G4VCH8_SCHMA Loading...

Putative cationic amino acid transporter

AlphaFold DB , UniProt , Accession G4VCH8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 679 aa.

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

 

Download Structure   PDB   PAE   Table  
Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M54.2Low71.7Confident213 Ų213104.1 Ų104.1100%1.04958%0.575SS**  0-44.10-69.1174.689.200113.3S3 C4 S5M1-S3 PolarHBondContact O-N 3.43Å; M1-C4 PolarHBondContact O-N 3.34Å; M1-S5 PolarHBondContact O-N 3.37Å
2S64.9Low72.5Confident86 Ų86106 Ų10660%0.60157%0.573SS**Hα-helixtrans-57.4-41.5179.157.90000114.2S5 R6S2-S5 PolarHBondContact O-N 3.45Å; S2-R6 WeakPolarHBondContact O-CG 3.35Å; S2-R6 PolarHBondContact O-N 3.32Å
3S66Low73.2Confident85 Ų85103.6 Ų103.659%0.59456%0.559SS**Hα-helixtrans-62-49.1176.8-168.10000111.9M1 S5 R6 T7M1-S3 PolarHBondContact O-N 3.43Å; S3-S5 VanDerWaalsContact C-N 3.34Å; S3-S5 PolarHBondContact O-N 2.66Å; S3-R6 PolarHBondContact O-N 2.91Å; S3-T7 PolarHBondContact O-N 3.46Å; S3-T7 PolarHBondContact O-OG1 3.31Å
4C63.1Low73.8Confident94 Ų9497.4 Ų97.464%0.63553%0.527SS*.Hα-helixtrans-62.5-40.6-180-165.80000111.9M1 T7 A8M1-C4 PolarHBondContact O-N 3.34Å; C4-T7 PolarHBondContact O-N 3.14Å; C4-A8 WeakPolarHBondContact O-CB 3.23Å; C4-A8 PolarHBondContact O-N 3.37Å
5S70.4Confident74.6Confident82 Ų8291.9 Ų91.957%0.57350%0.497SS*.Hα-helixtrans-63.5-41.5174.9175.50000112.7M1 S2 S3 A8 K9M1-S5 PolarHBondContact O-N 3.37Å; S2-S5 PolarHBondContact O-N 3.45Å; S3-S5 VanDerWaalsContact C-N 3.34Å; S3-S5 PolarHBondContact O-N 2.66Å; S5-A8 PolarHBondContact O-N 3.32Å; S5-K9 WeakPolarHBondContact O-CB 3.43Å; S5-K9 PolarHBondContact O-N 3.4Å
6R71.8Confident75.4Confident179 Ų17991 Ų9168%0.67549%0.492SS*.Hα-helixtrans-63.8-47.9174.8-75.2179.2-178.5-179.9-0.1111.2S2 S3 A8 K9 D10S2-R6 WeakPolarHBondContact O-CG 3.35Å; S2-R6 PolarHBondContact O-N 3.32Å; S3-R6 PolarHBondContact O-N 2.91Å; R6-A8 VanDerWaalsContact C-N 3.33Å; R6-A8 PolarHBondContact O-N 3.06Å; R6-K9 PolarHBondContact O-N 3.06Å; R6-K9 VanDerWaalsContact O-N 3.17Å; R6-D10 WeakPolarHBondContact O-CB 3.29Å; R6-D10 VanDerWaalsContact O-CG 3.22Å; R6-D10 PolarHBondContact O-N 3.5Å
7T79.7Confident76.1Confident88 Ų8886.2 Ų86.254%0.5447%0.465SS..Hα-helixtrans-59.8-42.3177.7-490000112S3 C4 F11S3-T7 PolarHBondContact O-N 3.46Å; S3-T7 PolarHBondContact O-OG1 3.31Å; C4-T7 PolarHBondContact O-N 3.14Å; T7-F11 VanDerWaalsContact O-CB 3.3Å; T7-F11 WeakPolarHBondContact O-CB 3.37Å; T7-F11 PolarHBondContact O-N 3.35Å
8A76.8Confident76.7Confident42 Ų4284.7 Ų84.735%0.34745%0.454SS..Hα-helixtrans-65-43.6175.500000111.9C4 S5 R6 F11 F12C4-A8 WeakPolarHBondContact O-CB 3.23Å; C4-A8 PolarHBondContact O-N 3.37Å; S5-A8 PolarHBondContact O-N 3.32Å; R6-A8 VanDerWaalsContact C-N 3.33Å; R6-A8 PolarHBondContact O-N 3.06Å; A8-F11 WeakPolarHBondContact O-CB 3.48Å; A8-F11 PolarHBondContact O-N 3.4Å; A8-F12 WeakPolarHBondContact O-CD2 3.33Å; A8-F12 PolarHBondContact O-N 3.41Å
9K78.4Confident77Confident96 Ų9681.5 Ų81.542%0.41744%0.435SS..Hα-helixtrans-60.2-47.9176.5-171.1-175.8178.1-176.40111.1S5 R6 F11 F12 I13S5-K9 WeakPolarHBondContact O-CB 3.43Å; S5-K9 PolarHBondContact O-N 3.4Å; R6-K9 PolarHBondContact O-N 3.06Å; R6-K9 VanDerWaalsContact O-N 3.17Å; K9-F11 VanDerWaalsContact C-N 3.28Å; K9-F11 PolarHBondContact O-N 3.3Å; K9-F12 PolarHBondContact O-N 3.08Å; K9-I13 HydrophobicContact CD-CD1 4.46Å; K9-I13 HydrophobicContact CG-CD1 3.93Å; K9-I13 VanDerWaalsContact O-CG1 3.29Å; K9-I13 WeakPolarHBondContact O-CG1 3.39Å; K9-I13 PolarHBondContact O-N 3.09Å
10D80.1Confident76.9Confident101 Ų10180 Ų8054%0.5443%0.429SS..Hα-helixtrans-62.7-38.6178.4-65.7-20.4000110.9R6 I13 S14R6-D10 WeakPolarHBondContact O-CB 3.29Å; R6-D10 VanDerWaalsContact O-CG 3.22Å; R6-D10 PolarHBondContact O-N 3.5Å; D10-I13 PolarHBondContact O-N 2.81Å; D10-S14 WeakPolarHBondContact O-CB 3.23Å; D10-S14 PolarHBondContact O-N 3.29Å; D10-S14 PolarHBondContact O-OG 3.48Å
