A0A087X9D7_POEFO Loading...

Centrosomal protein of 70 kDa

Plays a role in the organization of both preexisting and nascent microtubules in interphase cells. During mitosis, required for the organization and orientation of the mitotic spindle.

AlphaFold DB , UniProt , Accession A0A087X9D7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 486 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M53Low65.2Low116 Ų116105.1 Ų105.157%0.57152%0.522SS*.  0148.50-66.8-164.694.400109.2E5 F26 V39M1-E5 HydrophobicContact CE-CB 4.33Å; M1-F26 HydrophobicContact CE-CD2 4.46Å; M1-F26 HydrophobicContact CE-CE2 4.2Å; M1-F26 HydrophobicContact CE-CZ 4.25Å; M1-F26 HydrophobicContact SD-CD2 3.99Å; M1-F26 HydrophobicContact SD-CE2 4.23Å; M1-F26 HydrophobicContact SD-CG 4.33Å; M1-V39 HydrophobicContact CE-CB 4.4Å; M1-V39 HydrophobicContact CE-CG1 3.65Å; M1-V39 HydrophobicContact CE-CG2 3.79Å; M1-V39 HydrophobicContact SD-CG1 4.45Å
2K48.8Very low66.3Low148 Ų148101.5 Ų101.564%0.64351%0.509SS*.  trans-74.2144.9173.5-68.3171.8-176.7166.20108.6Q4 E5K2-Q4 PolarHBondContact O-N 3.39Å; K2-E5 HydrophobicContact CB-CG 4.49Å; K2-E5 PolarHBondContact N-OE2 3.23Å; K2-E5 VanDerWaalsContact N-OE2 3.14Å; K2-E5 PolarHBondContact O-N 3.25Å; K2-E5 VanDerWaalsContact O-N 3.11Å
3P58Low67.6Low113 Ų11394.8 Ų94.873%0.73448%0.476SS*.Hα-helixtrans-55.8-27.4-177.9-18.524.4000113.9V7P3-V7 WeakPolarHBondContact O-CG2 3.5Å
4Q57.2Low68.9Low146 Ų14696.9 Ų96.968%0.68248%0.481SS*.Hα-helixtrans-73.9-33.3-177.6-163.2153.5-9.200113.1K2 Q6 V7 E8K2-Q4 PolarHBondContact O-N 3.39Å; Q4-Q6 VanDerWaalsContact C-N 3.34Å; Q4-V7 PolarHBondContact O-N 2.7Å; Q4-E8 PolarHBondContact O-N 3.01Å
5E60.5Low69.6Low74 Ų7497.4 Ų97.435%0.34649%0.485SS..Hα-helixtrans-68.9-36.1176.1-67.2163.117100110.6M1 K2 V7 E8 W9M1-E5 HydrophobicContact CE-CB 4.33Å; K2-E5 HydrophobicContact CB-CG 4.49Å; K2-E5 PolarHBondContact N-OE2 3.23Å; K2-E5 VanDerWaalsContact N-OE2 3.14Å; K2-E5 PolarHBondContact O-N 3.25Å; K2-E5 VanDerWaalsContact O-N 3.11Å; E5-V7 VanDerWaalsContact C-N 3.34Å; E5-V7 PolarHBondContact O-N 2.83Å; E5-E8 PolarHBondContact O-N 3.07Å; E5-W9 PolarHBondContact O-N 3.01Å; E5-W9 VanDerWaalsContact O-N 3.15Å
6Q64.3Low70.2Confident97 Ų9793.7 Ų93.745%0.45347%0.467SS..Hα-helixtrans-61.8-42.1177.9-158.294.118.100111.8Q4 W9 D10Q4-Q6 VanDerWaalsContact C-N 3.34Å; Q6-W9 PolarHBondContact O-N 2.9Å; Q6-D10 VanDerWaalsContact O-CG 3.32Å; Q6-D10 PolarHBondContact O-N 3.47Å
7V68.9Low70.9Confident85 Ų8594.5 Ų94.552%0.51547%0.469SS..Hα-helixtrans-66.3-40.1179.9176.50000111.3P3 Q4 E5 D10 D11P3-V7 WeakPolarHBondContact O-CG2 3.5Å; Q4-V7 PolarHBondContact O-N 2.7Å; E5-V7 VanDerWaalsContact C-N 3.34Å; E5-V7 PolarHBondContact O-N 2.83Å; V7-D10 PolarHBondContact O-N 3.42Å; V7-D11 PolarHBondContact O-N 3.15Å; V7-D11 VanDerWaalsContact O-N 3.15Å
8E73Confident71.6Confident118 Ų11898 Ų9855%0.55148%0.484SS*.Hα-helixtrans-63.9-40.1176.6-70.1176.8-176.300111.9Q4 E5 D11 V12Q4-E8 PolarHBondContact O-N 3.01Å; E5-E8 PolarHBondContact O-N 3.07Å; E8-D11 PolarHBondContact O-N 3.34Å; E8-V12 WeakPolarHBondContact O-CG2 3.49Å; E8-V12 PolarHBondContact O-N 3.2Å; E8-V12 VanDerWaalsContact O-N 3.1Å
9W73.8Confident71.9Confident92 Ų9299.2 Ų99.235%0.34849%0.488SS..Hα-helixtrans-72.9-30176.9-77.7105000113.7E5 Q6 D11 V12 N13 F26E5-W9 PolarHBondContact O-N 3.01Å; E5-W9 VanDerWaalsContact O-N 3.15Å; Q6-W9 PolarHBondContact O-N 2.9Å; W9-D11 VanDerWaalsContact C-N 3.35Å; W9-V12 HydrophobicContact CE3-CB 4.4Å; W9-V12 HydrophobicContact CE3-CG1 4.26Å; W9-V12 HydrophobicContact CZ3-CG1 4.34Å; W9-V12 PolarHBondContact O-N 3.38Å; W9-N13 VanDerWaalsContact O-CB 3.31Å; W9-N13 WeakPolarHBondContact O-CB 3.49Å; W9-N13 PolarHBondContact O-N 3.22Å; W9-N13 PolarHBondContact O-ND2 3.4Å; W9-F26 HydrophobicContact CB-CE2 4.07Å; W9-F26 HydrophobicContact CB-CZ 4.45Å; W9-F26 AromaticContact CD1-CE2 3.72Å; W9-F26 AromaticContact CD1-CZ 3.53Å; W9-F26 HydrophobicContact CD2-CE2 4.07Å; W9-F26 AromaticContact CD2-CZ 3.56Å; W9-F26 HydrophobicContact CD2-CZ 3.56Å; W9-F26 AromaticContact CE2-CZ 3.51Å; W9-F26 HydrophobicContact CE3-CZ 4.21Å; W9-F26 AromaticContact CG-CE2 3.68Å; W9-F26 HydrophobicContact CG-CE2 3.68Å; W9-F26 AromaticContact CG-CZ 3.61Å; W9-F26 HydrophobicContact CG-CZ 3.61Å; W9-F26 HydrophobicContact CZ2-CZ 4.1Å; W9-F26 AromaticContact NE1-CZ 3.51Å
10D77.8Confident72.2Confident80 Ų8097.6 Ų97.643%0.42850%0.498SS..Hα-helixtrans-65.8-38.9172.4-75-23.9000111.5Q6 V7 N13 K14Q6-D10 VanDerWaalsContact O-CG 3.32Å; Q6-D10 PolarHBondContact O-N 3.47Å; V7-D10 PolarHBondContact O-N 3.42Å; D10-N13 PolarHBondContact O-N 2.96Å; D10-K14 WeakPolarHBondContact O-CG 3.42Å; D10-K14 PolarHBondContact O-N 3.16Å
11D81.7Confident72.4Confident87 Ų8796.2 Ų96.247%0.46549%0.489SS..Hα-helixtrans-69.7-38.6175.7-72.4-20.3000112.2V7 E8 W9 N13 K14 L15V7-D11 PolarHBondContact O-N 3.15Å; V7-D11 VanDerWaalsContact O-N 3.15Å; E8-D11 PolarHBondContact O-N 3.34Å; W9-D11 VanDerWaalsContact C-N 3.35Å; D11-N13 VanDerWaalsContact C-N 3.34Å; D11-K14 PolarHBondContact O-N 2.81Å; D11-K14 IonicContact OD1-NZ 2.7Å; D11-K14 PolarHBondContact OD1-NZ 2.78Å; D11-L15 PolarHBondContact O-N 3.28Å
12V79.3Confident73.7Confident62 Ų6296.5 Ų96.538%0.37649%0.487SS..Hα-helixtrans-61.9-42.5171.1171.80000111.1E8 W9 L15 L16E8-V12 WeakPolarHBondContact O-CG2 3.49Å; E8-V12 PolarHBondContact O-N 3.2Å; E8-V12 VanDerWaalsContact O-N 3.1Å; W9-V12 HydrophobicContact CE3-CB 4.4Å; W9-V12 HydrophobicContact CE3-CG1 4.26Å; W9-V12 HydrophobicContact CZ3-CG1 4.34Å; W9-V12 PolarHBondContact O-N 3.38Å; V12-L15 WeakPolarHBondContact O-CB 3.46Å; V12-L15 PolarHBondContact O-N 3.07Å; V12-L16 HydrophobicContact CG1-CD1 4.14Å; V12-L16 HydrophobicContact CG1-CG 4.42Å; V12-L16 WeakPolarHBondContact O-CG 3.48Å; V12-L16 PolarHBondContact O-N 3.05Å
13N82.7Confident75.1Confident15 Ų1591.1 Ų91.18%0.0847%0.467CS..Hα-helixtrans-66.7-36.9177.8-82.7-28000112.6W9 D10 D11 L15 L16 Q17 P23 V24W9-N13 VanDerWaalsContact O-CB 3.31Å; W9-N13 WeakPolarHBondContact O-CB 3.49Å; W9-N13 PolarHBondContact O-N 3.22Å; W9-N13 PolarHBondContact O-ND2 3.4Å; D10-N13 PolarHBondContact O-N 2.96Å; D11-N13 VanDerWaalsContact C-N 3.34Å; N13-L15 VanDerWaalsContact C-N 3.32Å; N13-L16 PolarHBondContact O-N 2.9Å; N13-Q17 WeakPolarHBondContact O-CB 3.46Å; N13-Q17 VanDerWaalsContact O-CG 3.23Å; N13-Q17 WeakPolarHBondContact O-CG 3.32Å; N13-Q17 PolarHBondContact O-N 2.93Å; N13-P23 HydrophobicContact CB-CB 4.2Å; N13-P23 WeakPolarHBondContact OD1-CA 3.36Å; N13-V24 PolarHBondContact ND2-O 3.35Å; N13-V24 PolarHBondContact OD1-N 2.84Å
14K85.3Confident76.1Confident124 Ų12486 Ų8654%0.53943%0.434SS..Hα-helixtrans-60.7-42.6170.7-72.3169.9-160.41560111.3D10 D11 Q17 H18D10-K14 WeakPolarHBondContact O-CG 3.42Å; D10-K14 PolarHBondContact O-N 3.16Å; D11-K14 PolarHBondContact O-N 2.81Å; D11-K14 IonicContact OD1-NZ 2.7Å; D11-K14 PolarHBondContact OD1-NZ 2.78Å; K14-Q17 PolarHBondContact O-N 3.44Å; K14-H18 WeakPolarHBondContact O-CB 3.5Å; K14-H18 PolarHBondContact O-N 3.45Å
15L80.3Confident76.9Confident104 Ų10484.8 Ų84.855%0.54543%0.426SS..Hα-helixtrans-66.6-44.2178.8-172.566.2000111.7D11 V12 N13 Q17 H18 H19D11-L15 PolarHBondContact O-N 3.28Å; V12-L15 WeakPolarHBondContact O-CB 3.46Å; V12-L15 PolarHBondContact O-N 3.07Å; N13-L15 VanDerWaalsContact C-N 3.32Å; L15-Q17 VanDerWaalsContact C-N 3.32Å; L15-Q17 PolarHBondContact O-N 3.16Å; L15-H18 WeakPolarHBondContact O-CB 3.48Å; L15-H18 PolarHBondContact O-N 2.81Å; L15-H19 PolarHBondContact O-CD2 3.43Å; L15-H19 VanDerWaalsContact O-CD2 3.25Å; L15-H19 PolarHBondContact O-N 3.23Å; L15-H19 VanDerWaalsContact O-N 3.11Å
16L78.8Confident77.3Confident38 Ų3883.8 Ų83.820%0.19942%0.421CS..Hα-helixtrans-57-46.9174.4-75.3173.5000111.1V12 N13 H18 H19 G20 F21 V24V12-L16 HydrophobicContact CG1-CD1 4.14Å; V12-L16 HydrophobicContact CG1-CG 4.42Å; V12-L16 WeakPolarHBondContact O-CG 3.48Å; V12-L16 PolarHBondContact O-N 3.05Å; N13-L16 PolarHBondContact O-N 2.9Å; L16-H18 PolarHBondContact O-N 3Å; L16-H19 CarbonylContact O-C 3.49Å; L16-H19 PolarHBondContact O-N 3.44Å; L16-G20 PolarHBondContact O-N 2.89Å; L16-F21 HydrophobicContact CB-CB 4.11Å; L16-F21 HydrophobicContact CD2-CB 4.11Å; L16-F21 HydrophobicContact CD2-CD2 4.04Å; L16-F21 HydrophobicContact CD2-CG 4.42Å; L16-F21 WeakPolarHBondContact O-CA 3.38Å; L16-F21 WeakPolarHBondContact O-CB 3.28Å; L16-F21 PolarHBondContact O-N 3.46Å; L16-V24 HydrophobicContact CD1-CG2 3.79Å
17Q81.6Confident77.3Confident108 Ų10880.5 Ų80.551%0.50541%0.41SS..Hα-helixtrans-64.6-38.5177.6-72.317510.300112.7N13 K14 L15 H19 G20 F21N13-Q17 WeakPolarHBondContact O-CB 3.46Å; N13-Q17 VanDerWaalsContact O-CG 3.23Å; N13-Q17 WeakPolarHBondContact O-CG 3.32Å; N13-Q17 PolarHBondContact O-N 2.93Å; K14-Q17 PolarHBondContact O-N 3.44Å; L15-Q17 VanDerWaalsContact C-N 3.32Å; L15-Q17 PolarHBondContact O-N 3.16Å; Q17-H19 PolarHBondContact O-N 2.96Å; Q17-G20 PolarHBondContact O-N 3.37Å; Q17-F21 WeakPolarHBondContact CA-O 3.42Å
18H83.7Confident76.9Confident157 Ų15780.8 Ų80.873%0.72741%0.409SS*.Hα-helixtrans-61.2-31.6175.1-173.3-89000112.3K14 L15 L16 G20K14-H18 WeakPolarHBondContact O-CB 3.5Å; K14-H18 PolarHBondContact O-N 3.45Å; L15-H18 WeakPolarHBondContact O-CB 3.48Å; L15-H18 PolarHBondContact O-N 2.81Å; L16-H18 PolarHBondContact O-N 3Å; H18-G20 VanDerWaalsContact C-N 3.34Å
19H77.4Confident76.2Confident120 Ų12080.5 Ų80.556%0.55642%0.418SS*.THydrogen-bonded Turntrans-90.59.1174-71.4-72.6000114L15 L16 Q17 F21L15-H19 PolarHBondContact O-CD2 3.43Å; L15-H19 VanDerWaalsContact O-CD2 3.25Å; L15-H19 PolarHBondContact O-N 3.23Å; L15-H19 VanDerWaalsContact O-N 3.11Å; L16-H19 CarbonylContact O-C 3.49Å; L16-H19 PolarHBondContact O-N 3.44Å; Q17-H19 PolarHBondContact O-N 2.96Å; H19-F21 HydrophobicContact CB-CD2 3.75Å; H19-F21 HydrophobicContact CB-CE2 3.7Å
20G77.4Confident75.3Confident68 Ų6881.7 Ų81.770%0.70143%0.434SS*.THydrogen-bonded Turntrans82.112.4176.200000115.2L16 Q17 H18L16-G20 PolarHBondContact O-N 2.89Å; Q17-G20 PolarHBondContact O-N 3.37Å; H18-G20 VanDerWaalsContact C-N 3.34Å
21F77.2Confident74.2Confident68 Ų6885.6 Ų85.630%0.29845%0.45SS..PPolyproline II helixtrans-92.3155.3177.6-55.4-58.9000112.3L16 Q17 H19 T52 M56L16-F21 HydrophobicContact CB-CB 4.11Å; L16-F21 HydrophobicContact CD2-CB 4.11Å; L16-F21 HydrophobicContact CD2-CD2 4.04Å; L16-F21 HydrophobicContact CD2-CG 4.42Å; L16-F21 WeakPolarHBondContact O-CA 3.38Å; L16-F21 WeakPolarHBondContact O-CB 3.28Å; L16-F21 PolarHBondContact O-N 3.46Å; Q17-F21 WeakPolarHBondContact CA-O 3.42Å; H19-F21 HydrophobicContact CB-CD2 3.75Å; H19-F21 HydrophobicContact CB-CE2 3.7Å; F21-T52 HydrophobicContact CD1-CG2 3.29Å; F21-T52 HydrophobicContact CE1-CG2 3.21Å; F21-T52 HydrophobicContact CG-CG2 4.19Å; F21-T52 HydrophobicContact CZ-CG2 4.04Å; F21-M56 HydrophobicContact CE1-SD 4.28Å; F21-M56 HydrophobicContact CZ-SD 3.73Å
22K79.5Confident72.9Confident123 Ų12385 Ų8554%0.53545%0.447SS..PPolyproline II helixtrans-74.7143.6177.8-68.8176.5-177.1159.50110.8E48K22-E48 HydrophobicContact CD-CG 4.15Å; K22-E48 WeakPolarHBondContact CD-OE2 3.27Å; K22-E48 IonicContact NZ-OE1 2.74Å; K22-E48 PolarHBondContact NZ-OE1 3.38Å; K22-E48 IonicContact NZ-OE2 2.78Å; K22-E48 PolarHBondContact NZ-OE2 3.29Å
23P78.9Confident71.7Confident35 Ų3593 Ų9323%0.22747%0.471CS..PPolyproline II helixtrans-65.2149.4174.526-32.2000111.6N13 F25N13-P23 HydrophobicContact CB-CB 4.2Å; N13-P23 WeakPolarHBondContact OD1-CA 3.36Å; P23-F25 HydrophobicContact CB-CE2 4.15Å; P23-F25 HydrophobicContact CB-CZ 4.01Å; P23-F25 HydrophobicContact CG-CE2 3.81Å; P23-F25 HydrophobicContact CG-CZ 3.74Å
24V78.9Confident70.4Confident6 Ų699.1 Ų99.14%0.03650%0.503CS..PPolyproline II helixtrans-103.3129.9-176.1175.40000109N13 L16 L41 L49N13-V24 PolarHBondContact ND2-O 3.35Å; N13-V24 PolarHBondContact OD1-N 2.84Å; L16-V24 HydrophobicContact CD1-CG2 3.79Å; V24-L41 HydrophobicContact CG1-CD1 3.93Å; V24-L41 HydrophobicContact CG1-CD2 3.23Å; V24-L41 HydrophobicContact CG1-CG 4.16Å; V24-L49 HydrophobicContact CG1-CD1 4.16Å; V24-L49 HydrophobicContact CG2-CD1 3.71Å; V24-L49 HydrophobicContact CG2-CD2 3.84Å; V24-L49 HydrophobicContact CG2-CG 3.86Å
25F74.1Confident68.8Low119 Ų11998.5 Ų98.552%0.52251%0.505SS..  trans-117.5151.8-177.3-59.1-79.7000111.9P23 D42 S45P23-F25 HydrophobicContact CB-CE2 4.15Å; P23-F25 HydrophobicContact CB-CZ 4.01Å; P23-F25 HydrophobicContact CG-CE2 3.81Å; P23-F25 HydrophobicContact CG-CZ 3.74Å; F25-D42 PolarHBondContact O-N 3.42Å; F25-S45 PolarHBondContact N-OG 3.03Å
26F68.8Low67.4Low53 Ų53100.9 Ų100.923%0.23252%0.524CS..BIsolated β-bridgetrans-89.1146.3173.5-63.7-66.1000111.3M1 W9 V39 L41M1-F26 HydrophobicContact CE-CD2 4.46Å; M1-F26 HydrophobicContact CE-CE2 4.2Å; M1-F26 HydrophobicContact CE-CZ 4.25Å; M1-F26 HydrophobicContact SD-CD2 3.99Å; M1-F26 HydrophobicContact SD-CE2 4.23Å; M1-F26 HydrophobicContact SD-CG 4.33Å; W9-F26 HydrophobicContact CB-CE2 4.07Å; W9-F26 HydrophobicContact CB-CZ 4.45Å; W9-F26 AromaticContact CD1-CE2 3.72Å; W9-F26 AromaticContact CD1-CZ 3.53Å; W9-F26 HydrophobicContact CD2-CE2 4.07Å; W9-F26 AromaticContact CD2-CZ 3.56Å; W9-F26 HydrophobicContact CD2-CZ 3.56Å; W9-F26 AromaticContact CE2-CZ 3.51Å; W9-F26 HydrophobicContact CE3-CZ 4.21Å; W9-F26 AromaticContact CG-CE2 3.68Å; W9-F26 HydrophobicContact CG-CE2 3.68Å; W9-F26 AromaticContact CG-CZ 3.61Å; W9-F26 HydrophobicContact CG-CZ 3.61Å; W9-F26 HydrophobicContact CZ2-CZ 4.1Å; W9-F26 AromaticContact NE1-CZ 3.51Å; F26-V39 HydrophobicContact CD1-CG1 3.07Å; F26-V39 HydrophobicContact CE1-CB 4.45Å; F26-V39 HydrophobicContact CE1-CG1 3.06Å; F26-V39 HydrophobicContact CG-CG1 3.96Å; F26-V39 HydrophobicContact CZ-CG1 3.94Å; F26-L41 HydrophobicContact CD1-CD2 3.69Å; F26-L41 HydrophobicContact CE1-CD2 3.5Å; F26-L41 HydrophobicContact CE1-CG 4.48Å; F26-L41 HydrophobicContact CZ-CD2 4.32Å
27A65.3Low66Low28 Ų28106.6 Ų106.623%0.23156%0.555CS.*PPolyproline II helixtrans-69.5147.4173.300000110.9L40A27-L40 HydrophobicContact CB-CB 4.37Å; A27-L40 VanDerWaalsContact CB-O 3.26Å; A27-L40 WeakPolarHBondContact CB-O 3.44Å; A27-L40 PolarHBondContact N-O 3.14Å
28D60.3Low64.7Low92 Ų92106.4 Ų106.449%0.49256%0.557SS.*PPolyproline II helixtrans-64.3125.8178.9-167.3-29.3000110.4V30 E31D28-V30 PolarHBondContact O-N 3.31Å; D28-V30 WeakPolarHBondContact OD1-CG2 3.4Å; D28-V30 PolarHBondContact OD1-N 3.39Å; D28-V30 VanDerWaalsContact OD1-N 3.14Å; D28-E31 PolarHBondContact O-N 2.7Å
29P56.6Low63.3Low112 Ų112102.8 Ų102.873%0.72755%0.546SS*.THydrogen-bonded Turntrans-55.5-21.2178.8-25.733000115
30V55.8Low62.6Low116 Ų116100.1 Ų100.170%0.70354%0.535SS*.THydrogen-bonded Turntrans-78.9-23.8-176.4-171.50000112.6D28D28-V30 PolarHBondContact O-N 3.31Å; D28-V30 WeakPolarHBondContact OD1-CG2 3.4Å; D28-V30 PolarHBondContact OD1-N 3.39Å; D28-V30 VanDerWaalsContact OD1-N 3.14Å
31E55.5Low62.2Low163 Ų16399.1 Ų99.176%0.76251%0.514SS*.THydrogen-bonded Turntrans-82.9-19.4-179.7-67.1-169.1158.300113.4D28D28-E31 PolarHBondContact O-N 2.7Å
32N53.3Low62Low75 Ų7597.8 Ų97.840%0.40151%0.51SS..  trans-10885.9-178.6-78.7-58.5000111.6N34N32-N34 PolarHBondContact O-N 2.93Å
33R54.6Low61.6Low229 Ų229100.3 Ų100.386%0.86452%0.521SS*.  trans-70.4-10.7-175-71.8-171.8178.2-172.4-0.3115.9
34N54.3Low61.4Low143 Ų143105.7 Ų105.777%0.76554%0.54SS*.SBendtrans-137.9116.5174.5-62-46.8000107.4N32N32-N34 PolarHBondContact O-N 2.93Å
35L53.3Low61.2Low112 Ų112105.7 Ų105.759%0.58654%0.541SS*.  trans14972.7162.2-80.2160.2000107.4D37 L40L35-D37 PolarHBondContact O-N 3.14Å; L35-L40 HydrophobicContact CD1-CD1 4.07Å
36T50Low61.3Low153 Ų153102.5 Ų102.594%0.93953%0.531SS*.THydrogen-bonded Turntrans-63.86.1-178.919.40000115
37D49.2Very low61.6Low158 Ų158103.1 Ų103.185%0.84554%0.537SS*.THydrogen-bonded Turntrans-147.519.3-176.7-120-4.5000115.8L35L35-D37 PolarHBondContact O-N 3.14Å
38L53.7Low62.2Low104 Ų104104.7 Ų104.755%0.54554%0.539SS..  trans-127.9109.5174.7-135.975.2000111.6L40L38-L40 VanDerWaalsContact C-N 3.31Å; L38-L40 PolarHBondContact O-N 2.98Å
39V54.5Low63.2Low82 Ų82102.8 Ų102.850%0.49753%0.529SS..  trans-64.492.4169.8178.80000108.1M1 F26 L41M1-V39 HydrophobicContact CE-CB 4.4Å; M1-V39 HydrophobicContact CE-CG1 3.65Å; M1-V39 HydrophobicContact CE-CG2 3.79Å; M1-V39 HydrophobicContact SD-CG1 4.45Å; F26-V39 HydrophobicContact CD1-CG1 3.07Å; F26-V39 HydrophobicContact CE1-CB 4.45Å; F26-V39 HydrophobicContact CE1-CG1 3.06Å; F26-V39 HydrophobicContact CG-CG1 3.96Å; F26-V39 HydrophobicContact CZ-CG1 3.94Å; V39-L41 PolarHBondContact O-N 3.13Å
40L63.6Low64.3Low64 Ų64102.1 Ų102.134%0.33551%0.512SS..  trans-79.1113.7178.7-82.4147.6000109A27 L35 L38A27-L40 HydrophobicContact CB-CB 4.37Å; A27-L40 VanDerWaalsContact CB-O 3.26Å; A27-L40 WeakPolarHBondContact CB-O 3.44Å; A27-L40 PolarHBondContact N-O 3.14Å; L35-L40 HydrophobicContact CD1-CD1 4.07Å; L38-L40 VanDerWaalsContact C-N 3.31Å; L38-L40 PolarHBondContact O-N 2.98Å
41L68.6Low65.5Low47 Ų47101.9 Ų101.925%0.24650%0.504CS..BIsolated β-bridgetrans-55.5144.6164.2-70.2179.4000109.8V24 F26 V39 V46 L49V24-L41 HydrophobicContact CG1-CD1 3.93Å; V24-L41 HydrophobicContact CG1-CD2 3.23Å; V24-L41 HydrophobicContact CG1-CG 4.16Å; F26-L41 HydrophobicContact CD1-CD2 3.69Å; F26-L41 HydrophobicContact CE1-CD2 3.5Å; F26-L41 HydrophobicContact CE1-CG 4.48Å; F26-L41 HydrophobicContact CZ-CD2 4.32Å; V39-L41 PolarHBondContact O-N 3.13Å; L41-V46 HydrophobicContact CB-CG2 3.4Å; L41-V46 HydrophobicContact CD1-CG2 4.21Å; L41-V46 HydrophobicContact CG-CG2 4.44Å; L41-L49 HydrophobicContact CD1-CD1 4.06Å
42D74.3Confident66.7Low40 Ų4095.3 Ų95.321%0.21448%0.475CS..  trans-62.9145.2176.585.1-33.1000110.3F25 K44 S45 V46F25-D42 PolarHBondContact O-N 3.42Å; D42-K44 PolarHBondContact O-N 2.92Å; D42-K44 WeakPolarHBondContact OD2-CB 3.26Å; D42-S45 PolarHBondContact O-N 2.61Å; D42-S45 VanDerWaalsContact O-N 3.09Å; D42-S45 WeakPolarHBondContact OD1-CA 3.41Å; D42-S45 WeakPolarHBondContact OD1-CB 3.39Å; D42-S45 PolarHBondContact OD1-N 3.36Å; D42-S45 PolarHBondContact OD1-OG 3.01Å; D42-V46 WeakPolarHBondContact O-CG2 3.27Å; D42-V46 PolarHBondContact O-N 3.39Å; D42-V46 VanDerWaalsContact O-N 3.07Å
43K70.3Confident68.2Low175 Ų17596.7 Ų96.776%0.76148%0.482SS*.Hα-helixtrans-56.3-28.5-174-171.1174.5-177.6175.50112.4N47K43-N47 WeakPolarHBondContact O-CB 3.34Å; K43-N47 PolarHBondContact O-N 3.48Å; K43-N47 PolarHBondContact O-ND2 3.24Å; K43-N47 VanDerWaalsContact O-ND2 3.15Å
44K74.6Confident69.6Low148 Ų14891.5 Ų91.564%0.64346%0.463SS*.Hα-helixtrans-71.3-49.9177.9-167.7179.9178.4-176.80111.5D42 V46 N47 E48D42-K44 PolarHBondContact O-N 2.92Å; D42-K44 WeakPolarHBondContact OD2-CB 3.26Å; K44-V46 VanDerWaalsContact C-N 3.32Å; K44-V46 PolarHBondContact O-N 2.92Å; K44-N47 PolarHBondContact O-N 2.85Å; K44-E48 VanDerWaalsContact O-CG 3.3Å; K44-E48 WeakPolarHBondContact O-CG 3.42Å; K44-E48 PolarHBondContact O-N 3Å
45S74.6Confident70.9Confident7 Ų790.6 Ų90.65%0.04946%0.455CS..Hα-helixtrans-64.6-36.8177.9-56.40000112F25 D42 N47 E48 L49F25-S45 PolarHBondContact N-OG 3.03Å; D42-S45 PolarHBondContact O-N 2.61Å; D42-S45 VanDerWaalsContact O-N 3.09Å; D42-S45 WeakPolarHBondContact OD1-CA 3.41Å; D42-S45 WeakPolarHBondContact OD1-CB 3.39Å; D42-S45 PolarHBondContact OD1-N 3.36Å; D42-S45 PolarHBondContact OD1-OG 3.01Å; S45-N47 PolarHBondContact O-N 3.49Å; S45-E48 PolarHBondContact O-N 3.33Å; S45-L49 WeakPolarHBondContact O-CB 3.27Å; S45-L49 WeakPolarHBondContact O-CG 3.49Å; S45-L49 PolarHBondContact O-N 3.5Å
46V77.2Confident72.3Confident51 Ų5189.8 Ų89.831%0.30945%0.45SS..Hα-helixtrans-62.3-42.8175179.70000111.4L41 D42 K44 R50L41-V46 HydrophobicContact CB-CG2 3.4Å; L41-V46 HydrophobicContact CD1-CG2 4.21Å; L41-V46 HydrophobicContact CG-CG2 4.44Å; D42-V46 WeakPolarHBondContact O-CG2 3.27Å; D42-V46 PolarHBondContact O-N 3.39Å; D42-V46 VanDerWaalsContact O-N 3.07Å; K44-V46 VanDerWaalsContact C-N 3.32Å; K44-V46 PolarHBondContact O-N 2.92Å; V46-R50 WeakPolarHBondContact O-CB 3.4Å; V46-R50 PolarHBondContact O-N 2.88Å
47N73.4Confident73.7Confident67 Ų6783.8 Ų83.836%0.35841%0.412SS..Hα-helixtrans-67-39.7178.1-74.2-23.3000112.3K43 K44 S45 R50 M51K43-N47 WeakPolarHBondContact O-CB 3.34Å; K43-N47 PolarHBondContact O-N 3.48Å; K43-N47 PolarHBondContact O-ND2 3.24Å; K43-N47 VanDerWaalsContact O-ND2 3.15Å; K44-N47 PolarHBondContact O-N 2.85Å; S45-N47 PolarHBondContact O-N 3.49Å; N47-R50 PolarHBondContact O-N 2.98Å; N47-R50 PolarHBondContact OD1-NH1 3.21Å; N47-R50 PolarHBondContact OD1-NH2 3.44Å; N47-M51 PolarHBondContact O-N 2.97Å
48E79.3Confident75.4Confident61 Ų6182.2 Ų82.229%0.28540%0.401SS..Hα-helixtrans-66.7-47.2177.1-67.6-76.4179.700111.3K22 K44 S45 R50 M51 T52K22-E48 HydrophobicContact CD-CG 4.15Å; K22-E48 WeakPolarHBondContact CD-OE2 3.27Å; K22-E48 IonicContact NZ-OE1 2.74Å; K22-E48 PolarHBondContact NZ-OE1 3.38Å; K22-E48 IonicContact NZ-OE2 2.78Å; K22-E48 PolarHBondContact NZ-OE2 3.29Å; K44-E48 VanDerWaalsContact O-CG 3.3Å; K44-E48 WeakPolarHBondContact O-CG 3.42Å; K44-E48 PolarHBondContact O-N 3Å; S45-E48 PolarHBondContact O-N 3.33Å; E48-R50 VanDerWaalsContact C-N 3.27Å; E48-R50 PolarHBondContact O-N 3.44Å; E48-M51 WeakPolarHBondContact O-CB 3.28Å; E48-M51 PolarHBondContact O-N 2.93Å; E48-M51 VanDerWaalsContact O-N 3.11Å; E48-T52 PolarHBondContact O-N 3.01Å; E48-T52 PolarHBondContact O-OG1 3.15Å
49L79.8Confident76.8Confident52 Ų5280.1 Ų80.127%0.27239%0.39SS..Hα-helixtrans-56.4-42.7173.6-77.3173000111.7V24 L41 S45 M51 T52 L53V24-L49 HydrophobicContact CG1-CD1 4.16Å; V24-L49 HydrophobicContact CG2-CD1 3.71Å; V24-L49 HydrophobicContact CG2-CD2 3.84Å; V24-L49 HydrophobicContact CG2-CG 3.86Å; L41-L49 HydrophobicContact CD1-CD1 4.06Å; S45-L49 WeakPolarHBondContact O-CB 3.27Å; S45-L49 WeakPolarHBondContact O-CG 3.49Å; S45-L49 PolarHBondContact O-N 3.5Å; L49-M51 PolarHBondContact O-N 2.92Å; L49-T52 PolarHBondContact O-N 2.97Å; L49-L53 WeakPolarHBondContact O-CB 3.42Å; L49-L53 VanDerWaalsContact O-CG 3.29Å; L49-L53 WeakPolarHBondContact O-CG 3.4Å; L49-L53 PolarHBondContact O-N 2.93Å
50R80.9Confident78.2Confident98 Ų9878.2 Ų78.237%0.3738%0.38SS..Hα-helixtrans-63.1-41.4177.3-162.9-172.4-44.8113.26.8112V46 N47 E48 R54V46-R50 WeakPolarHBondContact O-CB 3.4Å; V46-R50 PolarHBondContact O-N 2.88Å; N47-R50 PolarHBondContact O-N 2.98Å; N47-R50 PolarHBondContact OD1-NH1 3.21Å; N47-R50 PolarHBondContact OD1-NH2 3.44Å; E48-R50 VanDerWaalsContact C-N 3.27Å; E48-R50 PolarHBondContact O-N 3.44Å; R50-R54 WeakPolarHBondContact O-CB 3.25Å; R50-R54 VanDerWaalsContact O-CG 3.31Å; R50-R54 WeakPolarHBondContact O-CG 3.29Å; R50-R54 PolarHBondContact O-N 3.49Å
51M79.7Confident79.1Confident111 Ų11179.2 Ų79.255%0.54738%0.383SS..Hα-helixtrans-65.4-46.6177.1-169.870.574.700110.9N47 E48 L49 R54 M55N47-M51 PolarHBondContact O-N 2.97Å; E48-M51 WeakPolarHBondContact O-CB 3.28Å; E48-M51 PolarHBondContact O-N 2.93Å; E48-M51 VanDerWaalsContact O-N 3.11Å; L49-M51 PolarHBondContact O-N 2.92Å; M51-R54 PolarHBondContact O-N 3.37Å; M51-M55 WeakPolarHBondContact O-CG 3.39Å; M51-M55 PolarHBondContact O-N 2.97Å
52T82.4Confident80Confident25 Ų2585.2 Ų85.215%0.15340%0.402CS..Hα-helixtrans-58.9-49.1177.1-65.50000111.8F21 E48 L49 R54 M55 M56F21-T52 HydrophobicContact CD1-CG2 3.29Å; F21-T52 HydrophobicContact CE1-CG2 3.21Å; F21-T52 HydrophobicContact CG-CG2 4.19Å; F21-T52 HydrophobicContact CZ-CG2 4.04Å; E48-T52 PolarHBondContact O-N 3.01Å; E48-T52 PolarHBondContact O-OG1 3.15Å; L49-T52 PolarHBondContact O-N 2.97Å; T52-R54 PolarHBondContact O-N 3.49Å; T52-M55 PolarHBondContact O-N 3.46Å; T52-M56 HydrophobicContact CG2-SD 4.22Å; T52-M56 WeakPolarHBondContact O-CG 3.46Å; T52-M56 PolarHBondContact O-N 2.83Å
53L83.4Confident80.7Confident103 Ų10386.4 Ų86.454%0.53940%0.404SS..Hα-helixtrans-59-47.8176.8-72.5171.8000110.6L49 M55 M56 L57L49-L53 WeakPolarHBondContact O-CB 3.42Å; L49-L53 VanDerWaalsContact O-CG 3.29Å; L49-L53 WeakPolarHBondContact O-CG 3.4Å; L49-L53 PolarHBondContact O-N 2.93Å; L53-M55 VanDerWaalsContact C-N 3.32Å; L53-M55 PolarHBondContact O-N 3.22Å; L53-M56 PolarHBondContact O-N 3.12Å; L53-M56 VanDerWaalsContact O-N 3.15Å; L53-L57 VanDerWaalsContact O-CG 3.24Å; L53-L57 WeakPolarHBondContact O-CG 3.4Å; L53-L57 PolarHBondContact O-N 3.08Å
54R84.5Confident81.6Confident121 Ų12182 Ų8246%0.45739%0.386SS..Hα-helixtrans-56.2-43.9176.2-77.8177.3-180177.5-0.7112.8R50 M51 T52 L57 M58R50-R54 WeakPolarHBondContact O-CB 3.25Å; R50-R54 VanDerWaalsContact O-CG 3.31Å; R50-R54 WeakPolarHBondContact O-CG 3.29Å; R50-R54 PolarHBondContact O-N 3.49Å; M51-R54 PolarHBondContact O-N 3.37Å; T52-R54 PolarHBondContact O-N 3.49Å; R54-L57 PolarHBondContact O-N 3.32Å; R54-M58 WeakPolarHBondContact O-CG 3.35Å; R54-M58 PolarHBondContact O-N 3.26Å
55M82.5Confident82.2Confident123 Ų12377.3 Ų77.361%0.60638%0.375SS*.Hα-helixtrans-65.3-42.2177.3-69.6-160.5-55.900112.2M51 T52 L53 L57 M58 D59M51-M55 WeakPolarHBondContact O-CG 3.39Å; M51-M55 PolarHBondContact O-N 2.97Å; T52-M55 PolarHBondContact O-N 3.46Å; L53-M55 VanDerWaalsContact C-N 3.32Å; L53-M55 PolarHBondContact O-N 3.22Å; M55-L57 VanDerWaalsContact C-N 3.26Å; M55-L57 PolarHBondContact O-N 2.88Å; M55-M58 PolarHBondContact O-N 3.27Å; M55-D59 WeakPolarHBondContact O-CB 3.42Å; M55-D59 PolarHBondContact O-N 3.41Å
56M82.7Confident83.1Confident96 Ų9681.6 Ų81.647%0.47340%0.397SS..Hα-helixtrans-62.7-33.8176.4-71.9-176.964.500112.3F21 T52 L53 S60F21-M56 HydrophobicContact CE1-SD 4.28Å; F21-M56 HydrophobicContact CZ-SD 3.73Å; T52-M56 HydrophobicContact CG2-SD 4.22Å; T52-M56 WeakPolarHBondContact O-CG 3.46Å; T52-M56 PolarHBondContact O-N 2.83Å; L53-M56 PolarHBondContact O-N 3.12Å; L53-M56 VanDerWaalsContact O-N 3.15Å; M56-S60 WeakPolarHBondContact O-CB 3.45Å; M56-S60 PolarHBondContact O-N 2.89Å
57L79.3Confident83.8Confident27 Ų2781.2 Ų81.214%0.14139%0.393CS..Hα-helixtrans-67.8-50.1175.4-66.6179.3000112.3L53 R54 M55 D59 S60 E61 V334 M338L53-L57 VanDerWaalsContact O-CG 3.24Å; L53-L57 WeakPolarHBondContact O-CG 3.4Å; L53-L57 PolarHBondContact O-N 3.08Å; R54-L57 PolarHBondContact O-N 3.32Å; M55-L57 VanDerWaalsContact C-N 3.26Å; M55-L57 PolarHBondContact O-N 2.88Å; L57-D59 PolarHBondContact O-N 3.01Å; L57-S60 WeakPolarHBondContact O-CB 3.27Å; L57-S60 PolarHBondContact O-N 2.7Å; L57-S60 VanDerWaalsContact O-N 3.09Å; L57-E61 WeakPolarHBondContact O-CG 3.4Å; L57-E61 PolarHBondContact O-N 2.95Å; L57-V334 HydrophobicContact CD1-CG1 4.27Å; L57-V334 HydrophobicContact CD2-CB 3.63Å; L57-V334 HydrophobicContact CD2-CG1 3.08Å; L57-V334 HydrophobicContact CD2-CG2 4.14Å; L57-V334 HydrophobicContact CG-CG1 4.28Å; L57-M338 HydrophobicContact CD1-CG 3.82Å; L57-M338 HydrophobicContact CD1-SD 3.29Å; L57-M338 WeakPolarHBondContact CD1-SD 3.39Å
58M84.7Confident84.6Confident125 Ų12582.8 Ų82.862%0.61640%0.398SS*.Hα-helixtrans-57.8-39.1176.1-66.9-61.1-55.100111.3R54 M55 R62R54-M58 WeakPolarHBondContact O-CG 3.35Å; R54-M58 PolarHBondContact O-N 3.26Å; M55-M58 PolarHBondContact O-N 3.27Å; M58-R62 WeakPolarHBondContact O-CB 3.44Å; M58-R62 PolarHBondContact O-N 3.16Å
59D83.4Confident85.3Confident60 Ų6085 Ų8532%0.32141%0.408SS..Hα-helixtrans-69.5-40176.3-167.150.7000112.2M55 L57 R62 R63M55-D59 WeakPolarHBondContact O-CB 3.42Å; M55-D59 PolarHBondContact O-N 3.41Å; L57-D59 PolarHBondContact O-N 3.01Å; D59-R62 PolarHBondContact O-N 3.34Å; D59-R63 WeakPolarHBondContact O-CB 3.41Å; D59-R63 VanDerWaalsContact O-CG 3.26Å; D59-R63 WeakPolarHBondContact O-CG 3.27Å; D59-R63 PolarHBondContact O-N 3.4Å; D59-R63 IonicContact OD1-NE 2.69Å; D59-R63 IonicContact OD2-CZ 2.67Å; D59-R63 IonicContact OD2-NE 3.73Å; D59-R63 PolarHBondContact OD2-NE 2.97Å; D59-R63 IonicContact OD2-NH2 2.78Å; D59-R63 PolarHBondContact OD2-NH2 2.9Å
