrophobicContact CG1-CD1 3.79Å; V305-I409 HydrophobicContact CG1-CG1 4.18Å; V305-I409 HydrophobicContact CG1-CG2 3.81Å; F309-I409 HydrophobicContact CD2-CD1 4.45Å; F309-I409 HydrophobicContact CE2-CD1 4.09Å; F335-I409 HydrophobicContact CE2-CD1 4.22Å; F335-I409 HydrophobicContact CZ-CG2 4.49Å; A380-I409 HydrophobicContact CB-CG1 4Å; L384-I409 HydrophobicContact CD1-CD1 4.35Å; L384-I409 HydrophobicContact CD2-CD1 3.88Å; L384-I409 HydrophobicContact CG-CD1 4.24Å; C405-I409 HydrophobicContact CB-CD1 4.32Å; C405-I409 WeakPolarHBondContact O-CB 3.49Å; C405-I409 WeakPolarHBondContact O-CD1 3.19Å; C405-I409 WeakPolarHBondContact O-CG1 3.47Å; C405-I409 PolarHBondContact O-N 3.01Å; S407-I409 VanDerWaalsContact C-N 3.34Å; S407-I409 PolarHBondContact O-N 3.18Å; I409-G411 VanDerWaalsContact C-N 3.33Å; I409-G411 PolarHBondContact O-N 2.87Å
410N96.3Very high95.5Very high7 Ų711.6 Ų11.64%0.0377%0.067CC..Hα-helixtrans-78.2-18.2-175.3-63.6-36.1000112.7S306 F335 G406 Y413 A414S306-N410 WeakPolarHBondContact CB-OD1 3.35Å; S306-N410 PolarHBondContact OG-OD1 3.48Å; F335-N410 WeakPolarHBondContact CE1-ND2 3.38Å; G406-N410 WeakPolarHBondContact O-CB 3.48Å; G406-N410 PolarHBondContact O-N 3.29Å; G406-N410 PolarHBondContact O-ND2 3.37Å; N410-Y413 HydrophobicContact CB-CD1 4.35Å; N410-A414 WeakPolarHBondContact O-CB 3.36Å; N410-A414 PolarHBondContact O-N 3.48Å
411G96.7Very high95.5Very high0 Ų07.5 Ų7.50%05%0.047CC..Hα-helixtrans-57.9-63.9172.800000112.4I346 S407 I409 Y413 A414 L415I346-G411 WeakPolarHBondContact CG2-O 3.41Å; S407-G411 PolarHBondContact O-N 3.29Å; I409-G411 VanDerWaalsContact C-N 3.33Å; I409-G411 PolarHBondContact O-N 2.87Å; G411-Y413 VanDerWaalsContact C-N 3.26Å; G411-Y413 PolarHBondContact O-N 2.89Å; G411-A414 WeakPolarHBondContact O-CB 3.46Å; G411-A414 PolarHBondContact O-N 2.97Å; G411-L415 PolarHBondContact O-N 3.19Å
412P97.1Very high95.4Very high0 Ų06.4 Ų6.40%04%0.041CC..Hα-helixtrans-52.3-43.2175.5-28.735.8000113.2T302 I346 C373 M376 L377 A408 L415 V416T302-P412 HydrophobicContact CG2-CB 4.21Å; I346-P412 HydrophobicContact CD1-CB 4.48Å; I346-P412 HydrophobicContact CD1-CG 4.17Å; C373-P412 HydrophobicContact CB-CB 4.15Å; M376-P412 HydrophobicContact CB-CG 3.8Å; L377-P412 HydrophobicContact CD2-CB 4.12Å; L377-P412 HydrophobicContact CD2-CG 3.87Å; L377-P412 HydrophobicContact CG-CB 4.22Å; L377-P412 HydrophobicContact CG-CG 3.85Å; A408-P412 WeakPolarHBondContact O-CD 3.33Å; A408-P412 WeakPolarHBondContact O-CG 3.27Å; P412-L415 PolarHBondContact O-N 2.93Å; P412-V416 WeakPolarHBondContact O-CB 3.49Å; P412-V416 WeakPolarHBondContact O-CG2 3.18Å; P412-V416 PolarHBondContact O-N 3.3Å
413Y95.7Very high95.2Very high8 Ų87 Ų73%0.0314%0.044CC..Hα-helixtrans-55.7-51.6173.8157.1-104.1000112T185 L299 K303 N410 G411 L415 V416 T417T185-Y413 HydrophobicContact CG2-CE1 4.06Å; L299-Y413 HydrophobicContact CD1-CD2 3.73Å; L299-Y413 HydrophobicContact CD1-CE2 4.44Å; K303-Y413 HydrophobicContact CB-CD2 4.24Å; K303-Y413 HydrophobicContact CD-CD2 4.35Å; K303-Y413 HydrophobicContact CD-CE2 3.88Å; K303-Y413 HydrophobicContact CG-CD2 4Å; K303-Y413 HydrophobicContact CG-CE2 3.85Å; N410-Y413 HydrophobicContact CB-CD1 4.35Å; G411-Y413 VanDerWaalsContact C-N 3.26Å; G411-Y413 PolarHBondContact O-N 2.89Å; Y413-L415 PolarHBondContact O-N 3.46Å; Y413-V416 PolarHBondContact O-N 3.32Å; Y413-T417 HydrophobicContact CE2-CG2 4.47Å; Y413-T417 WeakPolarHBondContact O-CB 3.4Å; Y413-T417 VanDerWaalsContact O-CG2 3.29Å; Y413-T417 WeakPolarHBondContact O-CG2 3.38Å; Y413-T417 PolarHBondContact O-N 2.96Å
414A96.1Very high95Very high1 Ų15.6 Ų5.61%0.0084%0.035CC..Hα-helixtrans-60.1-46.8179.400000112N182 N410 G411 V416 T417 T418N182-A414 HydrophobicContact CB-CB 4.23Å; N182-A414 WeakPolarHBondContact ND2-CA 2.94Å; N182-A414 WeakPolarHBondContact ND2-CB 3.34Å; N410-A414 WeakPolarHBondContact O-CB 3.36Å; N410-A414 PolarHBondContact O-N 3.48Å; G411-A414 WeakPolarHBondContact O-CB 3.46Å; G411-A414 PolarHBondContact O-N 2.97Å; A414-V416 VanDerWaalsContact C-N 3.35Å; A414-V416 PolarHBondContact O-N 3.24Å; A414-T417 WeakPolarHBondContact O-CG2 3.47Å; A414-T418 WeakPolarHBondContact O-CB 3.5Å; A414-T418 PolarHBondContact O-N 3.48Å; A414-T418 VanDerWaalsContact O-N 3.15Å; A414-T418 PolarHBondContact O-OG1 3.33Å
415L96.4Very high94.7Very high3 Ų33.5 Ų3.52%0.0162%0.022CC..Hα-helixtrans-63.7-43.2-178.3-171.968.6000111.8I346 S350 R369 A372 G411 P412 Y413 A419 V420I346-L415 HydrophobicContact CD1-CB 3.98Å; I346-L415 HydrophobicContact CD1-CD2 3.77Å; I346-L415 HydrophobicContact CD1-CG 4.46Å; I346-L415 HydrophobicContact CG1-CB 4.49Å; I346-L415 HydrophobicContact CG1-CD2 3.97Å; I346-L415 HydrophobicContact CG2-CB 3.85Å; I346-L415 HydrophobicContact CG2-CD1 4.39Å; S350-L415 VanDerWaalsContact OG-CD1 3.32Å; S350-L415 WeakPolarHBondContact OG-CD1 3.25Å; R369-L415 HydrophobicContact CB-CD2 3.93Å; R369-L415 HydrophobicContact CG-CD2 4.25Å; A372-L415 HydrophobicContact CB-CD2 4.37Å; G411-L415 PolarHBondContact O-N 3.19Å; P412-L415 PolarHBondContact O-N 2.93Å; Y413-L415 PolarHBondContact O-N 3.46Å; L415-A419 HydrophobicContact CD1-CB 4.05Å; L415-A419 PolarHBondContact O-N 3.06Å; L415-V420 HydrophobicContact CG-CG2 4.25Å; L415-V420 PolarHBondContact O-N 2.98Å
416V96.8Very high94.2Very high0 Ų04 Ų40%03%0.025CC..Iπ-helixtrans-74.5-43.3-173.6177.40000110.7Y295 L298 L299 P412 Y413 A414 T418 V420 S421 I444Y295-V416 HydrophobicContact CD1-CG1 4.07Å; Y295-V416 HydrophobicContact CD1-CG2 4.11Å; Y295-V416 HydrophobicContact CE1-CG2 4.35Å; L298-V416 HydrophobicContact CD2-CG2 3.66Å; L299-V416 HydrophobicContact CB-CG1 3.84Å; L299-V416 HydrophobicContact CD1-CB 4.24Å; L299-V416 HydrophobicContact CD1-CG1 4.26Å; L299-V416 HydrophobicContact CD2-CG1 4.35Å; L299-V416 HydrophobicContact CG-CG1 4.37Å; P412-V416 WeakPolarHBondContact O-CB 3.49Å; P412-V416 WeakPolarHBondContact O-CG2 3.18Å; P412-V416 PolarHBondContact O-N 3.3Å; Y413-V416 PolarHBondContact O-N 3.32Å; A414-V416 VanDerWaalsContact C-N 3.35Å; A414-V416 PolarHBondContact O-N 3.24Å; V416-T418 VanDerWaalsContact C-N 3.3Å; V416-T418 PolarHBondContact O-N 2.9Å; V416-V420 HydrophobicContact CG2-CG2 4.27Å; V416-S421 PolarHBondContact O-N 3.32Å; V416-I444 HydrophobicContact CG1-CG2 4.21Å
417T94.8Very high93.8Very high2 Ų24.8 Ų4.81%0.0123%0.029CC..Iπ-helixtrans-65.5-34.7178.8-163.30000112W158 N182 Y413 A414 S421W158-T417 HydrophobicContact CH2-CG2 4.15Å; W158-T417 HydrophobicContact CZ2-CG2 3.91Å; W158-T417 VanDerWaalsContact CZ2-O 3.31Å; W158-T417 WeakPolarHBondContact CZ2-O 3.16Å; W158-T417 WeakPolarHBondContact CZ2-OG1 3.31Å; N182-T417 WeakPolarHBondContact OD1-CG2 3.38Å; Y413-T417 HydrophobicContact CE2-CG2 4.47Å; Y413-T417 WeakPolarHBondContact O-CB 3.4Å; Y413-T417 VanDerWaalsContact O-CG2 3.29Å; Y413-T417 WeakPolarHBondContact O-CG2 3.38Å; Y413-T417 PolarHBondContact O-N 2.96Å; A414-T417 WeakPolarHBondContact O-CG2 3.47Å; T417-S421 WeakPolarHBondContact O-CB 3.18Å; T417-S421 PolarHBondContact O-OG 3.06Å
418T94.2Very high93.2Very high2 Ų25 Ų51%0.0123%0.031CC..Iπ-helixtrans-100-78.2-177.359.10000114.2W158 M178 W181 N182 A414 V416 S421 A422W158-T418 HydrophobicContact CH2-CG2 3.63Å; W158-T418 HydrophobicContact CZ2-CG2 4.05Å; M178-T418 WeakPolarHBondContact CB-OG1 3.15Å; W181-T418 HydrophobicContact CE3-CG2 3.95Å; W181-T418 HydrophobicContact CZ3-CG2 3.92Å; N182-T418 HydrophobicContact CB-CG2 3.82Å; A414-T418 WeakPolarHBondContact O-CB 3.5Å; A414-T418 PolarHBondContact O-N 3.48Å; A414-T418 VanDerWaalsContact O-N 3.15Å; A414-T418 PolarHBondContact O-OG1 3.33Å; V416-T418 VanDerWaalsContact C-N 3.3Å; V416-T418 PolarHBondContact O-N 2.9Å; T418-S421 PolarHBondContact O-OG 3.25Å; T418-A422 WeakPolarHBondContact O-CB 3.49Å; T418-A422 PolarHBondContact O-N 3.15Å; T418-A422 VanDerWaalsContact O-N 3.08Å
419A93.1Very high92.6Very high0 Ų06.9 Ų6.90%05%0.046CC..Iπ-helixtrans-72.3-39.1-165.800000112.3M178 R369 L415 D423M178-A419 HydrophobicContact CB-CB 3.98Å; M178-A419 HydrophobicContact CG-CB 4.24Å; R369-A419 VanDerWaalsContact CZ-CB 3.48Å; L415-A419 HydrophobicContact CD1-CB 4.05Å; L415-A419 PolarHBondContact O-N 3.06Å; A419-D423 VanDerWaalsContact O-CB 3.31Å; A419-D423 WeakPolarHBondContact O-CB 3.31Å; A419-D423 PolarHBondContact O-N 3.32Å