11F83.1Confident76.5Confident79 Ų7978.6 Ų78.635%0.34642%0.421SS..Hα-helixtrans-60.9-50.1173.2-178.5-104.7000111.8T7 A8 K9 I13 S14 L15 F665 Y669T7-F11 VanDerWaalsContact O-CB 3.3Å; T7-F11 WeakPolarHBondContact O-CB 3.37Å; T7-F11 PolarHBondContact O-N 3.35Å; A8-F11 WeakPolarHBondContact O-CB 3.48Å; A8-F11 PolarHBondContact O-N 3.4Å; K9-F11 VanDerWaalsContact C-N 3.28Å; K9-F11 PolarHBondContact O-N 3.3Å; F11-I13 PolarHBondContact O-N 3.06Å; F11-S14 WeakPolarHBondContact CA-OG 3.32Å; F11-S14 WeakPolarHBondContact O-CA 3.27Å; F11-S14 WeakPolarHBondContact O-CB 3.39Å; F11-S14 PolarHBondContact O-N 3.18Å; F11-S14 PolarHBondContact O-OG 2.96Å; F11-L15 HydrophobicContact CD1-CD1 4.05Å; F11-L15 HydrophobicContact CE1-CD1 3.55Å; F11-L15 HydrophobicContact CE1-CG 4.26Å; F11-L15 HydrophobicContact CZ-CD1 3.91Å; F11-L15 HydrophobicContact CZ-CD2 4.27Å; F11-L15 HydrophobicContact CZ-CG 4.3Å; F11-L15 WeakPolarHBondContact O-CG 3.38Å; F11-L15 PolarHBondContact O-N 2.83Å; F11-F665 HydrophobicContact CE2-CE1 4.5Å; F11-F665 AromaticContact CZ-CE1 3.83Å; F11-F665 HydrophobicContact CZ-CE1 3.83Å; F11-Y669 HydrophobicContact CE2-CE2 4.31Å
12F81.2Confident76.6Confident127 Ų12771 Ų7156%0.55739%0.388SS*.Hα-helixtrans-63-39.3177-77.6-67.1000113.3A8 K9 S14 L15 N16A8-F12 WeakPolarHBondContact O-CD2 3.33Å; A8-F12 PolarHBondContact O-N 3.41Å; K9-F12 PolarHBondContact O-N 3.08Å; F12-S14 PolarHBondContact O-N 3.49Å; F12-L15 PolarHBondContact O-N 3.02Å; F12-N16 PolarHBondContact O-N 3.18Å; F12-N16 PolarHBondContact O-ND2 3.09Å
13I81.5Confident76.1Confident75 Ų7573.2 Ų73.239%0.38539%0.387SS..Hα-helixtrans-62.1-38.4173.5-69.1167.8000110.1K9 D10 F11 L15 N16K9-I13 HydrophobicContact CD-CD1 4.46Å; K9-I13 HydrophobicContact CG-CD1 3.93Å; K9-I13 VanDerWaalsContact O-CG1 3.29Å; K9-I13 WeakPolarHBondContact O-CG1 3.39Å; K9-I13 PolarHBondContact O-N 3.09Å; D10-I13 PolarHBondContact O-N 2.81Å; F11-I13 PolarHBondContact O-N 3.06Å; I13-L15 VanDerWaalsContact C-N 3.35Å; I13-L15 PolarHBondContact O-N 2.91Å; I13-N16 PolarHBondContact O-N 3.07Å
14S81.9Confident75.1Confident16 Ų1673.3 Ų73.311%0.11239%0.387CS..Hα-helixtrans-68.3-31.7179.483.30000112.8D10 F11 F12 N16 R17 Y669D10-S14 WeakPolarHBondContact O-CB 3.23Å; D10-S14 PolarHBondContact O-N 3.29Å; D10-S14 PolarHBondContact O-OG 3.48Å; F11-S14 WeakPolarHBondContact CA-OG 3.32Å; F11-S14 WeakPolarHBondContact O-CA 3.27Å; F11-S14 WeakPolarHBondContact O-CB 3.39Å; F11-S14 PolarHBondContact O-N 3.18Å; F11-S14 PolarHBondContact O-OG 2.96Å; F12-S14 PolarHBondContact O-N 3.49Å; S14-N16 VanDerWaalsContact C-N 3.32Å; S14-R17 WeakPolarHBondContact O-CG 3.42Å; S14-R17 PolarHBondContact O-NE 3.4Å; S14-R17 VanDerWaalsContact O-NE 3.08Å; S14-R17 PolarHBondContact O-NH1 3.09Å; S14-R17 PolarHBondContact O-NH2 2.92Å; S14-Y669 VanDerWaalsContact OG-CE2 3.24Å; S14-Y669 WeakPolarHBondContact OG-CE2 3.45Å; S14-Y669 PolarHBondContact OG-OH 3.29Å
15L86.3Confident74.4Confident15 Ų1574 Ų748%0.07938%0.382CS..Hα-helixtrans-73.7-23.5175.1-65.8178.2000113.4F11 F12 I13 E110 I111 Y664 F665 Y669F11-L15 HydrophobicContact CD1-CD1 4.05Å; F11-L15 HydrophobicContact CE1-CD1 3.55Å; F11-L15 HydrophobicContact CE1-CG 4.26Å; F11-L15 HydrophobicContact CZ-CD1 3.91Å; F11-L15 HydrophobicContact CZ-CD2 4.27Å; F11-L15 HydrophobicContact CZ-CG 4.3Å; F11-L15 WeakPolarHBondContact O-CG 3.38Å; F11-L15 PolarHBondContact O-N 2.83Å; F12-L15 PolarHBondContact O-N 3.02Å; I13-L15 VanDerWaalsContact C-N 3.35Å; I13-L15 PolarHBondContact O-N 2.91Å; L15-E110 WeakPolarHBondContact O-CB 3.42Å; L15-I111 HydrophobicContact CB-CB 4.22Å; L15-I111 HydrophobicContact CB-CG2 4.19Å; L15-I111 PolarHBondContact O-N 2.97Å; L15-Y664 HydrophobicContact CD2-CE1 3.77Å; L15-F665 HydrophobicContact CD2-CE1 3.97Å; L15-Y669 HydrophobicContact CD2-CD2 3.91Å; L15-Y669 HydrophobicContact CD2-CE2 3.95Å
16N87.5Confident73.4Confident78 Ų7872 Ų7242%0.41736%0.364SS..THydrogen-bonded Turntrans-100.124.1-177.4-69.6-32.3000113F12 I13 S14 K18F12-N16 PolarHBondContact O-N 3.18Å; F12-N16 PolarHBondContact O-ND2 3.09Å; I13-N16 PolarHBondContact O-N 3.07Å; S14-N16 VanDerWaalsContact C-N 3.32Å; N16-K18 PolarHBondContact O-N 3.43Å
17R87.5Confident71.8Confident9 Ų968.2 Ų68.23%0.03437%0.365CS..PPolyproline II helixtrans-58.2132.5172.1-73.8179.3-67.9-107.4-1.4109.5S14 Y105 G109 E110 E674 K678S14-R17 WeakPolarHBondContact O-CG 3.42Å; S14-R17 PolarHBondContact O-NE 3.4Å; S14-R17 VanDerWaalsContact O-NE 3.08Å; S14-R17 PolarHBondContact O-NH1 3.09Å; S14-R17 PolarHBondContact O-NH2 2.92Å; R17-Y105 WeakPolarHBondContact O-CE2 3.39Å; R17-G109 CarbonylContact O-C 3.46Å; R17-G109 VanDerWaalsContact O-CA 3.31Å; R17-G109 WeakPolarHBondContact O-CA 3.26Å; R17-E110 HydrophobicContact CB-CB 4.3Å; R17-E110 IonicContact CZ-OE1 2.97Å; R17-E110 IonicContact CZ-OE2 3.66Å; R17-E110 IonicContact NE-OE1 2.84Å; R17-E110 IonicContact NE-OE2 3.75Å; R17-E110 PolarHBondContact NE-OE2 3.29Å; R17-E110 IonicContact NH2-OE1 3.36Å; R17-E110 PolarHBondContact NH2-OE1 3.11Å; R17-E110 IonicContact NH2-OE2 2.76Å; R17-E110 PolarHBondContact NH2-OE2 3.5Å; R17-E110 WeakPolarHBondContact O-CB 3.41Å; R17-E110 PolarHBondContact O-N 3.31Å; R17-E674 HydrophobicContact CB-CB 4.12Å; R17-K678 HydrophobicContact CG-CD 4.3Å