60S82.9Confident86.1Confident41 Ų4186.6 Ų86.629%0.28742%0.417SS..Hα-helixtrans-62.8-42.8174.9-174.20000112.2M56 L57 R63 Q64M56-S60 WeakPolarHBondContact O-CB 3.45Å; M56-S60 PolarHBondContact O-N 2.89Å; L57-S60 WeakPolarHBondContact O-CB 3.27Å; L57-S60 PolarHBondContact O-N 2.7Å; L57-S60 VanDerWaalsContact O-N 3.09Å; S60-R63 PolarHBondContact O-N 3.34Å; S60-Q64 WeakPolarHBondContact O-CB 3.43Å; S60-Q64 PolarHBondContact O-N 2.87Å
61E81.7Confident86.6Confident86 Ų8685.5 Ų85.540%0.40242%0.421SS..Hα-helixtrans-62.8-44.2175.5-74.3172.9-164.100111.4L57 Q64 A65L57-E61 WeakPolarHBondContact O-CG 3.4Å; L57-E61 PolarHBondContact O-N 2.95Å; E61-Q64 PolarHBondContact O-N 3.48Å; E61-A65 PolarHBondContact O-N 2.93Å
62R89.2Confident87.3Confident172 Ų17285.8 Ų85.865%0.64942%0.419SS*.Hα-helixtrans-60.9-45.7175.8-177.5-177.3176.7-172.9-0.9111.7M58 D59 Q64 A65 L66M58-R62 WeakPolarHBondContact O-CB 3.44Å; M58-R62 PolarHBondContact O-N 3.16Å; D59-R62 PolarHBondContact O-N 3.34Å; R62-Q64 VanDerWaalsContact C-N 3.34Å; R62-A65 PolarHBondContact O-N 3.44Å; R62-L66 HydrophobicContact CG-CD1 4.48Å; R62-L66 WeakPolarHBondContact O-CG 3.35Å; R62-L66 PolarHBondContact O-N 2.95Å
63R89.1Confident88Confident65 Ų6587.8 Ų87.825%0.24543%0.434CS..Hα-helixtrans-61.9-43.1176-71173.6-170-1668.5111.1D59 S60 A65 L66 I67 W298D59-R63 WeakPolarHBondContact O-CB 3.41Å; D59-R63 VanDerWaalsContact O-CG 3.26Å; D59-R63 WeakPolarHBondContact O-CG 3.27Å; D59-R63 PolarHBondContact O-N 3.4Å; D59-R63 IonicContact OD1-NE 2.69Å; D59-R63 IonicContact OD2-CZ 2.67Å; D59-R63 IonicContact OD2-NE 3.73Å; D59-R63 PolarHBondContact OD2-NE 2.97Å; D59-R63 IonicContact OD2-NH2 2.78Å; D59-R63 PolarHBondContact OD2-NH2 2.9Å; S60-R63 PolarHBondContact O-N 3.34Å; R63-A65 VanDerWaalsContact C-N 3.33Å; R63-A65 PolarHBondContact O-N 2.95Å; R63-L66 PolarHBondContact O-N 3.13Å; R63-I67 VanDerWaalsContact O-CG1 3.27Å; R63-I67 WeakPolarHBondContact O-CG1 3.2Å; R63-I67 PolarHBondContact O-N 3.4Å; R63-W298 HydrophobicContact CB-CE3 4.39Å; R63-W298 HydrophobicContact CB-CH2 4.16Å; R63-W298 HydrophobicContact CB-CZ2 4.32Å; R63-W298 HydrophobicContact CB-CZ3 4.2Å; R63-W298 HydrophobicContact CG-CD2 4.48Å; R63-W298 HydrophobicContact CG-CH2 3.9Å; R63-W298 HydrophobicContact CG-CZ2 3.67Å; R63-W298 HydrophobicContact CG-CZ3 4.42Å
64Q87.4Confident88.5Confident83 Ų8387.4 Ų87.439%0.38843%0.433SS..Hα-helixtrans-61.1-41.2177-173.266.41.300112.1S60 E61 R62 I67 Q68S60-Q64 WeakPolarHBondContact O-CB 3.43Å; S60-Q64 PolarHBondContact O-N 2.87Å; E61-Q64 PolarHBondContact O-N 3.48Å; R62-Q64 VanDerWaalsContact C-N 3.34Å; Q64-I67 PolarHBondContact O-N 2.83Å; Q64-Q68 WeakPolarHBondContact O-CG 3.35Å; Q64-Q68 PolarHBondContact O-N 3.23Å
65A89.1Confident89.1Confident50 Ų5085.7 Ų85.741%0.41343%0.432SS..Hα-helixtrans-62.5-43.7174.700000111.9E61 R62 R63 I67 Q68 E69E61-A65 PolarHBondContact O-N 2.93Å; R62-A65 PolarHBondContact O-N 3.44Å; R63-A65 VanDerWaalsContact C-N 3.33Å; R63-A65 PolarHBondContact O-N 2.95Å; A65-I67 PolarHBondContact O-N 3.44Å; A65-Q68 PolarHBondContact O-N 3.04Å; A65-E69 PolarHBondContact O-N 3.27Å
66L92.4Very high89.7Confident97 Ų9785.9 Ų85.951%0.50843%0.43SS..Hα-helixtrans-62.2-42.3176-71.9169.4000112.2R62 R63 Q68 E69 L70R62-L66 HydrophobicContact CG-CD1 4.48Å; R62-L66 WeakPolarHBondContact O-CG 3.35Å; R62-L66 PolarHBondContact O-N 2.95Å; R63-L66 PolarHBondContact O-N 3.13Å; L66-Q68 VanDerWaalsContact C-N 3.31Å; L66-Q68 PolarHBondContact O-N 2.87Å; L66-E69 PolarHBondContact O-N 3.08Å; L66-L70 WeakPolarHBondContact O-CB 3.34Å; L66-L70 PolarHBondContact O-N 2.95Å
67I92Very high90.4Very high42 Ų4285.8 Ų85.822%0.21543%0.431CS..Hα-helixtrans-60.7-43.2175.6-65.7165.1000110.2R63 Q64 A65 L70 V71 W298R63-I67 VanDerWaalsContact O-CG1 3.27Å; R63-I67 WeakPolarHBondContact O-CG1 3.2Å; R63-I67 PolarHBondContact O-N 3.4Å; Q64-I67 PolarHBondContact O-N 2.83Å; A65-I67 PolarHBondContact O-N 3.44Å; I67-L70 PolarHBondContact O-N 3.03Å; I67-V71 HydrophobicContact CG2-CG2 4.38Å; I67-V71 VanDerWaalsContact O-CG2 3.29Å; I67-V71 WeakPolarHBondContact O-CG2 3.46Å; I67-V71 PolarHBondContact O-N 3.5Å; I67-W298 HydrophobicContact CD1-CE3 3.65Å; I67-W298 HydrophobicContact CD1-CZ3 4Å; I67-W298 HydrophobicContact CG1-CE3 3.89Å; I67-W298 HydrophobicContact CG1-CZ3 3.74Å
68Q90.7Very high91.2Very high101 Ų10191.6 Ų91.647%0.47246%0.455SS..Hα-helixtrans-63.1-43.2178.3-74.2-179.64.600112.3Q64 A65 L66 L70 V71 K72Q64-Q68 WeakPolarHBondContact O-CG 3.35Å; Q64-Q68 PolarHBondContact O-N 3.23Å; A65-Q68 PolarHBondContact O-N 3.04Å; L66-Q68 VanDerWaalsContact C-N 3.31Å; L66-Q68 PolarHBondContact O-N 2.87Å; Q68-L70 VanDerWaalsContact C-N 3.34Å; Q68-V71 PolarHBondContact O-N 3.18Å; Q68-K72 WeakPolarHBondContact O-CG 3.45Å; Q68-K72 PolarHBondContact O-N 3.03Å
69E94.5Very high91.8Very high106 Ų10692.3 Ų92.350%0.49546%0.456SS..Hα-helixtrans-65.7-38.2175.6-68.3-53.8125.800111.9A65 L66 V71 K72 S73A65-E69 PolarHBondContact O-N 3.27Å; L66-E69 PolarHBondContact O-N 3.08Å; E69-V71 PolarHBondContact O-N 3.22Å; E69-K72 PolarHBondContact O-N 3.03Å; E69-K72 IonicContact OE1-NZ 3.04Å; E69-K72 PolarHBondContact OE1-NZ 2.98Å; E69-S73 WeakPolarHBondContact O-CB 3.25Å; E69-S73 PolarHBondContact O-N 2.99Å
70L94.9Very high92.4Very high87 Ų8793.3 Ų93.346%0.45546%0.459SS..Hα-helixtrans-62.4-42.5174.1-163.9108.7000111.6L66 I67 Q68 S73 N74L66-L70 WeakPolarHBondContact O-CB 3.34Å; L66-L70 PolarHBondContact O-N 2.95Å; I67-L70 PolarHBondContact O-N 3.03Å; Q68-L70 VanDerWaalsContact C-N 3.34Å; L70-S73 PolarHBondContact O-N 3.26Å; L70-N74 VanDerWaalsContact O-CB 3.3Å; L70-N74 WeakPolarHBondContact O-CB 3.46Å; L70-N74 PolarHBondContact O-N 2.92Å
71V92.6Very high93Very high74 Ų7495.3 Ų95.345%0.44847%0.469SS..Hα-helixtrans-63.6-44.3176.2168.60000111.2I67 Q68 E69 N74 N75I67-V71 HydrophobicContact CG2-CG2 4.38Å; I67-V71 VanDerWaalsContact O-CG2 3.29Å; I67-V71 WeakPolarHBondContact O-CG2 3.46Å; I67-V71 PolarHBondContact O-N 3.5Å; Q68-V71 PolarHBondContact O-N 3.18Å; E69-V71 PolarHBondContact O-N 3.22Å; V71-N74 PolarHBondContact O-N 3.22Å; V71-N75 WeakPolarHBondContact O-CB 3.47Å; V71-N75 VanDerWaalsContact O-CG 3.3Å; V71-N75 PolarHBondContact O-N 2.85Å; V71-N75 PolarHBondContact O-ND2 3.18Å
72K94.9Very high93.7Very high117 Ų11797.1 Ų97.151%0.50948%0.478SS..Hα-helixtrans-60.9-46.2175.5-71.2173.2-169.9168.40111.4Q68 E69 N75 K76Q68-K72 WeakPolarHBondContact O-CG 3.45Å; Q68-K72 PolarHBondContact O-N 3.03Å; E69-K72 PolarHBondContact O-N 3.03Å; E69-K72 IonicContact OE1-NZ 3.04Å; E69-K72 PolarHBondContact OE1-NZ 2.98Å; K72-N75 PolarHBondContact O-N 3.27Å; K72-K76 PolarHBondContact O-N 3.43Å
73S96.5Very high94.1Very high67 Ų6795 Ų9547%0.46947%0.474SS..Hα-helixtrans-61.7-45.1177.8-1730000111.8E69 L70 N75 K76 L77E69-S73 WeakPolarHBondContact O-CB 3.25Å; E69-S73 PolarHBondContact O-N 2.99Å; L70-S73 PolarHBondContact O-N 3.26Å; S73-N75 PolarHBondContact O-N 2.92Å; S73-K76 PolarHBondContact O-N 3.14Å; S73-L77 WeakPolarHBondContact O-CG 3.37Å; S73-L77 PolarHBondContact O-N 3.4Å
74N94.1Very high94.4Very high96 Ų9698.2 Ų98.251%0.51349%0.491SS..Hα-helixtrans-63-43177.8-167-63.8000112L70 V71 K76 L77 K78L70-N74 VanDerWaalsContact O-CB 3.3Å; L70-N74 WeakPolarHBondContact O-CB 3.46Å; L70-N74 PolarHBondContact O-N 2.92Å; V71-N74 PolarHBondContact O-N 3.22Å; N74-K76 VanDerWaalsContact C-N 3.34Å; N74-K76 PolarHBondContact O-N 3.49Å; N74-L77 PolarHBondContact O-N 3.22Å; N74-K78 WeakPolarHBondContact O-CB 3.39Å; N74-K78 PolarHBondContact O-N 3.1Å
75N96.3Very high94.8Very high85 Ų8599.7 Ų99.746%0.45550%0.499SS..Hα-helixtrans-61.1-42.7175.2-74.3-23.2000111.7V71 K72 S73 K78 E79V71-N75 WeakPolarHBondContact O-CB 3.47Å; V71-N75 VanDerWaalsContact O-CG 3.3Å; V71-N75 PolarHBondContact O-N 2.85Å; V71-N75 PolarHBondContact O-ND2 3.18Å; K72-N75 PolarHBondContact O-N 3.27Å; S73-N75 PolarHBondContact O-N 2.92Å; N75-K78 WeakPolarHBondContact O-CB 3.48Å; N75-K78 PolarHBondContact O-N 3.46Å; N75-E79 WeakPolarHBondContact O-CG 3.31Å; N75-E79 PolarHBondContact O-N 3.07Å
76K96.3Very high95.1Very high127 Ų127100.3 Ų100.355%0.55250%0.5SS*.Hα-helixtrans-62.3-45.7175.5-173.3-178.9176.9-171.40111.9K72 S73 N74 K78 E79 E80K72-K76 PolarHBondContact O-N 3.43Å; S73-K76 PolarHBondContact O-N 3.14Å; N74-K76 VanDerWaalsContact C-N 3.34Å; N74-K76 PolarHBondContact O-N 3.49Å; K76-K78 VanDerWaalsContact C-N 3.28Å; K76-K78 PolarHBondContact O-N 3.02Å; K76-E79 WeakPolarHBondContact O-CB 3.47Å; K76-E79 PolarHBondContact O-N 3.46Å; K76-E80 VanDerWaalsContact CE-OE1 3.3Å; K76-E80 WeakPolarHBondContact CE-OE1 3.43Å; K76-E80 WeakPolarHBondContact O-CG 3.43Å; K76-E80 PolarHBondContact O-N 2.89Å
77L95.7Very high95.3Very high94 Ų9499.7 Ų99.749%0.49250%0.495SS..Hα-helixtrans-60.1-39.8175.3-74.8170.9000111.4S73 N74 E79 E80 V81S73-L77 WeakPolarHBondContact O-CG 3.37Å; S73-L77 PolarHBondContact O-N 3.4Å; N74-L77 PolarHBondContact O-N 3.22Å; L77-E79 PolarHBondContact O-N 2.8Å; L77-E80 PolarHBondContact O-N 3.45Å; L77-V81 WeakPolarHBondContact O-CB 3.5Å; L77-V81 VanDerWaalsContact O-CG2 3.28Å; L77-V81 WeakPolarHBondContact O-CG2 3.5Å; L77-V81 PolarHBondContact O-N 3.13Å
78K97.3Very high95.4Very high149 Ų149100.6 Ų100.665%0.64851%0.508SS*.Hα-helixtrans-63.4-40.7176.3-171.1177.3179.6-1800112.1N74 N75 K76 Q82N74-K78 WeakPolarHBondContact O-CB 3.39Å; N74-K78 PolarHBondContact O-N 3.1Å; N75-K78 WeakPolarHBondContact O-CB 3.48Å; N75-K78 PolarHBondContact O-N 3.46Å; K76-K78 VanDerWaalsContact C-N 3.28Å; K76-K78 PolarHBondContact O-N 3.02Å; K78-Q82 WeakPolarHBondContact O-CB 3.45Å; K78-Q82 PolarHBondContact O-N 3.22Å
79E97.3Very high95.7Very high139 Ų13998.7 Ų98.765%0.6551%0.51SS*.Hα-helixtrans-64.1-43.7173.5-72173.1-170.300111.9N75 K76 L77 Q82 K83N75-E79 WeakPolarHBondContact O-CG 3.31Å; N75-E79 PolarHBondContact O-N 3.07Å; K76-E79 WeakPolarHBondContact O-CB 3.47Å; K76-E79 PolarHBondContact O-N 3.46Å; L77-E79 PolarHBondContact O-N 2.8Å; E79-Q82 PolarHBondContact O-N 2.95Å; E79-K83 WeakPolarHBondContact O-CB 3.38Å; E79-K83 PolarHBondContact O-N 3.18Å
80E95.9Very high95.8Very high82 Ų8298.1 Ų98.138%0.38351%0.508SS..Hα-helixtrans-62.9-44.9176.8-73.4178-176.800111.6K76 L77 Q82 K83 H84K76-E80 VanDerWaalsContact CE-OE1 3.3Å; K76-E80 WeakPolarHBondContact CE-OE1 3.43Å; K76-E80 WeakPolarHBondContact O-CG 3.43Å; K76-E80 PolarHBondContact O-N 2.89Å; L77-E80 PolarHBondContact O-N 3.45Å; E80-Q82 VanDerWaalsContact C-N 3.35Å; E80-Q82 PolarHBondContact O-N 3.19Å; E80-K83 PolarHBondContact O-N 3.12Å; E80-H84 PolarHBondContact O-CD2 2.92Å; E80-H84 PolarHBondContact O-N 3.43Å
81V95.8Very high95.8Very high82 Ų8299.2 Ų99.250%0.49751%0.51SS..Hα-helixtrans-59.4-45.7174.1169.20000110.7L77 K83 H84 M85L77-V81 WeakPolarHBondContact O-CB 3.5Å; L77-V81 VanDerWaalsContact O-CG2 3.28Å; L77-V81 WeakPolarHBondContact O-CG2 3.5Å; L77-V81 PolarHBondContact O-N 3.13Å; V81-K83 VanDerWaalsContact C-N 3.32Å; V81-K83 PolarHBondContact O-N 3.41Å; V81-H84 PolarHBondContact O-N 3.5Å; V81-M85 HydrophobicContact CG1-CG 4.39Å; V81-M85 HydrophobicContact CG1-SD 4.13Å; V81-M85 WeakPolarHBondContact O-CB 3.28Å; V81-M85 WeakPolarHBondContact O-CG 3.48Å; V81-M85 PolarHBondContact O-N 3.42Å
82Q96.4Very high95.9Very high124 Ų12499.2 Ų99.258%0.57951%0.514SS*.Hα-helixtrans-61.8-40.9177.9-173.764.311.400111.8K78 E79 E80 M85 S86K78-Q82 WeakPolarHBondContact O-CB 3.45Å; K78-Q82 PolarHBondContact O-N 3.22Å; E79-Q82 PolarHBondContact O-N 2.95Å; E80-Q82 VanDerWaalsContact C-N 3.35Å; E80-Q82 PolarHBondContact O-N 3.19Å; Q82-M85 PolarHBondContact O-N 3.47Å; Q82-S86 PolarHBondContact O-N 3.28Å
83K96.8Very high96Very high129 Ų12998.8 Ų98.856%0.56151%0.513SS*.Hα-helixtrans-63.5-46.5175.3-175.2178178.4-177.10111.3E79 E80 V81 M85 S86 H87E79-K83 WeakPolarHBondContact O-CB 3.38Å; E79-K83 PolarHBondContact O-N 3.18Å; E80-K83 PolarHBondContact O-N 3.12Å; V81-K83 VanDerWaalsContact C-N 3.32Å; V81-K83 PolarHBondContact O-N 3.41Å; K83-M85 VanDerWaalsContact C-N 3.34Å; K83-M85 PolarHBondContact O-N 3.07Å; K83-S86 PolarHBondContact O-N 3.13Å; K83-S86 PolarHBondContact O-OG 2.98Å; K83-H87 WeakPolarHBondContact CE-NE2 3.44Å; K83-H87 PolarHBondContact O-CD2 3.48Å; K83-H87 VanDerWaalsContact O-CD2 3.24Å; K83-H87 PolarHBondContact O-N 3.49Å
84H95.8Very high96.1Very high131 Ų131101.3 Ų101.361%0.60651%0.513SS*.Hα-helixtrans-60.9-40.8175.4-76.7-60.4000112.4E80 V81 H87 A88E80-H84 PolarHBondContact O-CD2 2.92Å; E80-H84 PolarHBondContact O-N 3.43Å; V81-H84 PolarHBondContact O-N 3.5Å; H84-H87 PolarHBondContact O-N 3.49Å; H84-A88 WeakPolarHBondContact O-CB 3.39Å; H84-A88 PolarHBondContact O-N 2.89Å
85M94.9Very high96.2Very high114 Ų11499.5 Ų99.556%0.56251%0.511SS*.Hα-helixtrans-61.7-45.3174.6-75.3-178.164.600111.8V81 Q82 K83 H87 A88 A89V81-M85 HydrophobicContact CG1-CG 4.39Å; V81-M85 HydrophobicContact CG1-SD 4.13Å; V81-M85 WeakPolarHBondContact O-CB 3.28Å; V81-M85 WeakPolarHBondContact O-CG 3.48Å; V81-M85 PolarHBondContact O-N 3.42Å; Q82-M85 PolarHBondContact O-N 3.47Å; K83-M85 VanDerWaalsContact C-N 3.34Å; K83-M85 PolarHBondContact O-N 3.07Å; M85-H87 PolarHBondContact O-N 3.06Å; M85-A88 PolarHBondContact O-N 3.3Å; M85-A89 WeakPolarHBondContact O-CB 3.45Å; M85-A89 PolarHBondContact O-N 3Å
86S95.5Very high96.2Very high63 Ų6399.6 Ų99.644%0.44152%0.515SS..Hα-helixtrans-62.6-42.2177.473.20000112.3Q82 K83 A89 Q90Q82-S86 PolarHBondContact O-N 3.28Å; K83-S86 PolarHBondContact O-N 3.13Å; K83-S86 PolarHBondContact O-OG 2.98Å; S86-A89 PolarHBondContact O-N 3.5Å; S86-Q90 PolarHBondContact O-N 2.99Å
87H97.5Very high96.3Very high85 Ų8598.6 Ų98.639%0.39451%0.512SS..Hα-helixtrans-64.2-44.6174.2-73.5-46.4000112.3K83 H84 M85 A89 Q90 Q91K83-H87 WeakPolarHBondContact CE-NE2 3.44Å; K83-H87 PolarHBondContact O-CD2 3.48Å; K83-H87 VanDerWaalsContact O-CD2 3.24Å; K83-H87 PolarHBondContact O-N 3.49Å; H84-H87 PolarHBondContact O-N 3.49Å; M85-H87 PolarHBondContact O-N 3.06Å; H87-A89 VanDerWaalsContact C-N 3.34Å; H87-A89 PolarHBondContact O-N 3.48Å; H87-Q90 PolarHBondContact O-N 2.93Å; H87-Q91 VanDerWaalsContact O-CG 3.32Å; H87-Q91 WeakPolarHBondContact O-CG 3.47Å; H87-Q91 PolarHBondContact O-N 3.4Å
88A94Very high96.3Very high60 Ų6099.6 Ų99.650%0.49652%0.518SS..Hα-helixtrans-61.9-41.9177.300000111.9H84 M85 Q91 S92H84-A88 WeakPolarHBondContact O-CB 3.39Å; H84-A88 PolarHBondContact O-N 2.89Å; M85-A88 PolarHBondContact O-N 3.3Å; A88-Q91 PolarHBondContact O-N 3.43Å; A88-S92 WeakPolarHBondContact O-CB 3.46Å; A88-S92 PolarHBondContact O-N 2.82Å
89A96.1Very high96.3Very high62 Ų6297.1 Ų97.151%0.51251%0.508SS..Hα-helixtrans-61.6-43.8175.200000111.8M85 S86 H87 Q91 S92 Q93M85-A89 WeakPolarHBondContact O-CB 3.45Å; M85-A89 PolarHBondContact O-N 3Å; S86-A89 PolarHBondContact O-N 3.5Å; H87-A89 VanDerWaalsContact C-N 3.34Å; H87-A89 PolarHBondContact O-N 3.48Å; A89-Q91 PolarHBondContact O-N 3.39Å; A89-S92 WeakPolarHBondContact O-CB 3.41Å; A89-S92 PolarHBondContact O-N 3.46Å; A89-Q93 WeakPolarHBondContact O-CB 3.47Å; A89-Q93 PolarHBondContact O-N 3.36Å
90Q97.1Very high96.3Very high94 Ų9492.4 Ų92.444%0.43950%0.497SS..Hα-helixtrans-63.5-40.7175.9-171.3-178.615.300112.1S86 H87 Q93 R94S86-Q90 PolarHBondContact O-N 2.99Å; H87-Q90 PolarHBondContact O-N 2.93Å; Q90-Q93 PolarHBondContact O-N 3.01Å; Q90-R94 WeakPolarHBondContact O-CG 3.48Å; Q90-R94 PolarHBondContact O-N 3.06Å
91Q94.6Very high96.4Very high110 Ų11093.3 Ų93.351%0.51450%0.504SS..Hα-helixtrans-66.9-39.6175.9-66.9-61.5-14.500111.9H87 A88 A89 Q93 R94 A95H87-Q91 VanDerWaalsContact O-CG 3.32Å; H87-Q91 WeakPolarHBondContact O-CG 3.47Å; H87-Q91 PolarHBondContact O-N 3.4Å; A88-Q91 PolarHBondContact O-N 3.43Å; A89-Q91 PolarHBondContact O-N 3.39Å; Q91-Q93 VanDerWaalsContact C-N 3.34Å; Q91-Q93 PolarHBondContact O-N 3.31Å; Q91-R94 PolarHBondContact O-N 2.88Å; Q91-A95 WeakPolarHBondContact O-CB 3.29Å; Q91-A95 PolarHBondContact O-N 2.99Å
92S95.9Very high96.5Very high74 Ų7494.2 Ų94.252%0.51751%0.506SS..Hα-helixtrans-59.9-45.6173.6-1730000111.1A88 A89 R94 A95 T96A88-S92 WeakPolarHBondContact O-CB 3.46Å; A88-S92 PolarHBondContact O-N 2.82Å; A89-S92 WeakPolarHBondContact O-CB 3.41Å; A89-S92 PolarHBondContact O-N 3.46Å; S92-R94 PolarHBondContact O-N 3.42Å; S92-A95 WeakPolarHBondContact O-CB 3.4Å; S92-A95 PolarHBondContact O-N 3.38Å; S92-T96 PolarHBondContact O-N 2.9Å; S92-T96 PolarHBondContact O-OG1 3.49Å; S92-T96 VanDerWaalsContact O-OG1 3.08Å
93Q97.2Very high96.6Very high107 Ų10792.3 Ų92.350%0.550%0.499SS..Hα-helixtrans-60.2-46.8177.7179.259.729.200111.8A89 Q90 Q91 A95 T96 E97A89-Q93 WeakPolarHBondContact O-CB 3.47Å; A89-Q93 PolarHBondContact O-N 3.36Å; Q90-Q93 PolarHBondContact O-N 3.01Å; Q91-Q93 VanDerWaalsContact C-N 3.34Å; Q91-Q93 PolarHBondContact O-N 3.31Å; Q93-A95 VanDerWaalsContact C-N 3.31Å; Q93-A95 PolarHBondContact O-N 3.49Å; Q93-T96 WeakPolarHBondContact O-CB 3.44Å; Q93-T96 PolarHBondContact O-N 3.07Å; Q93-E97 WeakPolarHBondContact CG-OE1 3.25Å; Q93-E97 PolarHBondContact NE2-OE1 3.47Å; Q93-E97 WeakPolarHBondContact O-CG 3.33Å; Q93-E97 PolarHBondContact O-N 3.39Å
94R97.7Very high96.6Very high120 Ų12090.5 Ų90.545%0.45349%0.493SS..Hα-helixtrans-60.6-39.6175.3-73.5177.7178.2-174.60.2112.3Q90 Q91 S92 T96 E97 L98Q90-R94 WeakPolarHBondContact O-CG 3.48Å; Q90-R94 PolarHBondContact O-N 3.06Å; Q91-R94 PolarHBondContact O-N 2.88Å; S92-R94 PolarHBondContact O-N 3.42Å; R94-T96 VanDerWaalsContact C-N 3.34Å; R94-E97 PolarHBondContact O-N 2.97Å; R94-L98 WeakPolarHBondContact O-CB 3.35Å; R94-L98 VanDerWaalsContact O-CG 3.31Å; R94-L98 WeakPolarHBondContact O-CG 3.48Å; R94-L98 PolarHBondContact O-N 3.33Å
95A95.4Very high96.7Very high58 Ų5888.1 Ų88.148%0.47949%0.487SS..Hα-helixtrans-63.8-40.4176.100000111.4Q91 S92 Q93 L98 Q99Q91-A95 WeakPolarHBondContact O-CB 3.29Å; Q91-A95 PolarHBondContact O-N 2.99Å; S92-A95 WeakPolarHBondContact O-CB 3.4Å; S92-A95 PolarHBondContact O-N 3.38Å; Q93-A95 VanDerWaalsContact C-N 3.31Å; Q93-A95 PolarHBondContact O-N 3.49Å; A95-L98 PolarHBondContact O-N 3.1Å; A95-Q99 WeakPolarHBondContact O-CB 3.46Å; A95-Q99 PolarHBondContact O-N 3.32Å
96T96.8Very high96.8Very high87 Ų8789.3 Ų89.353%0.53449%0.489SS..Hα-helixtrans-64.2-41.5174.6-54.30000112.1S92 Q93 R94 Q99 G100S92-T96 PolarHBondContact O-N 2.9Å; S92-T96 PolarHBondContact O-OG1 3.49Å; S92-T96 VanDerWaalsContact O-OG1 3.08Å; Q93-T96 WeakPolarHBondContact O-CB 3.44Å; Q93-T96 PolarHBondContact O-N 3.07Å; R94-T96 VanDerWaalsContact C-N 3.34Å; T96-Q99 PolarHBondContact O-N 2.99Å; T96-G100 PolarHBondContact O-N 3.01Å
97E97.9Very high96.9Very high106 Ų10688.1 Ų88.150%0.49549%0.487SS..Hα-helixtrans-63-46.1175.3-72.5166.1-165.900111.9Q93 R94 Q99 G100 L101Q93-E97 WeakPolarHBondContact CG-OE1 3.25Å; Q93-E97 PolarHBondContact NE2-OE1 3.47Å; Q93-E97 WeakPolarHBondContact O-CG 3.33Å; Q93-E97 PolarHBondContact O-N 3.39Å; R94-E97 PolarHBondContact O-N 2.97Å; E97-Q99 VanDerWaalsContact C-N 3.31Å; E97-Q99 PolarHBondContact O-N 3.39Å; E97-G100 PolarHBondContact O-N 3.02Å; E97-L101 PolarHBondContact O-N 2.74Å
98L97.3Very high96.9Very high116 Ų11691.5 Ų91.561%0.60750%0.496SS*.Hα-helixtrans-63.2-38.2176-72174.5000112R94 A95 L101 L102R94-L98 WeakPolarHBondContact O-CB 3.35Å; R94-L98 VanDerWaalsContact O-CG 3.31Å; R94-L98 WeakPolarHBondContact O-CG 3.48Å; R94-L98 PolarHBondContact O-N 3.33Å; A95-L98 PolarHBondContact O-N 3.1Å; L98-L101 PolarHBondContact O-N 2.93Å; L98-L102 WeakPolarHBondContact O-CB 3.33Å; L98-L102 PolarHBondContact O-N 3.32Å
99Q96.9Very high97Very high96 Ų9691.9 Ų91.945%0.44949%0.492SS..Hα-helixtrans-62.4-43.4174.2-175.759.941.700111.1A95 T96 E97 L101 L102 D103A95-Q99 WeakPolarHBondContact O-CB 3.46Å; A95-Q99 PolarHBondContact O-N 3.32Å; T96-Q99 PolarHBondContact O-N 2.99Å; E97-Q99 VanDerWaalsContact C-N 3.31Å; E97-Q99 PolarHBondContact O-N 3.39Å; Q99-L101 PolarHBondContact O-N 3.4Å; Q99-L102 WeakPolarHBondContact O-CB 3.31Å; Q99-L102 PolarHBondContact O-N 3.41Å; Q99-D103 PolarHBondContact NE2-OD1 2.9Å; Q99-D103 PolarHBondContact NE2-OD2 3.36Å; Q99-D103 PolarHBondContact O-N 3.23Å
100G97.5Very high97Very high41 Ų4193.6 Ų93.642%0.42349%0.49SS..Hα-helixtrans-60.8-43.3175.200000113T96 E97 L102 D103 E104T96-G100 PolarHBondContact O-N 3.01Å; E97-G100 PolarHBondContact O-N 3.02Å; G100-L102 VanDerWaalsContact C-N 3.35Å; G100-D103 PolarHBondContact O-N 3.47Å; G100-E104 PolarHBondContact O-N 2.68Å
101L98Very high97.1Very high100 Ų10093.7 Ų93.752%0.52449%0.49SS..Hα-helixtrans-64.3-39.1174.7-69.8175.3000112.2E97 L98 Q99 E104 V105E97-L101 PolarHBondContact O-N 2.74Å; L98-L101 PolarHBondContact O-N 2.93Å; Q99-L101 PolarHBondContact O-N 3.4Å; L101-E104 PolarHBondContact O-N 3.2Å; L101-V105 WeakPolarHBondContact O-CG2 3.43Å; L101-V105 PolarHBondContact O-N 3.14Å
102L97.5Very high97.2Very high102 Ų10292.8 Ų92.853%0.53449%0.488SS..Hα-helixtrans-63.6-43.4176.6-178.665.1000111.2L98 Q99 G100 E104 V105 K106L98-L102 WeakPolarHBondContact O-CB 3.33Å; L98-L102 PolarHBondContact O-N 3.32Å; Q99-L102 WeakPolarHBondContact O-CB 3.31Å; Q99-L102 PolarHBondContact O-N 3.41Å; G100-L102 VanDerWaalsContact C-N 3.35Å; L102-E104 VanDerWaalsContact C-N 3.33Å; L102-E104 PolarHBondContact O-N 2.93Å; L102-V105 PolarHBondContact O-N 3.02Å; L102-K106 VanDerWaalsContact O-CB 3.29Å; L102-K106 WeakPolarHBondContact O-CB 3.38Å; L102-K106 PolarHBondContact O-N 3.45Å
103D97.2Very high97.2Very high83 Ų8394.8 Ų94.844%0.44449%0.489SS..Hα-helixtrans-64.7-38.2177.3-69.9-30.7000111.4Q99 G100 K106 G107Q99-D103 PolarHBondContact NE2-OD1 2.9Å; Q99-D103 PolarHBondContact NE2-OD2 3.36Å; Q99-D103 PolarHBondContact O-N 3.23Å; G100-D103 PolarHBondContact O-N 3.47Å; D103-K106 PolarHBondContact O-N 2.99Å; D103-G107 PolarHBondContact O-N 3.35Å
104E97.8Very high97.2Very high91 Ų9194.8 Ų94.843%0.42549%0.489SS..Hα-helixtrans-63.3-47.7173.1-170.5-175171.800112G100 L101 L102 K106 G107 R108G100-E104 PolarHBondContact O-N 2.68Å; L101-E104 PolarHBondContact O-N 3.2Å; L102-E104 VanDerWaalsContact C-N 3.33Å; L102-E104 PolarHBondContact O-N 2.93Å; E104-K106 VanDerWaalsContact C-N 3.31Å; E104-K106 PolarHBondContact O-N 3.21Å; E104-G107 PolarHBondContact O-N 3.32Å; E104-R108 WeakPolarHBondContact O-CG 3.32Å; E104-R108 PolarHBondContact O-N 2.84Å; E104-R108 IonicContact OE1-CZ 2.86Å; E104-R108 VanDerWaalsContact OE1-CZ 3.24Å; E104-R108 IonicContact OE1-NE 3.25Å; E104-R108 PolarHBondContact OE1-NE 2.89Å; E104-R108 IonicContact OE1-NH2 3.9Å; E104-R108 PolarHBondContact OE1-NH2 2.99Å
105V97.3Very high97.2Very high81 Ų8195.4 Ų95.449%0.49149%0.492SS..Hα-helixtrans-61.8-42.3177.3170.40000110.7L101 L102 G107 R108 V109L101-V105 WeakPolarHBondContact O-CG2 3.43Å; L101-V105 PolarHBondContact O-N 3.14Å; L102-V105 PolarHBondContact O-N 3.02Å; V105-G107 VanDerWaalsContact C-N 3.34Å; V105-G107 PolarHBondContact O-N 2.93Å; V105-R108 PolarHBondContact O-N 2.85Å; V105-V109 HydrophobicContact CG1-CG2 4.31Å; V105-V109 WeakPolarHBondContact O-CG2 3.39Å; V105-V109 PolarHBondContact O-N 3.31Å
106K97.1Very high97.1Very high139 Ų13996.6 Ų96.660%0.60450%0.496SS*.Hα-helixtrans-59.6-44.8176-174.7180177.2-175.10111.3L102 D103 E104 R108 V109 Q110L102-K106 VanDerWaalsContact O-CB 3.29Å; L102-K106 WeakPolarHBondContact O-CB 3.38Å; L102-K106 PolarHBondContact O-N 3.45Å; D103-K106 PolarHBondContact O-N 2.99Å; E104-K106 VanDerWaalsContact C-N 3.31Å; E104-K106 PolarHBondContact O-N 3.21Å; K106-R108 PolarHBondContact O-N 3.48Å; K106-V109 PolarHBondContact O-N 3.43Å; K106-Q110 WeakPolarHBondContact O-CB 3.43Å; K106-Q110 PolarHBondContact O-N 3Å
107G97.1Very high97.1Very high38 Ų3898 Ų9839%0.39250%0.499SS..Hα-helixtrans-60.6-42.7174.400000112.8D103 E104 V105 Q110 H111D103-G107 PolarHBondContact O-N 3.35Å; E104-G107 PolarHBondContact O-N 3.32Å; V105-G107 VanDerWaalsContact C-N 3.34Å; V105-G107 PolarHBondContact O-N 2.93Å; G107-Q110 PolarHBondContact O-N 3.25Å; G107-H111 WeakPolarHBondContact O-CB 3.29Å; G107-H111 PolarHBondContact O-N 3.42Å
108R97.9Very high97Very high157 Ų15794.5 Ų94.559%0.59249%0.491SS*.Hα-helixtrans-64.4-43.1176.2-70.3175.7-179-161.31.1112.4E104 V105 K106 H111 L112E104-R108 WeakPolarHBondContact O-CG 3.32Å; E104-R108 PolarHBondContact O-N 2.84Å; E104-R108 IonicContact OE1-CZ 2.86Å; E104-R108 VanDerWaalsContact OE1-CZ 3.24Å; E104-R108 IonicContact OE1-NE 3.25Å; E104-R108 PolarHBondContact OE1-NE 2.89Å; E104-R108 IonicContact OE1-NH2 3.9Å; E104-R108 PolarHBondContact OE1-NH2 2.99Å; V105-R108 PolarHBondContact O-N 2.85Å; K106-R108 PolarHBondContact O-N 3.48Å; R108-H111 PolarHBondContact O-N 2.93Å; R108-L112 WeakPolarHBondContact O-CG 3.3Å; R108-L112 PolarHBondContact O-N 3.22Å
109V96.8Very high97Very high67 Ų6794.9 Ų94.941%0.40649%0.488SS..Hα-helixtrans-63.1-48.5176.8170.60000110.3V105 K106 H111 L112 E113V105-V109 HydrophobicContact CG1-CG2 4.31Å; V105-V109 WeakPolarHBondContact O-CG2 3.39Å; V105-V109 PolarHBondContact O-N 3.31Å; K106-V109 PolarHBondContact O-N 3.43Å; V109-H111 VanDerWaalsContact C-N 3.32Å; V109-H111 PolarHBondContact O-N 2.91Å; V109-L112 WeakPolarHBondContact O-CB 3.42Å; V109-L112 PolarHBondContact O-N 3.41Å; V109-E113 HydrophobicContact CG1-CG 4.31Å; V109-E113 WeakPolarHBondContact O-CG 3.41Å; V109-E113 PolarHBondContact O-N 3.23Å
110Q96.8Very high96.8Very high98 Ų9892.8 Ų92.846%0.45849%0.487SS..Hα-helixtrans-57.5-46177.5-177-179.5-12.300111.4K106 G107 L112 E113 E114K106-Q110 WeakPolarHBondContact O-CB 3.43Å; K106-Q110 PolarHBondContact O-N 3Å; G107-Q110 PolarHBondContact O-N 3.25Å; Q110-L112 VanDerWaalsContact C-N 3.3Å; Q110-L112 PolarHBondContact O-N 2.99Å; Q110-E113 WeakPolarHBondContact O-CB 3.47Å; Q110-E113 PolarHBondContact O-N 3.43Å; Q110-E114 WeakPolarHBondContact CG-OE1 3.34Å; Q110-E114 PolarHBondContact NE2-OE1 2.95Å; Q110-E114 WeakPolarHBondContact O-CB 3.38Å; Q110-E114 WeakPolarHBondContact O-CG 3.44Å; Q110-E114 PolarHBondContact O-N 2.92Å
111H97.5Very high96.7Very high96 Ų9695.7 Ų95.744%0.44450%0.497SS..Hα-helixtrans-61.7-37.9176.6179.5-70.1000112.2G107 R108 V109 R115G107-H111 WeakPolarHBondContact O-CB 3.29Å; G107-H111 PolarHBondContact O-N 3.42Å; R108-H111 PolarHBondContact O-N 2.93Å; V109-H111 VanDerWaalsContact C-N 3.32Å; V109-H111 PolarHBondContact O-N 2.91Å; H111-R115 PolarHBondContact CE1-NH2 3.12Å; H111-R115 WeakPolarHBondContact O-CB 3.49Å; H111-R115 PolarHBondContact O-N 3.35Å
112L97.3Very high96.6Very high91 Ų9197.3 Ų97.348%0.47650%0.501SS..Hα-helixtrans-67.7-41.8175.1-73.6174.2000111.8R108 V109 Q110 R115 C116R108-L112 WeakPolarHBondContact O-CG 3.3Å; R108-L112 PolarHBondContact O-N 3.22Å; V109-L112 WeakPolarHBondContact O-CB 3.42Å; V109-L112 PolarHBondContact O-N 3.41Å; Q110-L112 VanDerWaalsContact C-N 3.3Å; Q110-L112 PolarHBondContact O-N 2.99Å; L112-R115 PolarHBondContact O-N 3.11Å; L112-C116 WeakPolarHBondContact O-CB 3.49Å; L112-C116 PolarHBondContact O-N 3.42Å; L112-C116 PolarHBondContact O-SG 2.91Å
113E96.1Very high96.4Very high116 Ų11698.9 Ų98.954%0.54251%0.506SS..Hα-helixtrans-59.8-49.1174.9-71.9176.6164.500111V109 Q110 R115 C116 L117V109-E113 HydrophobicContact CG1-CG 4.31Å; V109-E113 WeakPolarHBondContact O-CG 3.41Å; V109-E113 PolarHBondContact O-N 3.23Å; Q110-E113 WeakPolarHBondContact O-CB 3.47Å; Q110-E113 PolarHBondContact O-N 3.43Å; E113-R115 VanDerWaalsContact C-N 3.31Å; E113-R115 PolarHBondContact O-N 3.47Å; E113-C116 PolarHBondContact O-N 3.41Å; E113-C116 VanDerWaalsContact O-N 3.17Å; E113-L117 WeakPolarHBondContact O-CB 3.39Å; E113-L117 VanDerWaalsContact O-CG 3.3Å; E113-L117 WeakPolarHBondContact O-CG 3.34Å; E113-L117 PolarHBondContact O-N 3.34Å
114E97.1Very high96.3Very high108 Ų108101.1 Ų101.151%0.50551%0.514SS..Hα-helixtrans-58.4-42.6176.3-73.2171.6-170.200111.7Q110 G118Q110-E114 WeakPolarHBondContact CG-OE1 3.34Å; Q110-E114 PolarHBondContact NE2-OE1 2.95Å; Q110-E114 WeakPolarHBondContact O-CB 3.38Å; Q110-E114 WeakPolarHBondContact O-CG 3.44Å; Q110-E114 PolarHBondContact O-N 2.92Å; E114-G118 PolarHBondContact O-N 2.96Å