420V94.3Very high92Very high2 Ų27.5 Ų7.51%0.0125%0.049CC..Iπ-helixtrans-66.1-51.2176.2174.50000110.9Y295 R369 L415 V416 A422 D423 L424Y295-V420 HydrophobicContact CD1-CG1 3.7Å; Y295-V420 HydrophobicContact CD1-CG2 4.46Å; Y295-V420 HydrophobicContact CD2-CG1 3.58Å; Y295-V420 HydrophobicContact CE1-CG1 3.77Å; Y295-V420 HydrophobicContact CE1-CG2 3.99Å; Y295-V420 HydrophobicContact CE2-CG1 3.64Å; Y295-V420 HydrophobicContact CG-CG1 3.59Å; R369-V420 HydrophobicContact CB-CG2 3.94Å; R369-V420 VanDerWaalsContact CD-CG2 3.49Å; R369-V420 HydrophobicContact CG-CG2 4.3Å; L415-V420 HydrophobicContact CG-CG2 4.25Å; L415-V420 PolarHBondContact O-N 2.98Å; V416-V420 HydrophobicContact CG2-CG2 4.27Å; V420-A422 PolarHBondContact O-N 2.96Å; V420-D423 PolarHBondContact O-N 3.13Å; V420-L424 HydrophobicContact CG1-CD1 3.69Å; V420-L424 HydrophobicContact CG1-CG 4.19Å; V420-L424 WeakPolarHBondContact O-CG 3.44Å; V420-L424 PolarHBondContact O-N 2.87Å
421S93.2Very high91.1Very high0 Ų010.1 Ų10.10%06%0.063CC..Hα-helixtrans-56.6-41.4-17969.30000111V416 T417 T418 G425V416-S421 PolarHBondContact O-N 3.32Å; T417-S421 WeakPolarHBondContact O-CB 3.18Å; T417-S421 PolarHBondContact O-OG 3.06Å; T418-S421 PolarHBondContact O-OG 3.25Å; S421-G425 PolarHBondContact O-N 3.22Å
422A90.6Very high89.9Confident0 Ų013.7 Ų13.70%010%0.099CC..Hα-helixtrans-75.7-32.3-177.500000112.1R174 M178 T418 V420 G425 T426 L437R174-A422 VanDerWaalsContact CZ-C 3.44Å; R174-A422 PolarHBondContact NH1-O 3.08Å; R174-A422 PolarHBondContact NH2-O 3.11Å; M178-A422 HydrophobicContact CE-CB 4.29Å; T418-A422 WeakPolarHBondContact O-CB 3.49Å; T418-A422 PolarHBondContact O-N 3.15Å; T418-A422 VanDerWaalsContact O-N 3.08Å; V420-A422 PolarHBondContact O-N 2.96Å; A422-G425 PolarHBondContact O-N 3.02Å; A422-T426 WeakPolarHBondContact O-CB 3.44Å; A422-T426 WeakPolarHBondContact O-CG2 3.44Å; A422-T426 PolarHBondContact O-N 3.46Å; A422-T426 VanDerWaalsContact O-N 3.14Å; A422-T426 PolarHBondContact O-OG1 3.21Å; A422-L437 HydrophobicContact CB-CD1 3.91Å
423D90.3Very high88.6Confident15 Ų1522.8 Ų22.88%0.0813%0.134CC..Hα-helixtrans-68.6-44.2171.5-78.3-10.4000112.7R174 T365 R369 A419 V420 G425 T426 Q427R174-D423 WeakPolarHBondContact CD-OD1 3.33Å; R174-D423 IonicContact CZ-OD1 3.7Å; R174-D423 IonicContact NE-OD1 2.71Å; R174-D423 IonicContact NH1-OD1 3.72Å; R174-D423 PolarHBondContact NH1-OD1 3.29Å; T365-D423 WeakPolarHBondContact CG2-OD2 3.29Å; R369-D423 IonicContact CZ-OD2 3.67Å; R369-D423 IonicContact NE-OD2 3.72Å; R369-D423 PolarHBondContact NE-OD2 3.05Å; R369-D423 IonicContact NH2-OD1 3.96Å; R369-D423 IonicContact NH2-OD2 2.84Å; R369-D423 PolarHBondContact NH2-OD2 3.1Å; A419-D423 VanDerWaalsContact O-CB 3.31Å; A419-D423 WeakPolarHBondContact O-CB 3.31Å; A419-D423 PolarHBondContact O-N 3.32Å; V420-D423 PolarHBondContact O-N 3.13Å; D423-G425 VanDerWaalsContact C-N 3.25Å; D423-G425 PolarHBondContact O-N 2.96Å; D423-T426 CarbonylContact O-C 3.51Å; D423-T426 PolarHBondContact O-N 3.15Å; D423-T426 VanDerWaalsContact O-N 3.13Å; D423-Q427 PolarHBondContact O-N 3.02Å
424L91.4Very high87.8Confident0 Ų024.2 Ų24.20%014%0.143CC..Hα-helixtrans-63-36.8173.9-65.7172.5000111.2V292 Y295 I366 V420 T426 Q427 I440 I444V292-L424 HydrophobicContact CG2-CB 4.23Å; V292-L424 HydrophobicContact CG2-CD1 4.1Å; Y295-L424 HydrophobicContact CD2-CD1 3.81Å; Y295-L424 HydrophobicContact CE2-CD1 4.47Å; Y295-L424 HydrophobicContact CG-CD1 4.45Å; I366-L424 HydrophobicContact CD1-CD2 3.84Å; I366-L424 HydrophobicContact CG1-CD2 4.2Å; V420-L424 HydrophobicContact CG1-CD1 3.69Å; V420-L424 HydrophobicContact CG1-CG 4.19Å; V420-L424 WeakPolarHBondContact O-CG 3.44Å; V420-L424 PolarHBondContact O-N 2.87Å; L424-T426 VanDerWaalsContact C-N 3.26Å; L424-T426 PolarHBondContact O-N 3.01Å; L424-Q427 WeakPolarHBondContact O-CG 3.46Å; L424-Q427 PolarHBondContact O-NE2 3.04Å; L424-Q427 VanDerWaalsContact O-NE2 3.16Å; L424-I440 HydrophobicContact CB-CG2 3.92Å; L424-I444 HydrophobicContact CD1-CD1 3.82Å
425G88.8Confident87Confident6 Ų627 Ų276%0.06215%0.154CC..Hα-helixtrans-65-21.7173.800000115.5S421 A422 D423S421-G425 PolarHBondContact O-N 3.22Å; A422-G425 PolarHBondContact O-N 3.02Å; D423-G425 VanDerWaalsContact C-N 3.25Å; D423-G425 PolarHBondContact O-N 2.96Å
426T86.5Confident86.7Confident10 Ų1027 Ų276%0.06115%0.154CC..THydrogen-bonded Turntrans-128.616.4-172.856.90000112.7K171 R174 L271 A422 D423 L424 L437K171-T426 WeakPolarHBondContact CE-O 2.94Å; K171-T426 WeakPolarHBondContact CE-OG1 3.47Å; K171-T426 PolarHBondContact NZ-O 3.46Å; R174-T426 PolarHBondContact NH1-OG1 3.4Å; L271-T426 HydrophobicContact CD1-CG2 4.16Å; A422-T426 WeakPolarHBondContact O-CB 3.44Å; A422-T426 WeakPolarHBondContact O-CG2 3.44Å; A422-T426 PolarHBondContact O-N 3.46Å; A422-T426 VanDerWaalsContact O-N 3.14Å; A422-T426 PolarHBondContact O-OG1 3.21Å; D423-T426 CarbonylContact O-C 3.51Å; D423-T426 PolarHBondContact O-N 3.15Å; D423-T426 VanDerWaalsContact O-N 3.13Å; L424-T426 VanDerWaalsContact C-N 3.26Å; L424-T426 PolarHBondContact O-N 3.01Å; T426-L437 HydrophobicContact CG2-CD1 4.26Å
427Q87.1Confident86.3Confident16 Ų1627.4 Ų27.48%0.07516%0.156CC..  trans-58.9152.2179.464.7-176.4-47.100111.6D423 L424 A429 L430 L431D423-Q427 PolarHBondContact O-N 3.02Å; L424-Q427 WeakPolarHBondContact O-CG 3.46Å; L424-Q427 PolarHBondContact O-NE2 3.04Å; L424-Q427 VanDerWaalsContact O-NE2 3.16Å; Q427-A429 HydrophobicContact CG-CB 4.23Å; Q427-A429 PolarHBondContact O-N 3.01Å; Q427-L430 HydrophobicContact CG-CB 4.41Å; Q427-L430 HydrophobicContact CG-CD1 3.82Å; Q427-L430 HydrophobicContact CG-CG 3.76Å; Q427-L430 PolarHBondContact O-N 2.95Å; Q427-L431 PolarHBondContact O-N 2.84Å
428S84.5Confident86.1Confident27 Ų2727.4 Ų27.419%0.18916%0.156CC..THydrogen-bonded Turntrans-58.6-25.5-174.8-50.10000113N358 D362 L430N358-S428 VanDerWaalsContact C-OG 3.3Å; N358-S428 WeakPolarHBondContact CA-OG 3.34Å; N358-S428 PolarHBondContact N-OG 2.9Å; D362-S428 WeakPolarHBondContact OD2-CA 3.38Å; D362-S428 WeakPolarHBondContact OD2-CB 3.4Å; D362-S428 PolarHBondContact OD2-N 3.41Å; D362-S428 PolarHBondContact OD2-OG 3.49Å; S428-L430 PolarHBondContact O-N 3.38Å
429A83.8Confident86Confident43 Ų4327.4 Ų27.436%0.35516%0.156SC..THydrogen-bonded Turntrans-65.6-21.517600000114.2L359 Q427L359-A429 HydrophobicContact CD2-CB 4.03Å; Q427-A429 HydrophobicContact CG-CB 4.23Å; Q427-A429 PolarHBondContact O-N 3.01Å
430L84.4Confident86Confident15 Ų1527.4 Ų27.48%0.07916%0.156CC..THydrogen-bonded Turntrans-105.5-20.5-176.2-58.7177.6000113I281 L289 Q427 S428 G432 R433 T434 A436 I440I281-L430 HydrophobicContact CD1-CD2 4.33Å; L289-L430 HydrophobicContact CD1-CD1 3.87Å; L289-L430 HydrophobicContact CD1-CD2 4.29Å; L289-L430 HydrophobicContact CD2-CD2 4.22Å; Q427-L430 HydrophobicContact CG-CB 4.41Å; Q427-L430 HydrophobicContact CG-CD1 3.82Å; Q427-L430 HydrophobicContact CG-CG 3.76Å; Q427-L430 PolarHBondContact O-N 2.95Å; S428-L430 PolarHBondContact O-N 3.38Å; L430-G432 PolarHBondContact O-N 3.32Å; L430-R433 PolarHBondContact O-N 3.45Å; L430-T434 PolarHBondContact O-N 3.48Å; L430-A436 HydrophobicContact CD1-CB 3.78Å; L430-I440 HydrophobicContact CD1-CD1 3.83Å
431L77.1Confident85.9Confident63 Ų6327.3 Ų27.333%0.3316%0.156SC..THydrogen-bonded Turntrans-55.9128.2-175.9-68178.1000111.3Q357 Q427 R433Q357-L431 HydrophobicContact CB-CD1 4.22Å; Q357-L431 HydrophobicContact CG-CD1 4.45Å; Q357-L431 VanDerWaalsContact OE1-CD1 3.24Å; Q427-L431 PolarHBondContact O-N 2.84Å; L431-R433 PolarHBondContact O-N 3.33Å
432G70.8Confident86Confident74 Ų7427.4 Ų27.476%0.76316%0.156SC*.THydrogen-bonded Turntrans74.3-5.7-179.500000115.6L430L430-G432 PolarHBondContact O-N 3.32Å
433R71.2Confident86.2Confident192 Ų19227.8 Ų27.873%0.72516%0.158SC*.THydrogen-bonded Turntrans-103.2-51.6-179.1-66.2-177.8174.8-171.3-2.8112L430 L431L430-R433 PolarHBondContact O-N 3.45Å; L431-R433 PolarHBondContact O-N 3.33Å
434T77.8Confident86.4Confident38 Ų3827.1 Ų27.123%0.23316%0.155CC..EExtended strand (participates in β ladder)trans-139.9149.3-173.253.30000113.4R279 L430R279-T434 CarbonylContact O-C 3.39Å; R279-T434 WeakPolarHBondContact O-CA 3.22Å; R279-T434 VanDerWaalsContact O-CB 3.28Å; R279-T434 WeakPolarHBondContact O-CB 3.39Å; L430-T434 PolarHBondContact O-N 3.48Å
435R80.9Confident86.6Confident59 Ų5927.2 Ų27.222%0.22316%0.155CC..EExtended strand (participates in β ladder)trans-86.3120.7163.6-50.4-170.5-163.7152.24.2107T275 T278 R279 I281T275-R435 VanDerWaalsContact CG2-NE 3.25Å; T275-R435 PolarHBondContact O-NE 3.25Å; T275-R435 PolarHBondContact O-NH2 2.74Å; T278-R435 WeakPolarHBondContact OG1-CG 3.5Å; T278-R435 PolarHBondContact OG1-NE 3.02Å; R279-R435 PolarHBondContact O-N 3.09Å; I281-R435 PolarHBondContact N-O 3.13Å