18K86.3Confident70.3Confident60 Ų6072 Ų7226%0.26137%0.374SS..PPolyproline II helixtrans-98.2142.5173.6-67.4-178.8173.6-170.30109.5N16 Y105 I106 A107 Q428 E551N16-K18 PolarHBondContact O-N 3.43Å; K18-Y105 WeakPolarHBondContact CA-O 3.36Å; K18-I106 WeakPolarHBondContact CD-O 3.36Å; K18-A107 VanDerWaalsContact CE-O 3.27Å; K18-A107 WeakPolarHBondContact CE-O 3.42Å; K18-A107 PolarHBondContact NZ-O 3.27Å; K18-Q428 VanDerWaalsContact NZ-NE2 3.15Å; K18-E551 IonicContact NZ-OE1 2.72Å; K18-E551 PolarHBondContact NZ-OE1 3.27Å
19K82.5Confident69.2Low23 Ų2375.9 Ų75.910%0.139%0.385CS..PPolyproline II helixtrans-71.3132.6174-176.8171.2-175.1169.30110Y105 I106 D363K19-Y105 HydrophobicContact CB-CD1 3.84Å; K19-Y105 HydrophobicContact CB-CD2 3.82Å; K19-Y105 HydrophobicContact CB-CE1 4.2Å; K19-Y105 HydrophobicContact CB-CE2 4.16Å; K19-Y105 HydrophobicContact CB-CG 3.64Å; K19-Y105 HydrophobicContact CD-CD1 3.88Å; K19-Y105 HydrophobicContact CD-CE1 4.33Å; K19-Y105 HydrophobicContact CD-CG 4.38Å; K19-Y105 HydrophobicContact CG-CD1 4.39Å; K19-Y105 PolarHBondContact N-O 3.05Å; K19-Y105 VanDerWaalsContact N-O 3.15Å; K19-I106 HydrophobicContact CB-CG1 4.13Å; K19-D363 VanDerWaalsContact CE-OD1 3.28Å; K19-D363 WeakPolarHBondContact CE-OD1 3.48Å; K19-D363 VanDerWaalsContact NZ-CG 3.28Å; K19-D363 IonicContact NZ-OD1 2.78Å; K19-D363 PolarHBondContact NZ-OD1 3.36Å; K19-D363 IonicContact NZ-OD2 3.52Å; K19-D363 PolarHBondContact NZ-OD2 3.27Å
20V75Confident68.5Low51 Ų5175.4 Ų75.431%0.30938%0.384SS..  trans-107.1125.8173.6177.60000108.8E674V20-E674 PolarHBondContact N-OE1 3.43Å
21I67.7Low68.1Low52 Ų5270.8 Ų70.827%0.26736%0.359SS..  trans-94.8105.8179.1-60.6175.1000108.8V94 Q96 I106I21-V94 HydrophobicContact CD1-CG1 3.63Å; I21-Q96 VanDerWaalsContact CG2-NE2 3.33Å; I21-I106 HydrophobicContact CD1-CD1 3.45Å; I21-I106 VanDerWaalsContact CD1-CD1 3.45Å; I21-I106 HydrophobicContact CD1-CG1 4.33Å; I21-I106 HydrophobicContact CG1-CD1 4.26Å
22C57.9Low67.8Low53 Ų5374 Ų7436%0.35837%0.369SS..  trans-91.5134.1171.8-71.10000110.7S24 E25C22-S24 PolarHBondContact O-N 3.15Å; C22-S24 VanDerWaalsContact O-N 3.16Å; C22-E25 HydrophobicContact CB-CG 4.24Å; C22-E25 PolarHBondContact O-N 3.04Å
23K53.7Low67.9Low132 Ų13272.9 Ų72.957%0.57436%0.361SS*.G310 helixtrans-59.1-28.3179.4-148.1175.8-172.5177.10112.6
24S44.6Very low68.2Low87 Ų8769.9 Ų69.961%0.60835%0.347SS*.G310 helixtrans-69.7-28.6177.155.10000113.7C22 L26 S27C22-S24 PolarHBondContact O-N 3.15Å; C22-S24 VanDerWaalsContact O-N 3.16Å; S24-L26 VanDerWaalsContact C-N 3.28Å; S24-L26 PolarHBondContact O-N 3.28Å; S24-S27 PolarHBondContact O-N 3.29Å; S24-S27 PolarHBondContact O-OG 2.73Å
25E49.4Very low68.6Low110 Ų11069.2 Ų69.251%0.51434%0.342SS..G310 helixtrans-74.4-19.2-179.9-69.6-166.6147.900113.1C22 S27C22-E25 HydrophobicContact CB-CG 4.24Å; C22-E25 PolarHBondContact O-N 3.04Å; E25-S27 PolarHBondContact O-N 3.44Å
26L49.4Very low69Low40 Ų4070.8 Ų70.821%0.20935%0.352CS..G310 helixtrans-62.6-22.1175.7-125.695.7000112.6S24 K28 E30 Y434S24-L26 VanDerWaalsContact C-N 3.28Å; S24-L26 PolarHBondContact O-N 3.28Å; L26-K28 VanDerWaalsContact C-N 3.27Å; L26-K28 PolarHBondContact O-N 3.23Å; L26-E30 WeakPolarHBondContact O-CG 3.23Å; L26-Y434 HydrophobicContact CD1-CE2 4.37Å; L26-Y434 WeakPolarHBondContact CD1-OH 3.4Å; L26-Y434 WeakPolarHBondContact CD2-OH 3.47Å
27S38.3Very low69.4Low99 Ų9970.3 Ų70.369%0.69235%0.349SS*.G310 helixtrans-73.6-5.9-173.664.90000115.9S24 E25S24-S27 PolarHBondContact O-N 3.29Å; S24-S27 PolarHBondContact O-OG 2.73Å; E25-S27 PolarHBondContact O-N 3.44Å
28K47.1Very low69.8Low166 Ų16675.3 Ų75.372%0.72237%0.371SS*.SBendtrans-89.6118.5-180-76.6-176.5177.81760111.1L26 E30L26-K28 VanDerWaalsContact C-N 3.27Å; L26-K28 PolarHBondContact O-N 3.23Å; K28-E30 PolarHBondContact O-N 2.94Å; K28-E30 VanDerWaalsContact O-N 3.14Å
29E53.4Low70.3Confident124 Ų12473.6 Ų73.658%0.57937%0.365SS*.SBendtrans32.762168.4-66-174.4154.900114.8I373E29-I373 VanDerWaalsContact O-CD1 3.31Å; E29-I373 WeakPolarHBondContact O-CD1 3.42Å
30E65.4Low70.9Confident87 Ų8772.5 Ų72.541%0.40736%0.36SS..  trans-59.9143.6-177.5-63.3-173.2166.800112.6L26 K28L26-E30 WeakPolarHBondContact O-CG 3.23Å; K28-E30 PolarHBondContact O-N 2.94Å; K28-E30 VanDerWaalsContact O-N 3.14Å