115R97.2Very high96.2Very high133 Ų13399.9 Ų99.950%0.50252%0.515SS..Hα-helixtrans-64.8-42.4175.9-176.3-174.4-73.7167.9-7.3112.1H111 L112 E113 G118 K119H111-R115 PolarHBondContact CE1-NH2 3.12Å; H111-R115 WeakPolarHBondContact O-CB 3.49Å; H111-R115 PolarHBondContact O-N 3.35Å; L112-R115 PolarHBondContact O-N 3.11Å; E113-R115 VanDerWaalsContact C-N 3.31Å; E113-R115 PolarHBondContact O-N 3.47Å; R115-G118 PolarHBondContact O-N 3.36Å; R115-K119 WeakPolarHBondContact O-CG 3.3Å; R115-K119 PolarHBondContact O-N 2.9Å
116C94.1Very high96.2Very high83 Ų83100.9 Ų100.956%0.56152%0.517SS*.Hα-helixtrans-65.4-45.2177.8-74.90000111.4L112 E113 G118 K119 A120L112-C116 WeakPolarHBondContact O-CB 3.49Å; L112-C116 PolarHBondContact O-N 3.42Å; L112-C116 PolarHBondContact O-SG 2.91Å; E113-C116 PolarHBondContact O-N 3.41Å; E113-C116 VanDerWaalsContact O-N 3.17Å; C116-G118 VanDerWaalsContact C-N 3.33Å; C116-G118 PolarHBondContact O-N 3.48Å; C116-K119 PolarHBondContact O-N 2.88Å; C116-A120 WeakPolarHBondContact O-CB 3.35Å; C116-A120 PolarHBondContact O-N 3.37Å
117L96.9Very high96.1Very high115 Ų11598.3 Ų98.360%0.60251%0.513SS*.Hα-helixtrans-59.5-45173.6-70.8171.1000111E113 K119 A120 V121E113-L117 WeakPolarHBondContact O-CB 3.39Å; E113-L117 VanDerWaalsContact O-CG 3.3Å; E113-L117 WeakPolarHBondContact O-CG 3.34Å; E113-L117 PolarHBondContact O-N 3.34Å; L117-K119 PolarHBondContact O-N 3.02Å; L117-A120 PolarHBondContact O-N 2.84Å; L117-V121 VanDerWaalsContact O-CG2 3.3Å; L117-V121 WeakPolarHBondContact O-CG2 3.47Å; L117-V121 PolarHBondContact O-N 3.17Å
118G96.1Very high96.1Very high33 Ų33102.1 Ų102.134%0.3452%0.521SS..Hα-helixtrans-57.3-46.817600000112.7E114 R115 C116 V121 Q122E114-G118 PolarHBondContact O-N 2.96Å; R115-G118 PolarHBondContact O-N 3.36Å; C116-G118 VanDerWaalsContact C-N 3.33Å; C116-G118 PolarHBondContact O-N 3.48Å; G118-V121 PolarHBondContact O-N 3.07Å; G118-Q122 WeakPolarHBondContact O-CG 3.42Å; G118-Q122 PolarHBondContact O-N 3.38Å
119K96.3Very high96Very high125 Ų125100 Ų10054%0.54352%0.517SS..Hα-helixtrans-63-42.9175.5-73.1179.7180-175.40112.4R115 C116 L117 Q122 Q123R115-K119 WeakPolarHBondContact O-CG 3.3Å; R115-K119 PolarHBondContact O-N 2.9Å; C116-K119 PolarHBondContact O-N 2.88Å; L117-K119 PolarHBondContact O-N 3.02Å; K119-Q122 PolarHBondContact O-N 3.32Å; K119-Q123 WeakPolarHBondContact O-CG 3.43Å; K119-Q123 PolarHBondContact O-N 3.21Å
120A92.7Very high95.9Very high51 Ų51101.2 Ų101.242%0.42152%0.521SS..Hα-helixtrans-62.6-42.9178.500000111.7C116 L117 Q123 H124C116-A120 WeakPolarHBondContact O-CB 3.35Å; C116-A120 PolarHBondContact O-N 3.37Å; L117-A120 PolarHBondContact O-N 2.84Å; A120-Q123 PolarHBondContact O-N 3.26Å; A120-H124 WeakPolarHBondContact O-CB 3.44Å; A120-H124 PolarHBondContact O-N 3.45Å
121V95.6Very high95.9Very high103 Ų103101.7 Ų101.762%0.62452%0.524SS*.Hα-helixtrans-63.4-43.7175.7172.30000111L117 G118 H124 S125L117-V121 VanDerWaalsContact O-CG2 3.3Å; L117-V121 WeakPolarHBondContact O-CG2 3.47Å; L117-V121 PolarHBondContact O-N 3.17Å; G118-V121 PolarHBondContact O-N 3.07Å; V121-H124 PolarHBondContact O-N 3.16Å; V121-S125 PolarHBondContact O-N 2.87Å
122Q96.1Very high95.8Very high133 Ų133103.5 Ų103.562%0.62153%0.53SS*.Hα-helixtrans-60.5-48.8175.4-75.2176-6.200111.9G118 K119 H124 S125 L126G118-Q122 WeakPolarHBondContact O-CG 3.42Å; G118-Q122 PolarHBondContact O-N 3.38Å; K119-Q122 PolarHBondContact O-N 3.32Å; Q122-H124 VanDerWaalsContact C-N 3.32Å; Q122-H124 PolarHBondContact O-N 3.3Å; Q122-S125 PolarHBondContact O-N 2.95Å; Q122-S125 PolarHBondContact O-OG 3.28Å; Q122-L126 PolarHBondContact O-N 3.36Å
123Q93.8Very high95.8Very high136 Ų136103.7 Ų103.764%0.63653%0.528SS*.Hα-helixtrans-60.7-40.1177.1-75.7-176.9-2800112.5K119 A120 L126 T127K119-Q123 WeakPolarHBondContact O-CG 3.43Å; K119-Q123 PolarHBondContact O-N 3.21Å; A120-Q123 PolarHBondContact O-N 3.26Å; Q123-L126 PolarHBondContact O-N 2.86Å; Q123-T127 WeakPolarHBondContact O-CB 3.4Å; Q123-T127 PolarHBondContact O-N 2.87Å; Q123-T127 PolarHBondContact O-OG1 2.98Å
124H95.1Very high95.6Very high130 Ų130101.9 Ų101.960%0.60253%0.529SS*.Hα-helixtrans-61.1-45.4175.3-172.367.8000111.6A120 V121 Q122 L126 T127 Q128A120-H124 WeakPolarHBondContact O-CB 3.44Å; A120-H124 PolarHBondContact O-N 3.45Å; V121-H124 PolarHBondContact O-N 3.16Å; Q122-H124 VanDerWaalsContact C-N 3.32Å; Q122-H124 PolarHBondContact O-N 3.3Å; H124-L126 PolarHBondContact O-N 3.49Å; H124-T127 PolarHBondContact O-N 3.48Å; H124-Q128 WeakPolarHBondContact O-CB 3.33Å; H124-Q128 PolarHBondContact O-N 3.3Å
125S95.6Very high95.6Very high65 Ų65102 Ų10246%0.45553%0.528SS..Hα-helixtrans-61.7-42.8177.873.70000112.7V121 Q122 Q128 Q129V121-S125 PolarHBondContact O-N 2.87Å; Q122-S125 PolarHBondContact O-N 2.95Å; Q122-S125 PolarHBondContact O-OG 3.28Å; S125-Q128 PolarHBondContact O-N 3.26Å; S125-Q129 PolarHBondContact O-N 3.4Å
126L97.3Very high95.5Very high101 Ų10198.8 Ų98.853%0.52952%0.519SS..Hα-helixtrans-64.3-44.5176.8-179.366.5000111.3Q122 Q123 H124 Q128 Q129 L130Q122-L126 PolarHBondContact O-N 3.36Å; Q123-L126 PolarHBondContact O-N 2.86Å; H124-L126 PolarHBondContact O-N 3.49Å; L126-Q128 VanDerWaalsContact C-N 3.31Å; L126-Q128 PolarHBondContact O-N 3.2Å; L126-Q129 PolarHBondContact O-N 2.97Å; L126-L130 HydrophobicContact CG-CD1 4.21Å; L126-L130 WeakPolarHBondContact O-CG 3.47Å; L126-L130 PolarHBondContact O-N 2.64Å
127T94.6Very high95.6Very high85 Ų8597.5 Ų97.552%0.52151%0.513SS..Hα-helixtrans-62.3-41.7178.2-54.50000110.9Q123 H124 Q129 L130 Q131Q123-T127 WeakPolarHBondContact O-CB 3.4Å; Q123-T127 PolarHBondContact O-N 2.87Å; Q123-T127 PolarHBondContact O-OG1 2.98Å; H124-T127 PolarHBondContact O-N 3.48Å; T127-Q129 VanDerWaalsContact C-N 3.34Å; T127-Q129 PolarHBondContact O-N 2.91Å; T127-L130 PolarHBondContact O-N 3.01Å; T127-Q131 WeakPolarHBondContact O-CB 3.46Å; T127-Q131 PolarHBondContact O-N 3.33Å
128Q96.6Very high95.6Very high119 Ų11999 Ų9956%0.55652%0.515SS*.Hα-helixtrans-63.6-39.9176.6-168.3177.917.500111.8H124 S125 L126 Q131 K132H124-Q128 WeakPolarHBondContact O-CB 3.33Å; H124-Q128 PolarHBondContact O-N 3.3Å; S125-Q128 PolarHBondContact O-N 3.26Å; L126-Q128 VanDerWaalsContact C-N 3.31Å; L126-Q128 PolarHBondContact O-N 3.2Å; Q128-Q131 PolarHBondContact O-N 3.46Å; Q128-K132 PolarHBondContact O-N 2.93Å; Q128-K132 VanDerWaalsContact O-N 3.07Å
129Q96.5Very high95.6Very high111 Ų111105.1 Ų105.152%0.51953%0.528SS..Hα-helixtrans-65.3-49.5174.8-179.1164.6-1300111.9S125 L126 T127 Q131 K132 E133S125-Q129 PolarHBondContact O-N 3.4Å; L126-Q129 PolarHBondContact O-N 2.97Å; T127-Q129 VanDerWaalsContact C-N 3.34Å; T127-Q129 PolarHBondContact O-N 2.91Å; Q129-Q131 VanDerWaalsContact C-N 3.26Å; Q129-Q131 PolarHBondContact O-N 2.85Å; Q129-K132 WeakPolarHBondContact O-CA 3.4Å; Q129-K132 WeakPolarHBondContact O-CB 3.29Å; Q129-K132 PolarHBondContact O-N 3.06Å; Q129-E133 WeakPolarHBondContact CG-OE1 3.46Å; Q129-E133 PolarHBondContact NE2-OE1 3.43Å; Q129-E133 PolarHBondContact O-N 3.37Å
130L95.8Very high95.7Very high94 Ų94107.6 Ų107.649%0.49253%0.534SS..Hα-helixtrans-58.5-38.4175.8-73.5171.9000112L126 T127 K132 E133 S134L126-L130 HydrophobicContact CG-CD1 4.21Å; L126-L130 WeakPolarHBondContact O-CG 3.47Å; L126-L130 PolarHBondContact O-N 2.64Å; T127-L130 PolarHBondContact O-N 3.01Å; L130-K132 VanDerWaalsContact C-N 3.32Å; L130-K132 PolarHBondContact O-N 3.37Å; L130-E133 PolarHBondContact O-N 2.93Å; L130-S134 VanDerWaalsContact O-CB 3.25Å; L130-S134 WeakPolarHBondContact O-CB 3.39Å; L130-S134 PolarHBondContact O-N 2.94Å
131Q95.6Very high95.6Very high108 Ų108112 Ų11251%0.50554%0.54SS..Hα-helixtrans-64.3-37.6175.5-166.5-171.114.300111.7T127 Q128 Q129 K135T127-Q131 WeakPolarHBondContact O-CB 3.46Å; T127-Q131 PolarHBondContact O-N 3.33Å; Q128-Q131 PolarHBondContact O-N 3.46Å; Q129-Q131 VanDerWaalsContact C-N 3.26Å; Q129-Q131 PolarHBondContact O-N 2.85Å; Q131-K135 VanDerWaalsContact O-CG 3.29Å; Q131-K135 WeakPolarHBondContact O-CG 3.35Å; Q131-K135 PolarHBondContact O-N 3.37Å
132K96.4Very high95.7Very high134 Ų134111.1 Ų111.158%0.58353%0.532SS*.Hα-helixtrans-66.3-47.7175.2-172.8-174.9175.2-171.10110.9Q128 Q129 L130 S134 K135 E136Q128-K132 PolarHBondContact O-N 2.93Å; Q128-K132 VanDerWaalsContact O-N 3.07Å; Q129-K132 WeakPolarHBondContact O-CA 3.4Å; Q129-K132 WeakPolarHBondContact O-CB 3.29Å; Q129-K132 PolarHBondContact O-N 3.06Å; L130-K132 VanDerWaalsContact C-N 3.32Å; L130-K132 PolarHBondContact O-N 3.37Å; K132-S134 PolarHBondContact O-N 2.83Å; K132-K135 WeakPolarHBondContact O-CB 3.36Å; K132-K135 PolarHBondContact O-N 3.45Å; K132-E136 VanDerWaalsContact CE-OE1 3.28Å; K132-E136 WeakPolarHBondContact CE-OE1 3.36Å; K132-E136 WeakPolarHBondContact O-CG 3.41Å; K132-E136 PolarHBondContact O-N 2.94Å
133E96.5Very high95.7Very high94 Ų94109.9 Ų109.944%0.43953%0.529SS..Hα-helixtrans-61.9-42.3177.9-70.6173.6-169.500111.6Q129 L130 K135 E136 A137Q129-E133 WeakPolarHBondContact CG-OE1 3.46Å; Q129-E133 PolarHBondContact NE2-OE1 3.43Å; Q129-E133 PolarHBondContact O-N 3.37Å; L130-E133 PolarHBondContact O-N 2.93Å; E133-K135 PolarHBondContact O-N 3.25Å; E133-E136 PolarHBondContact O-N 3.37Å; E133-A137 WeakPolarHBondContact O-CB 3.42Å; E133-A137 PolarHBondContact O-N 3.5Å
134S92.1Very high95.7Very high79 Ų79108.7 Ų108.755%0.55253%0.526SS*.Hα-helixtrans-59.6-44.2173.8177.90000112.1L130 K132 E136 A137 K138L130-S134 VanDerWaalsContact O-CB 3.25Å; L130-S134 WeakPolarHBondContact O-CB 3.39Å; L130-S134 PolarHBondContact O-N 2.94Å; K132-S134 PolarHBondContact O-N 2.83Å; S134-E136 VanDerWaalsContact C-N 3.34Å; S134-E136 PolarHBondContact O-N 3.22Å; S134-A137 PolarHBondContact O-N 2.86Å; S134-K138 WeakPolarHBondContact O-CB 3.47Å; S134-K138 PolarHBondContact O-N 3.36Å
135K96.4Very high95.7Very high110 Ų110106.7 Ų106.748%0.47852%0.517SS..Hα-helixtrans-62-41.6174.5-75.1171.8-177.3173.10111.6Q131 K132 E133 K138 R139Q131-K135 VanDerWaalsContact O-CG 3.29Å; Q131-K135 WeakPolarHBondContact O-CG 3.35Å; Q131-K135 PolarHBondContact O-N 3.37Å; K132-K135 WeakPolarHBondContact O-CB 3.36Å; K132-K135 PolarHBondContact O-N 3.45Å; E133-K135 PolarHBondContact O-N 3.25Å; K135-K138 PolarHBondContact O-N 2.97Å; K135-R139 WeakPolarHBondContact O-CG 3.32Å; K135-R139 PolarHBondContact O-N 3.48Å; K135-R139 VanDerWaalsContact O-N 3.12Å
136E96.6Very high95.8Very high66 Ų66111 Ų11131%0.30853%0.528SS..Hα-helixtrans-66.9-44.7177.2-74177.5-164.900112.2K132 E133 S134 K138 R139 R140K132-E136 VanDerWaalsContact CE-OE1 3.28Å; K132-E136 WeakPolarHBondContact CE-OE1 3.36Å; K132-E136 WeakPolarHBondContact O-CG 3.41Å; K132-E136 PolarHBondContact O-N 2.94Å; E133-E136 PolarHBondContact O-N 3.37Å; S134-E136 VanDerWaalsContact C-N 3.34Å; S134-E136 PolarHBondContact O-N 3.22Å; E136-K138 VanDerWaalsContact C-N 3.31Å; E136-K138 PolarHBondContact O-N 3Å; E136-R139 PolarHBondContact O-N 3.38Å; E136-R140 WeakPolarHBondContact O-CG 3.4Å; E136-R140 PolarHBondContact O-N 2.93Å
137A94.9Very high95.7Very high55 Ų55111.9 Ų111.946%0.45553%0.527SS..Hα-helixtrans-58.7-43.4174.600000111.2E133 S134 R139 R140 Y141E133-A137 WeakPolarHBondContact O-CB 3.42Å; E133-A137 PolarHBondContact O-N 3.5Å; S134-A137 PolarHBondContact O-N 2.86Å; A137-R139 VanDerWaalsContact C-N 3.35Å; A137-R139 PolarHBondContact O-N 3.25Å; A137-R140 WeakPolarHBondContact O-CB 3.05Å; A137-R140 PolarHBondContact O-N 2.96Å; A137-R140 VanDerWaalsContact O-N 3.13Å; A137-Y141 PolarHBondContact O-N 3.21Å
138K96.3Very high95.7Very high146 Ų146111.1 Ų111.164%0.63552%0.523SS*.Hα-helixtrans-61.3-39.9176-167.8168.8-172.7172.40112.6S134 K135 E136 Y141 L142S134-K138 WeakPolarHBondContact O-CB 3.47Å; S134-K138 PolarHBondContact O-N 3.36Å; K135-K138 PolarHBondContact O-N 2.97Å; E136-K138 VanDerWaalsContact C-N 3.31Å; E136-K138 PolarHBondContact O-N 3Å; K138-Y141 PolarHBondContact O-N 3.45Å; K138-L142 WeakPolarHBondContact O-CG 3.38Å; K138-L142 PolarHBondContact O-N 3.17Å; K138-L142 VanDerWaalsContact O-N 3.07Å
139R97.4Very high95.7Very high162 Ų162108.6 Ų108.661%0.61152%0.515SS*.Hα-helixtrans-63.5-40.8173.7-69.6-179.6-160.9130.3-0.8111.9K135 E136 A137 L143K135-R139 WeakPolarHBondContact O-CG 3.32Å; K135-R139 PolarHBondContact O-N 3.48Å; K135-R139 VanDerWaalsContact O-N 3.12Å; E136-R139 PolarHBondContact O-N 3.38Å; A137-R139 VanDerWaalsContact C-N 3.35Å; A137-R139 PolarHBondContact O-N 3.25Å; R139-L143 PolarHBondContact O-N 3.1Å; R139-L143 VanDerWaalsContact O-N 3.08Å
140R97.4Very high95.6Very high178 Ų178105.6 Ų105.667%0.67251%0.507SS*.Hα-helixtrans-64.1-44177.3-68.7176.5-173.6175.44.9111.3E136 A137 L143 L144E136-R140 WeakPolarHBondContact O-CG 3.4Å; E136-R140 PolarHBondContact O-N 2.93Å; A137-R140 WeakPolarHBondContact O-CB 3.05Å; A137-R140 PolarHBondContact O-N 2.96Å; A137-R140 VanDerWaalsContact O-N 3.13Å; R140-L143 PolarHBondContact O-N 3.44Å; R140-L144 WeakPolarHBondContact O-CB 3.31Å; R140-L144 PolarHBondContact O-N 3.45Å
141Y91.3Very high95.5Very high142 Ų142105.8 Ų105.856%0.55751%0.508SS*.Hα-helixtrans-56.6-53.4175.1176.4-89.1000111.3A137 K138 L143 L144 E145A137-Y141 PolarHBondContact O-N 3.21Å; K138-Y141 PolarHBondContact O-N 3.45Å; Y141-L143 PolarHBondContact O-N 3.08Å; Y141-L144 WeakPolarHBondContact O-CB 3.47Å; Y141-L144 PolarHBondContact O-N 2.96Å; Y141-E145 HydrophobicContact CE1-CB 4.44Å; Y141-E145 WeakPolarHBondContact O-CB 3.46Å; Y141-E145 PolarHBondContact O-N 2.91Å
142L96.9Very high95.5Very high85 Ų85106.3 Ų106.345%0.44551%0.51SS..Hα-helixtrans-59.2-35179.4-71.8168.5000112.8K138 K146K138-L142 WeakPolarHBondContact O-CG 3.38Å; K138-L142 PolarHBondContact O-N 3.17Å; K138-L142 VanDerWaalsContact O-N 3.07Å; L142-K146 WeakPolarHBondContact O-CG 3.33Å; L142-K146 PolarHBondContact O-N 3.46Å
143L97.2Very high95.4Very high107 Ų107105.5 Ų105.556%0.5651%0.508SS*.Hα-helixtrans-69.2-41.5175.8-177.666.3000111.6R139 R140 Y141 K146 K147R139-L143 PolarHBondContact O-N 3.1Å; R139-L143 VanDerWaalsContact O-N 3.08Å; R140-L143 PolarHBondContact O-N 3.44Å; Y141-L143 PolarHBondContact O-N 3.08Å; L143-K146 PolarHBondContact O-N 3.1Å; L143-K147 PolarHBondContact O-N 3.16Å; L143-K147 VanDerWaalsContact O-N 3.16Å
144L93.9Very high95.3Very high111 Ų111106.1 Ų106.158%0.58151%0.511SS*.Hα-helixtrans-67.6-42179.1-160.275.6000111R140 Y141 K146 K147 V148R140-L144 WeakPolarHBondContact O-CB 3.31Å; R140-L144 PolarHBondContact O-N 3.45Å; Y141-L144 WeakPolarHBondContact O-CB 3.47Å; Y141-L144 PolarHBondContact O-N 2.96Å; L144-K146 PolarHBondContact O-N 3.23Å; L144-K147 CarbonylContact O-C 3.55Å; L144-K147 WeakPolarHBondContact O-CA 3.48Å; L144-K147 WeakPolarHBondContact O-CB 3.48Å; L144-K147 PolarHBondContact O-N 3.36Å; L144-V148 WeakPolarHBondContact O-CG2 3.31Å; L144-V148 PolarHBondContact O-N 2.88Å
145E95.3Very high95.3Very high88 Ų88105.5 Ų105.541%0.41150%0.504SS..Hα-helixtrans-56.4-47.2174.7-175174.7-136.700111.4Y141 K147 V148 V149Y141-E145 HydrophobicContact CE1-CB 4.44Å; Y141-E145 WeakPolarHBondContact O-CB 3.46Å; Y141-E145 PolarHBondContact O-N 2.91Å; E145-K147 VanDerWaalsContact C-N 3.3Å; E145-K147 PolarHBondContact O-N 2.69Å; E145-V148 PolarHBondContact O-N 3.27Å; E145-V149 WeakPolarHBondContact O-CG2 3.44Å; E145-V149 PolarHBondContact O-N 2.63Å
146K95.9Very high95.2Very high157 Ų157102.8 Ų102.868%0.68350%0.503SS*.Hα-helixtrans-58.7-39.4173.2-73.7178.9-178.7-173.70113L142 L143 L144 S150L142-K146 WeakPolarHBondContact O-CG 3.33Å; L142-K146 PolarHBondContact O-N 3.46Å; L143-K146 PolarHBondContact O-N 3.1Å; L144-K146 PolarHBondContact O-N 3.23Å; K146-S150 PolarHBondContact O-N 3.02Å; K146-S150 VanDerWaalsContact O-N 3.13Å
147K96.5Very high95Very high118 Ų118105.1 Ų105.151%0.51351%0.513SS..Hα-helixtrans-66.3-41.7176.3-75.6-177.8174.8-174.30111.7L143 L144 E145 S150 L151L143-K147 PolarHBondContact O-N 3.16Å; L143-K147 VanDerWaalsContact O-N 3.16Å; L144-K147 CarbonylContact O-C 3.55Å; L144-K147 WeakPolarHBondContact O-CA 3.48Å; L144-K147 WeakPolarHBondContact O-CB 3.48Å; L144-K147 PolarHBondContact O-N 3.36Å; E145-K147 VanDerWaalsContact C-N 3.3Å; E145-K147 PolarHBondContact O-N 2.69Å; K147-S150 PolarHBondContact O-N 2.96Å; K147-S150 PolarHBondContact O-OG 2.96Å; K147-L151 WeakPolarHBondContact O-CG 3.46Å; K147-L151 PolarHBondContact O-N 2.98Å
148V94.5Very high95Very high69 Ų69107.7 Ų107.742%0.41852%0.519SS..Hα-helixtrans-59.4-49.2177171.50000110.1L144 E145 S150 L151 E152L144-V148 WeakPolarHBondContact O-CG2 3.31Å; L144-V148 PolarHBondContact O-N 2.88Å; E145-V148 PolarHBondContact O-N 3.27Å; V148-S150 VanDerWaalsContact C-N 3.31Å; V148-S150 PolarHBondContact O-N 2.78Å; V148-L151 PolarHBondContact O-N 3.49Å; V148-L151 VanDerWaalsContact O-N 3.08Å; V148-E152 HydrophobicContact CG1-CG 4.38Å; V148-E152 WeakPolarHBondContact O-CG 3.49Å; V148-E152 PolarHBondContact O-N 3.4Å
149V95.8Very high94.8Very high67 Ų67109 Ų10941%0.40652%0.52SS..Hα-helixtrans-57.6-43.3177175.40000111.6E145 L151 E152 E153E145-V149 WeakPolarHBondContact O-CG2 3.44Å; E145-V149 PolarHBondContact O-N 2.63Å; V149-L151 VanDerWaalsContact C-N 3.34Å; V149-L151 PolarHBondContact O-N 3.37Å; V149-E152 PolarHBondContact O-N 3.41Å; V149-E153 WeakPolarHBondContact O-CG 3.39Å; V149-E153 PolarHBondContact O-N 3.31Å
150S95Very high94.6Very high48 Ų48108.2 Ų108.234%0.33652%0.521SS..Hα-helixtrans-63-37.817768.60000113.4K146 K147 V148 E153 E154K146-S150 PolarHBondContact O-N 3.02Å; K146-S150 VanDerWaalsContact O-N 3.13Å; K147-S150 PolarHBondContact O-N 2.96Å; K147-S150 PolarHBondContact O-OG 2.96Å; V148-S150 VanDerWaalsContact C-N 3.31Å; V148-S150 PolarHBondContact O-N 2.78Å; S150-E153 PolarHBondContact O-N 3.49Å; S150-E154 WeakPolarHBondContact O-CG 3.33Å; S150-E154 PolarHBondContact O-N 2.92Å
151L94.1Very high94.5Very high98 Ų98106 Ų10651%0.51352%0.516SS..Hα-helixtrans-71.5-35.6177-70.3171.2000111.6K147 V148 V149 E153 E154 T155K147-L151 WeakPolarHBondContact O-CG 3.46Å; K147-L151 PolarHBondContact O-N 2.98Å; V148-L151 PolarHBondContact O-N 3.49Å; V148-L151 VanDerWaalsContact O-N 3.08Å; V149-L151 VanDerWaalsContact C-N 3.34Å; V149-L151 PolarHBondContact O-N 3.37Å; L151-E153 VanDerWaalsContact C-N 3.34Å; L151-E154 PolarHBondContact O-N 3.49Å; L151-T155 WeakPolarHBondContact O-CB 3.47Å; L151-T155 VanDerWaalsContact O-CG2 3.28Å; L151-T155 WeakPolarHBondContact O-CG2 3.33Å; L151-T155 PolarHBondContact O-N 2.92Å; L151-T155 PolarHBondContact O-OG1 3.17Å
152E94.8Very high94.5Very high118 Ų118104.8 Ų104.855%0.55152%0.519SS*.Hα-helixtrans-62.6-42172.3-73.4178.8167.100111.4V148 V149 T155 A156V148-E152 HydrophobicContact CG1-CG 4.38Å; V148-E152 WeakPolarHBondContact O-CG 3.49Å; V148-E152 PolarHBondContact O-N 3.4Å; V149-E152 PolarHBondContact O-N 3.41Å; E152-T155 WeakPolarHBondContact CA-OG1 3.35Å; E152-T155 PolarHBondContact O-N 3.5Å; E152-T155 PolarHBondContact O-OG1 3.22Å; E152-A156 VanDerWaalsContact O-CB 3.27Å; E152-A156 WeakPolarHBondContact O-CB 3.36Å; E152-A156 PolarHBondContact O-N 3.42Å
153E95Very high94.3Very high117 Ų117107.8 Ų107.855%0.54753%0.525SS..Hα-helixtrans-62.8-46.7173.8-71.9176.5178.600111.8V149 S150 L151 A156 Q157V149-E153 WeakPolarHBondContact O-CG 3.39Å; V149-E153 PolarHBondContact O-N 3.31Å; S150-E153 PolarHBondContact O-N 3.49Å; L151-E153 VanDerWaalsContact C-N 3.34Å; E153-A156 PolarHBondContact O-N 3.02Å; E153-Q157 VanDerWaalsContact O-CG 3.29Å; E153-Q157 WeakPolarHBondContact O-CG 3.23Å; E153-Q157 PolarHBondContact O-N 3.38Å
154E95.1Very high94.1Very high107 Ų107106.8 Ų106.850%0.552%0.52SS..Hα-helixtrans-60.6-45.9176.4-76.1-179.2-174.900112S150 L151 A156 Q157 L158S150-E154 WeakPolarHBondContact O-CG 3.33Å; S150-E154 PolarHBondContact O-N 2.92Å; L151-E154 PolarHBondContact O-N 3.49Å; E154-A156 PolarHBondContact O-N 2.97Å; E154-Q157 WeakPolarHBondContact O-CB 3.34Å; E154-Q157 PolarHBondContact O-N 3.21Å; E154-L158 WeakPolarHBondContact O-CG 3.39Å; E154-L158 PolarHBondContact O-N 3.3Å
155T91.5Very high93.9Very high66 Ų66105.3 Ų105.341%0.40552%0.515SS..Hα-helixtrans-66-37.817853.30000111.9L151 E152 L158 R159L151-T155 WeakPolarHBondContact O-CB 3.47Å; L151-T155 VanDerWaalsContact O-CG2 3.28Å; L151-T155 WeakPolarHBondContact O-CG2 3.33Å; L151-T155 PolarHBondContact O-N 2.92Å; L151-T155 PolarHBondContact O-OG1 3.17Å; E152-T155 WeakPolarHBondContact CA-OG1 3.35Å; E152-T155 PolarHBondContact O-N 3.5Å; E152-T155 PolarHBondContact O-OG1 3.22Å; T155-L158 PolarHBondContact O-N 3.48Å; T155-R159 WeakPolarHBondContact O-CB 3.38Å; T155-R159 VanDerWaalsContact O-CG 3.25Å; T155-R159 WeakPolarHBondContact O-CG 3.11Å; T155-R159 PolarHBondContact O-N 2.83Å
156A93.7Very high93.6Very high54 Ų54103.5 Ų103.545%0.44651%0.51SS..Hα-helixtrans-62.9-41.2172.700000111.9E152 E153 E154 R159 K160E152-A156 VanDerWaalsContact O-CB 3.27Å; E152-A156 WeakPolarHBondContact O-CB 3.36Å; E152-A156 PolarHBondContact O-N 3.42Å; E153-A156 PolarHBondContact O-N 3.02Å; E154-A156 PolarHBondContact O-N 2.97Å; A156-R159 PolarHBondContact O-N 3.42Å; A156-K160 PolarHBondContact O-N 2.9Å
157Q93.3Very high93.2Very high114 Ų114100.4 Ų100.453%0.53350%0.497SS..Hα-helixtrans-62.8-45.6174.8-72.1175.324.300112E153 E154 K160 K161E153-Q157 VanDerWaalsContact O-CG 3.29Å; E153-Q157 WeakPolarHBondContact O-CG 3.23Å; E153-Q157 PolarHBondContact O-N 3.38Å; E154-Q157 WeakPolarHBondContact O-CB 3.34Å; E154-Q157 PolarHBondContact O-N 3.21Å; Q157-K160 PolarHBondContact O-N 3.46Å; Q157-K161 PolarHBondContact O-N 3.14Å
158L94.1Very high92.7Very high109 Ų109100.8 Ų100.857%0.57150%0.5SS*.Hα-helixtrans-62.7-44.6176.9-71.3173.7000111.4E154 T155 K160 K161 L162E154-L158 WeakPolarHBondContact O-CG 3.39Å; E154-L158 PolarHBondContact O-N 3.3Å; T155-L158 PolarHBondContact O-N 3.48Å; L158-K160 VanDerWaalsContact C-N 3.31Å; L158-K160 PolarHBondContact O-N 3.46Å; L158-K161 PolarHBondContact O-N 3.41Å; L158-L162 WeakPolarHBondContact O-CB 3.4Å; L158-L162 PolarHBondContact O-N 3.4Å
159R92.3Very high91.9Very high174 Ų174101.3 Ų101.366%0.65750%0.498SS*.Hα-helixtrans-56.3-44.3174-76.7174.1179.41792.3111.8T155 A156 L162 Y163T155-R159 WeakPolarHBondContact O-CB 3.38Å; T155-R159 VanDerWaalsContact O-CG 3.25Å; T155-R159 WeakPolarHBondContact O-CG 3.11Å; T155-R159 PolarHBondContact O-N 2.83Å; A156-R159 PolarHBondContact O-N 3.42Å; R159-L162 PolarHBondContact O-N 3.49Å; R159-Y163 PolarHBondContact O-N 2.91Å
160K94.1Very high91.3Very high146 Ų146103 Ų10364%0.63550%0.502SS*.Hα-helixtrans-62.3-44.8177.1-175.9178.3179.1179.50112.1A156 Q157 L158 Y163 L164A156-K160 PolarHBondContact O-N 2.9Å; Q157-K160 PolarHBondContact O-N 3.46Å; L158-K160 VanDerWaalsContact C-N 3.31Å; L158-K160 PolarHBondContact O-N 3.46Å; K160-Y163 PolarHBondContact O-N 3.27Å; K160-L164 WeakPolarHBondContact O-CG 3.31Å; K160-L164 PolarHBondContact O-N 3.45Å; K160-L164 VanDerWaalsContact O-N 3.13Å
161K94.8Very high90.5Very high131 Ų131104.9 Ų104.957%0.5751%0.505SS*.Hα-helixtrans-60.1-47.3176-73.5178.5-179.7175.80111.3Q157 L158 Y163 L164 T165Q157-K161 PolarHBondContact O-N 3.14Å; L158-K161 PolarHBondContact O-N 3.41Å; K161-Y163 VanDerWaalsContact C-N 3.34Å; K161-Y163 PolarHBondContact O-N 2.76Å; K161-L164 PolarHBondContact O-N 3.41Å; K161-L164 VanDerWaalsContact O-N 3.14Å; K161-T165 PolarHBondContact O-N 3.31Å; K161-T165 PolarHBondContact O-OG1 3.47Å
162L90.4Very high89.7Confident117 Ų117105.6 Ų105.661%0.61350%0.501SS*.Hα-helixtrans-60.6-43.4-179.6-145.4156.6000111.2L158 R159 L164 T165 V166L158-L162 WeakPolarHBondContact O-CB 3.4Å; L158-L162 PolarHBondContact O-N 3.4Å; R159-L162 PolarHBondContact O-N 3.49Å; L162-L164 PolarHBondContact O-N 2.79Å; L162-T165 PolarHBondContact O-N 3.02Å; L162-V166 HydrophobicContact CD2-CG2 3.82Å; L162-V166 WeakPolarHBondContact O-CB 3.42Å; L162-V166 VanDerWaalsContact O-CG2 3.26Å; L162-V166 WeakPolarHBondContact O-CG2 3.35Å; L162-V166 PolarHBondContact O-N 2.84Å
163Y92.3Very high88.8Confident148 Ų148104.1 Ų104.158%0.5850%0.496SS*.Hα-helixtrans-58.5-44.3173.8174-101000112.9R159 K160 K161 K167R159-Y163 PolarHBondContact O-N 2.91Å; K160-Y163 PolarHBondContact O-N 3.27Å; K161-Y163 VanDerWaalsContact C-N 3.34Å; K161-Y163 PolarHBondContact O-N 2.76Å; Y163-K167 HydrophobicContact CE1-CD 4.43Å; Y163-K167 WeakPolarHBondContact O-CB 3.32Å; Y163-K167 PolarHBondContact O-N 3.3Å
164L93.8Very high87.7Confident85 Ų85101.9 Ų101.945%0.44549%0.491SS..Hα-helixtrans-63.3-48177.6-69.1171.9000111.4K160 K161 L162 V166 K167 E168K160-L164 WeakPolarHBondContact O-CG 3.31Å; K160-L164 PolarHBondContact O-N 3.45Å; K160-L164 VanDerWaalsContact O-N 3.13Å; K161-L164 PolarHBondContact O-N 3.41Å; K161-L164 VanDerWaalsContact O-N 3.14Å; L162-L164 PolarHBondContact O-N 2.79Å; L164-V166 PolarHBondContact O-N 3.29Å; L164-K167 PolarHBondContact O-N 2.8Å; L164-E168 WeakPolarHBondContact O-CG 3.47Å; L164-E168 PolarHBondContact O-N 2.86Å
165T90.1Very high86.8Confident80 Ų80104.6 Ų104.649%0.49150%0.497SS..Hα-helixtrans-62.2-41.6178.4-530000112.1K161 L162 E168 E169K161-T165 PolarHBondContact O-N 3.31Å; K161-T165 PolarHBondContact O-OG1 3.47Å; L162-T165 PolarHBondContact O-N 3.02Å; T165-E168 PolarHBondContact O-N 2.9Å; T165-E169 WeakPolarHBondContact O-CB 3.18Å; T165-E169 PolarHBondContact O-N 3.32Å
166V89.3Confident85.4Confident50 Ų50105.9 Ų105.930%0.30350%0.498SS..Hα-helixtrans-62-45.3175.1168.10000110.9L162 L164 E168 E169 E170L162-V166 HydrophobicContact CD2-CG2 3.82Å; L162-V166 WeakPolarHBondContact O-CB 3.42Å; L162-V166 VanDerWaalsContact O-CG2 3.26Å; L162-V166 WeakPolarHBondContact O-CG2 3.35Å; L162-V166 PolarHBondContact O-N 2.84Å; L164-V166 PolarHBondContact O-N 3.29Å; V166-E168 VanDerWaalsContact C-N 3.32Å; V166-E168 PolarHBondContact O-N 2.92Å; V166-E169 PolarHBondContact O-N 2.89Å; V166-E170 HydrophobicContact CG1-CG 4.38Å; V166-E170 WeakPolarHBondContact O-CG 3.24Å; V166-E170 PolarHBondContact O-N 3.47Å
167K88Confident83.8Confident93 Ų93106.1 Ų106.140%0.40450%0.497SS..Hα-helixtrans-63.1-38.6178.2-171.9178.9-178.1-179.50112.1Y163 L164 Q171Y163-K167 HydrophobicContact CE1-CD 4.43Å; Y163-K167 WeakPolarHBondContact O-CB 3.32Å; Y163-K167 PolarHBondContact O-N 3.3Å; L164-K167 PolarHBondContact O-N 2.8Å; K167-Q171 VanDerWaalsContact O-CG 3.27Å; K167-Q171 WeakPolarHBondContact O-CG 3.48Å; K167-Q171 PolarHBondContact O-N 3.14Å
168E84.8Confident82.2Confident125 Ų125109.2 Ų109.258%0.58450%0.503SS*.Hα-helixtrans-64.1-44.2173.6-74.9173.3175.100111.7L164 T165 V166 Q171 R172L164-E168 WeakPolarHBondContact O-CG 3.47Å; L164-E168 PolarHBondContact O-N 2.86Å; T165-E168 PolarHBondContact O-N 2.9Å; V166-E168 VanDerWaalsContact C-N 3.32Å; V166-E168 PolarHBondContact O-N 2.92Å; E168-Q171 PolarHBondContact O-N 3.35Å; E168-R172 PolarHBondContact O-N 2.66Å
169E78.4Confident80.5Confident81 Ų81110 Ų11038%0.37951%0.508SS..Hα-helixtrans-64.7-41.2175.3-82-63116.300112.6T165 V166 Q171 R172 L173T165-E169 WeakPolarHBondContact O-CB 3.18Å; T165-E169 PolarHBondContact O-N 3.32Å; V166-E169 PolarHBondContact O-N 2.89Å; E169-Q171 VanDerWaalsContact C-N 3.32Å; E169-Q171 PolarHBondContact O-N 3.39Å; E169-R172 VanDerWaalsContact CD-NE 3.32Å; E169-R172 WeakPolarHBondContact O-CB 3.49Å; E169-R172 PolarHBondContact O-N 2.95Å; E169-R172 VanDerWaalsContact O-N 3.16Å; E169-R172 IonicContact OE1-CZ 3.85Å; E169-R172 IonicContact OE1-NE 2.9Å; E169-R172 PolarHBondContact OE1-NE 2.85Å; E169-R172 IonicContact OE1-NH2 3.96Å; E169-R172 IonicContact OE2-CZ 3.28Å; E169-R172 VanDerWaalsContact OE2-CZ 3.28Å; E169-R172 IonicContact OE2-NE 3.01Å; E169-R172 PolarHBondContact OE2-NE 3.34Å; E169-R172 IonicContact OE2-NH2 2.7Å; E169-R172 PolarHBondContact OE2-NH2 2.88Å; E169-L173 WeakPolarHBondContact O-CB 3.4Å; E169-L173 WeakPolarHBondContact O-CG 3.23Å; E169-L173 PolarHBondContact O-N 3.23Å
170E81.6Confident78.6Confident101 Ų101108.2 Ų108.247%0.47251%0.507SS..Hα-helixtrans-61.1-40.6173.4-77.1-179.1166.400111.8V166 L173 T174V166-E170 HydrophobicContact CG1-CG 4.38Å; V166-E170 WeakPolarHBondContact O-CG 3.24Å; V166-E170 PolarHBondContact O-N 3.47Å; E170-L173 PolarHBondContact O-N 2.87Å; E170-T174 WeakPolarHBondContact O-CB 3.31Å; E170-T174 PolarHBondContact O-N 3.08Å; E170-T174 PolarHBondContact O-OG1 2.92Å