436A88.5Confident86.9Confident3 Ų327 Ų273%0.02515%0.153CC..  trans-137.4-7.6-17400000113.8E107 I281 L430 A438 T439 I440E107-A436 WeakPolarHBondContact OE1-CA 3.4Å; I281-A436 HydrophobicContact CB-CB 3.93Å; I281-A436 HydrophobicContact CD1-CB 3.97Å; I281-A436 HydrophobicContact CG2-CB 3.63Å; L430-A436 HydrophobicContact CD1-CB 3.78Å; A436-A438 PolarHBondContact O-N 3.4Å; A436-T439 PolarHBondContact O-N 3.45Å; A436-I440 HydrophobicContact CB-CD1 3.64Å; A436-I440 HydrophobicContact CB-CG1 4.32Å; A436-I440 VanDerWaalsContact O-CB 3.3Å; A436-I440 WeakPolarHBondContact O-CB 3.43Å; A436-I440 WeakPolarHBondContact O-CG1 3.47Å; A436-I440 PolarHBondContact O-N 3.49Å
437L89.3Confident87.3Confident9 Ų928.9 Ų28.95%0.04716%0.162CC..Hα-helixtrans-59.5-50.5-172.3177.160.4000112V162 A422 T426 T441V162-L437 HydrophobicContact CG1-CD1 4.28Å; V162-L437 HydrophobicContact CG1-CG 4.49Å; A422-L437 HydrophobicContact CB-CD1 3.91Å; T426-L437 HydrophobicContact CG2-CD1 4.26Å; L437-T441 WeakPolarHBondContact O-CB 3.13Å; L437-T441 PolarHBondContact O-N 3.14Å; L437-T441 PolarHBondContact O-OG1 3.24Å
438A90.1Very high87.8Confident1 Ų128.1 Ų28.11%0.00816%0.158CC..Hα-helixtrans-69-43.7-177.900000110.4A106 E107 P159 T163 A436 T441 S442A106-A438 HydrophobicContact CB-CB 4.24Å; E107-A438 HydrophobicContact CG-CB 3.67Å; E107-A438 PolarHBondContact OE1-N 3.46Å; P159-A438 HydrophobicContact CB-CB 4.19Å; T163-A438 VanDerWaalsContact OG1-CB 3.29Å; T163-A438 WeakPolarHBondContact OG1-CB 3.16Å; A436-A438 PolarHBondContact O-N 3.4Å; A438-T441 PolarHBondContact O-N 3.01Å; A438-S442 VanDerWaalsContact O-CB 3.25Å; A438-S442 WeakPolarHBondContact O-CB 3.3Å; A438-S442 PolarHBondContact O-N 3.3Å; A438-S442 PolarHBondContact O-OG 3.27Å
439T91.8Very high88.3Confident3 Ų326.9 Ų26.92%0.01815%0.149CC..Hα-helixtrans-62-48179.6-54.10000112.4E107 I281 A286 A436 S442 I443E107-T439 PolarHBondContact OE1-N 2.86Å; E107-T439 PolarHBondContact OE1-OG1 3.49Å; E107-T439 PolarHBondContact OE2-OG1 2.65Å; I281-T439 HydrophobicContact CG2-CG2 3.91Å; A286-T439 HydrophobicContact CB-CG2 4.15Å; A436-T439 PolarHBondContact O-N 3.45Å; T439-S442 WeakPolarHBondContact O-CB 3.32Å; T439-S442 PolarHBondContact O-N 3.17Å; T439-I443 HydrophobicContact CG2-CD1 3.99Å; T439-I443 WeakPolarHBondContact O-CD1 2.9Å; T439-I443 WeakPolarHBondContact O-CG1 3.13Å; T439-I443 PolarHBondContact O-N 3.22Å
440I93.1Very high88.9Confident0 Ų027.3 Ų27.30%015%0.145CC..Hα-helixtrans-66.3-42179.9-72.6166.7000111A286 L289 V292 L424 L430 A436 S442 I443 I444A286-I440 HydrophobicContact CB-CG1 4.02Å; L289-I440 HydrophobicContact CD1-CD1 3.45Å; L289-I440 VanDerWaalsContact CD1-CD1 3.45Å; L289-I440 HydrophobicContact CD1-CG1 4.28Å; V292-I440 HydrophobicContact CG1-CG2 4.47Å; V292-I440 HydrophobicContact CG2-CG2 4.27Å; L424-I440 HydrophobicContact CB-CG2 3.92Å; L430-I440 HydrophobicContact CD1-CD1 3.83Å; A436-I440 HydrophobicContact CB-CD1 3.64Å; A436-I440 HydrophobicContact CB-CG1 4.32Å; A436-I440 VanDerWaalsContact O-CB 3.3Å; A436-I440 WeakPolarHBondContact O-CB 3.43Å; A436-I440 WeakPolarHBondContact O-CG1 3.47Å; A436-I440 PolarHBondContact O-N 3.49Å; I440-S442 VanDerWaalsContact C-N 3.29Å; I440-S442 PolarHBondContact O-N 2.82Å; I440-I443 PolarHBondContact O-N 3.41Å; I440-I444 HydrophobicContact CG2-CD1 3.8Å; I440-I444 WeakPolarHBondContact O-CG1 3.48Å; I440-I444 PolarHBondContact O-N 3.2Å
441T93.2Very high89.4Confident0 Ų026.6 Ų26.60%014%0.141CC..Hα-helixtrans-61.2-41.4175.3-58.20000111.4V162 L437 A438 I444 D445V162-T441 HydrophobicContact CB-CG2 4.06Å; V162-T441 HydrophobicContact CG1-CG2 3.91Å; V162-T441 HydrophobicContact CG2-CG2 3.91Å; L437-T441 WeakPolarHBondContact O-CB 3.13Å; L437-T441 PolarHBondContact O-N 3.14Å; L437-T441 PolarHBondContact O-OG1 3.24Å; A438-T441 PolarHBondContact O-N 3.01Å; T441-I444 PolarHBondContact O-N 3.45Å; T441-D445 WeakPolarHBondContact O-CB 3.42Å; T441-D445 PolarHBondContact O-N 3.42Å
442S94.3Very high90.3Very high1 Ų123.6 Ų23.61%0.00713%0.126CC..Hα-helixtrans-64-40.5175.1-85.90000114.7M99 G103 P159 A438 T439 I440 G446M99-S442 VanDerWaalsContact CE-OG 3.23Å; M99-S442 WeakPolarHBondContact CE-OG 3.31Å; M99-S442 WeakPolarHBondContact O-CB 3.4Å; M99-S442 PolarHBondContact O-OG 3.31Å; G103-S442 WeakPolarHBondContact CA-OG 3.36Å; G103-S442 PolarHBondContact N-OG 3.18Å; G103-S442 VanDerWaalsContact N-OG 3.07Å; P159-S442 WeakPolarHBondContact CB-OG 3.36Å; A438-S442 VanDerWaalsContact O-CB 3.25Å; A438-S442 WeakPolarHBondContact O-CB 3.3Å; A438-S442 PolarHBondContact O-N 3.3Å; A438-S442 PolarHBondContact O-OG 3.27Å; T439-S442 WeakPolarHBondContact O-CB 3.32Å; T439-S442 PolarHBondContact O-N 3.17Å; I440-S442 VanDerWaalsContact C-N 3.29Å; I440-S442 PolarHBondContact O-N 2.82Å; S442-G446 VanDerWaalsContact O-CA 3.31Å; S442-G446 WeakPolarHBondContact O-CA 2.89Å; S442-G446 PolarHBondContact O-N 3.34Å
443I94.4Very high91.4Very high9 Ų920.1 Ų20.15%0.0469%0.09CC..Hα-helixtrans-63.8-48.9176.4-73.7160.9000109.9F283 A286 I287 V292 T439 I440 M447F283-I443 HydrophobicContact CD2-CD1 3.92Å; F283-I443 HydrophobicContact CD2-CG1 3.92Å; F283-I443 HydrophobicContact CE2-CD1 4.13Å; F283-I443 HydrophobicContact CE2-CG1 3.7Å; A286-I443 HydrophobicContact CB-CD1 3.39Å; I287-I443 HydrophobicContact CD1-CG2 4.38Å; I287-I443 HydrophobicContact CG1-CD1 3.94Å; I287-I443 HydrophobicContact CG1-CG1 4.33Å; I287-I443 HydrophobicContact CG1-CG2 3.77Å; V292-I443 HydrophobicContact CG1-CG2 4.13Å; T439-I443 HydrophobicContact CG2-CD1 3.99Å; T439-I443 WeakPolarHBondContact O-CD1 2.9Å; T439-I443 WeakPolarHBondContact O-CG1 3.13Å; T439-I443 PolarHBondContact O-N 3.22Å; I440-I443 PolarHBondContact O-N 3.41Å; I443-M447 WeakPolarHBondContact O-CB 3.23Å; I443-M447 PolarHBondContact O-N 3.15Å
444I95.5Very high92.6Very high0 Ų013.7 Ų13.70%07%0.07CC..Hα-helixtrans-63.8-53.3-177.9-69.3167.1000110.1V292 S296 L299 V416 L424 I440 T441 G446 M447 G448V292-I444 HydrophobicContact CG1-CD1 4.4Å; V292-I444 HydrophobicContact CG1-CG1 4.18Å; S296-I444 WeakPolarHBondContact OG-CG1 3.16Å; L299-I444 HydrophobicContact CB-CG2 4.45Å; L299-I444 HydrophobicContact CD2-CG2 3.55Å; L299-I444 WeakPolarHBondContact CD2-O 3.35Å; V416-I444 HydrophobicContact CG1-CG2 4.21Å; L424-I444 HydrophobicContact CD1-CD1 3.82Å; I440-I444 HydrophobicContact CG2-CD1 3.8Å; I440-I444 WeakPolarHBondContact O-CG1 3.48Å; I440-I444 PolarHBondContact O-N 3.2Å; T441-I444 PolarHBondContact O-N 3.45Å; I444-G446 PolarHBondContact O-N 3.5Å; I444-M447 PolarHBondContact O-N 2.88Å; I444-G448 PolarHBondContact O-N 3.02Å
445D94.9Very high93.2Very high2 Ų211.9 Ų11.91%0.0116%0.059CC..Hα-helixtrans-68.9-33.7-179.8-171.154.5000112.5Y95 M99 K303 T441 G448 S449Y95-D445 PolarHBondContact OH-OD2 3.13Å; M99-D445 HydrophobicContact CE-CB 4.44Å; M99-D445 HydrophobicContact CG-CB 4.46Å; K303-D445 IonicContact NZ-OD1 2.69Å; K303-D445 PolarHBondContact NZ-OD1 3.3Å; K303-D445 IonicContact NZ-OD2 2.63Å; T441-D445 WeakPolarHBondContact O-CB 3.42Å; T441-D445 PolarHBondContact O-N 3.42Å; D445-G448 PolarHBondContact O-N 3.24Å; D445-S449 WeakPolarHBondContact O-CB 3.45Å; D445-S449 PolarHBondContact O-N 3.46Å; D445-S449 PolarHBondContact O-OG 2.84Å
446G95.4Very high93.7Very high1 Ų19.1 Ų9.11%0.015%0.048CC..Hα-helixtrans-59.8-50173.900000111.7A96 S442 I444 S449 L450A96-G446 WeakPolarHBondContact CB-O 2.88Å; S442-G446 VanDerWaalsContact O-CA 3.31Å; S442-G446 WeakPolarHBondContact O-CA 2.89Å; S442-G446 PolarHBondContact O-N 3.34Å; I444-G446 PolarHBondContact O-N 3.5Å; G446-S449 WeakPolarHBondContact O-CB 3.33Å; G446-S449 PolarHBondContact O-N 3.36Å; G446-S449 VanDerWaalsContact O-N 3.1Å; G446-L450 PolarHBondContact O-N 3.24Å; G446-L450 VanDerWaalsContact O-N 3.12Å
447M95.7Very high93.8Very high51 Ų5111.1 Ų11.125%0.2516%0.058SC..Hα-helixtrans-62.6-43.2174.1-174.861.47100111.9S296 F300 I443 I444 S449 L450 G451S296-M447 WeakPolarHBondContact O-CG 3.48Å; F300-M447 HydrophobicContact CB-CG 4.25Å; F300-M447 HydrophobicContact CD2-CG 4.45Å; F300-M447 WeakPolarHBondContact CD2-O 3.43Å; F300-M447 HydrophobicContact CD2-SD 4.1Å; I443-M447 WeakPolarHBondContact O-CB 3.23Å; I443-M447 PolarHBondContact O-N 3.15Å; I444-M447 PolarHBondContact O-N 2.88Å; M447-S449 PolarHBondContact O-N 2.69Å; M447-L450 WeakPolarHBondContact O-CB 3.39Å; M447-L450 PolarHBondContact O-N 2.8Å; M447-L450 HydrophobicContact SD-CD1 3.99Å; M447-G451 PolarHBondContact O-N 2.96Å