31L71.5Confident72Confident3 Ų371.2 Ų71.22%0.01635%0.352CS..  trans-58.6148163.7-65.2171.9000109.6R33 E272 E273 I373 K378L31-R33 PolarHBondContact O-N 3.42Å; L31-E272 HydrophobicContact CB-CB 4.15Å; L31-E272 HydrophobicContact CD1-CB 3.89Å; L31-E272 HydrophobicContact CG-CB 4.45Å; L31-E273 HydrophobicContact CB-CG 3.6Å; L31-E273 HydrophobicContact CD1-CG 4.14Å; L31-E273 HydrophobicContact CG-CG 4.41Å; L31-I373 HydrophobicContact CD2-CD1 4.38Å; L31-K378 WeakPolarHBondContact CD2-O 3.49Å
32R75.6Confident73.4Confident146 Ų14669.1 Ų69.155%0.55134%0.343SS*.  trans-73.2114.6-174.1-173.6-176.7-177.7-176.32.9110.9C34 K378R32-C34 VanDerWaalsContact C-N 3.33Å; R32-C34 HydrophobicContact CG-CB 4.25Å; R32-C34 PolarHBondContact O-N 3Å; R32-C34 PolarHBondContact O-SG 3Å; R32-K378 HydrophobicContact CB-CB 4.21Å
33R83.7Confident75.2Confident105 Ų10567 Ų6740%0.39633%0.328SS..  trans-68.181.8172.2-66.1-173.6-167.1-167.48.5113L31 E272 E273 V274L31-R33 PolarHBondContact O-N 3.42Å; R33-E272 VanDerWaalsContact CG-O 3.27Å; R33-E272 WeakPolarHBondContact CG-O 3.04Å; R33-E273 CarbonylContact C-O 3.48Å; R33-E273 VanDerWaalsContact CA-O 3.28Å; R33-E273 WeakPolarHBondContact CA-O 3.49Å; R33-V274 WeakPolarHBondContact CD-O 3.39Å
34C86.9Confident77.2Confident11 Ų1160.8 Ų60.87%0.07430%0.301CS..  trans-116.9-15.1-175.259.20000114.4R32 R186 E273R32-C34 VanDerWaalsContact C-N 3.33Å; R32-C34 HydrophobicContact CG-CB 4.25Å; R32-C34 PolarHBondContact O-N 3Å; R32-C34 PolarHBondContact O-SG 3Å; C34-R186 HydrophobicContact CB-CB 4.28Å; C34-E273 PolarHBondContact N-O 3.48Å
35L91.3Very high79.7Confident3 Ų356.7 Ų56.72%0.01627%0.272CS..BIsolated β-bridgetrans-87.4146.8-175.1-58.3175.5000112.8D39 L40 V185 A189 T270 E273 V274 R275 F351L35-D39 HydrophobicContact CB-CB 4.43Å; L35-D39 HydrophobicContact CD2-CB 4.05Å; L35-L40 HydrophobicContact CB-CD1 3.61Å; L35-L40 HydrophobicContact CD1-CD1 3.97Å; L35-L40 HydrophobicContact CG-CD1 4.38Å; L35-V185 HydrophobicContact CD1-CG1 4.19Å; L35-V185 HydrophobicContact CD2-CG1 4.16Å; L35-V185 HydrophobicContact CG-CG1 4.31Å; L35-A189 HydrophobicContact CD2-CB 3.53Å; L35-T270 HydrophobicContact CD1-CG2 4.44Å; L35-E273 WeakPolarHBondContact CB-O 3.31Å; L35-E273 HydrophobicContact CD1-CB 3.95Å; L35-E273 HydrophobicContact CG-CB 4.34Å; L35-E273 PolarHBondContact N-O 3.47Å; L35-V274 HydrophobicContact CB-CG2 4.02Å; L35-V274 HydrophobicContact CD1-CG2 4.44Å; L35-R275 PolarHBondContact O-N 3.23Å; L35-F351 HydrophobicContact CD1-CZ 4.16Å
36T94.8Very high81.9Confident47 Ų4751.5 Ų51.529%0.28825%0.248SC..  trans-112.3171178.468.30000111.5F38 D39 L40T36-F38 PolarHBondContact O-N 3.27Å; T36-D39 WeakPolarHBondContact CB-OD2 3.32Å; T36-D39 PolarHBondContact N-OD2 2.91Å; T36-D39 PolarHBondContact O-N 3.07Å; T36-D39 PolarHBondContact OG1-N 3.29Å; T36-D39 PolarHBondContact OG1-OD2 2.76Å; T36-L40 WeakPolarHBondContact O-CD1 3.43Å; T36-L40 PolarHBondContact O-N 3.24Å
37I95.8Very high84Confident68 Ų6850.3 Ų50.335%0.34924%0.243SC..Hα-helixtrans-57-38.8175.1-56.1179.5000110.9L40 T41 A280 I283 S284I37-L40 PolarHBondContact O-N 3.3Å; I37-T41 WeakPolarHBondContact O-CB 3.23Å; I37-T41 PolarHBondContact O-N 2.84Å; I37-T41 PolarHBondContact O-OG1 2.89Å; I37-A280 HydrophobicContact CD1-CB 4.4Å; I37-A280 HydrophobicContact CG1-CB 3.62Å; I37-I283 HydrophobicContact CD1-CD1 4.43Å; I37-I283 HydrophobicContact CG2-CB 4.43Å; I37-I283 HydrophobicContact CG2-CG2 3.87Å; I37-S284 PolarHBondContact O-OG 3.01Å
38F96.2Very high86.7Confident115 Ų11545.9 Ų45.950%0.50421%0.211SC..Hα-helixtrans-64-48.2178-179.3-99.1000111.3T36 L40 T41 A42 N193 I197T36-F38 PolarHBondContact O-N 3.27Å; F38-L40 VanDerWaalsContact C-N 3.27Å; F38-L40 PolarHBondContact O-N 3.22Å; F38-T41 PolarHBondContact O-N 3.24Å; F38-A42 VanDerWaalsContact O-CB 3.3Å; F38-A42 WeakPolarHBondContact O-CB 3.38Å; F38-A42 PolarHBondContact O-N 3.48Å; F38-N193 HydrophobicContact CE1-CB 4.11Å; F38-I197 HydrophobicContact CZ-CD1 4.06Å; F38-I197 HydrophobicContact CZ-CG1 4.4Å
39D96.5Very high88.9Confident24 Ų2438 Ų3813%0.12818%0.177CC..Hα-helixtrans-59-41.3178.4-53.6-44.3000111.2L35 T36 L43 N193L35-D39 HydrophobicContact CB-CB 4.43Å; L35-D39 HydrophobicContact CD2-CB 4.05Å; T36-D39 WeakPolarHBondContact CB-OD2 3.32Å; T36-D39 PolarHBondContact N-OD2 2.91Å; T36-D39 PolarHBondContact O-N 3.07Å; T36-D39 PolarHBondContact OG1-N 3.29Å; T36-D39 PolarHBondContact OG1-OD2 2.76Å; D39-L43 VanDerWaalsContact O-CB 3.23Å; D39-L43 WeakPolarHBondContact O-CB 3.48Å; D39-L43 PolarHBondContact O-N 2.93Å; D39-N193 PolarHBondContact OD1-ND2 2.83Å