171Q79.1Confident76.4Confident88 Ų88108.5 Ų108.541%0.41151%0.51SS..Hα-helixtrans-65.8-39173.7-73.217810.200111.8K167 E168 E169 T174 R175K167-Q171 VanDerWaalsContact O-CG 3.27Å; K167-Q171 WeakPolarHBondContact O-CG 3.48Å; K167-Q171 PolarHBondContact O-N 3.14Å; E168-Q171 PolarHBondContact O-N 3.35Å; E169-Q171 VanDerWaalsContact C-N 3.32Å; E169-Q171 PolarHBondContact O-N 3.39Å; Q171-T174 PolarHBondContact O-N 3.22Å; Q171-R175 VanDerWaalsContact O-CG 3.28Å; Q171-R175 WeakPolarHBondContact O-CG 3.45Å; Q171-R175 PolarHBondContact O-N 2.91Å
172R77.4Confident73.9Confident114 Ų114106.7 Ų106.743%0.4351%0.514SS..Hα-helixtrans-61.9-46.7174.1-169.8-176.169.574.53.2111.1E168 E169 R175 Q176E168-R172 PolarHBondContact O-N 2.66Å; E169-R172 VanDerWaalsContact CD-NE 3.32Å; E169-R172 WeakPolarHBondContact O-CB 3.49Å; E169-R172 PolarHBondContact O-N 2.95Å; E169-R172 VanDerWaalsContact O-N 3.16Å; E169-R172 IonicContact OE1-CZ 3.85Å; E169-R172 IonicContact OE1-NE 2.9Å; E169-R172 PolarHBondContact OE1-NE 2.85Å; E169-R172 IonicContact OE1-NH2 3.96Å; E169-R172 IonicContact OE2-CZ 3.28Å; E169-R172 VanDerWaalsContact OE2-CZ 3.28Å; E169-R172 IonicContact OE2-NE 3.01Å; E169-R172 PolarHBondContact OE2-NE 3.34Å; E169-R172 IonicContact OE2-NH2 2.7Å; E169-R172 PolarHBondContact OE2-NH2 2.88Å; R172-R175 WeakPolarHBondContact O-CB 3.42Å; R172-R175 PolarHBondContact O-N 3.32Å; R172-Q176 PolarHBondContact O-N 3.32Å
173L75.7Confident71.8Confident86 Ų86109.4 Ų109.445%0.4552%0.521SS..Hα-helixtrans-62.2-42.8175.5-73.8168.5000111.5E169 E170 R175 Q176 S177E169-L173 WeakPolarHBondContact O-CB 3.4Å; E169-L173 WeakPolarHBondContact O-CG 3.23Å; E169-L173 PolarHBondContact O-N 3.23Å; E170-L173 PolarHBondContact O-N 2.87Å; L173-R175 VanDerWaalsContact C-N 3.31Å; L173-R175 PolarHBondContact O-N 3.03Å; L173-Q176 CarbonylContact O-C 3.55Å; L173-Q176 WeakPolarHBondContact O-CA 3.19Å; L173-Q176 WeakPolarHBondContact O-CB 3.31Å; L173-Q176 PolarHBondContact O-N 3.26Å; L173-Q176 VanDerWaalsContact O-N 3.07Å; L173-S177 PolarHBondContact O-N 2.84Å; L173-S177 PolarHBondContact O-OG 3.47Å
174T72.6Confident69.3Low71 Ų71111 Ų11144%0.43653%0.533SS..Hα-helixtrans-61.7-39.1176.6-540000111.7E170 Q171 R178E170-T174 WeakPolarHBondContact O-CB 3.31Å; E170-T174 PolarHBondContact O-N 3.08Å; E170-T174 PolarHBondContact O-OG1 2.92Å; Q171-T174 PolarHBondContact O-N 3.22Å; T174-R178 WeakPolarHBondContact O-CG 3.18Å; T174-R178 PolarHBondContact O-N 3.29Å
175R75.3Confident66.4Low163 Ų163114.2 Ų114.262%0.61555%0.55SS*.Hα-helixtrans-65.4-39.4173.1-69.8168.1-173160.35.5111.4Q171 R172 L173 L179Q171-R175 VanDerWaalsContact O-CG 3.28Å; Q171-R175 WeakPolarHBondContact O-CG 3.45Å; Q171-R175 PolarHBondContact O-N 2.91Å; R172-R175 WeakPolarHBondContact O-CB 3.42Å; R172-R175 PolarHBondContact O-N 3.32Å; L173-R175 VanDerWaalsContact C-N 3.31Å; L173-R175 PolarHBondContact O-N 3.03Å; R175-L179 WeakPolarHBondContact O-CD1 3.39Å; R175-L179 WeakPolarHBondContact O-CG 3.21Å; R175-L179 PolarHBondContact O-N 3.49Å; R175-L179 VanDerWaalsContact O-N 3.15Å
176Q62.6Low63.7Low94 Ų94116.8 Ų116.844%0.43956%0.561SS.*Hα-helixtrans-67.7-41.1176.7-169.4172.91000112.4R172 L173 L179 Q180R172-Q176 PolarHBondContact O-N 3.32Å; L173-Q176 CarbonylContact O-C 3.55Å; L173-Q176 WeakPolarHBondContact O-CA 3.19Å; L173-Q176 WeakPolarHBondContact O-CB 3.31Å; L173-Q176 PolarHBondContact O-N 3.26Å; L173-Q176 VanDerWaalsContact O-N 3.07Å; Q176-L179 WeakPolarHBondContact O-CB 3.39Å; Q176-L179 PolarHBondContact O-N 3.06Å; Q176-Q180 PolarHBondContact O-N 3.48Å
177S59.5Low61Low59 Ų59123.7 Ų123.741%0.41359%0.59SS.*Hα-helixtrans-66.2-39175.3-60.50000112.3L173 L179 Q180 E181L173-S177 PolarHBondContact O-N 2.84Å; L173-S177 PolarHBondContact O-OG 3.47Å; S177-L179 VanDerWaalsContact C-N 3.3Å; S177-L179 PolarHBondContact O-N 2.8Å; S177-Q180 CarbonylContact O-C 3.6Å; S177-Q180 WeakPolarHBondContact O-CA 3.16Å; S177-Q180 WeakPolarHBondContact O-CB 3.26Å; S177-Q180 PolarHBondContact O-N 3.06Å; S177-E181 PolarHBondContact O-N 3.38Å
178R59.9Low58.4Low178 Ų178123.3 Ų123.367%0.67260%0.604SS**Hα-helixtrans-64.4-33172.5-74.3-176.9-164.5-167.33.8113T174 Q180 S182T174-R178 WeakPolarHBondContact O-CG 3.18Å; T174-R178 PolarHBondContact O-N 3.29Å; R178-Q180 VanDerWaalsContact C-N 3.31Å; R178-S182 PolarHBondContact O-N 3.02Å
179L57.8Low55.9Low127 Ų127123.2 Ų123.267%0.66561%0.612SS**Hα-helixtrans-73.2-22.9172.7-71.9163.8000112.5R175 Q176 S177 S182R175-L179 WeakPolarHBondContact O-CD1 3.39Å; R175-L179 WeakPolarHBondContact O-CG 3.21Å; R175-L179 PolarHBondContact O-N 3.49Å; R175-L179 VanDerWaalsContact O-N 3.15Å; Q176-L179 WeakPolarHBondContact O-CB 3.39Å; Q176-L179 PolarHBondContact O-N 3.06Å; S177-L179 VanDerWaalsContact C-N 3.3Å; S177-L179 PolarHBondContact O-N 2.8Å; L179-S182 PolarHBondContact O-OG 3.21Å
180Q53.7Low53.7Low135 Ų135127.7 Ų127.763%0.63163%0.63SS**Hα-helixtrans-82.7-34.3170.4-81.4-179.8-39.700112.6Q176 S177 R178 S182 K183Q176-Q180 PolarHBondContact O-N 3.48Å; S177-Q180 CarbonylContact O-C 3.6Å; S177-Q180 WeakPolarHBondContact O-CA 3.16Å; S177-Q180 WeakPolarHBondContact O-CB 3.26Å; S177-Q180 PolarHBondContact O-N 3.06Å; R178-Q180 VanDerWaalsContact C-N 3.31Å; Q180-S182 VanDerWaalsContact C-N 3.28Å; Q180-S182 PolarHBondContact O-N 3.07Å; Q180-K183 PolarHBondContact O-N 3.49Å
181E46.3Very low51.3Low153 Ų153133.5 Ų133.572%0.71565%0.648SS**Hα-helixtrans-67.9-21.8175.2-84.3177.3159.400113.4S177 K183S177-E181 PolarHBondContact O-N 3.38Å; E181-K183 PolarHBondContact O-N 2.85Å
182S44.3Very low48.8Very low92 Ų92135.6 Ų135.664%0.64367%0.667SS**THydrogen-bonded Turntrans-77.79.217386.30000114.1R178 L179 Q180R178-S182 PolarHBondContact O-N 3.02Å; L179-S182 PolarHBondContact O-OG 3.21Å; Q180-S182 VanDerWaalsContact C-N 3.28Å; Q180-S182 PolarHBondContact O-N 3.07Å
183K45.4Very low46.6Very low174 Ų174135.3 Ų135.376%0.75768%0.682SS**THydrogen-bonded Turntrans-127.34.3-178-80.1-167.2177.3-175.70116.8Q180 E181Q180-K183 PolarHBondContact O-N 3.49Å; E181-K183 PolarHBondContact O-N 2.85Å
184H39.4Very low44.9Very low183 Ų183136 Ų13685%0.84770%0.701SS**  trans-143.6108.2173.8-93.1-84.1000112.7
185L33.8Very low43Very low151 Ų151137.2 Ų137.279%0.79171%0.712SS**  trans-105.2145.2163-173.267.5000108.1
186D32.8Very low41.4Very low135 Ų135135.9 Ų135.972%0.72272%0.721SS**  trans83.3100.9170.8-59.9-29.8000120
187Q33.2Very low40.5Very low194 Ų194134.8 Ų134.891%0.90772%0.724SS**  174.4125.8107.8-100.6177.67.700114.7
188A32Very low40.1Very low85 Ų85136.3 Ų136.370%0.70273%0.733SS**  trans20.7114.8143.300000123.7
189T32.5Very low39.8Very low123 Ų123131.2 Ų131.276%0.75572%0.724SS**  81.7125.9119.8-34.30000123.5
190K33.3Very low39.6Very low176 Ų176130.9 Ų130.977%0.76572%0.718SS**  trans93.6108.3146-95.2166.8-169.81760122.1
191R29.9Very low40.2Very low223 Ų223131.8 Ų131.884%0.84272%0.719SS**  trans72.3136.6132.4-78.9-175.9176.2168.4-1.6121.7
192T27.8Very low41.2Very low131 Ų131128.4 Ų128.480%0.80471%0.71SS**  trans92.711515758.70000120.3
193S31.4Very low42.4Very low109 Ų109127.8 Ų127.876%0.76270%0.698SS**  trans48127.5140.461.50000122
194A40.2Very low43.6Very low101 Ų101124.9 Ų124.984%0.83569%0.69SS**  trans67.7119.2138.900000118.6
195S31.4Very low45.3Very low96 Ų96122.5 Ų122.567%0.67168%0.677SS**  174.489.6126.9171.10000109.5
196V42.8Very low47.1Very low134 Ų134118.9 Ų118.981%0.81266%0.662SS**SBendtrans-71.9123.9150.1178.80000105.5
197S43.5Very low48.8Very low72 Ų72117 Ų11750%0.50365%0.648SS.*  trans-34.7125.8-169.7-168.80000114.3S199S197-S199 PolarHBondContact O-N 3.44Å
198P50.4Low50.7Low91 Ų91113.3 Ų113.359%0.59163%0.631SS**Hα-helixtrans-56.8-19.9-179.1-24.532.7000114.6T202P198-T202 VanDerWaalsContact O-CB 3.27Å; P198-T202 WeakPolarHBondContact O-CB 3.45Å; P198-T202 PolarHBondContact O-N 2.86Å; P198-T202 PolarHBondContact O-OG1 3.38Å
199S54.2Low52.6Low70 Ų70112.8 Ų112.849%0.4962%0.617SS.*Hα-helixtrans-74.4-50.2-175.2-179.10000113S197 K201 T202 I203S197-S199 PolarHBondContact O-N 3.44Å; S199-K201 PolarHBondContact O-N 2.83Å; S199-T202 PolarHBondContact O-N 3.15Å; S199-I203 WeakPolarHBondContact O-CD1 3.36Å; S199-I203 VanDerWaalsContact O-CG1 3.27Å; S199-I203 WeakPolarHBondContact O-CG1 3.36Å; S199-I203 PolarHBondContact O-N 2.97Å
200F53.6Low54.5Low120 Ų120112.7 Ų112.753%0.52661%0.608SS.*Hα-helixtrans-72.3-35.1-174.9-118.9-90.7000113.2T202 I203 L204F200-T202 VanDerWaalsContact C-N 3.33Å; F200-I203 PolarHBondContact O-N 3.11Å; F200-L204 HydrophobicContact CD1-CD1 4.45Å; F200-L204 WeakPolarHBondContact O-CB 3.28Å; F200-L204 PolarHBondContact O-N 2.92Å
201K65.6Low56.1Low154 Ų154110.9 Ų110.967%0.6760%0.602SS**Hα-helixtrans-70.1-32.7176.2-163.5176.1-177.3-179.20111.7S199 K205S199-K201 PolarHBondContact O-N 2.83Å; K201-K205 VanDerWaalsContact O-CB 3.27Å; K201-K205 WeakPolarHBondContact O-CB 3.42Å; K201-K205 PolarHBondContact O-N 3.43Å; K201-K205 VanDerWaalsContact O-N 3.12Å
202T67.2Low58.3Low83 Ų83106.5 Ų106.551%0.50959%0.589SS.*Hα-helixtrans-70.5-44174.1-57.60000110.7P198 S199 F200 K205 T206P198-T202 VanDerWaalsContact O-CB 3.27Å; P198-T202 WeakPolarHBondContact O-CB 3.45Å; P198-T202 PolarHBondContact O-N 2.86Å; P198-T202 PolarHBondContact O-OG1 3.38Å; S199-T202 PolarHBondContact O-N 3.15Å; F200-T202 VanDerWaalsContact C-N 3.33Å; T202-K205 PolarHBondContact O-N 3.07Å; T202-T206 HydrophobicContact CG2-CG2 4.45Å; T202-T206 WeakPolarHBondContact O-CG2 3.5Å; T202-T206 PolarHBondContact O-N 3.44Å; T202-T206 PolarHBondContact O-OG1 3.39Å
203I69.6Low60.6Low78 Ų78107 Ų10740%0.458%0.582SS.*Hα-helixtrans-65.3-42178.6-67.3164.5000112.2S199 F200 K205 T206 H207S199-I203 WeakPolarHBondContact O-CD1 3.36Å; S199-I203 VanDerWaalsContact O-CG1 3.27Å; S199-I203 WeakPolarHBondContact O-CG1 3.36Å; S199-I203 PolarHBondContact O-N 2.97Å; F200-I203 PolarHBondContact O-N 3.11Å; I203-K205 VanDerWaalsContact C-N 3.31Å; I203-K205 PolarHBondContact O-N 2.98Å; I203-T206 WeakPolarHBondContact CA-OG1 3.44Å; I203-T206 PolarHBondContact O-N 2.93Å; I203-T206 PolarHBondContact O-OG1 2.75Å; I203-H207 WeakPolarHBondContact O-CB 3.2Å; I203-H207 PolarHBondContact O-CD2 3.35Å; I203-H207 PolarHBondContact O-N 3.4Å
204L71.1Confident62.6Low113 Ų113105 Ų10559%0.59257%0.568SS**Hα-helixtrans-64.9-37.3174.7-85.7162.7000111.8F200 Q208F200-L204 HydrophobicContact CD1-CD1 4.45Å; F200-L204 WeakPolarHBondContact O-CB 3.28Å; F200-L204 PolarHBondContact O-N 2.92Å; L204-Q208 VanDerWaalsContact O-CB 3.25Å; L204-Q208 WeakPolarHBondContact O-CB 3.31Å; L204-Q208 PolarHBondContact O-N 3.38Å
205K75.2Confident64.3Low133 Ų133105.3 Ų105.358%0.57856%0.556SS**Hα-helixtrans-70.5-42.8177.3-169.7144.1-176.9174.50111.9K201 T202 I203 H207 Q208 D209K201-K205 VanDerWaalsContact O-CB 3.27Å; K201-K205 WeakPolarHBondContact O-CB 3.42Å; K201-K205 PolarHBondContact O-N 3.43Å; K201-K205 VanDerWaalsContact O-N 3.12Å; T202-K205 PolarHBondContact O-N 3.07Å; I203-K205 VanDerWaalsContact C-N 3.31Å; I203-K205 PolarHBondContact O-N 2.98Å; K205-H207 VanDerWaalsContact C-N 3.34Å; K205-H207 PolarHBondContact O-N 3.24Å; K205-Q208 PolarHBondContact O-N 2.96Å; K205-D209 WeakPolarHBondContact O-CB 2.99Å; K205-D209 PolarHBondContact O-N 2.96Å
206T71.9Confident66.6Low76 Ų76103.8 Ų103.847%0.46655%0.545SS..Hα-helixtrans-63.5-38.5173.953.50000112T202 I203 D209 Q210T202-T206 HydrophobicContact CG2-CG2 4.45Å; T202-T206 WeakPolarHBondContact O-CG2 3.5Å; T202-T206 PolarHBondContact O-N 3.44Å; T202-T206 PolarHBondContact O-OG1 3.39Å; I203-T206 WeakPolarHBondContact CA-OG1 3.44Å; I203-T206 PolarHBondContact O-N 2.93Å; I203-T206 PolarHBondContact O-OG1 2.75Å; T206-D209 PolarHBondContact O-N 3.46Å; T206-Q210 WeakPolarHBondContact O-CB 3.2Å; T206-Q210 PolarHBondContact O-N 3.45Å
207H68.8Low68.3Low94 Ų94103.2 Ų103.244%0.43553%0.533SS..Hα-helixtrans-68.9-36.3174.7-89.9-61.6000112.9I203 K205 Q211I203-H207 WeakPolarHBondContact O-CB 3.2Å; I203-H207 PolarHBondContact O-CD2 3.35Å; I203-H207 PolarHBondContact O-N 3.4Å; K205-H207 VanDerWaalsContact C-N 3.34Å; K205-H207 PolarHBondContact O-N 3.24Å; H207-Q211 WeakPolarHBondContact O-CB 3.49Å; H207-Q211 PolarHBondContact O-N 2.83Å
208Q71.4Confident69.9Low117 Ų117103.8 Ų103.855%0.54753%0.53SS..Hα-helixtrans-70.3-36.3176.1-170.8165.722.400111.8L204 K205 Q211 K212L204-Q208 VanDerWaalsContact O-CB 3.25Å; L204-Q208 WeakPolarHBondContact O-CB 3.31Å; L204-Q208 PolarHBondContact O-N 3.38Å; K205-Q208 PolarHBondContact O-N 2.96Å; Q208-Q211 PolarHBondContact O-N 3.48Å; Q208-K212 WeakPolarHBondContact O-CG 3.32Å; Q208-K212 PolarHBondContact O-N 3.3Å; Q208-K212 VanDerWaalsContact O-N 3.14Å
209D72.3Confident71.3Confident75 Ų75104.8 Ų104.840%0.40153%0.527SS..Hα-helixtrans-70.8-39.7175-65.9-24.6000110.5K205 T206 Q211 K212 E213K205-D209 WeakPolarHBondContact O-CB 2.99Å; K205-D209 PolarHBondContact O-N 2.96Å; T206-D209 PolarHBondContact O-N 3.46Å; D209-Q211 VanDerWaalsContact C-N 3.33Å; D209-Q211 PolarHBondContact O-N 3.25Å; D209-K212 PolarHBondContact O-N 2.96Å; D209-E213 PolarHBondContact O-N 2.85Å
210Q73.4Confident72.8Confident121 Ų121106.6 Ų106.657%0.56553%0.528SS*.Hα-helixtrans-66.7-31.3174.2-161.5172.337.500112.8T206 S214T206-Q210 WeakPolarHBondContact O-CB 3.2Å; T206-Q210 PolarHBondContact O-N 3.45Å; Q210-S214 WeakPolarHBondContact O-CB 3.35Å; Q210-S214 PolarHBondContact O-N 3.38Å
211Q66.9Low73.9Confident138 Ų138105.7 Ų105.765%0.64553%0.528SS*.Hα-helixtrans-69-38171.5-114.3-175.7-500112.3H207 Q208 D209 N215H207-Q211 WeakPolarHBondContact O-CB 3.49Å; H207-Q211 PolarHBondContact O-N 2.83Å; Q208-Q211 PolarHBondContact O-N 3.48Å; D209-Q211 VanDerWaalsContact C-N 3.33Å; D209-Q211 PolarHBondContact O-N 3.25Å; Q211-N215 WeakPolarHBondContact O-CB 3.39Å; Q211-N215 PolarHBondContact O-N 3.03Å
212K76.1Confident74.6Confident130 Ų130104.6 Ų104.657%0.56553%0.525SS*.Hα-helixtrans-67.5-43175.2-75.9178.6177.1-178.90111.2Q208 D209 N215 S216Q208-K212 WeakPolarHBondContact O-CG 3.32Å; Q208-K212 PolarHBondContact O-N 3.3Å; Q208-K212 VanDerWaalsContact O-N 3.14Å; D209-K212 PolarHBondContact O-N 2.96Å; K212-N215 PolarHBondContact O-N 3.25Å; K212-S216 PolarHBondContact O-N 2.85Å; K212-S216 PolarHBondContact O-OG 3.41Å
213E76.2Confident75.5Confident143 Ų143105.4 Ų105.467%0.66852%0.523SS*.Hα-helixtrans-63.4-44.4176.8-169.2170.3-16000111.6D209 N215 S216 H217D209-E213 PolarHBondContact O-N 2.85Å; E213-N215 VanDerWaalsContact C-N 3.32Å; E213-N215 PolarHBondContact O-N 2.99Å; E213-S216 PolarHBondContact O-N 3.35Å; E213-H217 PolarHBondContact O-N 3.46Å
214S72.9Confident76.1Confident66 Ų66106.4 Ų106.446%0.46253%0.526SS..Hα-helixtrans-62-37.6174.2-172.40000112.7Q210 H217 I218Q210-S214 WeakPolarHBondContact O-CB 3.35Å; Q210-S214 PolarHBondContact O-N 3.38Å; S214-H217 PolarHBondContact O-N 2.9Å; S214-I218 VanDerWaalsContact O-CG1 3.31Å; S214-I218 WeakPolarHBondContact O-CG1 3.47Å; S214-I218 PolarHBondContact O-N 3.3Å; S214-I218 VanDerWaalsContact O-N 3.1Å
215N75.8Confident76.5Confident107 Ų107105.3 Ų105.357%0.57252%0.524SS*.Hα-helixtrans-70.3-38.1176.2-84.5-1.5000112.3Q211 K212 E213 H217 I218 Q219Q211-N215 WeakPolarHBondContact O-CB 3.39Å; Q211-N215 PolarHBondContact O-N 3.03Å; K212-N215 PolarHBondContact O-N 3.25Å; E213-N215 VanDerWaalsContact C-N 3.32Å; E213-N215 PolarHBondContact O-N 2.99Å; N215-H217 VanDerWaalsContact C-N 3.3Å; N215-H217 PolarHBondContact O-N 3.19Å; N215-I218 PolarHBondContact O-N 3.38Å; N215-Q219 PolarHBondContact O-N 3.18Å
216S80.7Confident76.7Confident65 Ų65103.9 Ų103.946%0.45552%0.519SS..Hα-helixtrans-62.2-39.1173.2-67.40000111.8K212 E213 Q219 E220K212-S216 PolarHBondContact O-N 2.85Å; K212-S216 PolarHBondContact O-OG 3.41Å; E213-S216 PolarHBondContact O-N 3.35Å; S216-Q219 PolarHBondContact O-N 2.88Å; S216-E220 WeakPolarHBondContact O-CG 3.42Å; S216-E220 PolarHBondContact O-N 3.37Å
217H77.3Confident77.4Confident121 Ų121106.9 Ų106.956%0.5652%0.522SS*.Hα-helixtrans-70.5-34.6178.7-133.640.7000113.2E213 S214 N215 E220 L221E213-H217 PolarHBondContact O-N 3.46Å; S214-H217 PolarHBondContact O-N 2.9Å; N215-H217 VanDerWaalsContact C-N 3.3Å; N215-H217 PolarHBondContact O-N 3.19Å; H217-E220 IonicContact CE1-OE2 3.66Å; H217-E220 IonicContact ND1-OE2 2.98Å; H217-E220 PolarHBondContact ND1-OE2 3.28Å; H217-E220 PolarHBondContact O-N 3.42Å; H217-L221 WeakPolarHBondContact O-CG 3.29Å; H217-L221 PolarHBondContact O-N 3.41Å; H217-L221 VanDerWaalsContact O-N 3.13Å
218I76.6Confident77.9Confident85 Ų85107.3 Ų107.344%0.43653%0.527SS..Hα-helixtrans-64.8-42.5172.2-69.7165.6000110.3S214 N215 E220 L221 E222S214-I218 VanDerWaalsContact O-CG1 3.31Å; S214-I218 WeakPolarHBondContact O-CG1 3.47Å; S214-I218 PolarHBondContact O-N 3.3Å; S214-I218 VanDerWaalsContact O-N 3.1Å; N215-I218 PolarHBondContact O-N 3.38Å; I218-E220 PolarHBondContact O-N 3.1Å; I218-L221 PolarHBondContact O-N 3.09Å; I218-E222 WeakPolarHBondContact O-CG 3.22Å; I218-E222 PolarHBondContact O-N 3.29Å
219Q80.7Confident78.2Confident112 Ų112107 Ų10752%0.52352%0.524SS..Hα-helixtrans-64-40.1177.8-170.6178.8-12.500112.2N215 S216 L221 E222 E223N215-Q219 PolarHBondContact O-N 3.18Å; S216-Q219 PolarHBondContact O-N 2.88Å; Q219-L221 PolarHBondContact O-N 3.4Å; Q219-E222 PolarHBondContact O-N 3.44Å; Q219-E223 WeakPolarHBondContact O-CG 3.32Å; Q219-E223 PolarHBondContact O-N 3.48Å
220E84.6Confident78.2Confident108 Ų108106.5 Ų106.551%0.50553%0.526SS..Hα-helixtrans-61.8-41.8174.4-75.9173.516700112.3S216 H217 I218 E223 E224S216-E220 WeakPolarHBondContact O-CG 3.42Å; S216-E220 PolarHBondContact O-N 3.37Å; H217-E220 IonicContact CE1-OE2 3.66Å; H217-E220 IonicContact ND1-OE2 2.98Å; H217-E220 PolarHBondContact ND1-OE2 3.28Å; H217-E220 PolarHBondContact O-N 3.42Å; I218-E220 PolarHBondContact O-N 3.1Å; E220-E223 PolarHBondContact O-N 3.24Å; E220-E224 WeakPolarHBondContact O-CB 3.44Å; E220-E224 PolarHBondContact O-N 2.87Å
221L78.2Confident78.3Confident101 Ų101105.5 Ų105.553%0.52952%0.522SS..Hα-helixtrans-67-37.5176.8-74.5168000112.2H217 I218 Q219 E224 V225H217-L221 WeakPolarHBondContact O-CG 3.29Å; H217-L221 PolarHBondContact O-N 3.41Å; H217-L221 VanDerWaalsContact O-N 3.13Å; I218-L221 PolarHBondContact O-N 3.09Å; Q219-L221 PolarHBondContact O-N 3.4Å; L221-E224 PolarHBondContact O-N 3.44Å; L221-V225 VanDerWaalsContact O-CG2 3.31Å; L221-V225 WeakPolarHBondContact O-CG2 3.27Å; L221-V225 PolarHBondContact O-N 3.31Å
222E80.4Confident78.4Confident131 Ų131104.4 Ų104.461%0.61252%0.52SS*.Hα-helixtrans-64.4-42.1174.1-74.9-177.4160.300111.8I218 Q219 E224 V225 E226I218-E222 WeakPolarHBondContact O-CG 3.22Å; I218-E222 PolarHBondContact O-N 3.29Å; Q219-E222 PolarHBondContact O-N 3.44Å; E222-E224 VanDerWaalsContact C-N 3.34Å; E222-E224 PolarHBondContact O-N 3.47Å; E222-V225 PolarHBondContact O-N 2.91Å; E222-E226 PolarHBondContact O-N 2.77Å; E222-E226 VanDerWaalsContact O-N 3.1Å
223E84.6Confident78Confident99 Ų99103.1 Ų103.146%0.46352%0.519SS..Hα-helixtrans-65.9-35.2175.3-72.5178.7-169.200112.7Q219 E220 R227Q219-E223 WeakPolarHBondContact O-CG 3.32Å; Q219-E223 PolarHBondContact O-N 3.48Å; E220-E223 PolarHBondContact O-N 3.24Å; E223-R227 PolarHBondContact O-N 3Å
224E83.6Confident77.6Confident99 Ų99100.7 Ų100.746%0.46351%0.514SS..Hα-helixtrans-71.4-37.5176.9-166164.1-155.700112.3E220 L221 E222 R227 L228E220-E224 WeakPolarHBondContact O-CB 3.44Å; E220-E224 PolarHBondContact O-N 2.87Å; L221-E224 PolarHBondContact O-N 3.44Å; E222-E224 VanDerWaalsContact C-N 3.34Å; E222-E224 PolarHBondContact O-N 3.47Å; E224-R227 PolarHBondContact O-N 2.87Å; E224-L228 HydrophobicContact CG-CD1 4.45Å; E224-L228 WeakPolarHBondContact O-CB 3.46Å; E224-L228 WeakPolarHBondContact O-CG 3.29Å; E224-L228 PolarHBondContact O-N 3.45Å
225V78.2Confident77Confident90 Ų90105.3 Ų105.355%0.54552%0.521SS..Hα-helixtrans-63.3-42172.7168.90000111.2L221 E222 L228 K229L221-V225 VanDerWaalsContact O-CG2 3.31Å; L221-V225 WeakPolarHBondContact O-CG2 3.27Å; L221-V225 PolarHBondContact O-N 3.31Å; E222-V225 PolarHBondContact O-N 2.91Å; V225-L228 PolarHBondContact O-N 2.65Å; V225-K229 VanDerWaalsContact O-CB 3.29Å; V225-K229 WeakPolarHBondContact O-CB 3.49Å; V225-K229 PolarHBondContact O-N 2.85Å
226E80.1Confident75.8Confident104 Ų104103.7 Ų103.749%0.48652%0.518SS..Hα-helixtrans-72.2-31.9179-15362.6-162.900112E222 K229 S230E222-E226 PolarHBondContact O-N 2.77Å; E222-E226 VanDerWaalsContact O-N 3.1Å; E226-K229 IonicContact OE1-NZ 2.72Å; E226-K229 PolarHBondContact OE1-NZ 3.49Å; E226-K229 WeakPolarHBondContact OE2-CD 2.96Å; E226-K229 IonicContact OE2-NZ 2.73Å; E226-K229 PolarHBondContact OE2-NZ 3.32Å; E226-S230 PolarHBondContact O-N 3.24Å; E226-S230 PolarHBondContact O-OG 2.95Å; E226-S230 VanDerWaalsContact O-OG 3.14Å
227R86.8Confident74.4Confident138 Ų138109.5 Ų109.552%0.52153%0.53SS..Hα-helixtrans-61.3-50.6167.1-84.2-164.9-61-93.4-1.7112.1E223 E224 K229 S230 E231E223-R227 PolarHBondContact O-N 3Å; E224-R227 PolarHBondContact O-N 2.87Å; R227-K229 VanDerWaalsContact C-N 3.26Å; R227-K229 PolarHBondContact O-N 2.85Å; R227-S230 PolarHBondContact O-N 2.87Å; R227-S230 PolarHBondContact O-OG 3.19Å; R227-E231 PolarHBondContact O-N 3.44Å
228L78.4Confident73.2Confident104 Ų104106.8 Ų106.855%0.54552%0.524SS..Hα-helixtrans-62.9-34.1-179.9-73.3170.9000112.3E224 V225 E231 L232E224-L228 HydrophobicContact CG-CD1 4.45Å; E224-L228 WeakPolarHBondContact O-CB 3.46Å; E224-L228 WeakPolarHBondContact O-CG 3.29Å; E224-L228 PolarHBondContact O-N 3.45Å; V225-L228 PolarHBondContact O-N 2.65Å; L228-E231 PolarHBondContact O-N 2.93Å; L228-L232 WeakPolarHBondContact O-CB 3.41Å; L228-L232 PolarHBondContact O-N 3.5Å
229K78.4Confident71.9Confident109 Ų109108.5 Ų108.547%0.47453%0.534SS..Hα-helixtrans-68.3-42.1175.7-171.6-177.8167.7-156.10112.2V225 E226 R227 L232 D233V225-K229 VanDerWaalsContact O-CB 3.29Å; V225-K229 WeakPolarHBondContact O-CB 3.49Å; V225-K229 PolarHBondContact O-N 2.85Å; E226-K229 IonicContact OE1-NZ 2.72Å; E226-K229 PolarHBondContact OE1-NZ 3.49Å; E226-K229 WeakPolarHBondContact OE2-CD 2.96Å; E226-K229 IonicContact OE2-NZ 2.73Å; E226-K229 PolarHBondContact OE2-NZ 3.32Å; R227-K229 VanDerWaalsContact C-N 3.26Å; R227-K229 PolarHBondContact O-N 2.85Å; K229-L232 PolarHBondContact O-N 3.2Å; K229-D233 PolarHBondContact O-N 2.97Å; K229-D233 VanDerWaalsContact O-N 3.07Å
230S72.3Confident70.3Confident66 Ų66108.7 Ų108.746%0.46254%0.538SS..Hα-helixtrans-69-31.7174.260.30000113.1E226 R227 T234E226-S230 PolarHBondContact O-N 3.24Å; E226-S230 PolarHBondContact O-OG 2.95Å; E226-S230 VanDerWaalsContact O-OG 3.14Å; R227-S230 PolarHBondContact O-N 2.87Å; R227-S230 PolarHBondContact O-OG 3.19Å; S230-T234 WeakPolarHBondContact O-CG2 3.31Å; S230-T234 PolarHBondContact O-N 3.3Å; S230-T234 VanDerWaalsContact O-N 3.12Å; S230-T234 PolarHBondContact O-OG1 3.25Å
231E75.4Confident68.6Low100 Ų100108.1 Ų108.147%0.46754%0.543SS..Hα-helixtrans-69-35.6172.4-164.5177.2170.900112.4R227 L228 T234 R235R227-E231 PolarHBondContact O-N 3.44Å; L228-E231 PolarHBondContact O-N 2.93Å; E231-T234 WeakPolarHBondContact CA-OG1 3.48Å; E231-T234 PolarHBondContact O-OG1 2.86Å; E231-R235 PolarHBondContact O-N 2.89Å; E231-R235 VanDerWaalsContact O-N 3.11Å
232L70.2Confident67.1Low115 Ų115105.4 Ų105.460%0.60254%0.539SS*.Hα-helixtrans-70.3-40.1175.7-166.169.3000112.1L228 K229 T234 R235 C236L228-L232 WeakPolarHBondContact O-CB 3.41Å; L228-L232 PolarHBondContact O-N 3.5Å; K229-L232 PolarHBondContact O-N 3.2Å; L232-T234 VanDerWaalsContact C-N 3.32Å; L232-T234 PolarHBondContact O-N 3.39Å; L232-R235 PolarHBondContact O-N 3.07Å; L232-C236 PolarHBondContact O-N 3.44Å
233D67.1Low65.5Low103 Ų103101.5 Ų101.555%0.55153%0.526SS*.Hα-helixtrans-67.2-32.1176.5-95.4-8.6000112.7K229 R237K229-D233 PolarHBondContact O-N 2.97Å; K229-D233 VanDerWaalsContact O-N 3.07Å; D233-R237 PolarHBondContact O-N 2.84Å
234T66.8Low63.8Low92 Ų92101 Ų10156%0.56453%0.53SS*.Hα-helixtrans-73.4-37.2174.646.60000112.1S230 E231 L232 R237 S238S230-T234 WeakPolarHBondContact O-CG2 3.31Å; S230-T234 PolarHBondContact O-N 3.3Å; S230-T234 VanDerWaalsContact O-N 3.12Å; S230-T234 PolarHBondContact O-OG1 3.25Å; E231-T234 WeakPolarHBondContact CA-OG1 3.48Å; E231-T234 PolarHBondContact O-OG1 2.86Å; L232-T234 VanDerWaalsContact C-N 3.32Å; L232-T234 PolarHBondContact O-N 3.39Å; T234-R237 PolarHBondContact O-N 3.44Å; T234-S238 PolarHBondContact O-N 3.5Å
235R60.7Low62.2Low162 Ų162103 Ų10361%0.61154%0.541SS*.Hα-helixtrans-65.6-40.2170.9-84.5-176-176.8-177.95.9113.5E231 L232 R237 S238 D239E231-R235 PolarHBondContact O-N 2.89Å; E231-R235 VanDerWaalsContact O-N 3.11Å; L232-R235 PolarHBondContact O-N 3.07Å; R235-R237 VanDerWaalsContact C-N 3.27Å; R235-R237 PolarHBondContact O-N 3.24Å; R235-S238 PolarHBondContact O-N 3.21Å; R235-S238 PolarHBondContact O-OG 3.46Å; R235-D239 PolarHBondContact O-N 3.21Å
236C51.2Low60.8Low74 Ų74105.3 Ų105.350%0.555%0.546SS..Hα-helixtrans-64-31.4175.9-91.60000112.9L232 L240L232-C236 PolarHBondContact O-N 3.44Å; C236-L240 WeakPolarHBondContact O-CD1 3.31Å
237R49.9Very low59.4Low186 Ų186106.5 Ų106.570%0.70255%0.551SS**Hα-helixtrans-78.6-28.7-179.2-160.1178.4-61.9-131.40.7113.2D233 T234 R235 T241D233-R237 PolarHBondContact O-N 2.84Å; T234-R237 PolarHBondContact O-N 3.44Å; R235-R237 VanDerWaalsContact C-N 3.27Å; R235-R237 PolarHBondContact O-N 3.24Å; R237-T241 PolarHBondContact O-OG1 3.17Å
238S52.2Low57.8Low64 Ų64103.2 Ų103.245%0.44855%0.55SS..Hα-helixtrans-73.4-30.4174.953.30000113.3T234 R235 T241T234-S238 PolarHBondContact O-N 3.5Å; R235-S238 PolarHBondContact O-N 3.21Å; R235-S238 PolarHBondContact O-OG 3.46Å; S238-T241 PolarHBondContact O-OG1 3.06Å
239D49.5Very low56.6Low122 Ų122104.2 Ų104.265%0.65255%0.551SS**Hα-helixtrans-79.2-22.8-176.8-67.2-9.9000112.8R235R235-D239 PolarHBondContact O-N 3.21Å
240L47Very low55.5Low115 Ų115102.2 Ų102.260%0.60255%0.548SS*.Hα-helixtrans-83.8-27.7177.1-74.3161.1000113.5C236 T244C236-L240 WeakPolarHBondContact O-CD1 3.31Å; L240-T244 PolarHBondContact O-OG1 3.42Å
241T49Very low54.7Low97 Ų97102.4 Ų102.460%0.59555%0.55SS*.Hα-helixtrans-80-27.5177.944.50000112.7R237 S238R237-T241 PolarHBondContact O-OG1 3.17Å; S238-T241 PolarHBondContact O-OG1 3.06Å
242G47Very low54Low44 Ų44106.7 Ų106.745%0.45456%0.562SS.*Hα-helixtrans-69-40.817200000113.8
243S46.9Very low53.8Low49 Ų49105.7 Ų105.734%0.34355%0.554SS.*Hα-helixtrans-79.6-26-174.671.70000114.5Q247S243-Q247 WeakPolarHBondContact O-CG 3.27Å; S243-Q247 PolarHBondContact O-N 3.47Å
244T49.1Very low53.7Low89 Ų89110.2 Ų110.255%0.54656%0.563SS.*Hα-helixtrans-75.6-31-177.9-53.90000112.5L240 S248L240-T244 PolarHBondContact O-OG1 3.42Å; T244-S248 PolarHBondContact O-N 2.98Å; T244-S248 PolarHBondContact O-OG 3.01Å
245M49.6Very low54Low141 Ų141110.7 Ų110.770%0.69557%0.566SS**Hα-helixtrans-74.9-39.3176.7-118.9-175.9-17800112S248 Q249M245-S248 PolarHBondContact O-N 3.06Å; M245-S248 PolarHBondContact O-OG 3.44Å; M245-S248 VanDerWaalsContact O-OG 3.1Å; M245-Q249 PolarHBondContact O-N 2.92Å; M245-Q249 VanDerWaalsContact O-N 3.17Å
246E48.8Very low54.4Low138 Ų138108.4 Ų108.465%0.64556%0.562SS**Hα-helixtrans-69.6-36.1177.4-76.8-175.3155.400112.7S248 T250E246-S248 PolarHBondContact O-N 3.37Å; E246-T250 WeakPolarHBondContact O-CB 3.25Å; E246-T250 WeakPolarHBondContact O-CG2 3.25Å; E246-T250 PolarHBondContact O-N 2.99Å; E246-T250 PolarHBondContact O-OG1 3.3Å
247Q50.6Low55.3Low129 Ų129112.3 Ų112.360%0.60357%0.567SS**Hα-helixtrans-68-33.2176.4-77.4-179.3-3.400112.8S243 T250 S251S243-Q247 WeakPolarHBondContact O-CG 3.27Å; S243-Q247 PolarHBondContact O-N 3.47Å; Q247-T250 WeakPolarHBondContact CA-OG1 3.39Å; Q247-T250 PolarHBondContact O-OG1 3.2Å; Q247-S251 VanDerWaalsContact O-CB 3.31Å; Q247-S251 WeakPolarHBondContact O-CB 3.43Å; Q247-S251 PolarHBondContact O-N 2.95Å; Q247-S251 VanDerWaalsContact O-N 3.1Å; Q247-S251 PolarHBondContact O-OG 2.91Å