448G96.5Very high94Very high0 Ų013.3 Ų13.30%07%0.07CC..Hα-helixtrans-51-45.3171.100000111.8K303 I444 D445 L450 G451 A452K303-G448 WeakPolarHBondContact CD-O 3.48Å; I444-G448 PolarHBondContact O-N 3.02Å; D445-G448 PolarHBondContact O-N 3.24Å; G448-L450 VanDerWaalsContact C-N 3.32Å; G448-L450 PolarHBondContact O-N 3.41Å; G448-G451 PolarHBondContact O-N 2.96Å; G448-G451 VanDerWaalsContact O-N 3.1Å; G448-A452 PolarHBondContact O-N 3.25Å
449S95.8Very high94.1Very high0 Ų013.3 Ų13.30%07%0.069CC..Hα-helixtrans-70.1-26.9-175.6-560000113.1Y95 K303 D445 G446 M447 A452 A453Y95-S449 WeakPolarHBondContact CD1-OG 3.34Å; Y95-S449 VanDerWaalsContact CE1-OG 3.26Å; Y95-S449 WeakPolarHBondContact CE1-OG 3.25Å; K303-S449 PolarHBondContact NZ-OG 3.1Å; D445-S449 WeakPolarHBondContact O-CB 3.45Å; D445-S449 PolarHBondContact O-N 3.46Å; D445-S449 PolarHBondContact O-OG 2.84Å; G446-S449 WeakPolarHBondContact O-CB 3.33Å; G446-S449 PolarHBondContact O-N 3.36Å; G446-S449 VanDerWaalsContact O-N 3.1Å; M447-S449 PolarHBondContact O-N 2.69Å; S449-A452 CarbonylContact O-C 3.43Å; S449-A452 WeakPolarHBondContact O-CB 3.45Å; S449-A452 PolarHBondContact O-N 2.82Å; S449-A453 PolarHBondContact O-N 2.65Å
450L95.7Very high93.9Very high52 Ų5213.2 Ų13.227%0.2727%0.069SC..Hα-helixtrans-62.9-44.1167.7-67.5175.1000111.3F93 A96 F300 G446 M447 G448 A452 A453 L454F93-L450 HydrophobicContact CD2-CD2 3.91Å; F93-L450 HydrophobicContact CE2-CD2 4.08Å; A96-L450 HydrophobicContact CB-CD2 3.53Å; A96-L450 HydrophobicContact CB-CG 3.74Å; F300-L450 HydrophobicContact CD2-CB 4.1Å; F300-L450 HydrophobicContact CE2-CB 3.9Å; G446-L450 PolarHBondContact O-N 3.24Å; G446-L450 VanDerWaalsContact O-N 3.12Å; M447-L450 WeakPolarHBondContact O-CB 3.39Å; M447-L450 PolarHBondContact O-N 2.8Å; M447-L450 HydrophobicContact SD-CD1 3.99Å; G448-L450 VanDerWaalsContact C-N 3.32Å; G448-L450 PolarHBondContact O-N 3.41Å; L450-A452 VanDerWaalsContact C-N 3.28Å; L450-A452 PolarHBondContact O-N 2.94Å; L450-A453 WeakPolarHBondContact O-CB 3.47Å; L450-A453 PolarHBondContact O-N 3.27Å; L450-L454 PolarHBondContact O-N 3.44Å
451G96.4Very high93.8Very high0 Ų017.2 Ų17.20%09%0.09CC..Hα-helixtrans-63.4-39.4174.200000111.6F300 L304 M447 G448 A453 L454 G455F300-G451 VanDerWaalsContact CD2-CA 3.48Å; F300-G451 VanDerWaalsContact CE2-CA 3.42Å; L304-G451 WeakPolarHBondContact CA-O 3.48Å; L304-G451 VanDerWaalsContact CB-O 3.31Å; L304-G451 WeakPolarHBondContact CB-O 3.29Å; L304-G451 WeakPolarHBondContact CG-O 3.49Å; M447-G451 PolarHBondContact O-N 2.96Å; G448-G451 PolarHBondContact O-N 2.96Å; G448-G451 VanDerWaalsContact O-N 3.1Å; G451-A453 VanDerWaalsContact C-N 3.3Å; G451-A453 PolarHBondContact O-N 3.3Å; G451-L454 PolarHBondContact O-N 3.49Å; G451-G455 PolarHBondContact O-N 2.83Å
452A95.3Very high93.8Very high0 Ų019.1 Ų19.10%010%0.1CC..Hα-helixtrans-62.4-32.9174.800000113.5L92 K303 Y307 G448 S449 L450 P456L92-A452 HydrophobicContact CD1-CB 4.49Å; L92-A452 WeakPolarHBondContact CD1-O 3.34Å; K303-A452 HydrophobicContact CB-CB 4.39Å; K303-A452 HydrophobicContact CD-CB 3.92Å; K303-A452 HydrophobicContact CG-CB 3.71Å; Y307-A452 HydrophobicContact CD1-CB 3.42Å; Y307-A452 VanDerWaalsContact CD1-CB 3.42Å; Y307-A452 HydrophobicContact CD2-CB 4.27Å; Y307-A452 HydrophobicContact CE1-CB 3.92Å; Y307-A452 HydrophobicContact CG-CB 3.64Å; G448-A452 PolarHBondContact O-N 3.25Å; S449-A452 CarbonylContact O-C 3.43Å; S449-A452 WeakPolarHBondContact O-CB 3.45Å; S449-A452 PolarHBondContact O-N 2.82Å; L450-A452 VanDerWaalsContact C-N 3.28Å; L450-A452 PolarHBondContact O-N 2.94Å; A452-P456 WeakPolarHBondContact O-CD 3.43Å; A452-P456 WeakPolarHBondContact O-CG 3.4Å
453A94.8Very high93.5Very high1 Ų120.3 Ų20.31%0.00811%0.107CC..Hα-helixtrans-72.6-43.2173.300000111.2Y89 L92 F93 S449 L450 G451 L457Y89-A453 HydrophobicContact CD2-CB 3.81Å; Y89-A453 HydrophobicContact CE2-CB 4.14Å; L92-A453 HydrophobicContact CB-CB 3.51Å; F93-A453 HydrophobicContact CB-CB 4.44Å; S449-A453 PolarHBondContact O-N 2.65Å; L450-A453 WeakPolarHBondContact O-CB 3.47Å; L450-A453 PolarHBondContact O-N 3.27Å; G451-A453 VanDerWaalsContact C-N 3.3Å; G451-A453 PolarHBondContact O-N 3.3Å; A453-L457 PolarHBondContact O-N 2.93Å
454L94.4Very high93.2Very high58 Ų5824.1 Ų24.130%0.30413%0.133SC..Hα-helixtrans-66.9-37.3-176.8-172.962.2000112.5F300 L304 L450 G451 L457 L458F300-L454 HydrophobicContact CE1-CD2 4.41Å; F300-L454 HydrophobicContact CZ-CD2 3.86Å; L304-L454 HydrophobicContact CD1-CB 4.35Å; L304-L454 HydrophobicContact CD1-CD2 4.25Å; L304-L454 HydrophobicContact CD1-CG 4.39Å; L450-L454 PolarHBondContact O-N 3.44Å; G451-L454 PolarHBondContact O-N 3.49Å; L454-L457 HydrophobicContact CD1-CD2 4.46Å; L454-L457 PolarHBondContact O-N 3.17Å; L454-L458 HydrophobicContact CD1-CD1 4.08Å; L454-L458 HydrophobicContact CD1-CD2 4.24Å; L454-L458 HydrophobicContact CD1-CG 3.86Å; L454-L458 HydrophobicContact CD2-CD1 4.2Å; L454-L458 HydrophobicContact CG-CD1 3.71Å; L454-L458 HydrophobicContact CG-CG 3.96Å; L454-L458 WeakPolarHBondContact O-CB 3.46Å; L454-L458 VanDerWaalsContact O-CG 3.28Å; L454-L458 WeakPolarHBondContact O-CG 3.47Å; L454-L458 PolarHBondContact O-N 3.42Å
455G92.2Very high93Very high0 Ų032.8 Ų32.80%017%0.167CC..Hα-helixtrans-57.4-58.4-178.200000114.4T308 G451 L457 L458 T459T308-G455 WeakPolarHBondContact OG1-CA 3.37Å; T308-G455 PolarHBondContact OG1-O 3.23Å; G451-G455 PolarHBondContact O-N 2.83Å; G455-L457 VanDerWaalsContact C-N 3.34Å; G455-L457 PolarHBondContact O-N 3.02Å; G455-L458 PolarHBondContact O-N 3.48Å; G455-T459 WeakPolarHBondContact O-CB 3.28Å; G455-T459 PolarHBondContact O-N 3.4Å; G455-T459 PolarHBondContact O-OG1 2.92Å
456P89.7Confident92.8Very high0 Ų034 Ų340%018%0.18CC..Hα-helixtrans-61.1-37.3175.8-25.736.1000113.6E88 Y311 W312 A452 T459 G460E88-P456 HydrophobicContact CB-CB 4.34Å; E88-P456 WeakPolarHBondContact OE2-CB 3.09Å; Y311-P456 HydrophobicContact CD2-CB 4.4Å; Y311-P456 HydrophobicContact CD2-CG 3.59Å; Y311-P456 HydrophobicContact CE2-CG 4.35Å; Y311-P456 HydrophobicContact CG-CG 4.24Å; W312-P456 PolarHBondContact NE1-O 2.87Å; A452-P456 WeakPolarHBondContact O-CD 3.43Å; A452-P456 WeakPolarHBondContact O-CG 3.4Å; P456-T459 PolarHBondContact O-N 3.22Å; P456-G460 PolarHBondContact O-N 3.28Å
457L91.7Very high92.5Very high46 Ų4636 Ų3624%0.24119%0.188CC..Hα-helixtrans-59.9-55.3174.7177.764.7000111.1Y89 A453 L454 G455 T459 G460 L461Y89-L457 HydrophobicContact CD2-CB 3.99Å; Y89-L457 HydrophobicContact CD2-CD2 3.68Å; Y89-L457 HydrophobicContact CD2-CG 4.35Å; Y89-L457 HydrophobicContact CE2-CD2 3.83Å; Y89-L457 HydrophobicContact CG-CB 4.31Å; Y89-L457 HydrophobicContact CG-CD1 4.48Å; Y89-L457 HydrophobicContact CG-CD2 4.09Å; A453-L457 PolarHBondContact O-N 2.93Å; L454-L457 HydrophobicContact CD1-CD2 4.46Å; L454-L457 PolarHBondContact O-N 3.17Å; G455-L457 VanDerWaalsContact C-N 3.34Å; G455-L457 PolarHBondContact O-N 3.02Å; L457-T459 PolarHBondContact O-N 3.08Å; L457-G460 PolarHBondContact O-N 3.01Å; L457-G460 VanDerWaalsContact O-N 3.16Å; L457-L461 HydrophobicContact CG-CD1 4.37Å; L457-L461 WeakPolarHBondContact O-CG 3.36Å; L457-L461 PolarHBondContact O-N 3.48Å; L457-L461 VanDerWaalsContact O-N 3.07Å
458L93.3Very high92.4Very high55 Ų5536.5 Ų36.529%0.28820%0.196SC..Hα-helixtrans-59.4-38.4177.7-69.9178.6000110.7L454 G455 L461 L462 M473L454-L458 HydrophobicContact CD1-CD1 4.08Å; L454-L458 HydrophobicContact CD1-CD2 4.24Å; L454-L458 HydrophobicContact CD1-CG 3.86Å; L454-L458 HydrophobicContact CD2-CD1 4.2Å; L454-L458 HydrophobicContact CG-CD1 3.71Å; L454-L458 HydrophobicContact CG-CG 3.96Å; L454-L458 WeakPolarHBondContact O-CB 3.46Å; L454-L458 VanDerWaalsContact O-CG 3.28Å; L454-L458 WeakPolarHBondContact O-CG 3.47Å; L454-L458 PolarHBondContact O-N 3.42Å; G455-L458 PolarHBondContact O-N 3.48Å; L458-L461 PolarHBondContact O-N 2.72Å; L458-L462 HydrophobicContact CB-CD1 4.43Å; L458-L462 VanDerWaalsContact O-CB 3.23Å; L458-L462 WeakPolarHBondContact O-CB 3.43Å; L458-L462 WeakPolarHBondContact O-CG 3.28Å; L458-L462 PolarHBondContact O-N 3.08Å; L458-M473 HydrophobicContact CB-SD 3.39Å; L458-M473 WeakPolarHBondContact CB-SD 3.2Å; L458-M473 HydrophobicContact CD1-CG 4.35Å; L458-M473 HydrophobicContact CD1-SD 3.79Å; L458-M473 HydrophobicContact CG-SD 4.26Å