40L95.8Very high90.4Very high0 Ų032.2 Ų32.20%015%0.15CC..Hα-helixtrans-67-45.4178.8-95.860.3000112.3L35 T36 I37 F38 A42 L43 G44 I267 V274 A280 I281 S284L35-L40 HydrophobicContact CB-CD1 3.61Å; L35-L40 HydrophobicContact CD1-CD1 3.97Å; L35-L40 HydrophobicContact CG-CD1 4.38Å; T36-L40 WeakPolarHBondContact O-CD1 3.43Å; T36-L40 PolarHBondContact O-N 3.24Å; I37-L40 PolarHBondContact O-N 3.3Å; F38-L40 VanDerWaalsContact C-N 3.27Å; F38-L40 PolarHBondContact O-N 3.22Å; L40-A42 VanDerWaalsContact C-N 3.34Å; L40-L43 PolarHBondContact O-N 2.76Å; L40-G44 PolarHBondContact O-N 2.68Å; L40-I267 HydrophobicContact CB-CG2 4.11Å; L40-I267 HydrophobicContact CD2-CG2 3.77Å; L40-I267 HydrophobicContact CG-CG2 3.96Å; L40-V274 HydrophobicContact CD1-CG2 3.46Å; L40-V274 VanDerWaalsContact CD1-CG2 3.46Å; L40-V274 HydrophobicContact CD2-CG1 4.15Å; L40-V274 HydrophobicContact CD2-CG2 3.59Å; L40-V274 HydrophobicContact CG-CG2 4.09Å; L40-A280 HydrophobicContact CD2-CB 4.31Å; L40-I281 HydrophobicContact CD2-CG1 4.15Å; L40-S284 VanDerWaalsContact CB-OG 3.3Å; L40-S284 WeakPolarHBondContact CB-OG 3.27Å
41T97Very high91.2Very high23 Ų2329.7 Ų29.714%0.14114%0.144CC..Hα-helixtrans-64.3-43.6178.4-53.70000109.9I37 F38 L43 G44 V45 S284 I291I37-T41 WeakPolarHBondContact O-CB 3.23Å; I37-T41 PolarHBondContact O-N 2.84Å; I37-T41 PolarHBondContact O-OG1 2.89Å; F38-T41 PolarHBondContact O-N 3.24Å; T41-L43 PolarHBondContact O-N 3.03Å; T41-G44 PolarHBondContact O-N 2.82Å; T41-V45 HydrophobicContact CG2-CG2 4.21Å; T41-V45 WeakPolarHBondContact O-CB 3.48Å; T41-V45 WeakPolarHBondContact O-CG2 3.36Å; T41-V45 PolarHBondContact O-N 2.83Å; T41-S284 WeakPolarHBondContact OG1-CA 3.32Å; T41-S284 PolarHBondContact OG1-OG 3.3Å; T41-I291 HydrophobicContact CG2-CD1 4.07Å
42A97.3Very high91.9Very high8 Ų830.1 Ų30.17%0.06615%0.149CC..Hα-helixtrans-67.5-33.6177.400000112.9F38 L40 G46 N192 N193 T196F38-A42 VanDerWaalsContact O-CB 3.3Å; F38-A42 WeakPolarHBondContact O-CB 3.38Å; F38-A42 PolarHBondContact O-N 3.48Å; L40-A42 VanDerWaalsContact C-N 3.34Å; A42-G46 WeakPolarHBondContact O-CA 3.08Å; A42-G46 PolarHBondContact O-N 3.36Å; A42-N192 PolarHBondContact O-ND2 3.33Å; A42-N193 VanDerWaalsContact CB-OD1 3.22Å; A42-N193 WeakPolarHBondContact CB-OD1 3.3Å; A42-T196 HydrophobicContact CB-CG2 4.28Å; A42-T196 PolarHBondContact O-OG1 3.33Å
43L95.8Very high92.7Very high10 Ų1023.2 Ų23.25%0.05212%0.124CC..Hα-helixtrans-64.9-48.2171.9-178.564.8000111.3D39 L40 T41 T47 N192 I266 T270 F351D39-L43 VanDerWaalsContact O-CB 3.23Å; D39-L43 WeakPolarHBondContact O-CB 3.48Å; D39-L43 PolarHBondContact O-N 2.93Å; L40-L43 PolarHBondContact O-N 2.76Å; T41-L43 PolarHBondContact O-N 3.03Å; L43-T47 WeakPolarHBondContact O-CB 3.22Å; L43-T47 PolarHBondContact O-N 2.93Å; L43-T47 PolarHBondContact O-OG1 3.24Å; L43-N192 WeakPolarHBondContact CA-ND2 3.21Å; L43-N192 PolarHBondContact N-ND2 2.85Å; L43-I266 HydrophobicContact CD2-CG2 3.84Å; L43-I266 HydrophobicContact CG-CG2 3.99Å; L43-T270 HydrophobicContact CD2-CG2 3.96Å; L43-F351 HydrophobicContact CD2-CD1 4.11Å; L43-F351 HydrophobicContact CD2-CE1 4.09Å; L43-F351 HydrophobicContact CD2-CZ 4.48Å
44G96.1Very high93Very high0 Ų018.8 Ų18.80%011%0.107CC..Hα-helixtrans-62.6-50176.600000112.5L40 T41 T47 T48L40-G44 PolarHBondContact O-N 2.68Å; T41-G44 PolarHBondContact O-N 2.82Å; G44-T47 PolarHBondContact O-N 2.97Å; G44-T48 VanDerWaalsContact O-CB 3.24Å; G44-T48 WeakPolarHBondContact O-CB 3.48Å; G44-T48 PolarHBondContact O-N 3.43Å; G44-T48 PolarHBondContact O-OG1 3.47Å
45V97Very high93Very high2 Ų220.8 Ų20.81%0.01212%0.116CC..Hα-helixtrans-64-46.7-179.5171.30000111.1T41 T47 T48 L49 T196 L200 C288 I291T41-V45 HydrophobicContact CG2-CG2 4.21Å; T41-V45 WeakPolarHBondContact O-CB 3.48Å; T41-V45 WeakPolarHBondContact O-CG2 3.36Å; T41-V45 PolarHBondContact O-N 2.83Å; V45-T47 PolarHBondContact O-N 2.9Å; V45-T48 PolarHBondContact O-N 2.91Å; V45-L49 HydrophobicContact CG1-CD1 3.5Å; V45-L49 HydrophobicContact CG1-CG 4.06Å; V45-L49 WeakPolarHBondContact O-CB 2.95Å; V45-L49 WeakPolarHBondContact O-CG 3.31Å; V45-L49 PolarHBondContact O-N 3.41Å; V45-T196 HydrophobicContact CB-CG2 4.25Å; V45-T196 HydrophobicContact CG1-CG2 4Å; V45-L200 HydrophobicContact CG1-CD1 4.29Å; V45-L200 HydrophobicContact CG1-CD2 4.06Å; V45-L200 HydrophobicContact CG1-CG 4.44Å; V45-C288 HydrophobicContact CG2-CB 4.09Å; V45-C288 PolarHBondContact N-SG 3.15Å; V45-C288 VanDerWaalsContact N-SG 3.39Å; V45-I291 HydrophobicContact CG1-CG2 3.87Å; V45-I291 HydrophobicContact CG2-CB 3.98Å; V45-I291 HydrophobicContact CG2-CD1 4.04Å; V45-I291 HydrophobicContact CG2-CG2 3.98Å