248S52.7Low56.5Low69 Ų69109.8 Ų109.848%0.48356%0.563SS.*Hα-helixtrans-77.9-32.3178.440.80000112.7T244 M245 E246 R252T244-S248 PolarHBondContact O-N 2.98Å; T244-S248 PolarHBondContact O-OG 3.01Å; M245-S248 PolarHBondContact O-N 3.06Å; M245-S248 PolarHBondContact O-OG 3.44Å; M245-S248 VanDerWaalsContact O-OG 3.1Å; E246-S248 PolarHBondContact O-N 3.37Å; S248-R252 PolarHBondContact O-N 3.26Å
249Q54.8Low57.8Low124 Ų124112.1 Ų112.158%0.57957%0.567SS**Hα-helixtrans-71.9-42.7171.2-100.8165.8-29.100113M245 S251 R252 Q253M245-Q249 PolarHBondContact O-N 2.92Å; M245-Q249 VanDerWaalsContact O-N 3.17Å; Q249-S251 VanDerWaalsContact C-N 3.33Å; Q249-S251 PolarHBondContact O-N 3.38Å; Q249-R252 PolarHBondContact O-N 3.18Å; Q249-Q253 WeakPolarHBondContact O-CG 3.28Å; Q249-Q253 PolarHBondContact O-N 3.27Å
250T53.8Low59Low67 Ų67110.7 Ų110.741%0.41156%0.559SS.*Hα-helixtrans-67.1-33.3177.847.60000112.3E246 Q247 R254E246-T250 WeakPolarHBondContact O-CB 3.25Å; E246-T250 WeakPolarHBondContact O-CG2 3.25Å; E246-T250 PolarHBondContact O-N 2.99Å; E246-T250 PolarHBondContact O-OG1 3.3Å; Q247-T250 WeakPolarHBondContact CA-OG1 3.39Å; Q247-T250 PolarHBondContact O-OG1 3.2Å; T250-R254 PolarHBondContact O-N 3.5Å
251S56.7Low60.2Low71 Ų71110.5 Ų110.550%0.49756%0.558SS.*Hα-helixtrans-64.4-43.3172.6-60.40000112.2Q247 Q249 R254 V255Q247-S251 VanDerWaalsContact O-CB 3.31Å; Q247-S251 WeakPolarHBondContact O-CB 3.43Å; Q247-S251 PolarHBondContact O-N 2.95Å; Q247-S251 VanDerWaalsContact O-N 3.1Å; Q247-S251 PolarHBondContact O-OG 2.91Å; Q249-S251 VanDerWaalsContact C-N 3.33Å; Q249-S251 PolarHBondContact O-N 3.38Å; S251-R254 PolarHBondContact O-N 2.89Å; S251-V255 WeakPolarHBondContact O-CG2 3.48Å; S251-V255 PolarHBondContact O-N 3.24Å; S251-V255 VanDerWaalsContact O-N 3.14Å
252R61.2Low61.4Low190 Ų190109 Ų10972%0.71755%0.549SS*.Hα-helixtrans-68.3-40.3179-137.5175.7-168.6-178.52.5111.8S248 Q249 V255 Q256S248-R252 PolarHBondContact O-N 3.26Å; Q249-R252 PolarHBondContact O-N 3.18Å; R252-V255 PolarHBondContact O-N 3.42Å; R252-Q256 WeakPolarHBondContact O-CG 3.13Å; R252-Q256 PolarHBondContact O-N 3.01Å
253Q64.3Low62.6Low94 Ų94111.4 Ų111.444%0.43955%0.548SS..Hα-helixtrans-63.9-42.3174.3-75.8170.3-15.400111.6Q249 V255 Q256 Y257Q249-Q253 WeakPolarHBondContact O-CG 3.28Å; Q249-Q253 PolarHBondContact O-N 3.27Å; Q253-V255 VanDerWaalsContact C-N 3.35Å; Q253-V255 PolarHBondContact O-N 2.72Å; Q253-Q256 PolarHBondContact O-N 2.93Å; Q253-Y257 HydrophobicContact CB-CD2 4.36Å; Q253-Y257 HydrophobicContact CB-CE2 4.26Å; Q253-Y257 WeakPolarHBondContact O-CD2 3.45Å; Q253-Y257 PolarHBondContact O-N 3.49Å
254R66.1Low63.6Low197 Ų197113.7 Ų113.774%0.74356%0.556SS**Hα-helixtrans-60-42.1174.5-88.1-175.4-167.71705.6113T250 S251 Q256 Y257 H258T250-R254 PolarHBondContact O-N 3.5Å; S251-R254 PolarHBondContact O-N 2.89Å; R254-Q256 VanDerWaalsContact C-N 3.34Å; R254-Y257 PolarHBondContact O-N 3.24Å; R254-H258 WeakPolarHBondContact O-CB 3.46Å; R254-H258 PolarHBondContact O-N 2.96Å
255V72.7Confident64.2Low103 Ų103113.7 Ų113.762%0.62455%0.552SS**Hα-helixtrans-66-39177.2175.40000110.8S251 R252 Q253 H258 H259S251-V255 WeakPolarHBondContact O-CG2 3.48Å; S251-V255 PolarHBondContact O-N 3.24Å; S251-V255 VanDerWaalsContact O-N 3.14Å; R252-V255 PolarHBondContact O-N 3.42Å; Q253-V255 VanDerWaalsContact C-N 3.35Å; Q253-V255 PolarHBondContact O-N 2.72Å; V255-H258 PolarHBondContact O-N 3.42Å; V255-H259 WeakPolarHBondContact O-CB 3.44Å; V255-H259 PolarHBondContact O-N 3.41Å
256Q68.8Low64.9Low113 Ų113111 Ų11153%0.52854%0.544SS..Hα-helixtrans-66.3-43.6175.1-74.2173.1-10.400112.8R252 Q253 R254 H258 H259 L260R252-Q256 WeakPolarHBondContact O-CG 3.13Å; R252-Q256 PolarHBondContact O-N 3.01Å; Q253-Q256 PolarHBondContact O-N 2.93Å; R254-Q256 VanDerWaalsContact C-N 3.34Å; Q256-H258 VanDerWaalsContact C-N 3.33Å; Q256-H258 PolarHBondContact O-N 2.89Å; Q256-H259 PolarHBondContact O-N 2.95Å; Q256-L260 WeakPolarHBondContact O-CB 3.28Å; Q256-L260 WeakPolarHBondContact O-CG 3.46Å; Q256-L260 PolarHBondContact O-N 3.24Å
257Y71.4Confident65.6Low156 Ų156110 Ų11061%0.61254%0.542SS*.Hα-helixtrans-63.7-39.1174.7-78-62.6000111.8Q253 R254 L260 L261Q253-Y257 HydrophobicContact CB-CD2 4.36Å; Q253-Y257 HydrophobicContact CB-CE2 4.26Å; Q253-Y257 WeakPolarHBondContact O-CD2 3.45Å; Q253-Y257 PolarHBondContact O-N 3.49Å; R254-Y257 PolarHBondContact O-N 3.24Å; Y257-L260 PolarHBondContact O-N 3.46Å; Y257-L261 WeakPolarHBondContact O-CB 3.09Å; Y257-L261 WeakPolarHBondContact O-CG 3.29Å; Y257-L261 PolarHBondContact O-N 3.33Å
258H74.9Confident66Low133 Ų133108.4 Ų108.462%0.61654%0.541SS*.Hα-helixtrans-68-39.5176.7-163.547.6000112.1R254 V255 Q256 L261 T262R254-H258 WeakPolarHBondContact O-CB 3.46Å; R254-H258 PolarHBondContact O-N 2.96Å; V255-H258 PolarHBondContact O-N 3.42Å; Q256-H258 VanDerWaalsContact C-N 3.33Å; Q256-H258 PolarHBondContact O-N 2.89Å; H258-L261 PolarHBondContact O-N 3.48Å; H258-T262 WeakPolarHBondContact O-CB 3.37Å; H258-T262 PolarHBondContact O-N 2.95Å; H258-T262 PolarHBondContact O-OG1 3.37Å
259H78.6Confident66Low114 Ų114110.7 Ų110.753%0.52855%0.547SS..Hα-helixtrans-63.3-45.5173.4-174-9000112V255 Q256 T262 E263V255-H259 WeakPolarHBondContact O-CB 3.44Å; V255-H259 PolarHBondContact O-N 3.41Å; Q256-H259 PolarHBondContact O-N 2.95Å; H259-T262 WeakPolarHBondContact O-CB 3.39Å; H259-T262 PolarHBondContact O-N 3.45Å; H259-T262 VanDerWaalsContact O-N 3.14Å; H259-E263 IonicContact CE1-OE1 3.05Å; H259-E263 PolarHBondContact CE1-OE1 3.33Å; H259-E263 VanDerWaalsContact CE1-OE1 3.3Å; H259-E263 PolarHBondContact O-N 2.9Å
260L75.8Confident65.6Low91 Ų91107.1 Ų107.148%0.47653%0.532SS..Hα-helixtrans-63.1-42.1176.8-80.3164.9000112Q256 Y257 T262 E263 I264Q256-L260 WeakPolarHBondContact O-CB 3.28Å; Q256-L260 WeakPolarHBondContact O-CG 3.46Å; Q256-L260 PolarHBondContact O-N 3.24Å; Y257-L260 PolarHBondContact O-N 3.46Å; L260-T262 VanDerWaalsContact C-N 3.25Å; L260-T262 PolarHBondContact O-N 3.01Å; L260-E263 PolarHBondContact O-N 2.84Å; L260-I264 WeakPolarHBondContact O-CB 3.37Å; L260-I264 VanDerWaalsContact O-CG1 3.24Å; L260-I264 WeakPolarHBondContact O-CG1 3.42Å; L260-I264 PolarHBondContact O-N 3.06Å
261L71.8Confident65.6Low112 Ų112108 Ų10859%0.58654%0.539SS*.Hα-helixtrans-62-35.7173.6-83.4162.2000111.8Y257 H258 N265Y257-L261 WeakPolarHBondContact O-CB 3.09Å; Y257-L261 WeakPolarHBondContact O-CG 3.29Å; Y257-L261 PolarHBondContact O-N 3.33Å; H258-L261 PolarHBondContact O-N 3.48Å; L261-N265 WeakPolarHBondContact O-CB 3.23Å; L261-N265 PolarHBondContact O-N 3.48Å
262T74.2Confident65Low66 Ų66112.6 Ų112.641%0.40555%0.545SS..Hα-helixtrans-72.3-39177.8-50.10000111.3H258 H259 L260 N265 T266H258-T262 WeakPolarHBondContact O-CB 3.37Å; H258-T262 PolarHBondContact O-N 2.95Å; H258-T262 PolarHBondContact O-OG1 3.37Å; H259-T262 WeakPolarHBondContact O-CB 3.39Å; H259-T262 PolarHBondContact O-N 3.45Å; H259-T262 VanDerWaalsContact O-N 3.14Å; L260-T262 VanDerWaalsContact C-N 3.25Å; L260-T262 PolarHBondContact O-N 3.01Å; T262-N265 PolarHBondContact O-N 3.11Å; T262-T266 VanDerWaalsContact O-CG2 3.31Å; T262-T266 WeakPolarHBondContact O-CG2 3.48Å; T262-T266 PolarHBondContact O-N 3.4Å; T262-T266 PolarHBondContact O-OG1 3.29Å
263E71.4Confident64.2Low94 Ų94108.7 Ų108.744%0.43954%0.538SS..Hα-helixtrans-66-42.1172.2-77.5-168.6162.100112.8H259 L260 N265 T266 L267H259-E263 IonicContact CE1-OE1 3.05Å; H259-E263 PolarHBondContact CE1-OE1 3.33Å; H259-E263 VanDerWaalsContact CE1-OE1 3.3Å; H259-E263 PolarHBondContact O-N 2.9Å; L260-E263 PolarHBondContact O-N 2.84Å; E263-N265 VanDerWaalsContact C-N 3.29Å; E263-N265 PolarHBondContact O-N 3.47Å; E263-T266 WeakPolarHBondContact CA-OG1 3.31Å; E263-T266 PolarHBondContact O-N 2.95Å; E263-T266 PolarHBondContact O-OG1 3.17Å; E263-L267 VanDerWaalsContact O-CB 3.32Å; E263-L267 WeakPolarHBondContact O-CB 3.19Å; E263-L267 VanDerWaalsContact O-CG 3.22Å; E263-L267 WeakPolarHBondContact O-CG 3.5Å; E263-L267 PolarHBondContact O-N 3.32Å
264I68.1Low63.3Low97 Ų97111 Ų11150%0.49755%0.549SS..Hα-helixtrans-62.6-41.5173.7-68.1165.7000109.5L260 L267 V268L260-I264 WeakPolarHBondContact O-CB 3.37Å; L260-I264 VanDerWaalsContact O-CG1 3.24Å; L260-I264 WeakPolarHBondContact O-CG1 3.42Å; L260-I264 PolarHBondContact O-N 3.06Å; I264-L267 PolarHBondContact O-N 3.31Å; I264-V268 HydrophobicContact CG2-CG2 4.11Å; I264-V268 VanDerWaalsContact O-CB 3.31Å; I264-V268 WeakPolarHBondContact O-CB 3.5Å; I264-V268 WeakPolarHBondContact O-CG2 3.3Å; I264-V268 PolarHBondContact O-N 2.93Å
265N61.7Low62.2Low89 Ų89108.1 Ų108.148%0.47654%0.544SS..Hα-helixtrans-67.4-37178.1-161.235.4000112.5L261 T262 E263 I269L261-N265 WeakPolarHBondContact O-CB 3.23Å; L261-N265 PolarHBondContact O-N 3.48Å; T262-N265 PolarHBondContact O-N 3.11Å; E263-N265 VanDerWaalsContact C-N 3.29Å; E263-N265 PolarHBondContact O-N 3.47Å; N265-I269 VanDerWaalsContact O-CB 3.23Å; N265-I269 WeakPolarHBondContact O-CB 3.44Å; N265-I269 WeakPolarHBondContact O-CG1 3.42Å; N265-I269 PolarHBondContact O-N 3.35Å; N265-I269 WeakPolarHBondContact OD1-CD1 3.3Å
266T65.6Low60.8Low85 Ų85111.9 Ų111.952%0.52155%0.548SS..Hα-helixtrans-73.5-26.6174.157.80000113T262 E263 I269 N270T262-T266 VanDerWaalsContact O-CG2 3.31Å; T262-T266 WeakPolarHBondContact O-CG2 3.48Å; T262-T266 PolarHBondContact O-N 3.4Å; T262-T266 PolarHBondContact O-OG1 3.29Å; E263-T266 WeakPolarHBondContact CA-OG1 3.31Å; E263-T266 PolarHBondContact O-N 2.95Å; E263-T266 PolarHBondContact O-OG1 3.17Å; T266-I269 CarbonylContact O-C 3.37Å; T266-N270 PolarHBondContact O-N 3.5Å
267L61.9Low59.6Low115 Ų115115 Ų11560%0.60256%0.562SS**Hα-helixtrans-78.6-33.2172.4-73.3171.6000113.3E263 I264 N270E263-L267 VanDerWaalsContact O-CB 3.32Å; E263-L267 WeakPolarHBondContact O-CB 3.19Å; E263-L267 VanDerWaalsContact O-CG 3.22Å; E263-L267 WeakPolarHBondContact O-CG 3.5Å; E263-L267 PolarHBondContact O-N 3.32Å; I264-L267 PolarHBondContact O-N 3.31Å; L267-N270 VanDerWaalsContact O-CB 3.27Å; L267-N270 WeakPolarHBondContact O-CB 3.36Å
268V59.5Low57.9Low96 Ų96118 Ų11858%0.58257%0.572SS**Hα-helixtrans-77.9-36.5175.1171.20000110.4I264 N270I264-V268 HydrophobicContact CG2-CG2 4.11Å; I264-V268 VanDerWaalsContact O-CB 3.31Å; I264-V268 WeakPolarHBondContact O-CB 3.5Å; I264-V268 WeakPolarHBondContact O-CG2 3.3Å; I264-V268 PolarHBondContact O-N 2.93Å; V268-N270 PolarHBondContact O-N 3.16Å
269I52.3Low55.7Low117 Ų117120.5 Ų120.560%0.658%0.577SS**THydrogen-bonded Turntrans-92.946170.3-48169000109N265 T266N265-I269 VanDerWaalsContact O-CB 3.23Å; N265-I269 WeakPolarHBondContact O-CB 3.44Å; N265-I269 WeakPolarHBondContact O-CG1 3.42Å; N265-I269 PolarHBondContact O-N 3.35Å; N265-I269 WeakPolarHBondContact OD1-CD1 3.3Å; T266-I269 CarbonylContact O-C 3.37Å
270N47Very low53.8Low50 Ų50119.4 Ų119.427%0.26758%0.58SS.*  trans-84.1129.5173.7-152.9-41.3000108.4T266 L267 V268 R272 L273T266-N270 PolarHBondContact O-N 3.5Å; L267-N270 VanDerWaalsContact O-CB 3.27Å; L267-N270 WeakPolarHBondContact O-CB 3.36Å; V268-N270 PolarHBondContact O-N 3.16Å; N270-R272 PolarHBondContact O-N 2.99Å; N270-L273 PolarHBondContact O-N 3.18Å
271P53.2Low52.1Low85 Ų85124.9 Ų124.955%0.55259%0.594SS**Hα-helixtrans-58.4-9.3176.821.1-32.7000113.8Q274 Q275P271-Q274 WeakPolarHBondContact O-CB 3.38Å; P271-Q274 PolarHBondContact O-N 3.06Å; P271-Q275 PolarHBondContact O-N 2.93Å
272R44.6Very low50.8Low168 Ų168127.8 Ų127.863%0.63461%0.605SS**Hα-helixtrans-66.2-31.8171.9-66.5-176.3178-179.90.3113.4N270 Q274 Q275 Y276N270-R272 PolarHBondContact O-N 2.99Å; R272-Q274 VanDerWaalsContact C-N 3.25Å; R272-Q274 PolarHBondContact O-N 3.25Å; R272-Q275 PolarHBondContact O-N 3.46Å; R272-Y276 WeakPolarHBondContact O-CD2 3.33Å; R272-Y276 PolarHBondContact O-N 3.43Å
273L45.3Very low49.5Very low107 Ų107128.3 Ų128.356%0.5661%0.611SS**Hα-helixtrans-71-23.5172.4-69.9176.8000112.3N270 Q277N270-L273 PolarHBondContact O-N 3.18Å; L273-Q277 PolarHBondContact O-N 3.02Å
274Q44.8Very low48.3Very low144 Ų144129 Ų12967%0.67361%0.614SS**Hα-helixtrans-79.3-27.1170.4-65.3-169.3-1200112.6P271 R272 Q277 R278P271-Q274 WeakPolarHBondContact O-CB 3.38Å; P271-Q274 PolarHBondContact O-N 3.06Å; R272-Q274 VanDerWaalsContact C-N 3.25Å; R272-Q274 PolarHBondContact O-N 3.25Å; Q274-Q277 PolarHBondContact O-N 3.33Å; Q274-R278 VanDerWaalsContact O-CB 3.29Å; Q274-R278 WeakPolarHBondContact O-CB 3.39Å; Q274-R278 PolarHBondContact O-N 3.42Å
275Q42.2Very low47.4Very low136 Ų136129.9 Ų129.964%0.63662%0.616SS**Hα-helixtrans-70.3-31.7171.7-81.1177.4-17.400112.8P271 R272 R278P271-Q275 PolarHBondContact O-N 2.93Å; R272-Q275 PolarHBondContact O-N 3.46Å; Q275-R278 PolarHBondContact O-N 3.46Å
276Y43.9Very low47Very low182 Ų182129 Ų12971%0.71462%0.622SS**Hα-helixtrans-78.5-22.1174.4-72-71.6000114R272R272-Y276 WeakPolarHBondContact O-CD2 3.33Å; R272-Y276 PolarHBondContact O-N 3.43Å
277Q43.3Very low46.5Very low178 Ų178131.6 Ų131.683%0.83263%0.627SS**Hα-helixtrans-82.8-16.3169.6-75.1-170.5-3.900113.2L273 Q274L273-Q277 PolarHBondContact O-N 3.02Å; Q274-Q277 PolarHBondContact O-N 3.33Å
278R35.7Very low46.2Very low218 Ų218132 Ų13282%0.82363%0.625SS**  trans-112.545.1-176.2-155.6159.9-168.3153.42.4112.2Q274 Q275Q274-R278 VanDerWaalsContact O-CB 3.29Å; Q274-R278 WeakPolarHBondContact O-CB 3.39Å; Q274-R278 PolarHBondContact O-N 3.42Å; Q275-R278 PolarHBondContact O-N 3.46Å
279W28.4Very low46.3Very low186 Ų186133.5 Ų133.571%0.70563%0.625SS**SBendtrans-77.3132.8154.3-90.743.7000108.3R281W279-R281 VanDerWaalsContact C-N 3.34Å; W279-R281 PolarHBondContact O-N 2.81Å
280P38.8Very low47Very low91 Ų91130.8 Ų130.859%0.59162%0.62SS**  trans-7190.2-17529.1-32.6000109.8E282 S283P280-E282 PolarHBondContact O-N 3.34Å; P280-E282 VanDerWaalsContact O-N 3.16Å; P280-S283 PolarHBondContact O-N 2.95Å
281R40.5Very low48Very low207 Ų207131 Ų13178%0.78162%0.624SS**Hα-helixtrans-59.5-22.4176-167.4177.7-72.2-95.70.5112.5W279W279-R281 VanDerWaalsContact C-N 3.34Å; W279-R281 PolarHBondContact O-N 2.81Å
282E44.4Very low49Very low173 Ų173131.8 Ų131.881%0.80862%0.622SS**Hα-helixtrans-89.8-18.3-172.2-62.6-179.3171.300114.6P280P280-E282 PolarHBondContact O-N 3.34Å; P280-E282 VanDerWaalsContact O-N 3.16Å
283S46.3Very low50.7Low76 Ų76127 Ų12753%0.53161%0.613SS.*Hα-helixtrans-90.9-31.5-171.3-147.30000113.8P280P280-S283 PolarHBondContact O-N 2.95Å
284E47.2Very low52Low108 Ų108124.5 Ų124.551%0.50560%0.602SS.*Hα-helixtrans-83-31.5177-67.6-179.4178.700111.9A286 E287 F288E284-A286 VanDerWaalsContact C-N 3.3Å; E284-A286 PolarHBondContact O-N 3.17Å; E284-E287 PolarHBondContact O-N 3.32Å; E284-E287 VanDerWaalsContact O-N 3.11Å; E284-F288 HydrophobicContact CB-CD2 4.37Å; E284-F288 VanDerWaalsContact O-CD2 3.32Å; E284-F288 WeakPolarHBondContact O-CD2 3.49Å; E284-F288 PolarHBondContact O-N 2.76Å
285E49.2Very low53.2Low116 Ų116120.7 Ų120.754%0.54259%0.586SS.*Hα-helixtrans-62.5-38.7-178.6-135.2156.6-154.500111F288 Q289E285-F288 PolarHBondContact O-N 3.5Å; E285-Q289 WeakPolarHBondContact O-CB 3.34Å; E285-Q289 WeakPolarHBondContact O-CG 3.36Å; E285-Q289 PolarHBondContact O-N 3.34Å
286A53Low54.8Low72 Ų72120.1 Ų120.160%0.59558%0.584SS**Hα-helixtrans-66.2-35.6174.700000113.3E284E284-A286 VanDerWaalsContact C-N 3.3Å; E284-A286 PolarHBondContact O-N 3.17Å
287E56.1Low56.4Low138 Ų138116.4 Ų116.465%0.64557%0.573SS**Hα-helixtrans-73.5-38.6177.4-69.2-177.3175.300111.7E284 A290 V291E284-E287 PolarHBondContact O-N 3.32Å; E284-E287 VanDerWaalsContact O-N 3.11Å; E287-A290 PolarHBondContact O-N 3.27Å; E287-V291 WeakPolarHBondContact O-CG2 3.48Å
288F53.8Low58.2Low125 Ų125110.2 Ų110.255%0.54854%0.542SS..Hα-helixtrans-73.1-29176.3-84.6-78.9000113.7E284 E285 A290 V291 L292E284-F288 HydrophobicContact CB-CD2 4.37Å; E284-F288 VanDerWaalsContact O-CD2 3.32Å; E284-F288 WeakPolarHBondContact O-CD2 3.49Å; E284-F288 PolarHBondContact O-N 2.76Å; E285-F288 PolarHBondContact O-N 3.5Å; F288-A290 PolarHBondContact O-N 2.97Å; F288-V291 PolarHBondContact O-N 3.34Å; F288-L292 PolarHBondContact O-N 2.88Å
289Q63.3Low60Low126 Ų126103.5 Ų103.559%0.58953%0.528SS*.Hα-helixtrans-62.2-28.7175-75.8-71.9-20.800112.6E285 P293E285-Q289 WeakPolarHBondContact O-CB 3.34Å; E285-Q289 WeakPolarHBondContact O-CG 3.36Å; E285-Q289 PolarHBondContact O-N 3.34Å; Q289-P293 WeakPolarHBondContact O-CD 3.45Å
290A66.3Low62.4Low60 Ų60100.9 Ų100.950%0.49652%0.524SS..Hα-helixtrans-79.5-22.1174.100000113.3E287 F288 T294E287-A290 PolarHBondContact O-N 3.27Å; F288-A290 PolarHBondContact O-N 2.97Å; A290-T294 PolarHBondContact O-OG1 3.01Å
291V68.8Low64.3Low56 Ų56100.6 Ų100.634%0.33952%0.515SS..Hα-helixtrans-78.9-38.8-177.4176.40000111.7E287 F288 T294 L295E287-V291 WeakPolarHBondContact O-CG2 3.48Å; F288-V291 PolarHBondContact O-N 3.34Å; V291-T294 WeakPolarHBondContact O-CB 3.45Å; V291-T294 PolarHBondContact O-N 3.34Å; V291-L295 HydrophobicContact CG1-CD1 3.75Å; V291-L295 HydrophobicContact CG1-CG 3.96Å; V291-L295 WeakPolarHBondContact O-CG 3.47Å; V291-L295 PolarHBondContact O-N 3.03Å
292L73.3Confident65.9Low100 Ų10094.3 Ų94.352%0.52450%0.496SS..Hα-helixtrans-53-55.3177.2-96.5163000114.3F288 T294 L295 E296F288-L292 PolarHBondContact O-N 2.88Å; L292-T294 PolarHBondContact O-N 3.38Å; L292-L295 PolarHBondContact O-N 3.49Å; L292-E296 PolarHBondContact O-N 3.36Å
293P80.8Confident67.3Low67 Ų6791.4 Ų91.444%0.43548%0.482SS..Hα-helixtrans-64.5-31.2178.223.1-31.7000112.2Q289 E296 Q297Q289-P293 WeakPolarHBondContact O-CD 3.45Å; P293-E296 PolarHBondContact O-N 3.07Å; P293-Q297 WeakPolarHBondContact O-CB 3.3Å; P293-Q297 PolarHBondContact O-N 3.06Å
294T72.1Confident68.8Low55 Ų5593.6 Ų93.634%0.33749%0.486SS..Hα-helixtrans-66.8-41.2175-54.10000111.5A290 V291 L292 Q297 W298A290-T294 PolarHBondContact O-OG1 3.01Å; V291-T294 WeakPolarHBondContact O-CB 3.45Å; V291-T294 PolarHBondContact O-N 3.34Å; L292-T294 PolarHBondContact O-N 3.38Å; T294-Q297 PolarHBondContact O-N 3.27Å; T294-W298 HydrophobicContact CG2-CD2 4.32Å; T294-W298 HydrophobicContact CG2-CZ2 3.77Å; T294-W298 VanDerWaalsContact O-CD1 3.23Å; T294-W298 VanDerWaalsContact O-CG 3.23Å; T294-W298 PolarHBondContact O-N 3.46Å
295L70.5Confident70.2Confident65 Ų6590.5 Ų90.534%0.3447%0.473SS..Hα-helixtrans-68.6-38176-71.9175.2000112.2V291 L292 Q297 W298 S299V291-L295 HydrophobicContact CG1-CD1 3.75Å; V291-L295 HydrophobicContact CG1-CG 3.96Å; V291-L295 WeakPolarHBondContact O-CG 3.47Å; V291-L295 PolarHBondContact O-N 3.03Å; L292-L295 PolarHBondContact O-N 3.49Å; L295-Q297 VanDerWaalsContact C-N 3.35Å; L295-W298 HydrophobicContact CD2-CE3 3.91Å; L295-W298 HydrophobicContact CD2-CZ3 4.22Å; L295-W298 PolarHBondContact O-N 3.38Å; L295-S299 WeakPolarHBondContact O-CB 3.4Å; L295-S299 PolarHBondContact O-N 3.29Å
296E75.8Confident71.5Confident123 Ų12392 Ų9258%0.57547%0.473SS*.Hα-helixtrans-61.9-43.5172.2-75.1-179.5167.300111.4L292 P293 W298 S299 Q300L292-E296 PolarHBondContact O-N 3.36Å; P293-E296 PolarHBondContact O-N 3.07Å; E296-W298 PolarHBondContact O-N 2.88Å; E296-S299 WeakPolarHBondContact O-CB 3.41Å; E296-S299 PolarHBondContact O-N 2.89Å; E296-Q300 WeakPolarHBondContact O-CG 3.32Å; E296-Q300 PolarHBondContact O-N 3.36Å
297Q76.8Confident72.6Confident105 Ų10591.6 Ų91.649%0.49146%0.461SS..Hα-helixtrans-61.7-42.9175-173.7180-12.200111.7P293 T294 L295 Q300 Q301P293-Q297 WeakPolarHBondContact O-CB 3.3Å; P293-Q297 PolarHBondContact O-N 3.06Å; T294-Q297 PolarHBondContact O-N 3.27Å; L295-Q297 VanDerWaalsContact C-N 3.35Å; Q297-Q300 PolarHBondContact O-N 3.07Å; Q297-Q301 VanDerWaalsContact O-CG 3.3Å; Q297-Q301 WeakPolarHBondContact O-CG 3.3Å; Q297-Q301 PolarHBondContact O-N 3.28Å
298W82Confident73.6Confident48 Ų4889.6 Ų89.618%0.18245%0.454CS..Hα-helixtrans-66.4-37.9177.1-66.5-0.9000112.4R63 I67 T294 L295 E296 Q301 L302R63-W298 HydrophobicContact CB-CE3 4.39Å; R63-W298 HydrophobicContact CB-CH2 4.16Å; R63-W298 HydrophobicContact CB-CZ2 4.32Å; R63-W298 HydrophobicContact CB-CZ3 4.2Å; R63-W298 HydrophobicContact CG-CD2 4.48Å; R63-W298 HydrophobicContact CG-CH2 3.9Å; R63-W298 HydrophobicContact CG-CZ2 3.67Å; R63-W298 HydrophobicContact CG-CZ3 4.42Å; I67-W298 HydrophobicContact CD1-CE3 3.65Å; I67-W298 HydrophobicContact CD1-CZ3 4Å; I67-W298 HydrophobicContact CG1-CE3 3.89Å; I67-W298 HydrophobicContact CG1-CZ3 3.74Å; T294-W298 HydrophobicContact CG2-CD2 4.32Å; T294-W298 HydrophobicContact CG2-CZ2 3.77Å; T294-W298 VanDerWaalsContact O-CD1 3.23Å; T294-W298 VanDerWaalsContact O-CG 3.23Å; T294-W298 PolarHBondContact O-N 3.46Å; L295-W298 HydrophobicContact CD2-CE3 3.91Å; L295-W298 HydrophobicContact CD2-CZ3 4.22Å; L295-W298 PolarHBondContact O-N 3.38Å; E296-W298 PolarHBondContact O-N 2.88Å; W298-Q301 PolarHBondContact O-N 3.19Å; W298-L302 WeakPolarHBondContact O-CB 3.04Å; W298-L302 WeakPolarHBondContact O-CG 3.43Å; W298-L302 PolarHBondContact O-N 3.47Å
299S72.3Confident74.5Confident77 Ų7784.9 Ų84.954%0.53843%0.434SS..Hα-helixtrans-58.9-47173.3174.20000111.7L295 E296 Q301 L302 H303L295-S299 WeakPolarHBondContact O-CB 3.4Å; L295-S299 PolarHBondContact O-N 3.29Å; E296-S299 WeakPolarHBondContact O-CB 3.41Å; E296-S299 PolarHBondContact O-N 2.89Å; S299-Q301 PolarHBondContact O-N 3.05Å; S299-L302 PolarHBondContact O-N 3.46Å; S299-H303 PolarHBondContact O-N 3.48Å
300Q79.8Confident75Confident130 Ų13081.4 Ų81.461%0.60742%0.423SS*.Hα-helixtrans-61.5-43.3175.2-70.5175.40.600111.8E296 Q297 L302 H303 M304E296-Q300 WeakPolarHBondContact O-CG 3.32Å; E296-Q300 PolarHBondContact O-N 3.36Å; Q297-Q300 PolarHBondContact O-N 3.07Å; Q300-L302 PolarHBondContact O-N 3.32Å; Q300-H303 WeakPolarHBondContact O-CB 3.07Å; Q300-H303 PolarHBondContact O-N 2.98Å; Q300-M304 WeakPolarHBondContact O-CG 3.43Å; Q300-M304 PolarHBondContact O-N 3.01Å; Q300-M304 VanDerWaalsContact O-N 3.07Å
301Q77.9Confident75.5Confident85 Ų8587.1 Ų87.140%0.39743%0.432SS..Hα-helixtrans-62.5-40.1177.3-73179.2-34.100112.5Q297 W298 S299 H303 M304 L305Q297-Q301 VanDerWaalsContact O-CG 3.3Å; Q297-Q301 WeakPolarHBondContact O-CG 3.3Å; Q297-Q301 PolarHBondContact O-N 3.28Å; W298-Q301 PolarHBondContact O-N 3.19Å; S299-Q301 PolarHBondContact O-N 3.05Å; Q301-H303 VanDerWaalsContact C-N 3.32Å; Q301-H303 PolarHBondContact O-N 3.27Å; Q301-M304 PolarHBondContact O-N 2.89Å; Q301-L305 PolarHBondContact O-N 3.31Å; Q301-L305 VanDerWaalsContact O-N 3.11Å
302L74.6Confident75.7Confident75 Ų7585.8 Ų85.839%0.39342%0.423SS..Hα-helixtrans-64.7-35.5174.7-75.8168.2000112.3W298 S299 Q300 L305 R306W298-L302 WeakPolarHBondContact O-CB 3.04Å; W298-L302 WeakPolarHBondContact O-CG 3.43Å; W298-L302 PolarHBondContact O-N 3.47Å; S299-L302 PolarHBondContact O-N 3.46Å; Q300-L302 PolarHBondContact O-N 3.32Å; L302-L305 PolarHBondContact O-N 2.9Å; L302-R306 PolarHBondContact O-N 3.33Å
303H73.8Confident75.6Confident112 Ų11282.7 Ų82.752%0.51941%0.407SS..Hα-helixtrans-64.8-46.2174.5-167.873.7000111.7S299 Q300 Q301 L305 R306 D307S299-H303 PolarHBondContact O-N 3.48Å; Q300-H303 WeakPolarHBondContact O-CB 3.07Å; Q300-H303 PolarHBondContact O-N 2.98Å; Q301-H303 VanDerWaalsContact C-N 3.32Å; Q301-H303 PolarHBondContact O-N 3.27Å; H303-L305 VanDerWaalsContact C-N 3.25Å; H303-L305 PolarHBondContact O-N 3.37Å; H303-R306 WeakPolarHBondContact O-CB 3.37Å; H303-R306 PolarHBondContact O-N 3.48Å; H303-D307 IonicContact CD2-OD2 3.26Å; H303-D307 IonicContact NE2-OD2 2.9Å; H303-D307 PolarHBondContact O-N 2.96Å
304M78.3Confident75.4Confident122 Ų12286.1 Ų86.160%0.60142%0.415SS*.Hα-helixtrans-61.4-33177.4-64.1-65155.600112.8Q300 Q301 D307 L308Q300-M304 WeakPolarHBondContact O-CG 3.43Å; Q300-M304 PolarHBondContact O-N 3.01Å; Q300-M304 VanDerWaalsContact O-N 3.07Å; Q301-M304 PolarHBondContact O-N 2.89Å; M304-D307 PolarHBondContact O-N 2.85Å; M304-L308 PolarHBondContact O-N 3.48Å
305L75.1Confident75.3Confident44 Ų4487.8 Ų87.823%0.2342%0.422CS..Hα-helixtrans-67.5-36.7175.3-169.269.2000112.2Q301 L302 H303 L308 H309 V334 M337Q301-L305 PolarHBondContact O-N 3.31Å; Q301-L305 VanDerWaalsContact O-N 3.11Å; L302-L305 PolarHBondContact O-N 2.9Å; H303-L305 VanDerWaalsContact C-N 3.25Å; H303-L305 PolarHBondContact O-N 3.37Å; L305-L308 PolarHBondContact O-N 3.01Å; L305-H309 PolarHBondContact O-N 3.26Å; L305-V334 HydrophobicContact CD1-CG1 4.41Å; L305-V334 HydrophobicContact CD2-CG2 3.87Å; L305-M337 HydrophobicContact CD1-SD 4.43Å; L305-M337 HydrophobicContact CG-CE 4.29Å
306R76.5Confident75.1Confident147 Ų14784.9 Ų84.956%0.55541%0.407SS*.Hα-helixtrans-66.8-38.7172.9-72.6-170.8166.1-179.1-2.7112L302 H303 H309 S310 L332L302-R306 PolarHBondContact O-N 3.33Å; H303-R306 WeakPolarHBondContact O-CB 3.37Å; H303-R306 PolarHBondContact O-N 3.48Å; R306-H309 WeakPolarHBondContact O-CB 3.46Å; R306-H309 PolarHBondContact O-N 2.96Å; R306-S310 PolarHBondContact O-N 3.38Å; R306-L332 HydrophobicContact CG-CD1 3.77Å
307D76.6Confident74.7Confident63 Ų6382 Ų8234%0.33740%0.403SS..Hα-helixtrans-65.5-41.7175.7-72.5-20.1000111.9H303 M304 S310 R311H303-D307 IonicContact CD2-OD2 3.26Å; H303-D307 IonicContact NE2-OD2 2.9Å; H303-D307 PolarHBondContact O-N 2.96Å; M304-D307 PolarHBondContact O-N 2.85Å; D307-S310 PolarHBondContact O-N 2.85Å; D307-R311 VanDerWaalsContact O-CG 3.31Å; D307-R311 WeakPolarHBondContact O-CG 3.21Å; D307-R311 PolarHBondContact O-N 3.18Å
308L77.3Confident74.3Confident97 Ų9782.4 Ų82.451%0.50841%0.413SS..Hα-helixtrans-59.7-45.8174.3-17964.7000111.2M304 L305 S310 R311 L312M304-L308 PolarHBondContact O-N 3.48Å; L305-L308 PolarHBondContact O-N 3.01Å; L308-S310 PolarHBondContact O-N 3.44Å; L308-R311 PolarHBondContact O-N 3.29Å; L308-L312 WeakPolarHBondContact O-CB 3.47Å; L308-L312 PolarHBondContact O-N 3.09Å
309H72.6Confident73.2Confident25 Ų2585.3 Ų85.312%0.11643%0.432CS..Hα-helixtrans-57.7-47.7176.2-174.860.5000112.6L305 R306 R311 L312 N313 L332 M337L305-H309 PolarHBondContact O-N 3.26Å; R306-H309 WeakPolarHBondContact O-CB 3.46Å; R306-H309 PolarHBondContact O-N 2.96Å; H309-R311 VanDerWaalsContact C-N 3.31Å; H309-R311 PolarHBondContact O-N 2.91Å; H309-L312 PolarHBondContact O-N 3.49Å; H309-N313 PolarHBondContact CD2-ND2 3.35Å; H309-N313 PolarHBondContact CE1-ND2 3.34Å; H309-N313 VanDerWaalsContact CE1-ND2 3.33Å; H309-N313 PolarHBondContact NE2-ND2 3.49Å; H309-N313 PolarHBondContact O-N 3.33Å; H309-L332 HydrophobicContact CB-CD2 4.49Å; H309-L332 WeakPolarHBondContact CD2-CD2 3.32Å; H309-M337 HydrophobicContact CB-CE 3.44Å; H309-M337 VanDerWaalsContact CB-CE 3.44Å; H309-M337 HydrophobicContact CB-SD 3.72Å; H309-M337 WeakPolarHBondContact ND1-CG 3.36Å
310S73.7Confident72.5Confident53 Ų5385.2 Ų85.237%0.37142%0.424SS..Hα-helixtrans-59.9-42.1178-1790000111.9R306 D307 L308 K314R306-S310 PolarHBondContact O-N 3.38Å; D307-S310 PolarHBondContact O-N 2.85Å; L308-S310 PolarHBondContact O-N 3.44Å; S310-K314 VanDerWaalsContact O-CG 3.3Å; S310-K314 WeakPolarHBondContact O-CG 3.35Å; S310-K314 PolarHBondContact O-N 3.18Å; S310-K314 VanDerWaalsContact O-N 3.1Å
311R76.4Confident71.1Confident181 Ų18184.2 Ų84.268%0.68343%0.429SS*.Hα-helixtrans-67.7-39.7176.6-69.8171.7-176-92.42112.1D307 L308 H309 K314 L315D307-R311 VanDerWaalsContact O-CG 3.31Å; D307-R311 WeakPolarHBondContact O-CG 3.21Å; D307-R311 PolarHBondContact O-N 3.18Å; L308-R311 PolarHBondContact O-N 3.29Å; H309-R311 VanDerWaalsContact C-N 3.31Å; H309-R311 PolarHBondContact O-N 2.91Å; R311-K314 PolarHBondContact O-N 2.85Å; R311-L315 PolarHBondContact O-N 2.9Å
312L74.3Confident69.6Low27 Ų2788.5 Ų88.514%0.14145%0.453CS..Hα-helixtrans-66.4-41.5177.8-170.574000111.8L308 H309 L315 S316 M337 L340 V341 L344L308-L312 WeakPolarHBondContact O-CB 3.47Å; L308-L312 PolarHBondContact O-N 3.09Å; H309-L312 PolarHBondContact O-N 3.49Å; L312-L315 WeakPolarHBondContact O-CB 3.28Å; L312-L315 PolarHBondContact O-N 3.36Å; L312-S316 WeakPolarHBondContact O-CB 3.31Å; L312-S316 PolarHBondContact O-N 3.04Å; L312-M337 HydrophobicContact CD2-CB 4.29Å; L312-L340 HydrophobicContact CD2-CB 4.09Å; L312-L340 HydrophobicContact CD2-CD2 3.69Å; L312-L340 HydrophobicContact CD2-CG 4.11Å; L312-L340 HydrophobicContact CG-CD2 3.77Å; L312-L340 HydrophobicContact CG-CG 4.32Å; L312-V341 HydrophobicContact CD1-CG2 3.73Å; L312-V341 HydrophobicContact CD2-CG2 3.71Å; L312-V341 HydrophobicContact CG-CG2 4.38Å; L312-L344 HydrophobicContact CD1-CD1 4.22Å