459T91.9Very high92.3Very high0 Ų039.3 Ų39.30%021%0.213CC..Hα-helixtrans-61.1-47.5176.1-54.20000111.3T308 W312 G455 P456 L457 L461 L462 V463 W467 V470T308-T459 HydrophobicContact CG2-CG2 4.22Å; T308-T459 WeakPolarHBondContact CG2-OG1 3.35Å; W312-T459 HydrophobicContact CB-CG2 3.98Å; W312-T459 HydrophobicContact CD2-CG2 3.45Å; W312-T459 VanDerWaalsContact CD2-CG2 3.45Å; W312-T459 HydrophobicContact CE3-CG2 3.91Å; W312-T459 HydrophobicContact CG-CG2 3.46Å; W312-T459 VanDerWaalsContact CG-CG2 3.46Å; G455-T459 WeakPolarHBondContact O-CB 3.28Å; G455-T459 PolarHBondContact O-N 3.4Å; G455-T459 PolarHBondContact O-OG1 2.92Å; P456-T459 PolarHBondContact O-N 3.22Å; L457-T459 PolarHBondContact O-N 3.08Å; T459-L461 VanDerWaalsContact C-N 3.26Å; T459-L461 PolarHBondContact O-N 3.05Å; T459-L462 PolarHBondContact O-N 3.21Å; T459-L462 VanDerWaalsContact O-N 3.1Å; T459-V463 HydrophobicContact CG2-CG2 3.93Å; T459-V463 WeakPolarHBondContact O-CB 3.44Å; T459-V463 WeakPolarHBondContact O-CG2 3.47Å; T459-V463 PolarHBondContact O-N 3.19Å; T459-W467 HydrophobicContact CG2-CZ3 4.31Å; T459-V470 HydrophobicContact CG2-CG1 3.79Å; T459-V470 HydrophobicContact CG2-CG2 4.17Å
460G88.3Confident92.2Very high2 Ų239.4 Ų39.42%0.02121%0.214CC..Hα-helixtrans-58.7-3617600000113.4W312 P456 L457W312-G460 VanDerWaalsContact CZ2-CA 3.49Å; P456-G460 PolarHBondContact O-N 3.28Å; L457-G460 PolarHBondContact O-N 3.01Å; L457-G460 VanDerWaalsContact O-N 3.16Å
461L91.1Very high92.2Very high83 Ų8337.4 Ų37.444%0.43520%0.203SC..Hα-helixtrans-75.4-29.9175.7-63.3174.9000113.4L457 L458 T459 Y465L457-L461 HydrophobicContact CG-CD1 4.37Å; L457-L461 WeakPolarHBondContact O-CG 3.36Å; L457-L461 PolarHBondContact O-N 3.48Å; L457-L461 VanDerWaalsContact O-N 3.07Å; L458-L461 PolarHBondContact O-N 2.72Å; T459-L461 VanDerWaalsContact C-N 3.26Å; T459-L461 PolarHBondContact O-N 3.05Å; L461-Y465 WeakPolarHBondContact O-CE2 3.38Å
462L93Very high92.1Very high40 Ų4039.8 Ų39.821%0.20922%0.222CC..Hα-helixtrans-93.3-25.3-173.8-68.6175.7000113.8L458 T459 P464 Y465 G466 V469 V470 M473L458-L462 HydrophobicContact CB-CD1 4.43Å; L458-L462 VanDerWaalsContact O-CB 3.23Å; L458-L462 WeakPolarHBondContact O-CB 3.43Å; L458-L462 WeakPolarHBondContact O-CG 3.28Å; L458-L462 PolarHBondContact O-N 3.08Å; T459-L462 PolarHBondContact O-N 3.21Å; T459-L462 VanDerWaalsContact O-N 3.1Å; L462-P464 VanDerWaalsContact C-CD 3.41Å; L462-P464 VanDerWaalsContact C-N 3.31Å; L462-Y465 WeakPolarHBondContact O-CB 3.26Å; L462-Y465 PolarHBondContact O-N 2.84Å; L462-G466 PolarHBondContact O-N 3.3Å; L462-V469 HydrophobicContact CB-CG1 4.49Å; L462-V469 HydrophobicContact CD1-CG1 4.32Å; L462-V469 HydrophobicContact CD2-CG1 3.78Å; L462-V469 HydrophobicContact CG-CG1 4.41Å; L462-V470 HydrophobicContact CB-CG2 3.99Å; L462-M473 HydrophobicContact CD1-CB 4.01Å; L462-M473 HydrophobicContact CD1-CG 4.33Å; L462-M473 HydrophobicContact CD1-SD 3.88Å
463V88.3Confident92.2Very high26 Ų2641 Ų4116%0.15823%0.228CC..G310 helixtrans-51.5-40.7178.6161.40000113.3W312 T459 Y465 G466 W467 V470W312-V463 HydrophobicContact CE3-CG2 4.13Å; W312-V463 HydrophobicContact CZ3-CG2 3.91Å; T459-V463 HydrophobicContact CG2-CG2 3.93Å; T459-V463 WeakPolarHBondContact O-CB 3.44Å; T459-V463 WeakPolarHBondContact O-CG2 3.47Å; T459-V463 PolarHBondContact O-N 3.19Å; V463-Y465 PolarHBondContact O-N 3.45Å; V463-G466 WeakPolarHBondContact O-CA 3.18Å; V463-G466 PolarHBondContact O-N 3.4Å; V463-W467 HydrophobicContact CG2-CE3 4.44Å; V463-W467 HydrophobicContact CG2-CH2 4.01Å; V463-W467 HydrophobicContact CG2-CZ2 4.21Å; V463-W467 HydrophobicContact CG2-CZ3 4.12Å; V463-V470 HydrophobicContact CG2-CG2 4.16Å
464P87.5Confident92.3Very high90 Ų9041.2 Ų41.258%0.58423%0.229SC*.G310 helixtrans-58.5-26.2175-2736.2000114.7L462 G466L462-P464 VanDerWaalsContact C-CD 3.41Å; L462-P464 VanDerWaalsContact C-N 3.31Å; P464-G466 VanDerWaalsContact C-N 3.33Å
465Y91.5Very high92.4Very high181 Ų18139.6 Ų39.671%0.7122%0.221SC*.G310 helixtrans-89.71176.6-55.1-83.2000113L461 L462 V463L461-Y465 WeakPolarHBondContact O-CE2 3.38Å; L462-Y465 WeakPolarHBondContact O-CB 3.26Å; L462-Y465 PolarHBondContact O-N 2.84Å; V463-Y465 PolarHBondContact O-N 3.45Å
466G90Very high92.6Very high29 Ų2943.4 Ų43.430%0.29924%0.244SC..  trans97.8152.1176.900000114.5L462 V463 P464 S468 V469L462-G466 PolarHBondContact O-N 3.3Å; V463-G466 WeakPolarHBondContact O-CA 3.18Å; V463-G466 PolarHBondContact O-N 3.4Å; P464-G466 VanDerWaalsContact C-N 3.33Å; G466-S468 PolarHBondContact O-N 3.45Å; G466-S468 VanDerWaalsContact O-N 3.11Å; G466-V469 PolarHBondContact O-N 3.4Å
467W90.2Very high93Very high43 Ų4343.7 Ų43.716%0.16325%0.246CC..Hα-helixtrans-60.3-24.7-176.3-70.3108000114.4W312 Y316 I319 V320 T459 V463 V469 V470 F471W312-W467 HydrophobicContact CB-CH2 4.48Å; W312-W467 HydrophobicContact CE3-CH2 4.07Å; Y316-W467 HydrophobicContact CD2-CB 4.49Å; Y316-W467 AromaticContact CD2-CD2 3.46Å; Y316-W467 HydrophobicContact CD2-CD2 3.46Å; Y316-W467 VanDerWaalsContact CD2-CD2 3.46Å; Y316-W467 AromaticContact CD2-CE2 3.67Å; Y316-W467 AromaticContact CD2-CE3 3.6Å; Y316-W467 HydrophobicContact CD2-CE3 3.6Å; Y316-W467 AromaticContact CD2-CG 3.86Å; Y316-W467 HydrophobicContact CD2-CG 3.86Å; Y316-W467 HydrophobicContact CD2-CH2 4.13Å; Y316-W467 HydrophobicContact CD2-CZ2 4.02Å; Y316-W467 AromaticContact CD2-CZ3 3.94Å; Y316-W467 HydrophobicContact CD2-CZ3 3.94Å; Y316-W467 HydrophobicContact CE2-CB 4.19Å; Y316-W467 HydrophobicContact CE2-CD2 4.04Å; Y316-W467 HydrophobicContact CE2-CE3 4.32Å; Y316-W467 AromaticContact CE2-CG 3.96Å; Y316-W467 HydrophobicContact CE2-CG 3.96Å; Y316-W467 HydrophobicContact CG-CE3 4.47Å; Y316-W467 HydrophobicContact CG-CH2 4.4Å; Y316-W467 HydrophobicContact CG-CZ2 4.48Å; Y316-W467 HydrophobicContact CG-CZ3 4.4Å; I319-W467 HydrophobicContact CD1-CZ2 4.5Å; V320-W467 HydrophobicContact CG2-CG 4.36Å; T459-W467 HydrophobicContact CG2-CZ3 4.31Å; V463-W467 HydrophobicContact CG2-CE3 4.44Å; V463-W467 HydrophobicContact CG2-CH2 4.01Å; V463-W467 HydrophobicContact CG2-CZ2 4.21Å; V463-W467 HydrophobicContact CG2-CZ3 4.12Å; W467-V469 PolarHBondContact O-N 2.72Å; W467-V470 HydrophobicContact CE3-CB 4.09Å; W467-V470 HydrophobicContact CE3-CG1 4.18Å; W467-V470 HydrophobicContact CE3-CG2 4.03Å; W467-V470 HydrophobicContact CZ3-CG1 4.31Å; W467-V470 HydrophobicContact CZ3-CG2 4.49Å; W467-V470 WeakPolarHBondContact O-CB 3.38Å; W467-V470 PolarHBondContact O-N 2.88Å; W467-V470 VanDerWaalsContact O-N 3.14Å; W467-F471 VanDerWaalsContact O-CD2 3.28Å; W467-F471 WeakPolarHBondContact O-CD2 3.02Å; W467-F471 PolarHBondContact O-N 3.38Å
468S92.4Very high93.3Very high61 Ų6141.6 Ų41.643%0.42724%0.235SC..Hα-helixtrans-58.6-36.8174.9-73.70000112.6R388 G466 F471 A472R388-S468 PolarHBondContact NE-OG 3.35Å; R388-S468 PolarHBondContact NH2-OG 3.3Å; G466-S468 PolarHBondContact O-N 3.45Å; G466-S468 VanDerWaalsContact O-N 3.11Å; S468-F471 PolarHBondContact O-N 2.9Å; S468-A472 PolarHBondContact O-N 2.93Å
469V94.7Very high93.5Very high59 Ų5942.4 Ų42.436%0.35824%0.24SC..Hα-helixtrans-71.9-36.3178.3-170.90000110.7L462 G466 W467 A472 M473L462-V469 HydrophobicContact CB-CG1 4.49Å; L462-V469 HydrophobicContact CD1-CG1 4.32Å; L462-V469 HydrophobicContact CD2-CG1 3.78Å; L462-V469 HydrophobicContact CG-CG1 4.41Å; G466-V469 PolarHBondContact O-N 3.4Å; W467-V469 PolarHBondContact O-N 2.72Å; V469-A472 PolarHBondContact O-N 2.87Å; V469-M473 PolarHBondContact O-N 3.38Å
470V93.9Very high93.8Very high2 Ų245.4 Ų45.41%0.01226%0.255CS..Hα-helixtrans-61.7-48.1173.3-178.90000110.7T308 T459 L462 V463 W467 A472 M473 L474T308-V470 HydrophobicContact CG2-CG1 4.42Å; T459-V470 HydrophobicContact CG2-CG1 3.79Å; T459-V470 HydrophobicContact CG2-CG2 4.17Å; L462-V470 HydrophobicContact CB-CG2 3.99Å; V463-V470 HydrophobicContact CG2-CG2 4.16Å; W467-V470 HydrophobicContact CE3-CB 4.09Å; W467-V470 HydrophobicContact CE3-CG1 4.18Å; W467-V470 HydrophobicContact CE3-CG2 4.03Å; W467-V470 HydrophobicContact CZ3-CG1 4.31Å; W467-V470 HydrophobicContact CZ3-CG2 4.49Å; W467-V470 WeakPolarHBondContact O-CB 3.38Å; W467-V470 PolarHBondContact O-N 2.88Å; W467-V470 VanDerWaalsContact O-N 3.14Å; V470-A472 VanDerWaalsContact C-N 3.31Å; V470-A472 PolarHBondContact O-N 3.01Å; V470-M473 HydrophobicContact CG1-CE 3.94Å; V470-M473 WeakPolarHBondContact O-CB 3.36Å; V470-M473 PolarHBondContact O-N 3.24Å; V470-L474 HydrophobicContact CG1-CD1 4.35Å; V470-L474 WeakPolarHBondContact O-CG 3.36Å; V470-L474 PolarHBondContact O-N 3.38Å