46G94.9Very high92.9Very high0 Ų022.3 Ų22.30%012%0.124CC..Hα-helixtrans-59.1-38.1178.500000112A42 T196 T344 S345A42-G46 WeakPolarHBondContact O-CA 3.08Å; A42-G46 PolarHBondContact O-N 3.36Å; G46-T196 WeakPolarHBondContact CA-OG1 3.21Å; G46-T344 WeakPolarHBondContact CA-OG1 3.4Å; G46-T344 PolarHBondContact O-OG1 3.5Å; G46-S345 PolarHBondContact O-OG 3.41Å
47T94.3Very high92.9Very high16 Ų1620.1 Ų20.110%0.09811%0.111CC..Hα-helixtrans-75.1-47.2178.3-48.40000112.8L43 G44 V45 I266 S345 G348L43-T47 WeakPolarHBondContact O-CB 3.22Å; L43-T47 PolarHBondContact O-N 2.93Å; L43-T47 PolarHBondContact O-OG1 3.24Å; G44-T47 PolarHBondContact O-N 2.97Å; V45-T47 PolarHBondContact O-N 2.9Å; T47-I266 HydrophobicContact CG2-CD1 3.24Å; T47-S345 PolarHBondContact O-OG 2.86Å; T47-G348 WeakPolarHBondContact OG1-CA 3.4Å
48T93.7Very high92.7Very high6 Ų617 Ų174%0.03710%0.095CC..Hα-helixtrans-71-38.6-172.3-53.50000112.2G44 V45 A260 C292 Y296G44-T48 VanDerWaalsContact O-CB 3.24Å; G44-T48 WeakPolarHBondContact O-CB 3.48Å; G44-T48 PolarHBondContact O-N 3.43Å; G44-T48 PolarHBondContact O-OG1 3.47Å; V45-T48 PolarHBondContact O-N 2.91Å; T48-A260 WeakPolarHBondContact CG2-O 3.5Å; T48-C292 HydrophobicContact CG2-CB 4.17Å; T48-Y296 PolarHBondContact O-OH 3.23Å
49L93.1Very high92.5Very high0 Ų014.2 Ų14.20%09%0.086CC..Hα-helixtrans-67.6-52.1176.9-70.8178.2000111.9V45 G52 V53 L200 I203 C292 A295 Y296V45-L49 HydrophobicContact CG1-CD1 3.5Å; V45-L49 HydrophobicContact CG1-CG 4.06Å; V45-L49 WeakPolarHBondContact O-CB 2.95Å; V45-L49 WeakPolarHBondContact O-CG 3.31Å; V45-L49 PolarHBondContact O-N 3.41Å; L49-G52 WeakPolarHBondContact O-CA 3.43Å; L49-G52 PolarHBondContact O-N 3.49Å; L49-V53 HydrophobicContact CB-CG1 4.49Å; L49-V53 PolarHBondContact O-N 2.94Å; L49-L200 HydrophobicContact CD1-CD2 3.69Å; L49-I203 HydrophobicContact CD1-CD1 3.74Å; L49-C292 HydrophobicContact CD2-CB 4.2Å; L49-A295 HydrophobicContact CD2-CB 3.62Å; L49-Y296 HydrophobicContact CD2-CD2 4.41Å; L49-Y296 HydrophobicContact CD2-CE2 4.06Å; L49-Y296 PolarHBondContact O-OH 3.47Å
50G86Confident92.3Very high2 Ų213.1 Ų13.12%0.0218%0.08CC..Hα-helixtrans34.2-132.4167.400000117.7G52 S345G50-G52 PolarHBondContact O-N 2.84Å; G50-S345 WeakPolarHBondContact CA-OG 3.44Å
51A82.5Confident92.3Very high34 Ų3413.1 Ų13.128%0.2818%0.08SC..Hα-helixtrans-66.9-25.2172.400000112.6V53 Y54 I55 L342A51-V53 PolarHBondContact O-N 3Å; A51-Y54 PolarHBondContact O-N 3.31Å; A51-I55 HydrophobicContact CB-CD1 4.26Å; A51-I55 WeakPolarHBondContact O-CB 3.09Å; A51-I55 PolarHBondContact O-N 3.03Å; A51-L342 HydrophobicContact CB-CD2 3.66Å
52G86.4Confident92.1Very high12 Ų1214 Ų1412%0.1248%0.081CC..Iπ-helixtrans-60.1-48-172.500000112.4L49 G50 Y54 L56 V57 Y296L49-G52 WeakPolarHBondContact O-CA 3.43Å; L49-G52 PolarHBondContact O-N 3.49Å; G50-G52 PolarHBondContact O-N 2.84Å; G52-Y54 VanDerWaalsContact C-N 3.28Å; G52-Y54 PolarHBondContact O-N 2.7Å; G52-L56 VanDerWaalsContact O-CB 3.23Å; G52-L56 WeakPolarHBondContact O-CB 3.43Å; G52-L56 PolarHBondContact O-N 3.29Å; G52-L56 VanDerWaalsContact O-N 3.07Å; G52-V57 PolarHBondContact O-N 3Å; G52-Y296 VanDerWaalsContact C-CE1 3.48Å; G52-Y296 WeakPolarHBondContact CA-OH 3.37Å
53V92.1Very high91.8Very high1 Ų118.4 Ų18.41%0.00610%0.1CC..Iπ-helixtrans-70.4-27.4-172.773.90000112.6L49 A51 I203 Y296 I299L49-V53 HydrophobicContact CB-CG1 4.49Å; L49-V53 PolarHBondContact O-N 2.94Å; A51-V53 PolarHBondContact O-N 3Å; V53-I203 HydrophobicContact CG1-CD1 4.14Å; V53-I203 HydrophobicContact CG2-CD1 4.24Å; V53-I203 HydrophobicContact CG2-CG1 4.45Å; V53-Y296 HydrophobicContact CB-CD1 4.32Å; V53-Y296 HydrophobicContact CB-CE1 3.89Å; V53-Y296 HydrophobicContact CG2-CD1 4.42Å; V53-Y296 HydrophobicContact CG2-CE1 4.48Å; V53-I299 HydrophobicContact CG2-CB 4.19Å; V53-I299 HydrophobicContact CG2-CG1 3.81Å; V53-I299 HydrophobicContact CG2-CG2 4.18Å
54Y89.7Confident91.5Very high12 Ų1219.3 Ų19.35%0.04711%0.105CC..Iπ-helixtrans-94.5-31.3-176.2-68.6-77.2000114A51 G52 N199 L318 I334 G337 A338 A341A51-Y54 PolarHBondContact O-N 3.31Å; G52-Y54 VanDerWaalsContact C-N 3.28Å; G52-Y54 PolarHBondContact O-N 2.7Å; Y54-N199 WeakPolarHBondContact CE2-OD1 3.19Å; Y54-N199 PolarHBondContact OH-OD1 2.85Å; Y54-L318 HydrophobicContact CD1-CD1 3.88Å; Y54-L318 HydrophobicContact CE1-CD1 4.24Å; Y54-I334 HydrophobicContact CD1-CG2 4.18Å; Y54-I334 HydrophobicContact CE1-CG2 3.95Å; Y54-G337 VanDerWaalsContact OH-C 3.27Å; Y54-G337 WeakPolarHBondContact OH-CA 3.39Å; Y54-A338 HydrophobicContact CD1-CB 3.76Å; Y54-A338 HydrophobicContact CD2-CB 3.89Å; Y54-A338 HydrophobicContact CE1-CB 4.05Å; Y54-A338 HydrophobicContact CE2-CB 4.18Å; Y54-A338 HydrophobicContact CG-CB 3.69Å; Y54-A341 HydrophobicContact CD2-CB 4.11Å; Y54-A341 HydrophobicContact CE2-CB 3.64Å