313N69.9Low68.5Low36 Ų3690.9 Ų90.919%0.19346%0.462CS..Hα-helixtrans-64.4-39.8174.8-69.6-14.4000111.6H309 L315 S316 A317 L340H309-N313 PolarHBondContact CD2-ND2 3.35Å; H309-N313 PolarHBondContact CE1-ND2 3.34Å; H309-N313 VanDerWaalsContact CE1-ND2 3.33Å; H309-N313 PolarHBondContact NE2-ND2 3.49Å; H309-N313 PolarHBondContact O-N 3.33Å; N313-L315 VanDerWaalsContact C-N 3.35Å; N313-S316 PolarHBondContact O-N 2.93Å; N313-A317 WeakPolarHBondContact O-CB 3.45Å; N313-A317 PolarHBondContact O-N 2.69Å; N313-L340 VanDerWaalsContact OD1-CD2 3.22Å; N313-L340 WeakPolarHBondContact OD1-CD2 3.35Å
314K76.9Confident67.3Low138 Ų13891.4 Ų91.460%0.648%0.476SS*.Hα-helixtrans-61.5-43173-73.6172.2-176179.60111.8S310 R311 T318S310-K314 VanDerWaalsContact O-CG 3.3Å; S310-K314 WeakPolarHBondContact O-CG 3.35Å; S310-K314 PolarHBondContact O-N 3.18Å; S310-K314 VanDerWaalsContact O-N 3.1Å; R311-K314 PolarHBondContact O-N 2.85Å; K314-T318 WeakPolarHBondContact O-CB 3.39Å; K314-T318 PolarHBondContact O-N 3.07Å; K314-T318 VanDerWaalsContact O-N 3.1Å; K314-T318 PolarHBondContact O-OG1 3.41Å
315L70.7Confident65.7Low91 Ų9188.6 Ų88.648%0.47647%0.468SS..Hα-helixtrans-62.7-46.1176.2-167.193000111R311 L312 N313 T318 L319 L344R311-L315 PolarHBondContact O-N 2.9Å; L312-L315 WeakPolarHBondContact O-CB 3.28Å; L312-L315 PolarHBondContact O-N 3.36Å; N313-L315 VanDerWaalsContact C-N 3.35Å; L315-T318 PolarHBondContact O-N 2.73Å; L315-L319 HydrophobicContact CD2-CD1 3.93Å; L315-L319 HydrophobicContact CG-CD1 3.8Å; L315-L319 HydrophobicContact CG-CG 4.49Å; L315-L319 WeakPolarHBondContact O-CB 3.36Å; L315-L319 WeakPolarHBondContact O-CG 3.3Å; L315-L319 PolarHBondContact O-N 3.47Å; L315-L344 HydrophobicContact CD2-CD1 4.27Å
316S66.4Low64.5Low4 Ų493.9 Ų93.93%0.02850%0.496CS..Hα-helixtrans-60.7-47.1177.1171.70000112.4L312 N313 T318 L319 M320L312-S316 WeakPolarHBondContact O-CB 3.31Å; L312-S316 PolarHBondContact O-N 3.04Å; N313-S316 PolarHBondContact O-N 2.93Å; S316-T318 PolarHBondContact O-N 3.39Å; S316-L319 PolarHBondContact O-N 2.88Å; S316-M320 PolarHBondContact O-N 3.09Å
317A67.5Low63.1Low61 Ų6190.6 Ų90.650%0.50449%0.492SS..Hα-helixtrans-61.6-31.3176.700000112.7N313N313-A317 WeakPolarHBondContact O-CB 3.45Å; N313-A317 PolarHBondContact O-N 2.69Å
318T68.4Low61.9Low114 Ų11494 Ų9470%0.69951%0.51SS*.Hα-helixtrans-76.8-39177.7-51.60000111.8K314 L315 S316K314-T318 WeakPolarHBondContact O-CB 3.39Å; K314-T318 PolarHBondContact O-N 3.07Å; K314-T318 VanDerWaalsContact O-N 3.1Å; K314-T318 PolarHBondContact O-OG1 3.41Å; L315-T318 PolarHBondContact O-N 2.73Å; S316-T318 PolarHBondContact O-N 3.39Å
319L58.5Low60.6Low109 Ų10992.7 Ų92.757%0.57151%0.513SS*.Hα-helixtrans-83.9-25.9-177.4-67173.1000113L315 S316 L344L315-L319 HydrophobicContact CD2-CD1 3.93Å; L315-L319 HydrophobicContact CG-CD1 3.8Å; L315-L319 HydrophobicContact CG-CG 4.49Å; L315-L319 WeakPolarHBondContact O-CB 3.36Å; L315-L319 WeakPolarHBondContact O-CG 3.3Å; L315-L319 PolarHBondContact O-N 3.47Å; S316-L319 PolarHBondContact O-N 2.88Å; L319-L344 HydrophobicContact CB-CD2 4.44Å; L319-L344 HydrophobicContact CD1-CD2 4.28Å
320M56.5Low59.5Low76 Ų76100.8 Ų100.837%0.37455%0.548SS..  trans-140.783.3-174.7-67.2-122.8147.600112.9S316 L322 N347S316-M320 PolarHBondContact O-N 3.09Å; M320-L322 VanDerWaalsContact C-N 3.3Å; M320-L322 PolarHBondContact O-N 3.38Å; M320-N347 HydrophobicContact CE-CB 3.49Å; M320-N347 VanDerWaalsContact CE-CB 3.49Å; M320-N347 WeakPolarHBondContact CE-ND2 3.49Å; M320-N347 HydrophobicContact SD-CB 4.41Å; M320-N347 PolarHBondContact SD-ND2 2.91Å
321P52.2Low58.4Low109 Ų109103.1 Ų103.171%0.70856%0.561SS**THydrogen-bonded Turntrans-70.3-12.8-171-20.132.3000116.6
322L44.9Very low57.5Low174 Ų17497 Ų9791%0.91154%0.541SS*.THydrogen-bonded Turntrans-91.15.9-174-85.4116.2000114.8M320M320-L322 VanDerWaalsContact C-N 3.3Å; M320-L322 PolarHBondContact O-N 3.38Å
323Q52.9Low57Low125 Ų125101.8 Ų101.858%0.58456%0.561SS**  trans-99124.9176.9-110.4-166.8-13.800112C325Q323-C325 PolarHBondContact O-N 3.03Å; Q323-C325 VanDerWaalsContact O-N 3.17Å
324P46.8Very low56.5Low124 Ų124101.1 Ų101.181%0.80556%0.558SS**  trans-75102.1164.928.1-27.8000108.8D326P324-D326 PolarHBondContact O-N 3.17Å
325C44.9Very low55.7Low63 Ų6399.1 Ų99.143%0.42655%0.551SS.*  trans-88.882.6174.6-157.50000108.6Q323Q323-C325 PolarHBondContact O-N 3.03Å; Q323-C325 VanDerWaalsContact O-N 3.17Å
326D50.3Low55.5Low155 Ų15598.1 Ų98.183%0.82955%0.546SS*.  trans-114.285.3173.6-1477.2000108.3P324P324-D326 PolarHBondContact O-N 3.17Å
327V46.5Very low55.5Low78 Ų7898.6 Ų98.647%0.47355%0.548SS..  trans-115.1105.7172.1-1210000107.2A329V327-A329 PolarHBondContact O-N 3.28Å
328D51.7Low55.2Low133 Ų13398.5 Ų98.571%0.71154%0.538SS*.  trans-49.6125.6173.9-98.3-39.7000110.5K330 T331D328-K330 PolarHBondContact O-N 2.72Å; D328-T331 PolarHBondContact O-N 3.17Å
329A50.1Low55.2Low70 Ų7096.6 Ų96.658%0.57952%0.523SS*.THydrogen-bonded Turntrans-61.33.9-174.100000115.8V327V327-A329 PolarHBondContact O-N 3.28Å
330K49.9Very low55.7Low196 Ų19692.6 Ų92.685%0.85250%0.502SS*.THydrogen-bonded Turntrans-95.9-20.8-173.1-75.6177.1179.6170.60114.2D328D328-K330 PolarHBondContact O-N 2.72Å
331T50.6Low56.2Low102 Ų10291.9 Ų91.963%0.62650%0.502SS*.  trans-12367.7175.445.40000110.2D328 K333D328-T331 PolarHBondContact O-N 3.17Å; T331-K333 PolarHBondContact O-N 2.71Å
332L56.6Low56.9Low53 Ų5390.6 Ų90.628%0.27749%0.486SS..  trans-75.997174.7-69.8157.7000109R306 H309 M337R306-L332 HydrophobicContact CG-CD1 3.77Å; H309-L332 HydrophobicContact CB-CD2 4.49Å; H309-L332 WeakPolarHBondContact CD2-CD2 3.32Å; L332-M337 HydrophobicContact CD2-CE 4.14Å
333K64.6Low57.9Low126 Ų12684.1 Ų84.155%0.54846%0.458SS..  trans-93.4135.5167.9-69.8-173-179.1-177.40109T331 E335 D336T331-K333 PolarHBondContact O-N 2.71Å; K333-E335 WeakPolarHBondContact CB-OE2 3.5Å; K333-E335 PolarHBondContact O-N 3.1Å; K333-D336 WeakPolarHBondContact O-CB 3.27Å; K333-D336 PolarHBondContact O-N 3.2Å
334V58.8Low58.5Low23 Ų2379.6 Ų79.614%0.13944%0.437CS..Hα-helixtrans-74.6-19.2-177.7-1560000111.2L57 L305 D336 M337 M338L57-V334 HydrophobicContact CD1-CG1 4.27Å; L57-V334 HydrophobicContact CD2-CB 3.63Å; L57-V334 HydrophobicContact CD2-CG1 3.08Å; L57-V334 HydrophobicContact CD2-CG2 4.14Å; L57-V334 HydrophobicContact CG-CG1 4.28Å; L305-V334 HydrophobicContact CD1-CG1 4.41Å; L305-V334 HydrophobicContact CD2-CG2 3.87Å; V334-D336 PolarHBondContact O-N 2.89Å; V334-M337 HydrophobicContact CG1-CB 4.38Å; V334-M337 HydrophobicContact CG1-SD 4.36Å; V334-M337 PolarHBondContact O-N 3.36Å; V334-M338 PolarHBondContact O-N 3.27Å
335E61.7Low59.3Low96 Ų9678.8 Ų78.845%0.44943%0.426SS..Hα-helixtrans-57-36.4165-62.7100139.900112.5K333 M337 M338 L339K333-E335 WeakPolarHBondContact CB-OE2 3.5Å; K333-E335 PolarHBondContact O-N 3.1Å; E335-M337 VanDerWaalsContact C-N 3.35Å; E335-M338 PolarHBondContact O-N 3.33Å; E335-L339 WeakPolarHBondContact O-CB 3.37Å; E335-L339 VanDerWaalsContact O-CG 3.23Å; E335-L339 WeakPolarHBondContact O-CG 3.3Å; E335-L339 PolarHBondContact O-N 3.41Å
336D65.1Low60.2Low70 Ų7080 Ų8037%0.37443%0.425SS..Hα-helixtrans-70.5-33.9179.1-59.4-29.4000111.2K333 V334 L339 L340K333-D336 WeakPolarHBondContact O-CB 3.27Å; K333-D336 PolarHBondContact O-N 3.2Å; V334-D336 PolarHBondContact O-N 2.89Å; D336-L339 PolarHBondContact O-N 3.37Å; D336-L340 WeakPolarHBondContact O-CB 3.42Å; D336-L340 PolarHBondContact O-N 3.1Å
337M66.1Low60.4Low13 Ų1377.4 Ų77.46%0.06441%0.411CS..Hα-helixtrans-69.9-40.2173.2-56.5-170-157.600111.7L305 H309 L312 L332 V334 E335 L340 V341L305-M337 HydrophobicContact CD1-SD 4.43Å; L305-M337 HydrophobicContact CG-CE 4.29Å; H309-M337 HydrophobicContact CB-CE 3.44Å; H309-M337 VanDerWaalsContact CB-CE 3.44Å; H309-M337 HydrophobicContact CB-SD 3.72Å; H309-M337 WeakPolarHBondContact ND1-CG 3.36Å; L312-M337 HydrophobicContact CD2-CB 4.29Å; L332-M337 HydrophobicContact CD2-CE 4.14Å; V334-M337 HydrophobicContact CG1-CB 4.38Å; V334-M337 HydrophobicContact CG1-SD 4.36Å; V334-M337 PolarHBondContact O-N 3.36Å; E335-M337 VanDerWaalsContact C-N 3.35Å; M337-L340 PolarHBondContact O-N 2.89Å; M337-V341 WeakPolarHBondContact O-CG2 3.29Å; M337-V341 PolarHBondContact O-N 2.97Å
338M62.4Low60.8Low59 Ų5976.9 Ų76.929%0.29142%0.415SS..Hα-helixtrans-62.2-43.8173.2-83.2-169.46100111.6L57 V334 E335 L340 V341 E342L57-M338 HydrophobicContact CD1-CG 3.82Å; L57-M338 HydrophobicContact CD1-SD 3.29Å; L57-M338 WeakPolarHBondContact CD1-SD 3.39Å; V334-M338 PolarHBondContact O-N 3.27Å; E335-M338 PolarHBondContact O-N 3.33Å; M338-L340 VanDerWaalsContact C-N 3.3Å; M338-L340 PolarHBondContact O-N 3.23Å; M338-V341 PolarHBondContact O-N 3.34Å; M338-E342 VanDerWaalsContact O-CB 3.31Å; M338-E342 WeakPolarHBondContact O-CB 3.39Å; M338-E342 WeakPolarHBondContact O-CG 3.42Å; M338-E342 PolarHBondContact O-N 2.96Å
339L67.3Low60.7Low74 Ų7474.1 Ų74.139%0.38741%0.407SS..Hα-helixtrans-63.7-36.9176.7-72.9170.4000111.8E335 D336 E342 A343E335-L339 WeakPolarHBondContact O-CB 3.37Å; E335-L339 VanDerWaalsContact O-CG 3.23Å; E335-L339 WeakPolarHBondContact O-CG 3.3Å; E335-L339 PolarHBondContact O-N 3.41Å; D336-L339 PolarHBondContact O-N 3.37Å; L339-E342 PolarHBondContact O-N 2.85Å; L339-A343 WeakPolarHBondContact O-CB 3.43Å; L339-A343 PolarHBondContact O-N 3.26Å
340L69.2Low60.7Low26 Ų2676.5 Ų76.514%0.13642%0.419CS..Hα-helixtrans-66.7-43.5174.7-170.764.2000111.7L312 N313 D336 M337 M338 A343 L344L312-L340 HydrophobicContact CD2-CB 4.09Å; L312-L340 HydrophobicContact CD2-CD2 3.69Å; L312-L340 HydrophobicContact CD2-CG 4.11Å; L312-L340 HydrophobicContact CG-CD2 3.77Å; L312-L340 HydrophobicContact CG-CG 4.32Å; N313-L340 VanDerWaalsContact OD1-CD2 3.22Å; N313-L340 WeakPolarHBondContact OD1-CD2 3.35Å; D336-L340 WeakPolarHBondContact O-CB 3.42Å; D336-L340 PolarHBondContact O-N 3.1Å; M337-L340 PolarHBondContact O-N 2.89Å; M338-L340 VanDerWaalsContact C-N 3.3Å; M338-L340 PolarHBondContact O-N 3.23Å; L340-A343 PolarHBondContact O-N 3.4Å; L340-L344 HydrophobicContact CG-CD1 4.47Å; L340-L344 WeakPolarHBondContact O-CB 3.44Å; L340-L344 VanDerWaalsContact O-CG 3.22Å; L340-L344 WeakPolarHBondContact O-CG 3.12Å; L340-L344 PolarHBondContact O-N 3.47Å
341V67.3Low60.2Low61 Ų6173.8 Ų73.837%0.3741%0.414SS..Hα-helixtrans-64.4-44.1174.2173.40000111.1L312 M337 M338 L344 L345L312-V341 HydrophobicContact CD1-CG2 3.73Å; L312-V341 HydrophobicContact CD2-CG2 3.71Å; L312-V341 HydrophobicContact CG-CG2 4.38Å; M337-V341 WeakPolarHBondContact O-CG2 3.29Å; M337-V341 PolarHBondContact O-N 2.97Å; M338-V341 PolarHBondContact O-N 3.34Å; V341-L344 PolarHBondContact O-N 3.05Å; V341-L345 HydrophobicContact CG1-CD1 3.79Å; V341-L345 HydrophobicContact CG1-CG 4.38Å; V341-L345 WeakPolarHBondContact O-CB 3.41Å; V341-L345 WeakPolarHBondContact O-CG 3.47Å; V341-L345 PolarHBondContact O-N 3.02Å
342E66.6Low60.1Low82 Ų8276.6 Ų76.638%0.38343%0.425SS..Hα-helixtrans-63.2-41.9177.1-76.8178175.500111.3M338 L339 L345 E346M338-E342 VanDerWaalsContact O-CB 3.31Å; M338-E342 WeakPolarHBondContact O-CB 3.39Å; M338-E342 WeakPolarHBondContact O-CG 3.42Å; M338-E342 PolarHBondContact O-N 2.96Å; L339-E342 PolarHBondContact O-N 2.85Å; E342-L345 PolarHBondContact O-N 2.95Å; E342-E346 VanDerWaalsContact O-CB 3.25Å; E342-E346 WeakPolarHBondContact O-CB 3.25Å; E342-E346 PolarHBondContact O-N 3.33Å
343A66.6Low59.9Low38 Ų3882.6 Ų82.631%0.31445%0.449SS..Hα-helixtrans-65.5-40.4175.100000112.6L339 L340 L345 E346 N347L339-A343 WeakPolarHBondContact O-CB 3.43Å; L339-A343 PolarHBondContact O-N 3.26Å; L340-A343 PolarHBondContact O-N 3.4Å; A343-L345 VanDerWaalsContact C-N 3.31Å; A343-L345 PolarHBondContact O-N 3.47Å; A343-E346 PolarHBondContact O-N 2.93Å; A343-N347 WeakPolarHBondContact O-CB 3.28Å; A343-N347 VanDerWaalsContact O-CG 3.24Å; A343-N347 PolarHBondContact O-N 2.89Å; A343-N347 PolarHBondContact O-ND2 3.2Å
344L65Low58.8Low29 Ų2985.9 Ų85.915%0.15247%0.466CS..Hα-helixtrans-63.7-37.6173.7-73.1170.9000111.9L312 L315 L319 L340 V341 A348L312-L344 HydrophobicContact CD1-CD1 4.22Å; L315-L344 HydrophobicContact CD2-CD1 4.27Å; L319-L344 HydrophobicContact CB-CD2 4.44Å; L319-L344 HydrophobicContact CD1-CD2 4.28Å; L340-L344 HydrophobicContact CG-CD1 4.47Å; L340-L344 WeakPolarHBondContact O-CB 3.44Å; L340-L344 VanDerWaalsContact O-CG 3.22Å; L340-L344 WeakPolarHBondContact O-CG 3.12Å; L340-L344 PolarHBondContact O-N 3.47Å; V341-L344 PolarHBondContact O-N 3.05Å; L344-A348 WeakPolarHBondContact O-CB 3.44Å; L344-A348 PolarHBondContact O-N 3.45Å
345L63.9Low58.1Low107 Ų10793.4 Ų93.456%0.5650%0.502SS*.Hα-helixtrans-71.9-37.9176.9-72.9168.5000112.4V341 E342 A343 A348 S349V341-L345 HydrophobicContact CG1-CD1 3.79Å; V341-L345 HydrophobicContact CG1-CG 4.38Å; V341-L345 WeakPolarHBondContact O-CB 3.41Å; V341-L345 WeakPolarHBondContact O-CG 3.47Å; V341-L345 PolarHBondContact O-N 3.02Å; E342-L345 PolarHBondContact O-N 2.95Å; A343-L345 VanDerWaalsContact C-N 3.31Å; A343-L345 PolarHBondContact O-N 3.47Å; L345-A348 PolarHBondContact O-N 3.24Å; L345-S349 PolarHBondContact O-N 3.42Å; L345-S349 VanDerWaalsContact O-N 3.09Å
346E64Low57.6Low89 Ų8997.2 Ų97.242%0.41652%0.524SS..Hα-helixtrans-72.4-33.1-179.1-162.1159.9-146.300111.9E342 A343 A348 S349 R357E342-E346 VanDerWaalsContact O-CB 3.25Å; E342-E346 WeakPolarHBondContact O-CB 3.25Å; E342-E346 PolarHBondContact O-N 3.33Å; A343-E346 PolarHBondContact O-N 2.93Å; E346-A348 VanDerWaalsContact C-N 3.32Å; E346-S349 PolarHBondContact O-N 3.01Å; E346-S349 PolarHBondContact O-OG 3.38Å; E346-S349 VanDerWaalsContact O-OG 3.08Å; E346-R357 IonicContact OE1-CZ 3.13Å; E346-R357 IonicContact OE1-NH1 3.07Å; E346-R357 PolarHBondContact OE1-NH1 3.19Å; E346-R357 IonicContact OE1-NH2 2.68Å; E346-R357 PolarHBondContact OE1-NH2 3.28Å
347N54.8Low56.9Low100 Ų100102.4 Ų102.454%0.53554%0.539SS..Hα-helixtrans-73.6-21.6170.8-69.3-33.6000113.6M320 A343M320-N347 HydrophobicContact CE-CB 3.49Å; M320-N347 VanDerWaalsContact CE-CB 3.49Å; M320-N347 WeakPolarHBondContact CE-ND2 3.49Å; M320-N347 HydrophobicContact SD-CB 4.41Å; M320-N347 PolarHBondContact SD-ND2 2.91Å; A343-N347 WeakPolarHBondContact O-CB 3.28Å; A343-N347 VanDerWaalsContact O-CG 3.24Å; A343-N347 PolarHBondContact O-N 2.89Å; A343-N347 PolarHBondContact O-ND2 3.2Å
348A54.3Low56.2Low67 Ų67106.4 Ų106.455%0.55457%0.568SS**Hα-helixtrans-84.9-22.4174.600000112.6L344 L345 E346 S350L344-A348 WeakPolarHBondContact O-CB 3.44Å; L344-A348 PolarHBondContact O-N 3.45Å; L345-A348 PolarHBondContact O-N 3.24Å; E346-A348 VanDerWaalsContact C-N 3.32Å; A348-S350 PolarHBondContact O-N 3.04Å
349S49.1Very low56Low76 Ų76107.3 Ų107.353%0.53158%0.578SS.*SBendtrans-87.289.3173.564.80000110.7L345 E346 D351L345-S349 PolarHBondContact O-N 3.42Å; L345-S349 VanDerWaalsContact O-N 3.09Å; E346-S349 PolarHBondContact O-N 3.01Å; E346-S349 PolarHBondContact O-OG 3.38Å; E346-S349 VanDerWaalsContact O-OG 3.08Å; S349-D351 PolarHBondContact O-N 3.49Å
350S50.7Low55.8Low120 Ų120107.6 Ų107.684%0.83958%0.583SS**  trans-68.393.8169.566.50000110.1A348A348-S350 PolarHBondContact O-N 3.04Å
351D40.1Very low55.3Low139 Ų139115.9 Ų115.974%0.74361%0.612SS**  trans-140.275.1160.4-154.215.3000110.2S349 K353S349-D351 PolarHBondContact O-N 3.49Å; D351-K353 PolarHBondContact O-N 3.11Å
352D48.1Very low55.2Low160 Ų160121.7 Ų121.786%0.85663%0.629SS**  trans-67.578.3166.7-87.1-32.4000109.6
353K51.6Low55.4Low180 Ų180120.7 Ų120.778%0.78363%0.629SS**  trans-178.989.6156.1-96.2145.6-164.3-177.70111D351D351-K353 PolarHBondContact O-N 3.11Å
354Q42.4Very low55.8Low195 Ų195122.9 Ų122.991%0.91164%0.635SS**  -167.7121.4128.8-108.6166.519.200112
355M44Very low56Low180 Ų180124.2 Ų124.289%0.88765%0.65SS**  trans-62.5155173.6-70.316977.800111.9
356L50.8Low56.6Low176 Ų176122.3 Ų122.392%0.92165%0.646SS**  trans84.954176.3-50.4176.7000115.5
357R50.5Low57.3Low179 Ų179123.4 Ų123.468%0.67565%0.652SS**  trans-84.2131.1160-102.5176172.9-173.2-8.5109.5E346E346-R357 IonicContact OE1-CZ 3.13Å; E346-R357 IonicContact OE1-NH1 3.07Å; E346-R357 PolarHBondContact OE1-NH1 3.19Å; E346-R357 IonicContact OE1-NH2 2.68Å; E346-R357 PolarHBondContact OE1-NH2 3.28Å
358S52.1Low58.4Low97 Ų97120.9 Ų120.968%0.67864%0.64SS**  trans-39.1142.3158.538.30000109.8T360S358-T360 PolarHBondContact O-N 2.95Å
359P56.9Low59.6Low78 Ų78120 Ų12051%0.50663%0.633SS.*SBendtrans-48.5120.4179.414.2-25.6000108.3T363 L364P359-T363 HydrophobicContact CB-CG2 4.48Å; P359-L364 HydrophobicContact CB-CG 4.45Å; P359-L364 HydrophobicContact CG-CD2 4.44Å; P359-L364 HydrophobicContact CG-CG 4.49Å
360T64.4Low61.1Low80 Ų80122.1 Ų122.149%0.49163%0.634SS.*  trans-50.4145.3-172.1-31.20000108.3S358 Y362 T363 L364S358-T360 PolarHBondContact O-N 2.95Å; T360-Y362 CarbonylContact O-C 3.55Å; T360-Y362 PolarHBondContact O-N 3.06Å; T360-T363 WeakPolarHBondContact O-CA 3.29Å; T360-T363 WeakPolarHBondContact O-CB 3.31Å; T360-T363 PolarHBondContact O-N 2.91Å; T360-L364 PolarHBondContact O-N 3.44Å; T360-L364 VanDerWaalsContact O-N 3.13Å
361R58.6Low62.6Low200 Ų200121.3 Ų121.376%0.75562%0.616SS**Hα-helixtrans-49.6-30.8177.9-83.1-170.5173.6-174-0.8112.4L364 A365R361-L364 PolarHBondContact O-N 3.3Å; R361-A365 VanDerWaalsContact O-CB 3.28Å; R361-A365 WeakPolarHBondContact O-CB 3.46Å; R361-A365 PolarHBondContact O-N 2.94Å
362Y64.2Low64.5Low184 Ų184116.9 Ų116.972%0.72259%0.591SS**Hα-helixtrans-61-46.5170.9180-100.8000114.2T360 L364 A365 S366T360-Y362 CarbonylContact O-C 3.55Å; T360-Y362 PolarHBondContact O-N 3.06Å; Y362-L364 VanDerWaalsContact C-N 3.32Å; Y362-L364 PolarHBondContact O-N 2.91Å; Y362-A365 PolarHBondContact O-N 2.82Å; Y362-S366 WeakPolarHBondContact O-CB 3.23Å; Y362-S366 PolarHBondContact O-N 3.1Å
363T72Confident66.3Low61 Ų61117.3 Ų117.337%0.37459%0.585SS.*Hα-helixtrans-63.4-40.1176.6-43.80000111.1P359 T360 S366 M367P359-T363 HydrophobicContact CB-CG2 4.48Å; T360-T363 WeakPolarHBondContact O-CA 3.29Å; T360-T363 WeakPolarHBondContact O-CB 3.31Å; T360-T363 PolarHBondContact O-N 2.91Å; T363-S366 PolarHBondContact O-N 3.35Å; T363-M367 WeakPolarHBondContact O-CG 3.29Å; T363-M367 PolarHBondContact O-N 3.34Å
364L73.8Confident67.8Low84 Ų84114 Ų11444%0.4458%0.575SS.*Hα-helixtrans-66.1-42173.8-72.2169.8000111.9P359 T360 R361 Y362 S366 M367 V368P359-L364 HydrophobicContact CB-CG 4.45Å; P359-L364 HydrophobicContact CG-CD2 4.44Å; P359-L364 HydrophobicContact CG-CG 4.49Å; T360-L364 PolarHBondContact O-N 3.44Å; T360-L364 VanDerWaalsContact O-N 3.13Å; R361-L364 PolarHBondContact O-N 3.3Å; Y362-L364 VanDerWaalsContact C-N 3.32Å; Y362-L364 PolarHBondContact O-N 2.91Å; L364-S366 VanDerWaalsContact C-N 3.33Å; L364-S366 PolarHBondContact O-N 2.87Å; L364-M367 PolarHBondContact O-N 3.5Å; L364-V368 VanDerWaalsContact O-CG2 3.29Å; L364-V368 WeakPolarHBondContact O-CG2 3.41Å; L364-V368 PolarHBondContact O-N 2.84Å
365A70.6Confident69.6Low57 Ų57106.7 Ų106.747%0.47154%0.54SS..Hα-helixtrans-63.8-38.8175.400000111.9R361 Y362 V368 A369R361-A365 VanDerWaalsContact O-CB 3.28Å; R361-A365 WeakPolarHBondContact O-CB 3.46Å; R361-A365 PolarHBondContact O-N 2.94Å; Y362-A365 PolarHBondContact O-N 2.82Å; A365-V368 PolarHBondContact O-N 3.25Å; A365-A369 WeakPolarHBondContact O-CB 3.31Å; A365-A369 PolarHBondContact O-N 3.4Å
366S75.9Confident71.5Confident67 Ų67104.9 Ų104.947%0.46953%0.534SS..Hα-helixtrans-64.3-42.7174.4-1760000112Y362 T363 L364 A369 H370Y362-S366 WeakPolarHBondContact O-CB 3.23Å; Y362-S366 PolarHBondContact O-N 3.1Å; T363-S366 PolarHBondContact O-N 3.35Å; L364-S366 VanDerWaalsContact C-N 3.33Å; L364-S366 PolarHBondContact O-N 2.87Å; S366-A369 PolarHBondContact O-N 3.47Å; S366-H370 WeakPolarHBondContact O-CB 3.46Å; S366-H370 PolarHBondContact O-N 3.01Å
367M77.8Confident72.8Confident112 Ų11297.6 Ų97.655%0.55250%0.497SS*.Hα-helixtrans-61.3-44.7172.7-73.3176.5138.600111.9T363 L364 H370 F371T363-M367 WeakPolarHBondContact O-CG 3.29Å; T363-M367 PolarHBondContact O-N 3.34Å; L364-M367 PolarHBondContact O-N 3.5Å; M367-H370 WeakPolarHBondContact O-CB 3.48Å; M367-H370 PolarHBondContact O-N 2.89Å; M367-F371 WeakPolarHBondContact O-CD2 3.5Å; M367-F371 PolarHBondContact O-N 3.49Å
368V77.6Confident73.9Confident46 Ų4695.1 Ų95.128%0.27950%0.504SS..Hα-helixtrans-63.1-44.2177.3168.60000111.5L364 A365 H370 F371 Q372 L380L364-V368 VanDerWaalsContact O-CG2 3.29Å; L364-V368 WeakPolarHBondContact O-CG2 3.41Å; L364-V368 PolarHBondContact O-N 2.84Å; A365-V368 PolarHBondContact O-N 3.25Å; V368-H370 VanDerWaalsContact C-N 3.3Å; V368-H370 PolarHBondContact O-N 2.87Å; V368-F371 PolarHBondContact O-N 3.35Å; V368-Q372 WeakPolarHBondContact O-CG 3.33Å; V368-Q372 PolarHBondContact O-N 3.48Å; V368-Q372 PolarHBondContact O-OE1 2.85Å; V368-L380 HydrophobicContact CG1-CB 4.19Å; V368-L380 HydrophobicContact CG1-CD1 3.87Å; V368-L380 HydrophobicContact CG1-CD2 4.34Å; V368-L380 HydrophobicContact CG1-CG 4.35Å; V368-L380 HydrophobicContact CG2-CD1 4.26Å; V368-L380 HydrophobicContact CG2-CD2 4.42Å
369A79.6Confident75Confident49 Ų4992.8 Ų92.841%0.40549%0.488SS..Hα-helixtrans-62.3-37.4176.700000112.1A365 S366 Q372 K373A365-A369 WeakPolarHBondContact O-CB 3.31Å; A365-A369 PolarHBondContact O-N 3.4Å; S366-A369 PolarHBondContact O-N 3.47Å; A369-Q372 PolarHBondContact O-N 3.31Å; A369-K373 WeakPolarHBondContact O-CB 3.25Å; A369-K373 PolarHBondContact O-N 2.78Å
370H81.8Confident75.8Confident121 Ų12193.8 Ų93.856%0.5649%0.488SS*.Hα-helixtrans-62.7-43.8175.2-174.4-109.9000112S366 M367 V368 K373 L374S366-H370 WeakPolarHBondContact O-CB 3.46Å; S366-H370 PolarHBondContact O-N 3.01Å; M367-H370 WeakPolarHBondContact O-CB 3.48Å; M367-H370 PolarHBondContact O-N 2.89Å; V368-H370 VanDerWaalsContact C-N 3.3Å; V368-H370 PolarHBondContact O-N 2.87Å; H370-K373 PolarHBondContact O-N 3.48Å; H370-L374 WeakPolarHBondContact O-CB 3.18Å; H370-L374 PolarHBondContact O-N 2.82Å
371F80.9Confident76.1Confident103 Ų10394.4 Ų94.445%0.45250%0.496SS..Hα-helixtrans-68.3-37.1176-78.4-67.8000113.1M367 V368 K373 L374 F375 V383M367-F371 WeakPolarHBondContact O-CD2 3.5Å; M367-F371 PolarHBondContact O-N 3.49Å; V368-F371 PolarHBondContact O-N 3.35Å; F371-K373 VanDerWaalsContact C-N 3.3Å; F371-K373 PolarHBondContact O-N 3.25Å; F371-L374 HydrophobicContact CD1-CD2 4.38Å; F371-L374 PolarHBondContact O-N 2.91Å; F371-F375 HydrophobicContact CD1-CD2 4.48Å; F371-F375 HydrophobicContact CD1-CE2 4.07Å; F371-F375 WeakPolarHBondContact O-CD2 3.22Å; F371-F375 PolarHBondContact O-N 3.12Å; F371-F375 VanDerWaalsContact O-N 3.11Å; F371-V383 HydrophobicContact CB-CG1 4.39Å
372Q81.9Confident77Confident46 Ų4685.7 Ų85.722%0.21547%0.468CS..Hα-helixtrans-60.5-40.7173.2-76174.3-58.400111.9V368 A369 D376 V377 P378 S379 V383V368-Q372 WeakPolarHBondContact O-CG 3.33Å; V368-Q372 PolarHBondContact O-N 3.48Å; V368-Q372 PolarHBondContact O-OE1 2.85Å; A369-Q372 PolarHBondContact O-N 3.31Å; Q372-D376 WeakPolarHBondContact O-CA 3.48Å; Q372-D376 PolarHBondContact O-N 2.71Å; Q372-D376 VanDerWaalsContact O-N 3.09Å; Q372-V377 VanDerWaalsContact CB-O 3.25Å; Q372-V377 WeakPolarHBondContact CB-O 3.28Å; Q372-V377 PolarHBondContact O-N 3.45Å; Q372-P378 PolarHBondContact NE2-O 3.44Å; Q372-S379 VanDerWaalsContact NE2-CA 3.32Å; Q372-V383 HydrophobicContact CG-CG2 4.11Å
373K84.6Confident77.8Confident169 Ų16977.6 Ų77.674%0.73544%0.438SS*.Hα-helixtrans-72.2-38.6175.5-168.1175-177.4177.80113A369 H370 F371 F375 D376A369-K373 WeakPolarHBondContact O-CB 3.25Å; A369-K373 PolarHBondContact O-N 2.78Å; H370-K373 PolarHBondContact O-N 3.48Å; F371-K373 VanDerWaalsContact C-N 3.3Å; F371-K373 PolarHBondContact O-N 3.25Å; K373-F375 VanDerWaalsContact C-N 3.27Å; K373-F375 PolarHBondContact O-N 2.87Å; K373-D376 PolarHBondContact O-N 3.46Å
374L83.5Confident78.1Confident110 Ų11082.7 Ų82.758%0.57645%0.451SS*.Hα-helixtrans-62.8-35.9178.7-176.266.8000112.2H370 F371H370-L374 WeakPolarHBondContact O-CB 3.18Å; H370-L374 PolarHBondContact O-N 2.82Å; F371-L374 HydrophobicContact CD1-CD2 4.38Å; F371-L374 PolarHBondContact O-N 2.91Å
375F80.6Confident78.4Confident41 Ų4182.3 Ų82.318%0.1845%0.454CS..THydrogen-bonded Turntrans-100.83.6-178-71.2-71.9000113.9F371 K373 V377 V383 R386 M387 V390F371-F375 HydrophobicContact CD1-CD2 4.48Å; F371-F375 HydrophobicContact CD1-CE2 4.07Å; F371-F375 WeakPolarHBondContact O-CD2 3.22Å; F371-F375 PolarHBondContact O-N 3.12Å; F371-F375 VanDerWaalsContact O-N 3.11Å; K373-F375 VanDerWaalsContact C-N 3.27Å; K373-F375 PolarHBondContact O-N 2.87Å; F375-V377 HydrophobicContact CB-CG2 4.07Å; F375-V377 WeakPolarHBondContact O-CG2 3.48Å; F375-V377 PolarHBondContact O-N 2.82Å; F375-V383 HydrophobicContact CD2-CG1 3.86Å; F375-V383 HydrophobicContact CE2-CG1 4.26Å; F375-R386 HydrophobicContact CB-CB 4.42Å; F375-R386 HydrophobicContact CB-CG 4Å; F375-R386 HydrophobicContact CD1-CG 4.23Å; F375-R386 WeakPolarHBondContact O-CG 3.38Å; F375-M387 HydrophobicContact CE1-CB 4.34Å; F375-M387 HydrophobicContact CZ-CB 4.3Å; F375-M387 HydrophobicContact CZ-CG 4.31Å; F375-V390 HydrophobicContact CE1-CG2 4.5Å
376D83.1Confident79Confident142 Ų14284 Ų8476%0.75945%0.449SS*.THydrogen-bonded Turntrans51.348.6-175.3-69.2-38.4000113.6Q372 K373Q372-D376 WeakPolarHBondContact O-CA 3.48Å; Q372-D376 PolarHBondContact O-N 2.71Å; Q372-D376 VanDerWaalsContact O-N 3.09Å; K373-D376 PolarHBondContact O-N 3.46Å
377V79Confident79.4Confident23 Ų2383.2 Ų83.214%0.13944%0.438CS..  trans-124131.4-176.1-179.80000110.9Q372 F375 S379 R386Q372-V377 VanDerWaalsContact CB-O 3.25Å; Q372-V377 WeakPolarHBondContact CB-O 3.28Å; Q372-V377 PolarHBondContact O-N 3.45Å; F375-V377 HydrophobicContact CB-CG2 4.07Å; F375-V377 WeakPolarHBondContact O-CG2 3.48Å; F375-V377 PolarHBondContact O-N 2.82Å; V377-S379 VanDerWaalsContact C-N 3.33Å; V377-S379 WeakPolarHBondContact CG1-O 3.39Å; V377-S379 PolarHBondContact O-N 2.87Å; V377-R386 HydrophobicContact CG2-CB 3.69Å; V377-R386 HydrophobicContact CG2-CG 3.84Å
378P72.2Confident79.7Confident128 Ų12882.3 Ų82.383%0.83144%0.435SS*.SBendtrans-74.2-17.3-178.129.5-35.5000114.3Q372Q372-P378 PolarHBondContact NE2-O 3.44Å
379S76.4Confident80.1Confident47 Ų4783.4 Ų83.433%0.32944%0.437SS..SBendtrans-130.1147-177.371.90000113.5Q372 V377 S381 G382Q372-S379 VanDerWaalsContact NE2-CA 3.32Å; V377-S379 VanDerWaalsContact C-N 3.33Å; V377-S379 WeakPolarHBondContact CG1-O 3.39Å; V377-S379 PolarHBondContact O-N 2.87Å; S379-S381 PolarHBondContact O-N 3.4Å; S379-S381 PolarHBondContact OG-OG 3.49Å; S379-G382 PolarHBondContact O-N 2.84Å; S379-G382 PolarHBondContact OG-N 3.38Å
380L74.1Confident80.4Confident99 Ų9984.3 Ų84.352%0.51844%0.438SS..Hα-helixtrans-58.1-33.7174-177.961.6000112.4V368 G382 V383V368-L380 HydrophobicContact CG1-CB 4.19Å; V368-L380 HydrophobicContact CG1-CD1 3.87Å; V368-L380 HydrophobicContact CG1-CD2 4.34Å; V368-L380 HydrophobicContact CG1-CG 4.35Å; V368-L380 HydrophobicContact CG2-CD1 4.26Å; V368-L380 HydrophobicContact CG2-CD2 4.42Å; L380-G382 PolarHBondContact O-N 2.85Å; L380-V383 HydrophobicContact CD1-CG2 4.42Å; L380-V383 WeakPolarHBondContact O-CB 3.37Å; L380-V383 PolarHBondContact O-N 3.31Å
381S70.8Confident80.6Confident94 Ų9485.8 Ų85.866%0.65744%0.439SS*.Hα-helixtrans-64.7-26.7176.857.30000113.4S379 P385S379-S381 PolarHBondContact O-N 3.4Å; S379-S381 PolarHBondContact OG-OG 3.49Å; S381-P385 WeakPolarHBondContact O-CD 3.26Å; S381-P385 WeakPolarHBondContact O-CG 3.48Å
382G76.4Confident80.8Confident17 Ų1784.7 Ų84.718%0.17544%0.441CS..Hα-helixtrans-86-13.1177.600000113.6S379 L380 P385 R386S379-G382 PolarHBondContact O-N 2.84Å; S379-G382 PolarHBondContact OG-N 3.38Å; L380-G382 PolarHBondContact O-N 2.85Å; G382-P385 WeakPolarHBondContact O-CD 3.34Å; G382-R386 VanDerWaalsContact O-CB 3.23Å; G382-R386 WeakPolarHBondContact O-CB 3.16Å; G382-R386 PolarHBondContact O-N 2.98Å