471F94.7Very high94.3Very high9 Ų945.3 Ų45.34%0.03925%0.254CS..Hα-helixtrans-61.8-38.2176-83.8-81.4000112.5Y316 Y387 R388 W467 S468 M473 L474 I475Y316-F471 AromaticContact CE2-CE2 3.84Å; Y316-F471 HydrophobicContact CE2-CE2 3.84Å; Y316-F471 HydrophobicContact CE2-CZ 4.39Å; Y387-F471 AromaticContact CD1-CE1 3.98Å; Y387-F471 HydrophobicContact CD1-CE1 3.98Å; Y387-F471 AromaticContact CD1-CZ 3.79Å; Y387-F471 HydrophobicContact CD1-CZ 3.79Å; Y387-F471 HydrophobicContact CE1-CZ 4.19Å; R388-F471 HydrophobicContact CB-CD1 4.05Å; R388-F471 HydrophobicContact CB-CD2 4.24Å; R388-F471 HydrophobicContact CB-CE1 4.31Å; R388-F471 HydrophobicContact CB-CG 4.02Å; R388-F471 HydrophobicContact CG-CB 4.49Å; R388-F471 HydrophobicContact CG-CD2 4.25Å; R388-F471 HydrophobicContact CG-CG 4.27Å; W467-F471 VanDerWaalsContact O-CD2 3.28Å; W467-F471 WeakPolarHBondContact O-CD2 3.02Å; W467-F471 PolarHBondContact O-N 3.38Å; S468-F471 PolarHBondContact O-N 2.9Å; F471-M473 VanDerWaalsContact C-N 3.35Å; F471-M473 PolarHBondContact O-N 2.79Å; F471-L474 PolarHBondContact O-N 2.97Å; F471-I475 WeakPolarHBondContact O-CD1 3.32Å; F471-I475 VanDerWaalsContact O-CG1 3.31Å; F471-I475 WeakPolarHBondContact O-CG1 3.25Å; F471-I475 PolarHBondContact O-N 2.8Å
472A96Very high94.6Very high50 Ų5043.4 Ų43.441%0.41324%0.243SC..Hα-helixtrans-61.4-42175.400000112.2S468 V469 V470 T476S468-A472 PolarHBondContact O-N 2.93Å; V469-A472 PolarHBondContact O-N 2.87Å; V470-A472 VanDerWaalsContact C-N 3.31Å; V470-A472 PolarHBondContact O-N 3.01Å; A472-T476 WeakPolarHBondContact O-CB 3.45Å; A472-T476 PolarHBondContact O-N 3.34Å; A472-T476 PolarHBondContact O-OG1 2.99Å
473M96.3Very high94.8Very high26 Ų2646 Ų4613%0.12826%0.257CS..Hα-helixtrans-60.9-45172.6171.3-153.857.300111.6T308 L458 L462 V469 V470 F471 T476 S477T308-M473 HydrophobicContact CG2-CE 4.44Å; L458-M473 HydrophobicContact CB-SD 3.39Å; L458-M473 WeakPolarHBondContact CB-SD 3.2Å; L458-M473 HydrophobicContact CD1-CG 4.35Å; L458-M473 HydrophobicContact CD1-SD 3.79Å; L458-M473 HydrophobicContact CG-SD 4.26Å; L462-M473 HydrophobicContact CD1-CB 4.01Å; L462-M473 HydrophobicContact CD1-CG 4.33Å; L462-M473 HydrophobicContact CD1-SD 3.88Å; V469-M473 PolarHBondContact O-N 3.38Å; V470-M473 HydrophobicContact CG1-CE 3.94Å; V470-M473 WeakPolarHBondContact O-CB 3.36Å; V470-M473 PolarHBondContact O-N 3.24Å; F471-M473 VanDerWaalsContact C-N 3.35Å; F471-M473 PolarHBondContact O-N 2.79Å; M473-T476 PolarHBondContact O-N 3.03Å; M473-S477 PolarHBondContact O-N 3.3Å
474L96.9Very high95.3Very high5 Ų546.8 Ų46.83%0.02626%0.259CS..Hα-helixtrans-62-46.1179.7-65.6172.7000112.1V305 T308 F309 L384 V470 F471 T476 S477 D478V305-L474 HydrophobicContact CB-CD2 4.28Å; V305-L474 HydrophobicContact CG1-CB 4.43Å; V305-L474 HydrophobicContact CG1-CD2 4.05Å; V305-L474 HydrophobicContact CG2-CD2 4.32Å; V305-L474 WeakPolarHBondContact CG2-O 3.41Å; T308-L474 HydrophobicContact CG2-CD1 4.26Å; T308-L474 HydrophobicContact CG2-CD2 3.73Å; T308-L474 HydrophobicContact CG2-CG 4.44Å; F309-L474 HydrophobicContact CD2-CD1 4.48Å; F309-L474 HydrophobicContact CE2-CD1 3.88Å; F309-L474 HydrophobicContact CZ-CD1 4.45Å; L384-L474 HydrophobicContact CD1-CB 4.4Å; V470-L474 HydrophobicContact CG1-CD1 4.35Å; V470-L474 WeakPolarHBondContact O-CG 3.36Å; V470-L474 PolarHBondContact O-N 3.38Å; F471-L474 PolarHBondContact O-N 2.97Å; L474-T476 VanDerWaalsContact C-N 3.33Å; L474-T476 PolarHBondContact O-N 3.29Å; L474-S477 PolarHBondContact O-N 2.88Å; L474-D478 PolarHBondContact O-N 3.31Å
475I96.8Very high95.7Very high24 Ų2442.5 Ų42.512%0.12323%0.232CC..Hα-helixtrans-63.5-41.5177-66.5159.7000110.3A381 L384 L385 F471 S477 D478 L479A381-I475 HydrophobicContact CB-CG2 4.42Å; L384-I475 HydrophobicContact CB-CD1 4.48Å; L384-I475 HydrophobicContact CB-CG1 3.94Å; L384-I475 HydrophobicContact CD1-CG1 4.18Å; L385-I475 HydrophobicContact CD2-CD1 3.43Å; L385-I475 VanDerWaalsContact CD2-CD1 3.43Å; L385-I475 HydrophobicContact CG-CD1 3.64Å; F471-I475 WeakPolarHBondContact O-CD1 3.32Å; F471-I475 VanDerWaalsContact O-CG1 3.31Å; F471-I475 WeakPolarHBondContact O-CG1 3.25Å; F471-I475 PolarHBondContact O-N 2.8Å; I475-S477 VanDerWaalsContact C-N 3.34Å; I475-S477 PolarHBondContact O-N 2.73Å; I475-D478 PolarHBondContact O-N 3.46Å; I475-L479 HydrophobicContact CG2-CD1 4.11Å; I475-L479 HydrophobicContact CG2-CG 4.36Å; I475-L479 VanDerWaalsContact O-CG 3.28Å; I475-L479 WeakPolarHBondContact O-CG 3.44Å; I475-L479 PolarHBondContact O-N 3.14Å
476T97.5Very high96Very high80 Ų8037 Ų3749%0.49121%0.214SC..Hα-helixtrans-61.7-43.4177.3-58.20000111.3A472 M473 L474 L479 L480A472-T476 WeakPolarHBondContact O-CB 3.45Å; A472-T476 PolarHBondContact O-N 3.34Å; A472-T476 PolarHBondContact O-OG1 2.99Å; M473-T476 PolarHBondContact O-N 3.03Å; L474-T476 VanDerWaalsContact C-N 3.33Å; L474-T476 PolarHBondContact O-N 3.29Å; T476-L479 PolarHBondContact O-N 2.61Å; T476-L480 HydrophobicContact CG2-CD1 4.34Å; T476-L480 VanDerWaalsContact O-CG 3.32Å; T476-L480 WeakPolarHBondContact O-CG 3.42Å; T476-L480 PolarHBondContact O-N 2.76Å
477S97.7Very high96.3Very high6 Ų640.7 Ų40.74%0.04222%0.219CC..Hα-helixtrans-62.9-43.6175.7-170.10000111.8F301 M473 L474 I475 L479 L480 A481F301-S477 WeakPolarHBondContact CA-OG 3.17Å; F301-S477 WeakPolarHBondContact CB-O 3.45Å; F301-S477 PolarHBondContact O-OG 3.22Å; M473-S477 PolarHBondContact O-N 3.3Å; L474-S477 PolarHBondContact O-N 2.88Å; I475-S477 VanDerWaalsContact C-N 3.34Å; I475-S477 PolarHBondContact O-N 2.73Å; S477-L479 PolarHBondContact O-N 3.4Å; S477-L480 PolarHBondContact O-N 3.35Å; S477-A481 PolarHBondContact O-N 3.38Å
478D97.6Very high96.7Very high2 Ų238.7 Ų38.71%0.01121%0.211CC..Hα-helixtrans-60.1-44.2176-175.864.4000112.4L377 A380 A381 L474 I475 L480 A481 M482L377-D478 WeakPolarHBondContact CD2-OD1 3.42Å; A380-D478 WeakPolarHBondContact CB-OD1 3.36Å; A381-D478 WeakPolarHBondContact CB-OD2 3.28Å; A381-D478 PolarHBondContact N-OD2 3.2Å; A381-D478 VanDerWaalsContact N-OD2 3.15Å; L474-D478 PolarHBondContact O-N 3.31Å; I475-D478 PolarHBondContact O-N 3.46Å; D478-L480 VanDerWaalsContact C-N 3.34Å; D478-L480 PolarHBondContact O-N 3.38Å; D478-A481 WeakPolarHBondContact O-CB 3.28Å; D478-A481 PolarHBondContact O-N 3.09Å; D478-M482 PolarHBondContact O-N 3.15Å
479L97.7Very high96.8Very high73 Ų7336.9 Ų36.938%0.38220%0.198SC..Hα-helixtrans-62.9-38.7175.4-67.3174.8000112.2A381 I475 T476 S477 M482 L483A381-L479 HydrophobicContact CB-CD2 4.41Å; I475-L479 HydrophobicContact CG2-CD1 4.11Å; I475-L479 HydrophobicContact CG2-CG 4.36Å; I475-L479 VanDerWaalsContact O-CG 3.28Å; I475-L479 WeakPolarHBondContact O-CG 3.44Å; I475-L479 PolarHBondContact O-N 3.14Å; T476-L479 PolarHBondContact O-N 2.61Å; S477-L479 PolarHBondContact O-N 3.4Å; L479-M482 HydrophobicContact CD2-CE 3.74Å; L479-M482 WeakPolarHBondContact O-CB 3.36Å; L479-M482 PolarHBondContact O-N 3.2Å; L479-L483 WeakPolarHBondContact O-CG 3.36Å; L479-L483 PolarHBondContact O-N 3.41Å
480L98Very high96.9Very high62 Ų6237 Ų3733%0.32520%0.198SC..Hα-helixtrans-65.8-40.2174.4-69.9170.6000111.8F301 T476 S477 D478 M482 L483 M484F301-L480 HydrophobicContact CD1-CB 3.92Å; F301-L480 HydrophobicContact CD1-CD1 4.05Å; F301-L480 HydrophobicContact CD2-CB 3.85Å; F301-L480 HydrophobicContact CE1-CB 3.95Å; F301-L480 HydrophobicContact CE1-CD1 3.49Å; F301-L480 VanDerWaalsContact CE1-CD1 3.49Å; F301-L480 HydrophobicContact CE1-CG 4.35Å; F301-L480 HydrophobicContact CE2-CB 3.88Å; F301-L480 HydrophobicContact CG-CB 3.89Å; F301-L480 HydrophobicContact CZ-CB 3.93Å; F301-L480 HydrophobicContact CZ-CD1 3.81Å; F301-L480 HydrophobicContact CZ-CG 4.4Å; T476-L480 HydrophobicContact CG2-CD1 4.34Å; T476-L480 VanDerWaalsContact O-CG 3.32Å; T476-L480 WeakPolarHBondContact O-CG 3.42Å; T476-L480 PolarHBondContact O-N 2.76Å; S477-L480 PolarHBondContact O-N 3.35Å; D478-L480 VanDerWaalsContact C-N 3.34Å; D478-L480 PolarHBondContact O-N 3.38Å; L480-M482 VanDerWaalsContact C-N 3.32Å; L480-M482 PolarHBondContact O-N 3.32Å; L480-L483 HydrophobicContact CD2-CD1 4.29Å; L480-L483 PolarHBondContact O-N 3.06Å; L480-M484 WeakPolarHBondContact O-CG 3.31Å; L480-M484 PolarHBondContact O-N 3Å
481A98.1Very high96.9Very high0 Ų038.2 Ų38.20%021%0.205CC..Hα-helixtrans-60.2-42.9172.100000111.7F301 T302 L377 S477 D478 L483 M484 S485F301-A481 HydrophobicContact CB-CB 3.75Å; T302-A481 HydrophobicContact CG2-CB 3.63Å; L377-A481 HydrophobicContact CD1-CB 3.88Å; L377-A481 HydrophobicContact CD2-CB 4.3Å; S477-A481 PolarHBondContact O-N 3.38Å; D478-A481 WeakPolarHBondContact O-CB 3.28Å; D478-A481 PolarHBondContact O-N 3.09Å; A481-L483 PolarHBondContact O-N 3.27Å; A481-M484 PolarHBondContact O-N 2.89Å; A481-S485 PolarHBondContact O-N 3.47Å