55I86.9Confident91.5Very high53 Ų5319.3 Ų19.327%0.27211%0.106SC..Iπ-helixtrans-111.8-57.1-172.9-54.4177.7000110.4A51 V57 G58 D59A51-I55 HydrophobicContact CB-CD1 4.26Å; A51-I55 WeakPolarHBondContact O-CB 3.09Å; A51-I55 PolarHBondContact O-N 3.03Å; I55-V57 PolarHBondContact O-N 3.45Å; I55-G58 PolarHBondContact O-N 3.32Å; I55-D59 PolarHBondContact O-N 3.4Å; I55-D59 VanDerWaalsContact O-N 3.17Å
56L89.1Confident91.3Very high35 Ų3519.2 Ų19.218%0.18311%0.105CC..Iπ-helixtrans-63.8-39.6-169.3-166.968.6000113.1G52 G58 D59 V60 T256 A260G52-L56 VanDerWaalsContact O-CB 3.23Å; G52-L56 WeakPolarHBondContact O-CB 3.43Å; G52-L56 PolarHBondContact O-N 3.29Å; G52-L56 VanDerWaalsContact O-N 3.07Å; L56-G58 VanDerWaalsContact C-N 3.28Å; L56-G58 PolarHBondContact O-N 3.27Å; L56-D59 PolarHBondContact O-N 3.14Å; L56-V60 HydrophobicContact CD1-CG2 4.12Å; L56-V60 HydrophobicContact CG-CG2 4.1Å; L56-V60 WeakPolarHBondContact O-CG2 3.46Å; L56-V60 PolarHBondContact O-N 3.04Å; L56-T256 HydrophobicContact CD1-CG2 3.58Å; L56-T256 HydrophobicContact CG-CG2 4.39Å; L56-A260 HydrophobicContact CD2-CB 3.5Å; L56-A260 VanDerWaalsContact CD2-CB 3.5Å
57V94Very high91.4Very high2 Ų219.2 Ų19.21%0.01211%0.105CC..Hα-helixtrans-57.4-44.6179.5-179.60000110.9G52 I55 A61 F73 Y296 I299 S300 L303G52-V57 PolarHBondContact O-N 3Å; I55-V57 PolarHBondContact O-N 3.45Å; V57-A61 WeakPolarHBondContact O-CB 3.44Å; V57-A61 PolarHBondContact O-N 2.99Å; V57-F73 HydrophobicContact CB-CE2 4.26Å; V57-F73 HydrophobicContact CB-CZ 4.49Å; V57-F73 HydrophobicContact CG1-CE2 4.3Å; V57-F73 HydrophobicContact CG2-CE2 3.72Å; V57-F73 HydrophobicContact CG2-CZ 3.66Å; V57-Y296 HydrophobicContact CG2-CD1 3.91Å; V57-Y296 HydrophobicContact CG2-CE1 4.39Å; V57-I299 HydrophobicContact CB-CG2 4.43Å; V57-I299 HydrophobicContact CG1-CG2 4.15Å; V57-I299 HydrophobicContact CG2-CG2 4.24Å; V57-S300 WeakPolarHBondContact CG1-OG 3.4Å; V57-L303 HydrophobicContact CG1-CD2 4.15Å
58G93.1Very high91.5Very high1 Ų118.5 Ų18.51%0.0110%0.1CC..Hα-helixtrans-71.2-40.3-179.200000113.2I55 L56 K62I55-G58 PolarHBondContact O-N 3.32Å; L56-G58 VanDerWaalsContact C-N 3.28Å; L56-G58 PolarHBondContact O-N 3.27Å; G58-K62 VanDerWaalsContact O-CB 3.32Å; G58-K62 WeakPolarHBondContact O-CB 3.41Å; G58-K62 PolarHBondContact O-N 2.94Å
59D91.4Very high91.6Very high58 Ų5818.2 Ų18.231%0.3110%0.099SC..Hα-helixtrans-63.4-51.2179.2-16867.6000111.8I55 L56 A61 K62 F63I55-D59 PolarHBondContact O-N 3.4Å; I55-D59 VanDerWaalsContact O-N 3.17Å; L56-D59 PolarHBondContact O-N 3.14Å; D59-A61 PolarHBondContact O-N 3.18Å; D59-K62 PolarHBondContact O-N 3.17Å; D59-F63 PolarHBondContact O-N 3.19Å; D59-F63 WeakPolarHBondContact OD1-CD2 3.47Å
60V92.9Very high91.8Very high0 Ų019.9 Ų19.90%011%0.107CC..Hα-helixtrans-65.9-38.9178.3179.90000111.3L56 K62 T64 A65 V69 T256L56-V60 HydrophobicContact CD1-CG2 4.12Å; L56-V60 HydrophobicContact CG-CG2 4.1Å; L56-V60 WeakPolarHBondContact O-CG2 3.46Å; L56-V60 PolarHBondContact O-N 3.04Å; V60-K62 VanDerWaalsContact C-N 3.32Å; V60-K62 PolarHBondContact O-N 2.86Å; V60-T64 PolarHBondContact O-N 2.91Å; V60-T64 VanDerWaalsContact O-N 3.11Å; V60-A65 HydrophobicContact CG1-CB 4.06Å; V60-A65 PolarHBondContact O-N 3.21Å; V60-V69 HydrophobicContact CB-CG2 4.03Å; V60-V69 HydrophobicContact CG1-CB 4.48Å; V60-V69 HydrophobicContact CG1-CG2 3.73Å; V60-T256 HydrophobicContact CG2-CG2 3.62Å
61A94.9Very high92.3Very high0 Ų022.7 Ų22.70%012%0.121CC..Iπ-helixtrans-61.3-41175.100000111.7V57 D59 G66 V69 T304 I312V57-A61 WeakPolarHBondContact O-CB 3.44Å; V57-A61 PolarHBondContact O-N 2.99Å; D59-A61 PolarHBondContact O-N 3.18Å; A61-G66 WeakPolarHBondContact O-CA 3.18Å; A61-G66 PolarHBondContact O-N 3.49Å; A61-V69 HydrophobicContact CB-CB 4.38Å; A61-V69 HydrophobicContact CB-CG1 4.03Å; A61-T304 HydrophobicContact CB-CG2 4.06Å; A61-I312 HydrophobicContact CB-CD1 3.86Å
62K93Very high92.9Very high41 Ų4121.1 Ų21.118%0.17811%0.108CC..Iπ-helixtrans-75.5-49.4-176.5-175178.8-170.8163.70113.1G58 D59 V60 Y310 I312G58-K62 VanDerWaalsContact O-CB 3.32Å; G58-K62 WeakPolarHBondContact O-CB 3.41Å; G58-K62 PolarHBondContact O-N 2.94Å; D59-K62 PolarHBondContact O-N 3.17Å; V60-K62 VanDerWaalsContact C-N 3.32Å; V60-K62 PolarHBondContact O-N 2.86Å; K62-Y310 WeakPolarHBondContact CE-O 3.47Å; K62-I312 HydrophobicContact CB-CB 4.44Å; K62-I312 WeakPolarHBondContact CD-O 3.49Å; K62-I312 VanDerWaalsContact CE-O 3.32Å; K62-I312 WeakPolarHBondContact CE-O 3.02Å; K62-I312 PolarHBondContact NZ-O 2.89Å