383V81.8Confident81Confident13 Ų1389.7 Ų89.78%0.07946%0.458CS..Hα-helixtrans-63.3-44.6178176.70000110.6F371 Q372 F375 L380 R386 M387F371-V383 HydrophobicContact CB-CG1 4.39Å; Q372-V383 HydrophobicContact CG-CG2 4.11Å; F375-V383 HydrophobicContact CD2-CG1 3.86Å; F375-V383 HydrophobicContact CE2-CG1 4.26Å; L380-V383 HydrophobicContact CD1-CG2 4.42Å; L380-V383 WeakPolarHBondContact O-CB 3.37Å; L380-V383 PolarHBondContact O-N 3.31Å; V383-R386 PolarHBondContact O-N 3.46Å; V383-M387 WeakPolarHBondContact O-CB 3.26Å; V383-M387 PolarHBondContact O-N 3.35Å
384Y77.2Confident81.3Confident168 Ų16885.9 Ų85.966%0.65945%0.445SS*.Hα-helixtrans-63.6-50.5177.9-101.1-82.9000113.5R386 M387 N388Y384-R386 VanDerWaalsContact C-N 3.32Å; Y384-R386 PolarHBondContact O-N 3.21Å; Y384-M387 HydrophobicContact CD1-CE 3.75Å; Y384-M387 HydrophobicContact CE1-CE 3.8Å; Y384-M387 HydrophobicContact CG-CE 4.44Å; Y384-M387 PolarHBondContact O-N 3.35Å; Y384-N388 PolarHBondContact O-N 2.98Å
385P81.5Confident81.4Confident77 Ų7782.5 Ų82.550%0.544%0.438SS..Hα-helixtrans-55.2-45.3172.4-27.933.9000112.9S381 G382 N388 E389S381-P385 WeakPolarHBondContact O-CD 3.26Å; S381-P385 WeakPolarHBondContact O-CG 3.48Å; G382-P385 WeakPolarHBondContact O-CD 3.34Å; P385-N388 PolarHBondContact O-N 3.45Å; P385-E389 WeakPolarHBondContact O-CB 3.48Å; P385-E389 PolarHBondContact O-N 2.85Å
386R83.1Confident81.8Confident93 Ų9386 Ų8635%0.35145%0.454SS..Hα-helixtrans-67.6-38.6-179.1-170.357.3170.6170.52.4112.2F375 V377 G382 V383 Y384 E389 V390F375-R386 HydrophobicContact CB-CB 4.42Å; F375-R386 HydrophobicContact CB-CG 4Å; F375-R386 HydrophobicContact CD1-CG 4.23Å; F375-R386 WeakPolarHBondContact O-CG 3.38Å; V377-R386 HydrophobicContact CG2-CB 3.69Å; V377-R386 HydrophobicContact CG2-CG 3.84Å; G382-R386 VanDerWaalsContact O-CB 3.23Å; G382-R386 WeakPolarHBondContact O-CB 3.16Å; G382-R386 PolarHBondContact O-N 2.98Å; V383-R386 PolarHBondContact O-N 3.46Å; Y384-R386 VanDerWaalsContact C-N 3.32Å; Y384-R386 PolarHBondContact O-N 3.21Å; R386-E389 WeakPolarHBondContact CD-OE2 3.48Å; R386-E389 IonicContact CZ-OE2 3.3Å; R386-E389 IonicContact NH1-OE1 3.77Å; R386-E389 PolarHBondContact NH1-OE1 3.01Å; R386-E389 IonicContact NH1-OE2 3.92Å; R386-E389 PolarHBondContact NH1-OE2 2.88Å; R386-E389 WeakPolarHBondContact O-CB 3.26Å; R386-E389 PolarHBondContact O-N 3.44Å; R386-V390 WeakPolarHBondContact O-CG2 3.44Å; R386-V390 PolarHBondContact O-N 2.88Å
387M83Confident81.9Confident49 Ų4984.4 Ų84.424%0.24144%0.443CS..Hα-helixtrans-62.9-45.6173.7-177.5179.46700111.4F375 V383 Y384 E389 V390 Y391F375-M387 HydrophobicContact CE1-CB 4.34Å; F375-M387 HydrophobicContact CZ-CB 4.3Å; F375-M387 HydrophobicContact CZ-CG 4.31Å; V383-M387 WeakPolarHBondContact O-CB 3.26Å; V383-M387 PolarHBondContact O-N 3.35Å; Y384-M387 HydrophobicContact CD1-CE 3.75Å; Y384-M387 HydrophobicContact CE1-CE 3.8Å; Y384-M387 HydrophobicContact CG-CE 4.44Å; Y384-M387 PolarHBondContact O-N 3.35Å; M387-E389 VanDerWaalsContact C-N 3.31Å; M387-E389 PolarHBondContact O-N 3.35Å; M387-V390 PolarHBondContact O-N 3.41Å; M387-Y391 HydrophobicContact CG-CD2 3.91Å; M387-Y391 HydrophobicContact CG-CE2 3.55Å; M387-Y391 WeakPolarHBondContact O-CD2 3.2Å; M387-Y391 PolarHBondContact O-N 3.44Å; M387-Y391 HydrophobicContact SD-CE2 4.14Å
388N85.4Confident82.2Confident94 Ų9486.4 Ų86.450%0.50346%0.456SS..Hα-helixtrans-61.9-39.5174.5-82.7-1.9000111.9Y384 P385 V390 Y391 T392Y384-N388 PolarHBondContact O-N 2.98Å; P385-N388 PolarHBondContact O-N 3.45Å; N388-V390 VanDerWaalsContact C-N 3.33Å; N388-V390 PolarHBondContact O-N 2.98Å; N388-Y391 PolarHBondContact O-N 3.39Å; N388-T392 WeakPolarHBondContact O-CB 3.32Å; N388-T392 PolarHBondContact O-N 2.96Å; N388-T392 PolarHBondContact O-OG1 3.11Å
389E85.5Confident82.9Confident68 Ų6884 Ų8432%0.31844%0.436SS..Hα-helixtrans-61.2-41.7174.9-168.2-170.9164.400111.7P385 R386 M387 T392 R393P385-E389 WeakPolarHBondContact O-CB 3.48Å; P385-E389 PolarHBondContact O-N 2.85Å; R386-E389 WeakPolarHBondContact CD-OE2 3.48Å; R386-E389 IonicContact CZ-OE2 3.3Å; R386-E389 IonicContact NH1-OE1 3.77Å; R386-E389 PolarHBondContact NH1-OE1 3.01Å; R386-E389 IonicContact NH1-OE2 3.92Å; R386-E389 PolarHBondContact NH1-OE2 2.88Å; R386-E389 WeakPolarHBondContact O-CB 3.26Å; R386-E389 PolarHBondContact O-N 3.44Å; M387-E389 VanDerWaalsContact C-N 3.31Å; M387-E389 PolarHBondContact O-N 3.35Å; E389-T392 PolarHBondContact O-N 3.22Å; E389-R393 HydrophobicContact CG-CG 4.46Å; E389-R393 WeakPolarHBondContact O-CB 3.27Å; E389-R393 VanDerWaalsContact O-CG 3.31Å; E389-R393 WeakPolarHBondContact O-CG 3.22Å; E389-R393 PolarHBondContact O-N 3.05Å; E389-R393 IonicContact OE1-CZ 3.24Å; E389-R393 VanDerWaalsContact OE1-CZ 3.28Å; E389-R393 IonicContact OE1-NE 2.64Å; E389-R393 PolarHBondContact OE1-NE 3.26Å; E389-R393 IonicContact OE1-NH2 3.28Å; E389-R393 PolarHBondContact OE1-NH2 2.91Å
390V86.5Confident83.4Confident69 Ų6985.2 Ų85.242%0.41844%0.442SS..Hα-helixtrans-61.9-44.2174.5171.40000111F375 R386 M387 N388 R393 L394F375-V390 HydrophobicContact CE1-CG2 4.5Å; R386-V390 WeakPolarHBondContact O-CG2 3.44Å; R386-V390 PolarHBondContact O-N 2.88Å; M387-V390 PolarHBondContact O-N 3.41Å; N388-V390 VanDerWaalsContact C-N 3.33Å; N388-V390 PolarHBondContact O-N 2.98Å; V390-R393 PolarHBondContact O-N 3.34Å; V390-L394 VanDerWaalsContact O-CB 3.22Å; V390-L394 WeakPolarHBondContact O-CB 3.36Å; V390-L394 PolarHBondContact O-N 3.19Å
391Y84.2Confident83.8Confident151 Ų15182 Ų8259%0.59242%0.424SS*.Hα-helixtrans-63.4-43.3176.2-78.6-65.6000112.5M387 N388 L394 G395M387-Y391 HydrophobicContact CG-CD2 3.91Å; M387-Y391 HydrophobicContact CG-CE2 3.55Å; M387-Y391 WeakPolarHBondContact O-CD2 3.2Å; M387-Y391 PolarHBondContact O-N 3.44Å; M387-Y391 HydrophobicContact SD-CE2 4.14Å; N388-Y391 PolarHBondContact O-N 3.39Å; Y391-L394 PolarHBondContact O-N 2.83Å; Y391-G395 PolarHBondContact O-N 2.84Å
392T86.6Confident84.4Confident80 Ų8083.2 Ų83.249%0.49142%0.415SS..Hα-helixtrans-62.8-49.8176.8-59.30000110.7N388 E389 L394 G395 E396N388-T392 WeakPolarHBondContact O-CB 3.32Å; N388-T392 PolarHBondContact O-N 2.96Å; N388-T392 PolarHBondContact O-OG1 3.11Å; E389-T392 PolarHBondContact O-N 3.22Å; T392-L394 VanDerWaalsContact C-N 3.33Å; T392-L394 PolarHBondContact O-N 3.23Å; T392-G395 CarbonylContact O-C 3.59Å; T392-G395 WeakPolarHBondContact O-CA 3.35Å; T392-G395 PolarHBondContact O-N 3.24Å; T392-G395 VanDerWaalsContact O-N 3.12Å; T392-E396 HydrophobicContact CG2-CG 4.47Å; T392-E396 WeakPolarHBondContact CG2-OE1 3.48Å; T392-E396 WeakPolarHBondContact O-CG 3.47Å; T392-E396 PolarHBondContact O-N 2.93Å
393R86.6Confident84.8Confident152 Ų15286 Ų8657%0.57443%0.426SS*.Hα-helixtrans-62.3-38.4178-73.8-173-173.5-133.44.6112.6E389 V390 G395 E396 M397E389-R393 HydrophobicContact CG-CG 4.46Å; E389-R393 WeakPolarHBondContact O-CB 3.27Å; E389-R393 VanDerWaalsContact O-CG 3.31Å; E389-R393 WeakPolarHBondContact O-CG 3.22Å; E389-R393 PolarHBondContact O-N 3.05Å; E389-R393 IonicContact OE1-CZ 3.24Å; E389-R393 VanDerWaalsContact OE1-CZ 3.28Å; E389-R393 IonicContact OE1-NE 2.64Å; E389-R393 PolarHBondContact OE1-NE 3.26Å; E389-R393 IonicContact OE1-NH2 3.28Å; E389-R393 PolarHBondContact OE1-NH2 2.91Å; V390-R393 PolarHBondContact O-N 3.34Å; R393-G395 VanDerWaalsContact C-N 3.34Å; R393-E396 PolarHBondContact O-N 3.33Å; R393-M397 VanDerWaalsContact O-CB 3.27Å; R393-M397 WeakPolarHBondContact O-CB 3.37Å; R393-M397 PolarHBondContact O-N 3.33Å
394L89.7Confident85Confident88 Ų8888.9 Ų88.946%0.46144%0.44SS..Hα-helixtrans-65.9-39.8175-176.863.4000111.1V390 Y391 T392 M397 T398V390-L394 VanDerWaalsContact O-CB 3.22Å; V390-L394 WeakPolarHBondContact O-CB 3.36Å; V390-L394 PolarHBondContact O-N 3.19Å; Y391-L394 PolarHBondContact O-N 2.83Å; T392-L394 VanDerWaalsContact C-N 3.33Å; T392-L394 PolarHBondContact O-N 3.23Å; L394-M397 HydrophobicContact CD1-CE 3.85Å; L394-M397 PolarHBondContact O-N 2.97Å; L394-T398 WeakPolarHBondContact O-CB 3.46Å; L394-T398 PolarHBondContact O-N 3.21Å; L394-T398 PolarHBondContact O-OG1 2.93Å
395G85.9Confident85.3Confident40 Ų4081.8 Ų81.841%0.41241%0.413SS..Hα-helixtrans-62.6-46.7173.400000112.4Y391 T392 R393 T398 N399Y391-G395 PolarHBondContact O-N 2.84Å; T392-G395 CarbonylContact O-C 3.59Å; T392-G395 WeakPolarHBondContact O-CA 3.35Å; T392-G395 PolarHBondContact O-N 3.24Å; T392-G395 VanDerWaalsContact O-N 3.12Å; R393-G395 VanDerWaalsContact C-N 3.34Å; G395-T398 PolarHBondContact O-N 3.38Å; G395-N399 VanDerWaalsContact O-CB 3.32Å; G395-N399 WeakPolarHBondContact O-CB 3.48Å; G395-N399 PolarHBondContact O-N 2.96Å
396E89.1Confident85.3Confident113 Ų11383.1 Ų83.153%0.52842%0.416SS..Hα-helixtrans-60.4-45.5174.2-72.1171-177.600111.6T392 R393 T398 N399 T400T392-E396 HydrophobicContact CG2-CG 4.47Å; T392-E396 WeakPolarHBondContact CG2-OE1 3.48Å; T392-E396 WeakPolarHBondContact O-CG 3.47Å; T392-E396 PolarHBondContact O-N 2.93Å; R393-E396 PolarHBondContact O-N 3.33Å; E396-T398 PolarHBondContact O-N 3.06Å; E396-N399 PolarHBondContact O-N 3.38Å; E396-T400 WeakPolarHBondContact O-CB 3.42Å; E396-T400 VanDerWaalsContact O-CG2 3.29Å; E396-T400 WeakPolarHBondContact O-CG2 3.49Å; E396-T400 PolarHBondContact O-N 3.4Å; E396-T400 PolarHBondContact O-OG1 3.28Å
397M85.5Confident85.3Confident109 Ų10984.3 Ų84.354%0.53743%0.433SS..Hα-helixtrans-64.1-41.3177.7-170.6174.868.800111.6R393 L394 N399 T400 M401R393-M397 VanDerWaalsContact O-CB 3.27Å; R393-M397 WeakPolarHBondContact O-CB 3.37Å; R393-M397 PolarHBondContact O-N 3.33Å; L394-M397 HydrophobicContact CD1-CE 3.85Å; L394-M397 PolarHBondContact O-N 2.97Å; M397-N399 VanDerWaalsContact C-N 3.32Å; M397-N399 PolarHBondContact O-N 3.49Å; M397-T400 VanDerWaalsContact CA-OG1 3.23Å; M397-T400 WeakPolarHBondContact CA-OG1 3.36Å; M397-T400 PolarHBondContact O-OG1 3.09Å; M397-M401 WeakPolarHBondContact O-CB 3.23Å; M397-M401 PolarHBondContact O-N 2.88Å
398T84.9Confident85.2Confident66 Ų6683.6 Ų83.641%0.40543%0.43SS..Hα-helixtrans-66.1-38.3176.3-54.40000111L394 G395 E396 R402L394-T398 WeakPolarHBondContact O-CB 3.46Å; L394-T398 PolarHBondContact O-N 3.21Å; L394-T398 PolarHBondContact O-OG1 2.93Å; G395-T398 PolarHBondContact O-N 3.38Å; E396-T398 PolarHBondContact O-N 3.06Å; T398-R402 WeakPolarHBondContact O-CB 3.21Å; T398-R402 PolarHBondContact O-N 2.86Å
399N87.3Confident85.1Confident77 Ų7786.4 Ų86.441%0.41245%0.445SS..Hα-helixtrans-71.1-43.6178.3-165.551.2000112.4G395 E396 M397 M401 R402 N403G395-N399 VanDerWaalsContact O-CB 3.32Å; G395-N399 WeakPolarHBondContact O-CB 3.48Å; G395-N399 PolarHBondContact O-N 2.96Å; E396-N399 PolarHBondContact O-N 3.38Å; M397-N399 VanDerWaalsContact C-N 3.32Å; M397-N399 PolarHBondContact O-N 3.49Å; N399-M401 VanDerWaalsContact C-N 3.35Å; N399-R402 PolarHBondContact O-N 2.88Å; N399-N403 WeakPolarHBondContact O-CB 3.43Å; N399-N403 PolarHBondContact O-N 3.15Å; N399-N403 PolarHBondContact O-ND2 2.87Å
400T86.8Confident84.9Confident72 Ų7285.6 Ų85.644%0.44244%0.442SS..Hα-helixtrans-62.6-42.5174.448.80000111E396 M397 R402 N403 L404E396-T400 WeakPolarHBondContact O-CB 3.42Å; E396-T400 VanDerWaalsContact O-CG2 3.29Å; E396-T400 WeakPolarHBondContact O-CG2 3.49Å; E396-T400 PolarHBondContact O-N 3.4Å; E396-T400 PolarHBondContact O-OG1 3.28Å; M397-T400 VanDerWaalsContact CA-OG1 3.23Å; M397-T400 WeakPolarHBondContact CA-OG1 3.36Å; M397-T400 PolarHBondContact O-OG1 3.09Å; T400-R402 PolarHBondContact O-N 2.67Å; T400-N403 PolarHBondContact O-N 3.36Å; T400-L404 WeakPolarHBondContact O-CB 3.32Å; T400-L404 VanDerWaalsContact O-CG 3.31Å; T400-L404 WeakPolarHBondContact O-CG 3.38Å; T400-L404 PolarHBondContact O-N 3.37Å
401M83.1Confident84.6Confident31 Ų3187.2 Ų87.215%0.15345%0.449CS..Hα-helixtrans-60.1-45.3174.6-167.460.658.500111.7M397 N399 N403 L404 Q405 P416 V419 V420M397-M401 WeakPolarHBondContact O-CB 3.23Å; M397-M401 PolarHBondContact O-N 2.88Å; N399-M401 VanDerWaalsContact C-N 3.35Å; M401-N403 PolarHBondContact O-N 3.05Å; M401-L404 PolarHBondContact O-N 3.35Å; M401-Q405 WeakPolarHBondContact O-CB 2.95Å; M401-Q405 VanDerWaalsContact O-CG 3.26Å; M401-Q405 WeakPolarHBondContact O-CG 3.41Å; M401-Q405 PolarHBondContact O-N 3.42Å; M401-P416 HydrophobicContact CE-CB 3.89Å; M401-P416 HydrophobicContact SD-CB 4.2Å; M401-V419 HydrophobicContact SD-CB 3.51Å; M401-V419 VanDerWaalsContact SD-CB 3.51Å; M401-V419 HydrophobicContact SD-CG1 3.57Å; M401-V419 VanDerWaalsContact SD-CG1 3.57Å; M401-V419 HydrophobicContact SD-CG2 3.75Å; M401-V420 HydrophobicContact CE-CG2 4.39Å
402R82.8Confident84.2Confident121 Ų12184.6 Ų84.646%0.45745%0.453SS..Hα-helixtrans-62.8-41.5175.4-171.7-175.9-62.1109.61.6112.3T398 N399 T400 Q405 N406T398-R402 WeakPolarHBondContact O-CB 3.21Å; T398-R402 PolarHBondContact O-N 2.86Å; N399-R402 PolarHBondContact O-N 2.88Å; T400-R402 PolarHBondContact O-N 2.67Å; R402-Q405 WeakPolarHBondContact O-CB 3.39Å; R402-Q405 PolarHBondContact O-N 3.21Å; R402-N406 PolarHBondContact O-N 2.87Å; R402-N406 PolarHBondContact O-ND2 3.11Å
403N84.9Confident83.7Confident76 Ų7689.3 Ų89.341%0.40647%0.466SS..Hα-helixtrans-64.7-43176.9-72-15.1000111.4N399 T400 M401 N406 V407N399-N403 WeakPolarHBondContact O-CB 3.43Å; N399-N403 PolarHBondContact O-N 3.15Å; N399-N403 PolarHBondContact O-ND2 2.87Å; T400-N403 PolarHBondContact O-N 3.36Å; M401-N403 PolarHBondContact O-N 3.05Å; N403-N406 PolarHBondContact O-N 3.25Å; N403-V407 WeakPolarHBondContact O-CB 3.43Å; N403-V407 VanDerWaalsContact O-CG2 3.28Å; N403-V407 WeakPolarHBondContact O-CG2 3.47Å; N403-V407 PolarHBondContact O-N 3.45Å
404L84.6Confident83.4Confident72 Ų7282.9 Ų82.938%0.37745%0.446SS..Hα-helixtrans-64.1-40.5175-71.1172.4000111.4T400 M401 N406 V407 L408 V419 V423T400-L404 WeakPolarHBondContact O-CB 3.32Å; T400-L404 VanDerWaalsContact O-CG 3.31Å; T400-L404 WeakPolarHBondContact O-CG 3.38Å; T400-L404 PolarHBondContact O-N 3.37Å; M401-L404 PolarHBondContact O-N 3.35Å; L404-N406 PolarHBondContact O-N 3.44Å; L404-V407 PolarHBondContact O-N 3.1Å; L404-L408 VanDerWaalsContact O-CB 3.25Å; L404-L408 WeakPolarHBondContact O-CB 3.35Å; L404-L408 WeakPolarHBondContact O-CD1 3.45Å; L404-L408 WeakPolarHBondContact O-CG 3.45Å; L404-L408 PolarHBondContact O-N 3.34Å; L404-V419 HydrophobicContact CB-CG1 3.73Å; L404-V419 HydrophobicContact CD1-CG1 4.5Å; L404-V423 HydrophobicContact CD2-CG2 4.39Å
405Q84Confident83.2Confident20 Ų2080.8 Ų80.89%0.09344%0.439CS..Hα-helixtrans-58.4-47172.8-74.9169.1-1000111.7M401 R402 L408 D409 L410 A414 V419M401-Q405 WeakPolarHBondContact O-CB 2.95Å; M401-Q405 VanDerWaalsContact O-CG 3.26Å; M401-Q405 WeakPolarHBondContact O-CG 3.41Å; M401-Q405 PolarHBondContact O-N 3.42Å; R402-Q405 WeakPolarHBondContact O-CB 3.39Å; R402-Q405 PolarHBondContact O-N 3.21Å; Q405-L408 CarbonylContact O-C 3.58Å; Q405-L408 PolarHBondContact O-N 3.46Å; Q405-D409 PolarHBondContact O-N 3.02Å; Q405-L410 HydrophobicContact CB-CB 4.48Å; Q405-L410 PolarHBondContact O-N 3.15Å; Q405-A414 PolarHBondContact NE2-O 3.05Å; Q405-V419 HydrophobicContact CG-CG1 4.46Å; Q405-V419 HydrophobicContact CG-CG2 3.43Å; Q405-V419 VanDerWaalsContact CG-CG2 3.43Å
406N82.2Confident82.9Confident104 Ų10482.7 Ų82.756%0.55644%0.444SS*.Hα-helixtrans-63.2-41.3177.6-68.6-20000112.5R402 N403 L404 L408 D409R402-N406 PolarHBondContact O-N 2.87Å; R402-N406 PolarHBondContact O-ND2 3.11Å; N403-N406 PolarHBondContact O-N 3.25Å; L404-N406 PolarHBondContact O-N 3.44Å; N406-L408 VanDerWaalsContact C-N 3.32Å; N406-D409 PolarHBondContact O-N 3.36Å
407V82.9Confident82.6Confident118 Ų11881.8 Ų81.872%0.71545%0.446SS*.Hα-helixtrans-70.6-30.7179.9169.50000111.8N403 L404N403-V407 WeakPolarHBondContact O-CB 3.43Å; N403-V407 VanDerWaalsContact O-CG2 3.28Å; N403-V407 WeakPolarHBondContact O-CG2 3.47Å; N403-V407 PolarHBondContact O-N 3.45Å; L404-V407 PolarHBondContact O-N 3.1Å
408L81.9Confident82.5Confident35 Ų3581.8 Ų81.818%0.18345%0.445CS..THydrogen-bonded Turntrans-92.94.5179.8-61.6171.7000113.2L404 Q405 N406 L410 V419 Q422 V423 L426L404-L408 VanDerWaalsContact O-CB 3.25Å; L404-L408 WeakPolarHBondContact O-CB 3.35Å; L404-L408 WeakPolarHBondContact O-CD1 3.45Å; L404-L408 WeakPolarHBondContact O-CG 3.45Å; L404-L408 PolarHBondContact O-N 3.34Å; Q405-L408 CarbonylContact O-C 3.58Å; Q405-L408 PolarHBondContact O-N 3.46Å; N406-L408 VanDerWaalsContact C-N 3.32Å; L408-L410 HydrophobicContact CB-CD1 3.9Å; L408-L410 HydrophobicContact CB-CG 3.83Å; L408-L410 HydrophobicContact CD1-CD1 4.08Å; L408-L410 PolarHBondContact O-N 3.45Å; L408-V419 HydrophobicContact CD1-CG1 4.13Å; L408-Q422 HydrophobicContact CD1-CB 4.35Å; L408-Q422 HydrophobicContact CD1-CG 4.32Å; L408-Q422 HydrophobicContact CD2-CG 4.49Å; L408-V423 HydrophobicContact CD1-CG2 3.64Å; L408-L426 HydrophobicContact CD2-CD1 3.21Å
409D82.5Confident82.5Confident153 Ų15378.6 Ų78.682%0.81843%0.425SS*.THydrogen-bonded Turntrans4838.2-174.1-72.9-34.6000113.5Q405 N406Q405-D409 PolarHBondContact O-N 3.02Å; N406-D409 PolarHBondContact O-N 3.36Å
410L81.4Confident82.4Confident50 Ų5078.8 Ų78.826%0.26243%0.429SS..  trans-85.9147.7176-63.1173.3000110.2Q405 L408 S412 A414 V419 Q422Q405-L410 HydrophobicContact CB-CB 4.48Å; Q405-L410 PolarHBondContact O-N 3.15Å; L408-L410 HydrophobicContact CB-CD1 3.9Å; L408-L410 HydrophobicContact CB-CG 3.83Å; L408-L410 HydrophobicContact CD1-CD1 4.08Å; L408-L410 PolarHBondContact O-N 3.45Å; L410-S412 PolarHBondContact O-N 2.78Å; L410-A414 HydrophobicContact CB-CB 4.21Å; L410-V419 HydrophobicContact CD1-CB 4.32Å; L410-V419 HydrophobicContact CD1-CG1 4.48Å; L410-V419 HydrophobicContact CD1-CG2 3.93Å; L410-Q422 HydrophobicContact CD1-CB 4.35Å
411D79.9Confident82.3Confident104 Ų10479.2 Ų79.256%0.55643%0.429SS*.  trans-58.3142.1175.4-175.913.4000110.3K413 A414D411-K413 PolarHBondContact O-N 2.93Å; D411-A414 WeakPolarHBondContact O-CB 3.43Å; D411-A414 PolarHBondContact O-N 3.37Å
412S75.1Confident82.1Confident96 Ų9680.8 Ų80.867%0.67144%0.435SS*.THydrogen-bonded Turntrans-54.4-13.9174.9620000114.7L410L410-S412 PolarHBondContact O-N 2.78Å
413K77.3Confident82.1Confident178 Ų17877.3 Ų77.377%0.77443%0.428SS*.THydrogen-bonded Turntrans-96.6-0.9175.2-62.9-176.3-179.8177.40114.3D411D411-K413 PolarHBondContact O-N 2.93Å
414A79.8Confident81.9Confident18 Ų1876.8 Ų76.815%0.14943%0.43CS..  trans-60.6136.8178.600000110.8Q405 L410 D411 V419Q405-A414 PolarHBondContact NE2-O 3.05Å; L410-A414 HydrophobicContact CB-CB 4.21Å; D411-A414 WeakPolarHBondContact O-CB 3.43Å; D411-A414 PolarHBondContact O-N 3.37Å; A414-V419 HydrophobicContact CB-CG2 4.36Å
415S84.6Confident81.6Confident44 Ų4479.1 Ų79.131%0.30843%0.434SS..  trans-70151178.966.40000111.1T417 E418 V419S415-T417 PolarHBondContact O-N 3.36Å; S415-T417 VanDerWaalsContact O-N 3.1Å; S415-E418 PolarHBondContact N-OE2 2.9Å; S415-E418 PolarHBondContact O-N 3.31Å; S415-E418 VanDerWaalsContact O-N 3.09Å; S415-E418 VanDerWaalsContact OG-CD 3.24Å; S415-E418 VanDerWaalsContact OG-CG 3.26Å; S415-E418 WeakPolarHBondContact OG-CG 3.33Å; S415-E418 PolarHBondContact OG-N 3.22Å; S415-E418 PolarHBondContact OG-OE2 2.87Å; S415-V419 PolarHBondContact O-N 3.43Å
416P81.1Confident81.1Confident80 Ų8082.4 Ų82.452%0.51945%0.451SS..Hα-helixtrans-53.3-32.3175.5-29.236.6000113.8M401 V420M401-P416 HydrophobicContact CE-CB 3.89Å; M401-P416 HydrophobicContact SD-CB 4.2Å; P416-V420 VanDerWaalsContact O-CG2 3.29Å; P416-V420 WeakPolarHBondContact O-CG2 3.49Å; P416-V420 PolarHBondContact O-N 3Å
417T83.3Confident80.6Confident94 Ų9482.1 Ų82.158%0.57745%0.454SS*.Hα-helixtrans-68.4-42.8178.4-43.60000111.9S415 V419 V420 D421S415-T417 PolarHBondContact O-N 3.36Å; S415-T417 VanDerWaalsContact O-N 3.1Å; T417-V419 VanDerWaalsContact C-N 3.33Å; T417-V419 PolarHBondContact O-N 3.41Å; T417-V420 PolarHBondContact O-N 3.11Å; T417-D421 WeakPolarHBondContact O-CB 3.34Å; T417-D421 PolarHBondContact O-N 3Å
418E83.4Confident79.9Confident108 Ų10880.8 Ų80.851%0.50545%0.449SS..Hα-helixtrans-64.6-37.8178.4-73.9162.615300112.4S415 Q422S415-E418 PolarHBondContact N-OE2 2.9Å; S415-E418 PolarHBondContact O-N 3.31Å; S415-E418 VanDerWaalsContact O-N 3.09Å; S415-E418 VanDerWaalsContact OG-CD 3.24Å; S415-E418 VanDerWaalsContact OG-CG 3.26Å; S415-E418 WeakPolarHBondContact OG-CG 3.33Å; S415-E418 PolarHBondContact OG-N 3.22Å; S415-E418 PolarHBondContact OG-OE2 2.87Å; E418-Q422 WeakPolarHBondContact O-CB 3.48Å; E418-Q422 PolarHBondContact O-N 3.33Å
419V84.6Confident78.9Confident0 Ų085.8 Ų85.80%048%0.475CS..Hα-helixtrans-64-47.9176-178.70000110.2M401 L404 Q405 L408 L410 A414 S415 T417 D421 Q422 V423M401-V419 HydrophobicContact SD-CB 3.51Å; M401-V419 VanDerWaalsContact SD-CB 3.51Å; M401-V419 HydrophobicContact SD-CG1 3.57Å; M401-V419 VanDerWaalsContact SD-CG1 3.57Å; M401-V419 HydrophobicContact SD-CG2 3.75Å; L404-V419 HydrophobicContact CB-CG1 3.73Å; L404-V419 HydrophobicContact CD1-CG1 4.5Å; Q405-V419 HydrophobicContact CG-CG1 4.46Å; Q405-V419 HydrophobicContact CG-CG2 3.43Å; Q405-V419 VanDerWaalsContact CG-CG2 3.43Å; L408-V419 HydrophobicContact CD1-CG1 4.13Å; L410-V419 HydrophobicContact CD1-CB 4.32Å; L410-V419 HydrophobicContact CD1-CG1 4.48Å; L410-V419 HydrophobicContact CD1-CG2 3.93Å; A414-V419 HydrophobicContact CB-CG2 4.36Å; S415-V419 PolarHBondContact O-N 3.43Å; T417-V419 VanDerWaalsContact C-N 3.33Å; T417-V419 PolarHBondContact O-N 3.41Å; V419-D421 PolarHBondContact O-N 3.23Å; V419-Q422 PolarHBondContact O-N 3.18Å; V419-V423 WeakPolarHBondContact O-CG2 3.44Å; V419-V423 PolarHBondContact O-N 3.22Å
420V84.8Confident77.4Confident81 Ų8183.1 Ų83.149%0.49146%0.461SS..Hα-helixtrans-64.1-40.5179.21720000111.4M401 P416 T417 Q422 V423 S424M401-V420 HydrophobicContact CE-CG2 4.39Å; P416-V420 VanDerWaalsContact O-CG2 3.29Å; P416-V420 WeakPolarHBondContact O-CG2 3.49Å; P416-V420 PolarHBondContact O-N 3Å; T417-V420 PolarHBondContact O-N 3.11Å; V420-Q422 VanDerWaalsContact C-N 3.33Å; V420-Q422 PolarHBondContact O-N 2.84Å; V420-V423 PolarHBondContact O-N 2.93Å; V420-S424 WeakPolarHBondContact O-CB 3.39Å; V420-S424 PolarHBondContact O-N 3.5Å
421D83.7Confident76.1Confident81 Ų8185.7 Ų85.743%0.43348%0.481SS..Hα-helixtrans-64.4-37.4176.2-86.54.1000112.1T417 V419 S424 R425T417-D421 WeakPolarHBondContact O-CB 3.34Å; T417-D421 PolarHBondContact O-N 3Å; V419-D421 PolarHBondContact O-N 3.23Å; D421-S424 PolarHBondContact O-N 2.94Å; D421-R425 WeakPolarHBondContact O-CG 3.43Å; D421-R425 PolarHBondContact O-N 3.41Å
422Q79.8Confident74.9Confident63 Ų6383 Ų8329%0.29448%0.478SS..Hα-helixtrans-69.3-41.4175.6-168.972.9-12.600111.7L408 L410 E418 V419 V420 S424 R425 L426L408-Q422 HydrophobicContact CD1-CB 4.35Å; L408-Q422 HydrophobicContact CD1-CG 4.32Å; L408-Q422 HydrophobicContact CD2-CG 4.49Å; L410-Q422 HydrophobicContact CD1-CB 4.35Å; E418-Q422 WeakPolarHBondContact O-CB 3.48Å; E418-Q422 PolarHBondContact O-N 3.33Å; V419-Q422 PolarHBondContact O-N 3.18Å; V420-Q422 VanDerWaalsContact C-N 3.33Å; V420-Q422 PolarHBondContact O-N 2.84Å; Q422-S424 VanDerWaalsContact C-N 3.33Å; Q422-R425 PolarHBondContact O-N 3.4Å; Q422-L426 WeakPolarHBondContact O-CG 3.36Å; Q422-L426 PolarHBondContact O-N 3.33Å
423V81.8Confident73.8Confident48 Ų4886 Ų8629%0.29149%0.486SS..Hα-helixtrans-60.4-44.4171.6173.90000110.6L404 L408 V419 V420 R425 L426 V427L404-V423 HydrophobicContact CD2-CG2 4.39Å; L408-V423 HydrophobicContact CD1-CG2 3.64Å; V419-V423 WeakPolarHBondContact O-CG2 3.44Å; V419-V423 PolarHBondContact O-N 3.22Å; V420-V423 PolarHBondContact O-N 2.93Å; V423-R425 VanDerWaalsContact C-N 3.32Å; V423-R425 PolarHBondContact O-N 2.83Å; V423-L426 PolarHBondContact O-N 3.31Å; V423-V427 HydrophobicContact CG1-CG2 4.13Å; V423-V427 WeakPolarHBondContact O-CB 3.5Å; V423-V427 WeakPolarHBondContact O-CG2 3.38Å; V423-V427 PolarHBondContact O-N 3.5Å
424S80.9Confident72.6Confident65 Ų6581.1 Ų81.146%0.45549%0.486SS..Hα-helixtrans-61.7-40178.4-174.60000111.9V420 D421 Q422 V427 S428V420-S424 WeakPolarHBondContact O-CB 3.39Å; V420-S424 PolarHBondContact O-N 3.5Å; D421-S424 PolarHBondContact O-N 2.94Å; Q422-S424 VanDerWaalsContact C-N 3.33Å; S424-V427 PolarHBondContact O-N 3.32Å; S424-S428 VanDerWaalsContact O-CB 3.3Å; S424-S428 WeakPolarHBondContact O-CB 3.5Å; S424-S428 PolarHBondContact O-N 2.96Å; S424-S428 PolarHBondContact O-OG 3.46Å
425R79.5Confident71.3Confident121 Ų12191.1 Ų91.146%0.45752%0.519SS..Hα-helixtrans-62.6-44172.7-77.1-173.5-71-88.64.5112.4D421 Q422 V423 S428 L429D421-R425 WeakPolarHBondContact O-CG 3.43Å; D421-R425 PolarHBondContact O-N 3.41Å; Q422-R425 PolarHBondContact O-N 3.4Å; V423-R425 VanDerWaalsContact C-N 3.32Å; V423-R425 PolarHBondContact O-N 2.83Å; R425-S428 PolarHBondContact O-N 2.91Å; R425-L429 WeakPolarHBondContact O-CB 3.32Å; R425-L429 WeakPolarHBondContact O-CD1 3.41Å; R425-L429 VanDerWaalsContact O-CG 3.23Å; R425-L429 WeakPolarHBondContact O-CG 3.48Å; R425-L429 PolarHBondContact O-N 2.82Å
426L73.4Confident69.9Low89 Ų8991.7 Ų91.747%0.46653%0.527SS..Hα-helixtrans-65.1-42.8177.6-72.5171.5000112.4L408 Q422 V423 S428 L429 D430L408-L426 HydrophobicContact CD2-CD1 3.21Å; Q422-L426 WeakPolarHBondContact O-CG 3.36Å; Q422-L426 PolarHBondContact O-N 3.33Å; V423-L426 PolarHBondContact O-N 3.31Å; L426-S428 PolarHBondContact O-N 2.98Å; L426-L429 PolarHBondContact O-N 3.25Å; L426-D430 PolarHBondContact O-N 3.49Å
427V70.4Confident69Low99 Ų9993.4 Ų93.460%0.653%0.531SS*.Hα-helixtrans-65-31175.7174.30000111.1V423 S424V423-V427 HydrophobicContact CG1-CG2 4.13Å; V423-V427 WeakPolarHBondContact O-CB 3.5Å; V423-V427 WeakPolarHBondContact O-CG2 3.38Å; V423-V427 PolarHBondContact O-N 3.5Å; S424-V427 PolarHBondContact O-N 3.32Å
428S67.8Low68.2Low90 Ų9094.9 Ų94.963%0.62954%0.535SS*.Hα-helixtrans-79.4-23.9176.1-57.30000113.5S424 R425 L426S424-S428 VanDerWaalsContact O-CB 3.3Å; S424-S428 WeakPolarHBondContact O-CB 3.5Å; S424-S428 PolarHBondContact O-N 2.96Å; S424-S428 PolarHBondContact O-OG 3.46Å; R425-S428 PolarHBondContact O-N 2.91Å; L426-S428 PolarHBondContact O-N 2.98Å
429L62.5Low67.2Low139 Ų13994.8 Ų94.873%0.72854%0.538SS*.Hα-helixtrans-81.3-25.4179.8-79.1162.5000113R425 L426R425-L429 WeakPolarHBondContact O-CB 3.32Å; R425-L429 WeakPolarHBondContact O-CD1 3.41Å; R425-L429 VanDerWaalsContact O-CG 3.23Å; R425-L429 WeakPolarHBondContact O-CG 3.48Å; R425-L429 PolarHBondContact O-N 2.82Å; L426-L429 PolarHBondContact O-N 3.25Å
430D51.5Low66.5Low98 Ų9897.3 Ų97.352%0.52456%0.555SS.*  trans-134.891.8175.6-160.9-3.9000111.7L426 G432L426-D430 PolarHBondContact O-N 3.49Å; D430-G432 PolarHBondContact O-N 3.23Å; D430-G432 VanDerWaalsContact O-N 3.09Å; D430-G432 PolarHBondContact OD1-N 3.42Å
431P53.3Low65.9Low104 Ų10497.8 Ų97.868%0.67555%0.554SS**G310 helixtrans-66.2-7.2175.4-1326.9000113.1L433 G434P431-L433 VanDerWaalsContact C-N 3.34Å; P431-L433 PolarHBondContact O-N 3.36Å; P431-G434 PolarHBondContact O-N 2.82Å
432G54.3Low65.2Low47 Ų4797.4 Ų97.449%0.48555%0.551SS.*G310 helixtrans-70.5-21.8-171.500000115.2D430 G434D430-G432 PolarHBondContact O-N 3.23Å; D430-G432 VanDerWaalsContact O-N 3.09Å; D430-G432 PolarHBondContact OD1-N 3.42Å; G432-G434 VanDerWaalsContact C-N 3.29Å; G432-G434 PolarHBondContact O-N 3.04Å
433L52.2Low65Low160 Ų16098.6 Ų98.684%0.83856%0.559SS**G310 helixtrans-77.5-12177.7-88.5155.9000113.8P431P431-L433 VanDerWaalsContact C-N 3.34Å; P431-L433 PolarHBondContact O-N 3.36Å
434G51.5Low64.6Low75 Ų75102.6 Ų102.677%0.77357%0.572SS**G310 helixtrans-98.1-0.9177.700000115.3P431 G432P431-G434 PolarHBondContact O-N 2.82Å; G432-G434 VanDerWaalsContact C-N 3.29Å; G432-G434 PolarHBondContact O-N 3.04Å
435R52.8Low64.3Low227 Ų227103.2 Ų103.286%0.85757%0.573SS**  trans-120.65.3-174-109.3-175.6-175.4-171.32.1115.3D437R435-D437 PolarHBondContact O-N 2.93Å