482M97.5Very high96.7Very high43 Ų4337.8 Ų37.821%0.21220%0.203CC..Hα-helixtrans-60.7-44177.1-170.2-177.260.600111.3L374 L377 A378 D478 L479 L480 M484 S485 I486L374-M482 HydrophobicContact CD1-CG 3.38Å; L374-M482 HydrophobicContact CD1-SD 4.2Å; L377-M482 HydrophobicContact CB-CB 4.29Å; A378-M482 HydrophobicContact CB-SD 4.31Å; D478-M482 PolarHBondContact O-N 3.15Å; L479-M482 HydrophobicContact CD2-CE 3.74Å; L479-M482 WeakPolarHBondContact O-CB 3.36Å; L479-M482 PolarHBondContact O-N 3.2Å; L480-M482 VanDerWaalsContact C-N 3.32Å; L480-M482 PolarHBondContact O-N 3.32Å; M482-M484 PolarHBondContact O-N 2.88Å; M482-S485 WeakPolarHBondContact O-CB 3.37Å; M482-S485 PolarHBondContact O-N 3.36Å; M482-S485 VanDerWaalsContact O-N 3.12Å; M482-I486 HydrophobicContact CG-CD1 4.36Å; M482-I486 WeakPolarHBondContact O-CG1 3.49Å; M482-I486 PolarHBondContact O-N 3Å
483L97.7Very high96.4Very high95 Ų9536.7 Ų36.750%0.49719%0.192SC..Hα-helixtrans-60.2-42.2174.9-71.7172.2000112.3L479 L480 A481 S485 I486 W487L479-L483 WeakPolarHBondContact O-CG 3.36Å; L479-L483 PolarHBondContact O-N 3.41Å; L480-L483 HydrophobicContact CD2-CD1 4.29Å; L480-L483 PolarHBondContact O-N 3.06Å; A481-L483 PolarHBondContact O-N 3.27Å; L483-S485 VanDerWaalsContact C-N 3.3Å; L483-S485 PolarHBondContact O-N 3.35Å; L483-I486 PolarHBondContact O-N 3.49Å; L483-W487 WeakPolarHBondContact O-CB 3.42Å; L483-W487 PolarHBondContact O-N 3.34Å
484M97.8Very high96.2Very high42 Ų4242.3 Ų42.321%0.20721%0.212CC..Hα-helixtrans-61.9-40.4173.9-65-55.6107.600111.3L297 L298 F301 L480 A481 M482 W487 I488L297-M484 HydrophobicContact CB-CG 4.06Å; L297-M484 HydrophobicContact CB-SD 4.03Å; L297-M484 HydrophobicContact CD1-SD 4.01Å; L298-M484 HydrophobicContact CB-CB 3.89Å; L298-M484 HydrophobicContact CG-CB 4.47Å; F301-M484 HydrophobicContact CD2-CG 4.39Å; F301-M484 HydrophobicContact CE2-CG 4.47Å; L480-M484 WeakPolarHBondContact O-CG 3.31Å; L480-M484 PolarHBondContact O-N 3Å; A481-M484 PolarHBondContact O-N 2.89Å; M482-M484 PolarHBondContact O-N 2.88Å; M484-W487 WeakPolarHBondContact O-CB 3.44Å; M484-W487 PolarHBondContact O-N 3.48Å; M484-I488 VanDerWaalsContact O-CG1 3.29Å; M484-I488 WeakPolarHBondContact O-CG1 3.09Å; M484-I488 PolarHBondContact O-N 2.98Å
485S97.2Very high95.8Very high0 Ų045.1 Ų45.10%022%0.222CC..Hα-helixtrans-63.6-44.4177.4-147.40000112.2A370 L374 A481 M482 L483 W487 I488 V489A370-S485 PolarHBondContact O-OG 3.29Å; L374-S485 PolarHBondContact N-OG 2.98Å; A481-S485 PolarHBondContact O-N 3.47Å; M482-S485 WeakPolarHBondContact O-CB 3.37Å; M482-S485 PolarHBondContact O-N 3.36Å; M482-S485 VanDerWaalsContact O-N 3.12Å; L483-S485 VanDerWaalsContact C-N 3.3Å; L483-S485 PolarHBondContact O-N 3.35Å; S485-W487 VanDerWaalsContact C-N 3.33Å; S485-W487 PolarHBondContact O-N 3.49Å; S485-I488 PolarHBondContact O-N 3.49Å; S485-V489 WeakPolarHBondContact O-CG2 3.42Å; S485-V489 PolarHBondContact O-N 2.87Å
486I97.5Very high95.2Very high66 Ų6647 Ų4734%0.33823%0.231SC..Hα-helixtrans-58.6-46.7174.6-67.9166.5000110.3L374 M482 L483 I488 V489 V490L374-I486 HydrophobicContact CD1-CD1 4.12Å; L374-I486 HydrophobicContact CD1-CG1 3.65Å; L374-I486 HydrophobicContact CD2-CG1 3.91Å; L374-I486 HydrophobicContact CG-CG1 4.43Å; M482-I486 HydrophobicContact CG-CD1 4.36Å; M482-I486 WeakPolarHBondContact O-CG1 3.49Å; M482-I486 PolarHBondContact O-N 3Å; L483-I486 PolarHBondContact O-N 3.49Å; I486-I488 VanDerWaalsContact C-N 3.29Å; I486-I488 PolarHBondContact O-N 2.95Å; I486-V489 PolarHBondContact O-N 3.22Å; I486-V490 HydrophobicContact CG2-CG2 4.3Å; I486-V490 WeakPolarHBondContact O-CG2 3.41Å; I486-V490 PolarHBondContact O-N 3.29Å
487W97.2Very high94.7Very high107 Ų10749.7 Ų49.741%0.40524%0.237SC..Hα-helixtrans-56.8-43.3178.3-177.5101.6000111.8T294 L483 M484 S485 V490 N491T294-W487 HydrophobicContact CG2-CD2 4.03Å; T294-W487 HydrophobicContact CG2-CE3 3.48Å; T294-W487 VanDerWaalsContact CG2-CE3 3.48Å; T294-W487 HydrophobicContact CG2-CH2 3.33Å; T294-W487 HydrophobicContact CG2-CZ2 3.84Å; T294-W487 HydrophobicContact CG2-CZ3 3.15Å; T294-W487 VanDerWaalsContact OG1-CZ3 3.24Å; T294-W487 WeakPolarHBondContact OG1-CZ3 3.48Å; L483-W487 WeakPolarHBondContact O-CB 3.42Å; L483-W487 PolarHBondContact O-N 3.34Å; M484-W487 WeakPolarHBondContact O-CB 3.44Å; M484-W487 PolarHBondContact O-N 3.48Å; S485-W487 VanDerWaalsContact C-N 3.33Å; S485-W487 PolarHBondContact O-N 3.49Å; W487-V490 PolarHBondContact O-N 2.95Å; W487-N491 HydrophobicContact CE3-CB 4.4Å; W487-N491 WeakPolarHBondContact CH2-ND2 3.18Å; W487-N491 WeakPolarHBondContact CZ2-ND2 3.49Å; W487-N491 HydrophobicContact CZ3-CB 4.3Å; W487-N491 WeakPolarHBondContact CZ3-ND2 3.39Å; W487-N491 PolarHBondContact NE1-ND2 3.22Å; W487-N491 WeakPolarHBondContact O-CB 3.37Å; W487-N491 PolarHBondContact O-N 3.4Å
488I96.7Very high94.3Very high0 Ų057.5 Ų57.50%027%0.266CS..Hα-helixtrans-64.9-46179.2-63.7163.5000110.3Y295 L298 I366 A370 M484 S485 I486 V490 N491 S492Y295-I488 HydrophobicContact CD1-CD1 3.65Å; Y295-I488 HydrophobicContact CD2-CD1 3.99Å; Y295-I488 HydrophobicContact CE1-CD1 3.74Å; Y295-I488 HydrophobicContact CE2-CD1 4.08Å; Y295-I488 HydrophobicContact CE2-CG2 3.92Å; Y295-I488 HydrophobicContact CG-CD1 3.8Å; L298-I488 HydrophobicContact CD1-CD1 4.11Å; I366-I488 HydrophobicContact CG2-CG2 3.95Å; A370-I488 HydrophobicContact CB-CB 3.9Å; A370-I488 HydrophobicContact CB-CG2 3.58Å; M484-I488 VanDerWaalsContact O-CG1 3.29Å; M484-I488 WeakPolarHBondContact O-CG1 3.09Å; M484-I488 PolarHBondContact O-N 2.98Å; S485-I488 PolarHBondContact O-N 3.49Å; I486-I488 VanDerWaalsContact C-N 3.29Å; I486-I488 PolarHBondContact O-N 2.95Å; I488-V490 PolarHBondContact O-N 2.94Å; I488-N491 PolarHBondContact O-N 3.01Å; I488-S492 WeakPolarHBondContact O-CB 3.28Å; I488-S492 PolarHBondContact O-N 3.48Å
489V96Very high93.6Very high24 Ų2460.9 Ų60.915%0.14528%0.279CS..Hα-helixtrans-58.8-46178.3172.50000111.5K367 A370 L371 S485 I486 S493K367-V489 HydrophobicContact CG-CG1 4.47Å; A370-V489 HydrophobicContact CB-CG2 3.65Å; L371-V489 HydrophobicContact CB-CG2 4.35Å; S485-V489 WeakPolarHBondContact O-CG2 3.42Å; S485-V489 PolarHBondContact O-N 2.87Å; I486-V489 PolarHBondContact O-N 3.22Å; V489-S493 WeakPolarHBondContact O-CB 3.32Å; V489-S493 PolarHBondContact O-N 2.75Å; V489-S493 VanDerWaalsContact O-N 3.11Å; V489-S493 PolarHBondContact O-OG 3.38Å
490V95.5Very high92.9Very high60 Ų6060.5 Ų60.536%0.36428%0.279SS..Hα-helixtrans-65.3-46.2179.7172.40000110.7I486 W487 I488 S493 R494I486-V490 HydrophobicContact CG2-CG2 4.3Å; I486-V490 WeakPolarHBondContact O-CG2 3.41Å; I486-V490 PolarHBondContact O-N 3.29Å; W487-V490 PolarHBondContact O-N 2.95Å; I488-V490 PolarHBondContact O-N 2.94Å; V490-S493 WeakPolarHBondContact O-CB 3.42Å; V490-S493 PolarHBondContact O-N 2.76Å; V490-R494 WeakPolarHBondContact O-CG 3.46Å; V490-R494 PolarHBondContact O-N 3.39Å
491N94.3Very high92.3Very high29 Ų2964.6 Ų64.616%0.15529%0.291CS..Hα-helixtrans-71.9-38.6-176.6-80.4-15.9000113.8W487 I488 S493 R494 R495W487-N491 HydrophobicContact CE3-CB 4.4Å; W487-N491 WeakPolarHBondContact CH2-ND2 3.18Å; W487-N491 WeakPolarHBondContact CZ2-ND2 3.49Å; W487-N491 HydrophobicContact CZ3-CB 4.3Å; W487-N491 WeakPolarHBondContact CZ3-ND2 3.39Å; W487-N491 PolarHBondContact NE1-ND2 3.22Å; W487-N491 WeakPolarHBondContact O-CB 3.37Å; W487-N491 PolarHBondContact O-N 3.4Å; I488-N491 PolarHBondContact O-N 3.01Å; N491-S493 VanDerWaalsContact C-N 3.29Å; N491-S493 PolarHBondContact O-N 2.95Å; N491-R494 PolarHBondContact O-N 3Å; N491-R495 WeakPolarHBondContact O-CG 3.38Å; N491-R495 PolarHBondContact O-N 2.87Å
492S91.1Very high91.7Very high0 Ų071.9 Ų71.90%032%0.32CS..Hα-helixtrans-63.8-37.2172-78.10000111.4E363 I366 I488 R494 R495 Q496E363-S492 WeakPolarHBondContact OE2-CB 3.3Å; E363-S492 PolarHBondContact OE2-OG 3.45Å; I366-S492 WeakPolarHBondContact CG2-OG 3.16Å; I488-S492 WeakPolarHBondContact O-CB 3.28Å; I488-S492 PolarHBondContact O-N 3.48Å; S492-R494 PolarHBondContact O-N 3.12Å; S492-R495 PolarHBondContact O-N 3.02Å; S492-Q496 WeakPolarHBondContact O-CB 3.01Å; S492-Q496 PolarHBondContact O-N 3.1Å
493S89.9Confident91.1Very high26 Ų2676.1 Ų76.118%0.18233%0.334CS..Hα-helixtrans-61.7-44.7173.4-58.50000111.9K367 V489 V490 N491 R495 Q496 Q497K367-S493 VanDerWaalsContact CE-OG 3.26Å; K367-S493 WeakPolarHBondContact CE-OG 3.42Å; K367-S493 PolarHBondContact NZ-OG 3.15Å; V489-S493 WeakPolarHBondContact O-CB 3.32Å; V489-S493 PolarHBondContact O-N 2.75Å; V489-S493 VanDerWaalsContact O-N 3.11Å; V489-S493 PolarHBondContact O-OG 3.38Å; V490-S493 WeakPolarHBondContact O-CB 3.42Å; V490-S493 PolarHBondContact O-N 2.76Å; N491-S493 VanDerWaalsContact C-N 3.29Å; N491-S493 PolarHBondContact O-N 2.95Å; S493-R495 PolarHBondContact O-N 2.98Å; S493-Q496 PolarHBondContact O-N 3.3Å; S493-Q497 WeakPolarHBondContact O-CG 3.41Å; S493-Q497 PolarHBondContact O-N 3.33Å
494R91.3Very high90.4Very high145 Ų14576.7 Ų76.755%0.54734%0.337SS..Hα-helixtrans-62.1-42.1175.8-71.8174.3176.4-176-2.2112.3V490 N491 S492 Q497 R498V490-R494 WeakPolarHBondContact O-CG 3.46Å; V490-R494 PolarHBondContact O-N 3.39Å; N491-R494 PolarHBondContact O-N 3Å; S492-R494 PolarHBondContact O-N 3.12Å; R494-Q497 PolarHBondContact O-N 2.95Å; R494-R498 WeakPolarHBondContact O-CG 3.35Å; R494-R498 PolarHBondContact O-N 2.87Å
495R88.6Confident89.7Confident64 Ų6479 Ų7924%0.24235%0.347CS..Hα-helixtrans-65.1-42.6177.1-72.5178.4-169.6152.25.6112.1P290 S291 E363 N491 S492 S493 R498 R499P290-R495 VanDerWaalsContact CB-CZ 3.48Å; S291-R495 PolarHBondContact OG-NH1 3.33Å; E363-R495 VanDerWaalsContact OE1-CD 3.23Å; E363-R495 WeakPolarHBondContact OE1-CD 3.01Å; E363-R495 IonicContact OE1-NH1 3.96Å; N491-R495 WeakPolarHBondContact O-CG 3.38Å; N491-R495 PolarHBondContact O-N 2.87Å; S492-R495 PolarHBondContact O-N 3.02Å; S493-R495 PolarHBondContact O-N 2.98Å; R495-R498 PolarHBondContact O-N 3.02Å; R495-R499 WeakPolarHBondContact O-CG 3.1Å; R495-R499 PolarHBondContact O-N 3.25Å
496Q84.4Confident89Confident64 Ų6481.9 Ų81.930%0.29937%0.367SS..Hα-helixtrans-62.5-43.4176.8-172.2179.1-4.900111.5S492 S493 R499 T500S492-Q496 WeakPolarHBondContact O-CB 3.01Å; S492-Q496 PolarHBondContact O-N 3.1Å; S493-Q496 PolarHBondContact O-N 3.3Å; Q496-R499 PolarHBondContact O-N 3.32Å; Q496-T500 WeakPolarHBondContact O-CB 3.42Å; Q496-T500 PolarHBondContact O-N 3.09Å; Q496-T500 PolarHBondContact O-OG1 3.16Å
497Q86.8Confident88.2Confident135 Ų13583.2 Ų83.263%0.63138%0.378SS*.Hα-helixtrans-60.7-48.8174.4-75.5174.5-18.500111.8S493 R494 R499 T500 Y501S493-Q497 WeakPolarHBondContact O-CG 3.41Å; S493-Q497 PolarHBondContact O-N 3.33Å; R494-Q497 PolarHBondContact O-N 2.95Å; Q497-R499 PolarHBondContact O-N 3.21Å; Q497-T500 PolarHBondContact O-N 3.07Å; Q497-Y501 WeakPolarHBondContact O-CB 3.11Å; Q497-Y501 PolarHBondContact O-N 2.85Å
498R88.6Confident87.5Confident170 Ų17084.9 Ų84.964%0.64239%0.394SS*.Hα-helixtrans-57.2-46177.3-75179.2-177.3-171.50.1112.2R494 R495 T500 Y501 Y502R494-R498 WeakPolarHBondContact O-CG 3.35Å; R494-R498 PolarHBondContact O-N 2.87Å; R495-R498 PolarHBondContact O-N 3.02Å; R498-T500 VanDerWaalsContact C-N 3.35Å; R498-T500 PolarHBondContact O-N 3.23Å; R498-Y501 WeakPolarHBondContact O-CB 3.47Å; R498-Y501 PolarHBondContact O-N 2.83Å; R498-Y502 HydrophobicContact CB-CE2 4.33Å; R498-Y502 WeakPolarHBondContact O-CD2 3.43Å; R498-Y502 PolarHBondContact O-N 2.99Å
499R84.2Confident86.5Confident74 Ų7490.1 Ų90.128%0.27943%0.426SS..Hα-helixtrans-64.2-39.4178.2-74.6-179.3179.1166.13.3112.6L359 E363 R495 Q496 Q497 Y502 R503L359-R499 PolarHBondContact O-NH1 2.88Å; E363-R499 IonicContact OE1-NH2 2.95Å; R495-R499 WeakPolarHBondContact O-CG 3.1Å; R495-R499 PolarHBondContact O-N 3.25Å; Q496-R499 PolarHBondContact O-N 3.32Å; Q497-R499 PolarHBondContact O-N 3.21Å; R499-Y502 PolarHBondContact O-N 3.44Å; R499-R503 WeakPolarHBondContact O-CG 3.5Å; R499-R503 PolarHBondContact O-N 3.45Å
500T83.4Confident85.1Confident65 Ų6596.6 Ų96.640%0.39947%0.466SS..Hα-helixtrans-63.9-45.2176.5-53.50000110.3Q496 Q497 R498 R503 L504Q496-T500 WeakPolarHBondContact O-CB 3.42Å; Q496-T500 PolarHBondContact O-N 3.09Å; Q496-T500 PolarHBondContact O-OG1 3.16Å; Q497-T500 PolarHBondContact O-N 3.07Å; R498-T500 VanDerWaalsContact C-N 3.35Å; R498-T500 PolarHBondContact O-N 3.23Å; T500-R503 PolarHBondContact O-N 2.93Å; T500-L504 HydrophobicContact CG2-CD1 4.25Å; T500-L504 WeakPolarHBondContact O-CG 3.11Å; T500-L504 PolarHBondContact O-N 3.37Å
501Y85.4Confident84.6Confident147 Ų14798.5 Ų98.558%0.57647%0.471SS*.Hα-helixtrans-57.6-50.8175.2-179.8-93.5000112.3Q497 R498 R503 L504 Q505Q497-Y501 WeakPolarHBondContact O-CB 3.11Å; Q497-Y501 PolarHBondContact O-N 2.85Å; R498-Y501 WeakPolarHBondContact O-CB 3.47Å; R498-Y501 PolarHBondContact O-N 2.83Å; Y501-R503 VanDerWaalsContact C-N 3.33Å; Y501-R503 PolarHBondContact O-N 2.58Å; Y501-L504 PolarHBondContact O-N 3.42Å; Y501-Q505 VanDerWaalsContact CE1-OE1 3.28Å; Y501-Q505 PolarHBondContact O-N 2.95Å
502Y85.4Confident84.1Confident154 Ų154102.1 Ų102.160%0.60449%0.488SS*.Hα-helixtrans-62.8-36.3178.6-73.5-61.1000113.3R498 R499 Q505 S506R498-Y502 HydrophobicContact CB-CE2 4.33Å; R498-Y502 WeakPolarHBondContact O-CD2 3.43Å; R498-Y502 PolarHBondContact O-N 2.99Å; R499-Y502 PolarHBondContact O-N 3.44Å; Y502-Q505 PolarHBondContact O-N 3.1Å; Y502-S506 WeakPolarHBondContact O-CB 3.44Å; Y502-S506 PolarHBondContact O-N 3.44Å; Y502-S506 PolarHBondContact O-OG 3.3Å
503R83.9Confident83.7Confident132 Ų132107.8 Ų107.850%0.49852%0.515SS..Hα-helixtrans-64.9-44.7175.1-76.7-177.1-172.3-163.71.5112.1N360 R499 T500 Y501 Q505 S506 T507N360-R503 PolarHBondContact ND2-NH1 3.13Å; N360-R503 VanDerWaalsContact ND2-NH1 3.16Å; N360-R503 PolarHBondContact ND2-NH2 3.25Å; R499-R503 WeakPolarHBondContact O-CG 3.5Å; R499-R503 PolarHBondContact O-N 3.45Å; T500-R503 PolarHBondContact O-N 2.93Å; Y501-R503 VanDerWaalsContact C-N 3.33Å; Y501-R503 PolarHBondContact O-N 2.58Å; R503-Q505 VanDerWaalsContact C-N 3.33Å; R503-S506 WeakPolarHBondContact CA-OG 3.4Å; R503-S506 PolarHBondContact O-N 3.02Å; R503-S506 PolarHBondContact O-OG 2.97Å; R503-T507 PolarHBondContact O-N 3.07Å; R503-T507 PolarHBondContact O-OG1 2.93Å
504L84.4Confident83.3Confident106 Ų106112.6 Ų112.656%0.55553%0.534SS*.Hα-helixtrans-61.8-45.2176.7-69.7170.7000110.6T500 Y501 S506 T507 I508T500-L504 HydrophobicContact CG2-CD1 4.25Å; T500-L504 WeakPolarHBondContact O-CG 3.11Å; T500-L504 PolarHBondContact O-N 3.37Å; Y501-L504 PolarHBondContact O-N 3.42Å; L504-S506 PolarHBondContact O-N 3.22Å; L504-T507 PolarHBondContact O-N 3.02Å; L504-I508 WeakPolarHBondContact O-CG1 3.47Å; L504-I508 PolarHBondContact O-N 3.18Å; L504-I508 VanDerWaalsContact O-N 3.08Å
505Q83Confident82.8Confident92 Ų92110.6 Ų110.643%0.4353%0.533SS..Hα-helixtrans-61.9-43.1177.3-166.4174.4-3.100112Y501 Y502 R503 T507 I508 T509Y501-Q505 VanDerWaalsContact CE1-OE1 3.28Å; Y501-Q505 PolarHBondContact O-N 2.95Å; Y502-Q505 PolarHBondContact O-N 3.1Å; R503-Q505 VanDerWaalsContact C-N 3.33Å; Q505-T507 VanDerWaalsContact C-N 3.27Å; Q505-T507 PolarHBondContact O-N 3.3Å; Q505-I508 PolarHBondContact O-N 3.5Å; Q505-T509 PolarHBondContact O-N 2.93Å; Q505-T509 PolarHBondContact O-OG1 3.11Å
506S81.2Confident82.4Confident60 Ų60113.7 Ų113.742%0.4255%0.553SS.*Hα-helixtrans-64.3-31176.459.70000113.4Y502 R503 L504 T509 T510Y502-S506 WeakPolarHBondContact O-CB 3.44Å; Y502-S506 PolarHBondContact O-N 3.44Å; Y502-S506 PolarHBondContact O-OG 3.3Å; R503-S506 WeakPolarHBondContact CA-OG 3.4Å; R503-S506 PolarHBondContact O-N 3.02Å; R503-S506 PolarHBondContact O-OG 2.97Å; L504-S506 PolarHBondContact O-N 3.22Å; S506-T509 WeakPolarHBondContact CA-OG1 3.23Å; S506-T509 PolarHBondContact O-OG1 3.14Å; S506-T510 WeakPolarHBondContact O-CG2 3.32Å; S506-T510 PolarHBondContact O-N 3.11Å; S506-T510 PolarHBondContact O-OG1 3.03Å
507T81.6Confident82.3Confident93 Ų93117.2 Ų117.257%0.57157%0.571SS**Hα-helixtrans-75.6-29.3178.4-49.40000111.7R503 L504 Q505 T510R503-T507 PolarHBondContact O-N 3.07Å; R503-T507 PolarHBondContact O-OG1 2.93Å; L504-T507 PolarHBondContact O-N 3.02Å; Q505-T507 VanDerWaalsContact C-N 3.27Å; Q505-T507 PolarHBondContact O-N 3.3Å; T507-T510 PolarHBondContact O-OG1 2.93Å; T507-T510 VanDerWaalsContact O-OG1 3.11Å
508I82Confident82Confident142 Ų142115.8 Ų115.873%0.72857%0.566SS**Hα-helixtrans-76.3-28.7176.8-66.8164.4000111.1L504 Q505L504-I508 WeakPolarHBondContact O-CG1 3.47Å; L504-I508 PolarHBondContact O-N 3.18Å; L504-I508 VanDerWaalsContact O-N 3.08Å; Q505-I508 PolarHBondContact O-N 3.5Å
509T76.1Confident81.4Confident110 Ų110111.3 Ų111.368%0.67556%0.56SS**  trans-86.5-8.7-179.550.10000114.8Q505 S506Q505-T509 PolarHBondContact O-N 2.93Å; Q505-T509 PolarHBondContact O-OG1 3.11Å; S506-T509 WeakPolarHBondContact CA-OG1 3.23Å; S506-T509 PolarHBondContact O-OG1 3.14Å
510T66.3Low81.2Confident161 Ų161114.7 Ų114.799%0.98859%0.586SS**  trans-101.60173.350.80000109.8S506 T507S506-T510 WeakPolarHBondContact O-CG2 3.32Å; S506-T510 PolarHBondContact O-N 3.11Å; S506-T510 PolarHBondContact O-OG1 3.03Å; T507-T510 PolarHBondContact O-OG1 2.93Å; T507-T510 VanDerWaalsContact O-OG1 3.11Å

Retrieved 510 of 510 residues in 1283.3 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).