436A55.7Low64Low56 Ų56103.6 Ų103.646%0.46358%0.578SS.*SBendtrans-70.4100.4162.500000107I438 I441A436-I438 PolarHBondContact O-N 2.95Å; A436-I441 HydrophobicContact CB-CD1 4.21Å; A436-I441 HydrophobicContact CB-CG1 4.31Å
437D61.4Low64Low116 Ų116104.8 Ų104.862%0.6258%0.581SS**  trans-45.8130.8173.2-98-30.8000108.5R435 D439 S440 I441R435-D437 PolarHBondContact O-N 2.93Å; D437-D439 HydrophobicContact CB-CB 4.44Å; D437-D439 PolarHBondContact O-N 3.48Å; D437-D439 VanDerWaalsContact O-N 3.07Å; D437-S440 WeakPolarHBondContact O-CA 3.49Å; D437-S440 WeakPolarHBondContact O-CB 3.48Å; D437-S440 PolarHBondContact O-N 3.29Å; D437-I441 PolarHBondContact O-N 2.87Å
438I66.9Low64Low126 Ų126104.9 Ų104.965%0.64658%0.575SS**Hα-helixtrans-52.7-33.3174.4-64.1173.6000109A436 I441 I442A436-I438 PolarHBondContact O-N 2.95Å; I438-I441 PolarHBondContact O-N 3.34Å; I438-I442 HydrophobicContact CG2-CD1 3.73Å; I438-I442 HydrophobicContact CG2-CG1 4.26Å; I438-I442 WeakPolarHBondContact O-CB 3.28Å; I438-I442 WeakPolarHBondContact O-CG1 3.41Å; I438-I442 PolarHBondContact O-N 3.38Å
439D63.6Low64.2Low106 Ų106105.8 Ų105.857%0.56757%0.573SS**Hα-helixtrans-63.9-38172.1-67.5-36.7000113.6D437 I441 I442 I443D437-D439 HydrophobicContact CB-CB 4.44Å; D437-D439 PolarHBondContact O-N 3.48Å; D437-D439 VanDerWaalsContact O-N 3.07Å; D439-I441 VanDerWaalsContact C-N 3.32Å; D439-I441 PolarHBondContact O-N 2.83Å; D439-I442 PolarHBondContact O-N 3.5Å; D439-I443 VanDerWaalsContact O-CB 3.31Å; D439-I443 WeakPolarHBondContact O-CB 3.34Å; D439-I443 WeakPolarHBondContact O-CD1 3.15Å; D439-I443 WeakPolarHBondContact O-CG1 3.48Å; D439-I443 PolarHBondContact O-N 2.76Å
440S69.4Low64.8Low52 Ų52106.7 Ų106.736%0.36457%0.573SS.*Hα-helixtrans-66.9-34.2172.6-178.50000112.1D437 K444D437-S440 WeakPolarHBondContact O-CA 3.49Å; D437-S440 WeakPolarHBondContact O-CB 3.48Å; D437-S440 PolarHBondContact O-N 3.29Å; S440-K444 WeakPolarHBondContact O-CG 3.21Å; S440-K444 PolarHBondContact O-N 3.45Å; S440-K444 VanDerWaalsContact O-N 3.08Å
441I70.8Confident66.1Low91 Ų91107.6 Ų107.647%0.46757%0.573SS.*Hα-helixtrans-70.4-45.1174.6-61.6174.2000109.6A436 D437 I438 D439 I443 K444 V445A436-I441 HydrophobicContact CB-CD1 4.21Å; A436-I441 HydrophobicContact CB-CG1 4.31Å; D437-I441 PolarHBondContact O-N 2.87Å; I438-I441 PolarHBondContact O-N 3.34Å; D439-I441 VanDerWaalsContact C-N 3.32Å; D439-I441 PolarHBondContact O-N 2.83Å; I441-I443 VanDerWaalsContact C-N 3.34Å; I441-I443 PolarHBondContact O-N 2.87Å; I441-K444 PolarHBondContact O-N 3.38Å; I441-V445 HydrophobicContact CG2-CG2 4.37Å; I441-V445 WeakPolarHBondContact O-CB 3.42Å; I441-V445 VanDerWaalsContact O-CG2 3.28Å; I441-V445 WeakPolarHBondContact O-CG2 3.4Å; I441-V445 PolarHBondContact O-N 3.23Å
442I70.4Confident67.4Low73 Ų73108.1 Ų108.137%0.37456%0.564SS.*Hα-helixtrans-61.4-41.3176.2-70.2167.1000110.9I438 D439 V445 K446I438-I442 HydrophobicContact CG2-CD1 3.73Å; I438-I442 HydrophobicContact CG2-CG1 4.26Å; I438-I442 WeakPolarHBondContact O-CB 3.28Å; I438-I442 WeakPolarHBondContact O-CG1 3.41Å; I438-I442 PolarHBondContact O-N 3.38Å; D439-I442 PolarHBondContact O-N 3.5Å; I442-V445 PolarHBondContact O-N 2.95Å; I442-K446 HydrophobicContact CG2-CD 4.22Å; I442-K446 HydrophobicContact CG2-CG 4.43Å; I442-K446 WeakPolarHBondContact O-CB 3.29Å; I442-K446 WeakPolarHBondContact O-CG 3.43Å; I442-K446 PolarHBondContact O-N 3.07Å
443I74.6Confident68.8Low89 Ų89109.2 Ų109.246%0.45656%0.563SS.*Hα-helixtrans-63.5-44.8175.8-72.3164.2000110.3D439 I441 V445 K446 Q447D439-I443 VanDerWaalsContact O-CB 3.31Å; D439-I443 WeakPolarHBondContact O-CB 3.34Å; D439-I443 WeakPolarHBondContact O-CD1 3.15Å; D439-I443 WeakPolarHBondContact O-CG1 3.48Å; D439-I443 PolarHBondContact O-N 2.76Å; I441-I443 VanDerWaalsContact C-N 3.34Å; I441-I443 PolarHBondContact O-N 2.87Å; I443-V445 PolarHBondContact O-N 3.46Å; I443-K446 PolarHBondContact O-N 3.34Å; I443-Q447 HydrophobicContact CG2-CG 4.45Å; I443-Q447 WeakPolarHBondContact O-CB 3.44Å; I443-Q447 VanDerWaalsContact O-CG 3.23Å; I443-Q447 WeakPolarHBondContact O-CG 3.22Å; I443-Q447 PolarHBondContact O-N 2.93Å
444K73.2Confident70.1Confident131 Ų131104.5 Ų104.557%0.5755%0.547SS*.Hα-helixtrans-64.9-37.7176.5-76.8-175.4177.1-175.30112.7S440 I441 Q447 H448S440-K444 WeakPolarHBondContact O-CG 3.21Å; S440-K444 PolarHBondContact O-N 3.45Å; S440-K444 VanDerWaalsContact O-N 3.08Å; I441-K444 PolarHBondContact O-N 3.38Å; K444-Q447 PolarHBondContact O-N 3.15Å; K444-H448 PolarHBondContact O-CD2 3.32Å; K444-H448 VanDerWaalsContact O-CD2 3.32Å; K444-H448 PolarHBondContact O-N 2.94Å
445V74.4Confident71.6Confident78 Ų78104.8 Ų104.847%0.47353%0.528SS..Hα-helixtrans-67.4-44.1175.3171.80000110.9I441 I442 I443 Q447 H448 D449I441-V445 HydrophobicContact CG2-CG2 4.37Å; I441-V445 WeakPolarHBondContact O-CB 3.42Å; I441-V445 VanDerWaalsContact O-CG2 3.28Å; I441-V445 WeakPolarHBondContact O-CG2 3.4Å; I441-V445 PolarHBondContact O-N 3.23Å; I442-V445 PolarHBondContact O-N 2.95Å; I443-V445 PolarHBondContact O-N 3.46Å; V445-Q447 VanDerWaalsContact C-N 3.34Å; V445-Q447 PolarHBondContact O-N 3.02Å; V445-H448 WeakPolarHBondContact O-CA 3.43Å; V445-H448 VanDerWaalsContact O-CB 3.31Å; V445-H448 WeakPolarHBondContact O-CB 3.2Å; V445-H448 PolarHBondContact O-N 2.96Å; V445-H448 VanDerWaalsContact O-N 3.07Å; V445-D449 PolarHBondContact O-N 2.8Å
446K73.2Confident73.1Confident129 Ų12999.7 Ų99.756%0.56151%0.513SS*.Hα-helixtrans-62.8-38.6174.3-78.3-176.5175.5-176.80112.9I442 I443 H448 D449 E450I442-K446 HydrophobicContact CG2-CD 4.22Å; I442-K446 HydrophobicContact CG2-CG 4.43Å; I442-K446 WeakPolarHBondContact O-CB 3.29Å; I442-K446 WeakPolarHBondContact O-CG 3.43Å; I442-K446 PolarHBondContact O-N 3.07Å; I443-K446 PolarHBondContact O-N 3.34Å; K446-H448 VanDerWaalsContact C-N 3.25Å; K446-H448 PolarHBondContact O-N 3.14Å; K446-D449 WeakPolarHBondContact O-CB 3.23Å; K446-D449 PolarHBondContact O-N 3.18Å; K446-D449 VanDerWaalsContact O-N 3.15Å; K446-E450 PolarHBondContact O-N 3.29Å; K446-E450 VanDerWaalsContact O-N 3.11Å
447Q73.4Confident74.6Confident115 Ų115102 Ų10254%0.53752%0.517SS..Hα-helixtrans-63-35.1173.4-76.5172.5-8.900111.4I443 K444 V445 F451I443-Q447 HydrophobicContact CG2-CG 4.45Å; I443-Q447 WeakPolarHBondContact O-CB 3.44Å; I443-Q447 VanDerWaalsContact O-CG 3.23Å; I443-Q447 WeakPolarHBondContact O-CG 3.22Å; I443-Q447 PolarHBondContact O-N 2.93Å; K444-Q447 PolarHBondContact O-N 3.15Å; V445-Q447 VanDerWaalsContact C-N 3.34Å; V445-Q447 PolarHBondContact O-N 3.02Å; Q447-F451 WeakPolarHBondContact O-CB 3.31Å; Q447-F451 PolarHBondContact O-N 3.21Å
448H71.1Confident75.7Confident100 Ų100101 Ų10146%0.46351%0.512SS..Hα-helixtrans-66.5-40.3171-91.1-73.3000112.3K444 V445 K446 E450 F451 F452K444-H448 PolarHBondContact O-CD2 3.32Å; K444-H448 VanDerWaalsContact O-CD2 3.32Å; K444-H448 PolarHBondContact O-N 2.94Å; V445-H448 WeakPolarHBondContact O-CA 3.43Å; V445-H448 VanDerWaalsContact O-CB 3.31Å; V445-H448 WeakPolarHBondContact O-CB 3.2Å; V445-H448 PolarHBondContact O-N 2.96Å; V445-H448 VanDerWaalsContact O-N 3.07Å; K446-H448 VanDerWaalsContact C-N 3.25Å; K446-H448 PolarHBondContact O-N 3.14Å; H448-E450 VanDerWaalsContact C-N 3.28Å; H448-E450 PolarHBondContact O-N 3.49Å; H448-F451 PolarHBondContact O-N 2.82Å; H448-F452 HydrophobicContact CB-CD2 4Å; H448-F452 HydrophobicContact CB-CE2 4.1Å; H448-F452 AromaticContact CE1-CE2 3.8Å; H448-F452 AromaticContact CG-CE2 3.84Å; H448-F452 AromaticContact ND1-CD2 3.52Å; H448-F452 AromaticContact ND1-CE2 2.96Å; H448-F452 WeakPolarHBondContact ND1-CE2 3.19Å; H448-F452 AromaticContact ND1-CZ 3.76Å; H448-F452 WeakPolarHBondContact O-CB 3.24Å; H448-F452 VanDerWaalsContact O-CD2 3.25Å; H448-F452 WeakPolarHBondContact O-CD2 3.34Å; H448-F452 PolarHBondContact O-N 3.4Å
449D72.1Confident76.6Confident110 Ų11095.8 Ų95.859%0.58849%0.486SS*.Hα-helixtrans-62.6-32177.2-68.7-28.1000113V445 K446 P453V445-D449 PolarHBondContact O-N 2.8Å; K446-D449 WeakPolarHBondContact O-CB 3.23Å; K446-D449 PolarHBondContact O-N 3.18Å; K446-D449 VanDerWaalsContact O-N 3.15Å; D449-P453 WeakPolarHBondContact O-CD 3.33Å; D449-P453 WeakPolarHBondContact O-CG 3.4Å
450E75.5Confident77.6Confident157 Ų15792.7 Ų92.773%0.73447%0.471SS*.Hα-helixtrans-84.9-38.7175.8-71-179.1-176.200112.9K446 H448K446-E450 PolarHBondContact O-N 3.29Å; K446-E450 VanDerWaalsContact O-N 3.11Å; H448-E450 VanDerWaalsContact C-N 3.28Å; H448-E450 PolarHBondContact O-N 3.49Å
451F79.3Confident78.4Confident117 Ų11796.1 Ų96.151%0.51348%0.481SS..Hα-helixtrans-71.5-43.5-177.2177.5-97.7000112.4Q447 H448 A454 F455Q447-F451 WeakPolarHBondContact O-CB 3.31Å; Q447-F451 PolarHBondContact O-N 3.21Å; H448-F451 PolarHBondContact O-N 2.82Å; F451-A454 PolarHBondContact O-N 3Å; F451-F455 HydrophobicContact CD1-CB 4.19Å; F451-F455 HydrophobicContact CE1-CB 3.81Å; F451-F455 HydrophobicContact CE1-CD2 4.2Å; F451-F455 AromaticContact CE1-CG 3.96Å; F451-F455 HydrophobicContact CE1-CG 3.96Å; F451-F455 HydrophobicContact CZ-CB 4Å; F451-F455 AromaticContact CZ-CD2 3.94Å; F451-F455 HydrophobicContact CZ-CD2 3.94Å; F451-F455 HydrophobicContact CZ-CG 4.12Å; F451-F455 VanDerWaalsContact O-CB 3.26Å; F451-F455 WeakPolarHBondContact O-CB 3.29Å; F451-F455 PolarHBondContact O-N 3.13Å
452F79.3Confident79.1Confident115 Ų11594.4 Ų94.450%0.50447%0.472SS..Hα-helixtrans-61.8-43.5-173.9-89.6-67000113.8H448 F455 H456H448-F452 HydrophobicContact CB-CD2 4Å; H448-F452 HydrophobicContact CB-CE2 4.1Å; H448-F452 AromaticContact CE1-CE2 3.8Å; H448-F452 AromaticContact CG-CE2 3.84Å; H448-F452 AromaticContact ND1-CD2 3.52Å; H448-F452 AromaticContact ND1-CE2 2.96Å; H448-F452 WeakPolarHBondContact ND1-CE2 3.19Å; H448-F452 AromaticContact ND1-CZ 3.76Å; H448-F452 WeakPolarHBondContact O-CB 3.24Å; H448-F452 VanDerWaalsContact O-CD2 3.25Å; H448-F452 WeakPolarHBondContact O-CD2 3.34Å; H448-F452 PolarHBondContact O-N 3.4Å; F452-F455 PolarHBondContact O-N 3.45Å; F452-H456 WeakPolarHBondContact O-CB 3.4Å; F452-H456 PolarHBondContact O-N 3.28Å
453P83.6Confident79.8Confident70 Ų7092.2 Ų92.246%0.45546%0.461SS..Hα-helixtrans-63.4-41.7175.6-24.434.7000112.9D449 H456 N457D449-P453 WeakPolarHBondContact O-CD 3.33Å; D449-P453 WeakPolarHBondContact O-CG 3.4Å; P453-H456 PolarHBondContact O-N 3.25Å; P453-N457 WeakPolarHBondContact O-CB 3.29Å; P453-N457 VanDerWaalsContact O-CG 3.23Å; P453-N457 PolarHBondContact O-N 2.97Å; P453-N457 PolarHBondContact O-ND2 2.97Å
454A79.9Confident80.3Confident62 Ų6295.7 Ų95.751%0.51247%0.473SS..Hα-helixtrans-65.6-44.8177.700000111.4F451 N457 L458F451-A454 PolarHBondContact O-N 3Å; A454-N457 PolarHBondContact O-N 2.77Å; A454-L458 WeakPolarHBondContact O-CB 3.46Å; A454-L458 PolarHBondContact O-N 2.92Å
455F83.4Confident80.9Confident81 Ų8196.1 Ų96.136%0.35548%0.48SS..Hα-helixtrans-63.9-44.4175.4177.5-102000112F451 F452 L458 V459F451-F455 HydrophobicContact CD1-CB 4.19Å; F451-F455 HydrophobicContact CE1-CB 3.81Å; F451-F455 HydrophobicContact CE1-CD2 4.2Å; F451-F455 AromaticContact CE1-CG 3.96Å; F451-F455 HydrophobicContact CE1-CG 3.96Å; F451-F455 HydrophobicContact CZ-CB 4Å; F451-F455 AromaticContact CZ-CD2 3.94Å; F451-F455 HydrophobicContact CZ-CD2 3.94Å; F451-F455 HydrophobicContact CZ-CG 4.12Å; F451-F455 VanDerWaalsContact O-CB 3.26Å; F451-F455 WeakPolarHBondContact O-CB 3.29Å; F451-F455 PolarHBondContact O-N 3.13Å; F452-F455 PolarHBondContact O-N 3.45Å; F455-L458 PolarHBondContact O-N 3.08Å; F455-V459 HydrophobicContact CD1-CG2 4.2Å; F455-V459 HydrophobicContact CD2-CG2 4.29Å; F455-V459 HydrophobicContact CE1-CG2 3.77Å; F455-V459 HydrophobicContact CE2-CG2 3.86Å; F455-V459 HydrophobicContact CG-CG2 4.45Å; F455-V459 HydrophobicContact CZ-CG2 3.59Å; F455-V459 WeakPolarHBondContact O-CB 3.46Å; F455-V459 VanDerWaalsContact O-CG2 3.31Å; F455-V459 WeakPolarHBondContact O-CG2 3.31Å; F455-V459 PolarHBondContact O-N 3.42Å
456H84.6Confident81.2Confident119 Ų11994 Ų9455%0.55147%0.466SS*.Hα-helixtrans-64-42178.3-174.370.7000111.6F452 P453 V459 T460F452-H456 WeakPolarHBondContact O-CB 3.4Å; F452-H456 PolarHBondContact O-N 3.28Å; P453-H456 PolarHBondContact O-N 3.25Å; H456-V459 PolarHBondContact O-N 2.83Å; H456-T460 VanDerWaalsContact O-CB 3.28Å; H456-T460 WeakPolarHBondContact O-CB 3.42Å; H456-T460 PolarHBondContact O-N 3.27Å; H456-T460 PolarHBondContact O-OG1 3.04Å
457N86.1Confident81.7Confident104 Ų10491.2 Ų91.256%0.55647%0.474SS*.Hα-helixtrans-60.6-48.4174-76.8-17.8000111.3P453 A454 V459 T460 E461P453-N457 WeakPolarHBondContact O-CB 3.29Å; P453-N457 VanDerWaalsContact O-CG 3.23Å; P453-N457 PolarHBondContact O-N 2.97Å; P453-N457 PolarHBondContact O-ND2 2.97Å; A454-N457 PolarHBondContact O-N 2.77Å; N457-V459 PolarHBondContact O-N 3.09Å; N457-T460 PolarHBondContact O-N 2.91Å; N457-E461 PolarHBondContact O-N 3.47Å
458L86Confident82.3Confident96 Ų9687.2 Ų87.250%0.50346%0.457SS..Hα-helixtrans-58.2-49177.5178.466.7000111.8A454 F455 T460 E461 I462A454-L458 WeakPolarHBondContact O-CB 3.46Å; A454-L458 PolarHBondContact O-N 2.92Å; F455-L458 PolarHBondContact O-N 3.08Å; L458-T460 VanDerWaalsContact C-N 3.32Å; L458-T460 PolarHBondContact O-N 2.89Å; L458-E461 PolarHBondContact O-N 3.48Å; L458-I462 HydrophobicContact CD1-CD1 4.19Å; L458-I462 HydrophobicContact CG-CD1 3.99Å; L458-I462 VanDerWaalsContact O-CG1 3.29Å; L458-I462 WeakPolarHBondContact O-CG1 3.45Å; L458-I462 PolarHBondContact O-N 3.32Å
459V85.8Confident82.7Confident17 Ų1787.2 Ų87.210%0.10347%0.468CS..Hα-helixtrans-61-42.6178164.60000111F455 H456 N457 E461 I462 L463 L471 I474F455-V459 HydrophobicContact CD1-CG2 4.2Å; F455-V459 HydrophobicContact CD2-CG2 4.29Å; F455-V459 HydrophobicContact CE1-CG2 3.77Å; F455-V459 HydrophobicContact CE2-CG2 3.86Å; F455-V459 HydrophobicContact CG-CG2 4.45Å; F455-V459 HydrophobicContact CZ-CG2 3.59Å; F455-V459 WeakPolarHBondContact O-CB 3.46Å; F455-V459 VanDerWaalsContact O-CG2 3.31Å; F455-V459 WeakPolarHBondContact O-CG2 3.31Å; F455-V459 PolarHBondContact O-N 3.42Å; H456-V459 PolarHBondContact O-N 2.83Å; N457-V459 PolarHBondContact O-N 3.09Å; V459-E461 VanDerWaalsContact C-N 3.35Å; V459-E461 PolarHBondContact O-N 3.02Å; V459-I462 PolarHBondContact O-N 3.39Å; V459-L463 HydrophobicContact CG1-CD1 3.87Å; V459-L463 HydrophobicContact CG1-CG 4.31Å; V459-L463 WeakPolarHBondContact O-CB 3.38Å; V459-L463 VanDerWaalsContact O-CG 3.27Å; V459-L463 WeakPolarHBondContact O-CG 3.46Å; V459-L463 PolarHBondContact O-N 3.49Å; V459-L471 HydrophobicContact CB-CD1 4.29Å; V459-L471 HydrophobicContact CG1-CD1 3.39Å; V459-L471 HydrophobicContact CG2-CD1 3.85Å; V459-I474 HydrophobicContact CG1-CD1 4.22Å
460T84.7Confident83.2Confident41 Ų4187.7 Ų87.725%0.25247%0.467SS..Hα-helixtrans-67.8-36.1-179.4-53.10000111.7H456 N457 L458 K464H456-T460 VanDerWaalsContact O-CB 3.28Å; H456-T460 WeakPolarHBondContact O-CB 3.42Å; H456-T460 PolarHBondContact O-N 3.27Å; H456-T460 PolarHBondContact O-OG1 3.04Å; N457-T460 PolarHBondContact O-N 2.91Å; L458-T460 VanDerWaalsContact C-N 3.32Å; L458-T460 PolarHBondContact O-N 2.89Å; T460-K464 WeakPolarHBondContact O-CB 3.23Å; T460-K464 VanDerWaalsContact O-CG 3.31Å; T460-K464 WeakPolarHBondContact O-CG 3.42Å; T460-K464 PolarHBondContact O-N 3.02Å
461E85.2Confident83.5Confident124 Ų12484.7 Ų84.758%0.57946%0.455SS*.Hα-helixtrans-64.5-45170.7-76.3-167.6157.100111.8N457 L458 V459 L463 K464 I465N457-E461 PolarHBondContact O-N 3.47Å; L458-E461 PolarHBondContact O-N 3.48Å; V459-E461 VanDerWaalsContact C-N 3.35Å; V459-E461 PolarHBondContact O-N 3.02Å; E461-L463 VanDerWaalsContact C-N 3.34Å; E461-L463 PolarHBondContact O-N 3.11Å; E461-K464 PolarHBondContact O-N 3.43Å; E461-I465 WeakPolarHBondContact O-CB 3.25Å; E461-I465 VanDerWaalsContact O-CG1 3.25Å; E461-I465 WeakPolarHBondContact O-CG1 3.31Å; E461-I465 PolarHBondContact O-N 3.36Å
462I85.3Confident83.8Confident54 Ų5485.6 Ų85.628%0.27747%0.465SS..Hα-helixtrans-60.6-44.3176.9-68.7167.5000110.8L458 V459 K464 I465 L466 I474L458-I462 HydrophobicContact CD1-CD1 4.19Å; L458-I462 HydrophobicContact CG-CD1 3.99Å; L458-I462 VanDerWaalsContact O-CG1 3.29Å; L458-I462 WeakPolarHBondContact O-CG1 3.45Å; L458-I462 PolarHBondContact O-N 3.32Å; V459-I462 PolarHBondContact O-N 3.39Å; I462-K464 PolarHBondContact O-N 3.42Å; I462-I465 PolarHBondContact O-N 2.82Å; I462-L466 HydrophobicContact CG2-CD1 3.59Å; I462-L466 HydrophobicContact CG2-CG 4.4Å; I462-L466 WeakPolarHBondContact O-CB 3.34Å; I462-L466 WeakPolarHBondContact O-CG 3.43Å; I462-L466 PolarHBondContact O-N 3.43Å; I462-I474 HydrophobicContact CG2-CD1 4.01Å; I462-I474 HydrophobicContact CG2-CG1 4.25Å; I462-I474 HydrophobicContact CG2-CG2 3.55Å
463L85.9Confident83.9Confident27 Ų2783.5 Ų83.514%0.14146%0.46CS..Hα-helixtrans-59.8-43.2175.2-74.5171.9000111.9V459 E461 G467 V468 H470 I474V459-L463 HydrophobicContact CG1-CD1 3.87Å; V459-L463 HydrophobicContact CG1-CG 4.31Å; V459-L463 WeakPolarHBondContact O-CB 3.38Å; V459-L463 VanDerWaalsContact O-CG 3.27Å; V459-L463 WeakPolarHBondContact O-CG 3.46Å; V459-L463 PolarHBondContact O-N 3.49Å; E461-L463 VanDerWaalsContact C-N 3.34Å; E461-L463 PolarHBondContact O-N 3.11Å; L463-G467 WeakPolarHBondContact O-CA 3.37Å; L463-G467 PolarHBondContact O-N 2.87Å; L463-V468 WeakPolarHBondContact CB-O 3.43Å; L463-V468 HydrophobicContact CD2-CB 4.09Å; L463-V468 HydrophobicContact CD2-CG1 4.27Å; L463-V468 WeakPolarHBondContact CD2-O 3.48Å; L463-V468 PolarHBondContact O-N 3.07Å; L463-H470 VanDerWaalsContact CD2-O 3.28Å; L463-H470 WeakPolarHBondContact CD2-O 3.44Å; L463-I474 HydrophobicContact CD2-CD1 3.72Å; L463-I474 HydrophobicContact CD2-CG1 3.46Å; L463-I474 VanDerWaalsContact CD2-CG1 3.46Å; L463-I474 HydrophobicContact CG-CD1 3.9Å; L463-I474 HydrophobicContact CG-CG1 4.15Å
464K85.3Confident83.9Confident163 Ų16381.1 Ų81.171%0.70944%0.443SS*.Hα-helixtrans-65.2-42.9176.1-77.2175.2-177.5175.10112.8T460 E461 I462 L466 G467T460-K464 WeakPolarHBondContact O-CB 3.23Å; T460-K464 VanDerWaalsContact O-CG 3.31Å; T460-K464 WeakPolarHBondContact O-CG 3.42Å; T460-K464 PolarHBondContact O-N 3.02Å; E461-K464 PolarHBondContact O-N 3.43Å; I462-K464 PolarHBondContact O-N 3.42Å; K464-L466 VanDerWaalsContact C-N 3.34Å; K464-G467 PolarHBondContact O-N 3.17Å
465I84.6Confident84.1Confident139 Ų13984 Ų8471%0.71345%0.449SS*.Hα-helixtrans-66.2-39.7-179.6-69.6165.5000110.6E461 I462E461-I465 WeakPolarHBondContact O-CB 3.25Å; E461-I465 VanDerWaalsContact O-CG1 3.25Å; E461-I465 WeakPolarHBondContact O-CG1 3.31Å; E461-I465 PolarHBondContact O-N 3.36Å; I462-I465 PolarHBondContact O-N 2.82Å
466L81.4Confident84.1Confident35 Ų3583.2 Ų83.218%0.18345%0.452CS..Hα-helixtrans-85.3-12.7-179.7-63.1171000113.4I462 K464 V468 I474 A477 L478 L481I462-L466 HydrophobicContact CG2-CD1 3.59Å; I462-L466 HydrophobicContact CG2-CG 4.4Å; I462-L466 WeakPolarHBondContact O-CB 3.34Å; I462-L466 WeakPolarHBondContact O-CG 3.43Å; I462-L466 PolarHBondContact O-N 3.43Å; K464-L466 VanDerWaalsContact C-N 3.34Å; L466-V468 HydrophobicContact CB-CG2 3.78Å; L466-V468 WeakPolarHBondContact O-CG2 3.45Å; L466-I474 HydrophobicContact CD1-CB 4.49Å; L466-I474 HydrophobicContact CD1-CG2 3.87Å; L466-A477 HydrophobicContact CB-CB 4.35Å; L466-A477 HydrophobicContact CD1-CB 4.48Å; L466-L478 HydrophobicContact CD1-CD1 4.27Å; L466-L478 HydrophobicContact CD1-CD2 4.09Å; L466-L478 HydrophobicContact CD1-CG 3.72Å; L466-L478 HydrophobicContact CD2-CD2 3.78Å; L466-L478 HydrophobicContact CD2-CG 4.13Å; L466-L481 HydrophobicContact CD2-CD2 4.44Å
467G82.8Confident83.8Confident70 Ų7078.7 Ų78.772%0.72244%0.435SS*.THydrogen-bonded Turntrans73.329.5-178.800000114L463 K464L463-G467 WeakPolarHBondContact O-CA 3.37Å; L463-G467 PolarHBondContact O-N 2.87Å; K464-G467 PolarHBondContact O-N 3.17Å
468V86.1Confident83.6Confident31 Ų3177.5 Ų77.519%0.18843%0.428CS..  trans-115.4145.6-170.3-172.40000110.5L463 L466 D473 A477L463-V468 WeakPolarHBondContact CB-O 3.43Å; L463-V468 HydrophobicContact CD2-CB 4.09Å; L463-V468 HydrophobicContact CD2-CG1 4.27Å; L463-V468 WeakPolarHBondContact CD2-O 3.48Å; L463-V468 PolarHBondContact O-N 3.07Å; L466-V468 HydrophobicContact CB-CG2 3.78Å; L466-V468 WeakPolarHBondContact O-CG2 3.45Å; V468-D473 HydrophobicContact CG1-CB 3.09Å; V468-A477 HydrophobicContact CG2-CB 3.62Å
469S81.1Confident83.4Confident99 Ų9978.8 Ų78.869%0.69243%0.432SS*.SBendtrans-98.8-21.7-174.445.50000115.4
470H82.6Confident83.2Confident121 Ų12181.5 Ų81.556%0.5645%0.451SS*.SBendtrans-119.4146.6179.7-67.7-74.3000112.6L463 D472 D473L463-H470 VanDerWaalsContact CD2-O 3.28Å; L463-H470 WeakPolarHBondContact CD2-O 3.44Å; H470-D472 VanDerWaalsContact C-N 3.26Å; H470-D472 PolarHBondContact O-N 2.94Å; H470-D473 PolarHBondContact O-N 2.95Å
471L81.2Confident83Confident93 Ų9384.8 Ų84.849%0.48747%0.467SS..G310 helixtrans-56.9-39.6179.8-17776.3000112.2V459 D473 I474V459-L471 HydrophobicContact CB-CD1 4.29Å; V459-L471 HydrophobicContact CG1-CD1 3.39Å; V459-L471 HydrophobicContact CG2-CD1 3.85Å; L471-D473 PolarHBondContact O-N 2.88Å; L471-I474 HydrophobicContact CD1-CD1 3.74Å; L471-I474 WeakPolarHBondContact O-CB 3.47Å; L471-I474 WeakPolarHBondContact O-CG1 3.49Å; L471-I474 PolarHBondContact O-N 2.98Å
472D84.3Confident82.9Confident137 Ų13785.6 Ų85.673%0.73347%0.468SS*.G310 helixtrans-66.7-21.2-177.2-62.1-34.9000113H470 P476H470-D472 VanDerWaalsContact C-N 3.26Å; H470-D472 PolarHBondContact O-N 2.94Å; D472-P476 WeakPolarHBondContact O-CD 3.26Å
473D82.6Confident82.5Confident71 Ų7189.6 Ų89.638%0.3849%0.486SS..G310 helixtrans-90.1-6.9-177.1-63.9-30.9000112.5V468 H470 L471 P476 A477V468-D473 HydrophobicContact CG1-CB 3.09Å; H470-D473 PolarHBondContact O-N 2.95Å; L471-D473 PolarHBondContact O-N 2.88Å; D473-P476 WeakPolarHBondContact O-CD 3.34Å; D473-A477 VanDerWaalsContact O-CB 3.3Å; D473-A477 WeakPolarHBondContact O-CB 3.38Å; D473-A477 PolarHBondContact O-N 3.15Å
474I84Confident81.7Confident19 Ų1992.3 Ų92.310%0.09751%0.512CS..Hα-helixtrans-62.3-48.3177.9-67.4176.8000111.5V459 I462 L463 L466 L471 A477 L478V459-I474 HydrophobicContact CG1-CD1 4.22Å; I462-I474 HydrophobicContact CG2-CD1 4.01Å; I462-I474 HydrophobicContact CG2-CG1 4.25Å; I462-I474 HydrophobicContact CG2-CG2 3.55Å; L463-I474 HydrophobicContact CD2-CD1 3.72Å; L463-I474 HydrophobicContact CD2-CG1 3.46Å; L463-I474 VanDerWaalsContact CD2-CG1 3.46Å; L463-I474 HydrophobicContact CG-CD1 3.9Å; L463-I474 HydrophobicContact CG-CG1 4.15Å; L466-I474 HydrophobicContact CD1-CB 4.49Å; L466-I474 HydrophobicContact CD1-CG2 3.87Å; L471-I474 HydrophobicContact CD1-CD1 3.74Å; L471-I474 WeakPolarHBondContact O-CB 3.47Å; L471-I474 WeakPolarHBondContact O-CG1 3.49Å; L471-I474 PolarHBondContact O-N 2.98Å; I474-A477 PolarHBondContact O-N 2.7Å; I474-L478 HydrophobicContact CG2-CD1 3.95Å; I474-L478 WeakPolarHBondContact O-CG 2.91Å; I474-L478 PolarHBondContact O-N 2.68Å
475L83.7Confident80.8Confident122 Ų12288.9 Ų88.964%0.63951%0.514SS*.Hα-helixtrans-66.2-46.9-178.1-76173.8000112.2A477 L478 Q479L475-A477 PolarHBondContact O-N 3.33Å; L475-L478 PolarHBondContact O-N 2.97Å; L475-Q479 WeakPolarHBondContact O-CG 3.45Å; L475-Q479 PolarHBondContact O-N 2.81Å
476P83.6Confident79.1Confident65 Ų6591.9 Ų91.942%0.42253%0.525SS..Hα-helixtrans-54.6-46.9171-27.133.5000113.2D472 D473 L478 Q479 S480D472-P476 WeakPolarHBondContact O-CD 3.26Å; D473-P476 WeakPolarHBondContact O-CD 3.34Å; P476-L478 PolarHBondContact O-N 2.76Å; P476-Q479 WeakPolarHBondContact O-CB 3.42Å; P476-Q479 PolarHBondContact O-N 3.22Å; P476-S480 PolarHBondContact O-N 3.47Å; P476-S480 PolarHBondContact O-OG 3.04Å
477A78.6Confident79Confident24 Ų2494.8 Ų94.820%0.19854%0.542CS..Hα-helixtrans-65-39.4-178.400000112.9L466 V468 D473 I474 L475 Q479 S480 L481L466-A477 HydrophobicContact CB-CB 4.35Å; L466-A477 HydrophobicContact CD1-CB 4.48Å; V468-A477 HydrophobicContact CG2-CB 3.62Å; D473-A477 VanDerWaalsContact O-CB 3.3Å; D473-A477 WeakPolarHBondContact O-CB 3.38Å; D473-A477 PolarHBondContact O-N 3.15Å; I474-A477 PolarHBondContact O-N 2.7Å; L475-A477 PolarHBondContact O-N 3.33Å; A477-Q479 VanDerWaalsContact C-N 3.34Å; A477-S480 PolarHBondContact O-N 3.2Å; A477-L481 WeakPolarHBondContact O-CB 3.3Å; A477-L481 PolarHBondContact O-N 2.49Å
478L82.1Confident78.8Confident79 Ų7996.1 Ų96.141%0.41453%0.533SS..Hα-helixtrans-64.5-37.7173.5-78.8168.4000112.4L466 I474 L475 P476 L481 K482L466-L478 HydrophobicContact CD1-CD1 4.27Å; L466-L478 HydrophobicContact CD1-CD2 4.09Å; L466-L478 HydrophobicContact CD1-CG 3.72Å; L466-L478 HydrophobicContact CD2-CD2 3.78Å; L466-L478 HydrophobicContact CD2-CG 4.13Å; I474-L478 HydrophobicContact CG2-CD1 3.95Å; I474-L478 WeakPolarHBondContact O-CG 2.91Å; I474-L478 PolarHBondContact O-N 2.68Å; L475-L478 PolarHBondContact O-N 2.97Å; P476-L478 PolarHBondContact O-N 2.76Å; L478-L481 PolarHBondContact O-N 2.84Å; L478-K482 VanDerWaalsContact O-CB 3.29Å; L478-K482 WeakPolarHBondContact O-CB 3.47Å; L478-K482 PolarHBondContact O-N 3.09Å
479Q81.4Confident78.4Confident123 Ų12399.7 Ų99.758%0.57555%0.552SS**Hα-helixtrans-66-41.8176-73.7178-1.100111.4L475 P476 A477 K482 Q483L475-Q479 WeakPolarHBondContact O-CG 3.45Å; L475-Q479 PolarHBondContact O-N 2.81Å; P476-Q479 WeakPolarHBondContact O-CB 3.42Å; P476-Q479 PolarHBondContact O-N 3.22Å; A477-Q479 VanDerWaalsContact C-N 3.34Å; Q479-K482 PolarHBondContact O-N 2.99Å; Q479-Q483 VanDerWaalsContact O-CG 3.31Å; Q479-Q483 WeakPolarHBondContact O-CG 3.47Å; Q479-Q483 PolarHBondContact O-N 3.19Å
480S81.6Confident78.3Confident74 Ų7499.7 Ų99.752%0.51754%0.544SS..Hα-helixtrans-65.1-41.6174.3-59.10000112.5P476 A477 Q483 A484P476-S480 PolarHBondContact O-N 3.47Å; P476-S480 PolarHBondContact O-OG 3.04Å; A477-S480 PolarHBondContact O-N 3.2Å; S480-Q483 PolarHBondContact O-N 2.88Å; S480-A484 PolarHBondContact O-N 2.78Å
481L80.8Confident78Confident110 Ų11098.4 Ų98.458%0.57654%0.543SS*.Hα-helixtrans-64.2-41.3176.5-163.984.3000111.6L466 A477 L478 Q483 A484 A485L466-L481 HydrophobicContact CD2-CD2 4.44Å; A477-L481 WeakPolarHBondContact O-CB 3.3Å; A477-L481 PolarHBondContact O-N 2.49Å; L478-L481 PolarHBondContact O-N 2.84Å; L481-Q483 VanDerWaalsContact C-N 3.34Å; L481-Q483 PolarHBondContact O-N 3Å; L481-A484 PolarHBondContact O-N 2.74Å; L481-A485 WeakPolarHBondContact O-CB 3.46Å; L481-A485 PolarHBondContact O-N 2.91Å; L481-A485 VanDerWaalsContact O-N 3.1Å
482K81.8Confident77.8Confident141 Ų14198.7 Ų98.761%0.61355%0.547SS*.Hα-helixtrans-63.4-39.7175.5-177.1-178.4176.8-1770111.9L478 Q479 A484 A485 Q486L478-K482 VanDerWaalsContact O-CB 3.29Å; L478-K482 WeakPolarHBondContact O-CB 3.47Å; L478-K482 PolarHBondContact O-N 3.09Å; Q479-K482 PolarHBondContact O-N 2.99Å; K482-A484 VanDerWaalsContact C-N 3.33Å; K482-A485 PolarHBondContact O-N 3.23Å; K482-Q486 PolarHBondContact O-N 3.14Å
483Q77.1Confident77.3Confident139 Ų13996 Ų9665%0.6553%0.533SS*.Hα-helixtrans-70.5-27.8176.4-74.3175.3-2.500113Q479 S480 L481Q479-Q483 VanDerWaalsContact O-CG 3.31Å; Q479-Q483 WeakPolarHBondContact O-CG 3.47Å; Q479-Q483 PolarHBondContact O-N 3.19Å; S480-Q483 PolarHBondContact O-N 2.88Å; L481-Q483 VanDerWaalsContact C-N 3.34Å; L481-Q483 PolarHBondContact O-N 3Å
484A70.3Confident76.9Confident84 Ų8497.9 Ų97.969%0.69455%0.545SS*.Hα-helixtrans-81.1-16.8174.900000113.6S480 L481 K482S480-A484 PolarHBondContact O-N 2.78Å; L481-A484 PolarHBondContact O-N 2.74Å; K482-A484 VanDerWaalsContact C-N 3.33Å
485A64.9Low76.3Confident90 Ų90104.5 Ų104.574%0.74458%0.583SS**Hα-helixtrans-98.5-7.7178.900000113.9L481 K482L481-A485 WeakPolarHBondContact O-CB 3.46Å; L481-A485 PolarHBondContact O-N 2.91Å; L481-A485 VanDerWaalsContact O-N 3.1Å; K482-A485 PolarHBondContact O-N 3.23Å
486Q50.4Low75.7Confident203 Ų203102.9 Ų102.995%0.94958%0.577SS**  trans-96.60166-77.8-174.6-70.300109.7K482K482-Q486 PolarHBondContact O-N 3.14Å

Retrieved 486 of 486 residues in 1501.3 ms (Link to these results)

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