63F90.5Very high93.4Very high102 Ų10220.5 Ų20.545%0.44710%0.102SC..Iπ-helixtrans-106-10.9-164.7-64-60.2000114.7D59D59-F63 PolarHBondContact O-N 3.19Å; D59-F63 WeakPolarHBondContact OD1-CD2 3.47Å
64T90.9Very high93.6Very high28 Ų2824.4 Ų24.417%0.17212%0.122CC..Iπ-helixtrans-130.3-48.7-168.1-42.90000114.1V60 F245 G249V60-T64 PolarHBondContact O-N 2.91Å; V60-T64 VanDerWaalsContact O-N 3.11Å; T64-F245 WeakPolarHBondContact O-CB 2.83Å; T64-F245 WeakPolarHBondContact O-CD2 3.25Å; T64-F245 WeakPolarHBondContact O-CG 3.32Å; T64-G249 CarbonylContact O-C 3.51Å; T64-G249 WeakPolarHBondContact O-CA 3.33Å
65A94.3Very high93.9Very high1 Ų127.1 Ų27.11%0.00814%0.137CC..Iπ-helixtrans-122.8-17.2-168.600000114.5V60 G68 V69V60-A65 HydrophobicContact CG1-CB 4.06Å; V60-A65 PolarHBondContact O-N 3.21Å; A65-G68 WeakPolarHBondContact O-CA 3.5Å; A65-G68 PolarHBondContact O-N 3.06Å; A65-G68 VanDerWaalsContact O-N 3.15Å; A65-V69 HydrophobicContact CB-CB 4.05Å
66G94Very high94.2Very high0 Ų024.6 Ų24.60%012%0.124CC..G310 helixtrans63.4-148.1-171.900000111.8A61 G68 V69A61-G66 WeakPolarHBondContact O-CA 3.18Å; A61-G66 PolarHBondContact O-N 3.49Å; G66-G68 PolarHBondContact O-N 3.35Å; G66-V69 VanDerWaalsContact O-CB 3.3Å; G66-V69 WeakPolarHBondContact O-CB 3.48Å; G66-V69 WeakPolarHBondContact O-CG1 3.33Å; G66-V69 PolarHBondContact O-N 3.3Å
67P96Very high94.5Very high0 Ų023.2 Ų23.20%012%0.118CC..G310 helixtrans-54.9-26.5167.3-26.937.6000114V69 I70 W219 F242P67-V69 PolarHBondContact O-N 2.92Å; P67-I70 WeakPolarHBondContact O-CD1 3.49Å; P67-I70 WeakPolarHBondContact O-CG1 3.41Å; P67-I70 PolarHBondContact O-N 2.76Å; P67-W219 HydrophobicContact CB-CD2 4.34Å; P67-W219 HydrophobicContact CB-CG 4.02Å; P67-W219 HydrophobicContact CG-CB 4.46Å; P67-W219 HydrophobicContact CG-CG 4.09Å; P67-F242 HydrophobicContact CB-CD2 3.42Å; P67-F242 VanDerWaalsContact CB-CD2 3.42Å; P67-F242 HydrophobicContact CB-CE2 3.61Å; P67-F242 HydrophobicContact CB-CG 3.96Å; P67-F242 HydrophobicContact CB-CZ 4.3Å; P67-F242 HydrophobicContact CG-CD2 4.42Å
68G96.5Very high94.6Very high0 Ų027.1 Ų27.10%014%0.141CC..G310 helixtrans-57.9-11.8172.400000115A65 G66 I70 I71 S72 F242A65-G68 WeakPolarHBondContact O-CA 3.5Å; A65-G68 PolarHBondContact O-N 3.06Å; A65-G68 VanDerWaalsContact O-N 3.15Å; G66-G68 PolarHBondContact O-N 3.35Å; G68-I70 PolarHBondContact O-N 2.99Å; G68-I70 VanDerWaalsContact O-N 3.11Å; G68-I71 WeakPolarHBondContact O-CA 3.35Å; G68-I71 WeakPolarHBondContact O-CB 3.45Å; G68-I71 PolarHBondContact O-N 2.89Å; G68-S72 PolarHBondContact O-N 3.42Å; G68-S72 VanDerWaalsContact O-N 3.1Å; G68-F242 PolarHBondContact N-O 3.37Å
69V96.5Very high94.6Very high0 Ų027.3 Ų27.30%014%0.143CC..Hα-helixtrans-54.1-27.8172.769.70000112.9V60 A61 A65 G66 P67 I71 S72 F73 T304V60-V69 HydrophobicContact CB-CG2 4.03Å; V60-V69 HydrophobicContact CG1-CB 4.48Å; V60-V69 HydrophobicContact CG1-CG2 3.73Å; A61-V69 HydrophobicContact CB-CB 4.38Å; A61-V69 HydrophobicContact CB-CG1 4.03Å; A65-V69 HydrophobicContact CB-CB 4.05Å; G66-V69 VanDerWaalsContact O-CB 3.3Å; G66-V69 WeakPolarHBondContact O-CB 3.48Å; G66-V69 WeakPolarHBondContact O-CG1 3.33Å; G66-V69 PolarHBondContact O-N 3.3Å; P67-V69 PolarHBondContact O-N 2.92Å; V69-I71 VanDerWaalsContact C-N 3.31Å; V69-I71 PolarHBondContact O-N 3.46Å; V69-S72 WeakPolarHBondContact O-CB 3.48Å; V69-S72 PolarHBondContact O-N 3.31Å; V69-F73 HydrophobicContact CG2-CD2 3.8Å; V69-F73 HydrophobicContact CG2-CE2 3.71Å; V69-F73 WeakPolarHBondContact O-CD2 3.42Å; V69-F73 PolarHBondContact O-N 3.25Å; V69-T304 HydrophobicContact CG1-CG2 4.02Å
70I96.9Very high94.7Very high36 Ų3624.6 Ų24.619%0.18513%0.128CC..Hα-helixtrans-60.2-44.1174.2-58.1159.3000110.4P67 G68 F73 L74 W219 F242 V301P67-I70 WeakPolarHBondContact O-CD1 3.49Å; P67-I70 WeakPolarHBondContact O-CG1 3.41Å; P67-I70 PolarHBondContact O-N 2.76Å; G68-I70 PolarHBondContact O-N 2.99Å; G68-I70 VanDerWaalsContact O-N 3.11Å; I70-F73 PolarHBondContact O-N 3.23Å; I70-L74 PolarHBondContact O-N 2.98Å; I70-W219 HydrophobicContact CD1-CH2 4.02Å; I70-W219 HydrophobicContact CD1-CZ2 3.71Å; I70-F242 HydrophobicContact CD1-CE2 4.27Å; I70-F242 HydrophobicContact CD1-CZ 4.19Å; I70-V301 HydrophobicContact CD1-CB 4.36Å; I70-V301 HydrophobicContact CD1-CG2 3.56Å; I70-V301 HydrophobicContact CG1-CG2 3.84Å; I70-V301 HydrophobicContact CG2-CG2 4.2Å
71I96.8Very high94.9Very high61 Ų6127.4 Ų27.431%0.31315%0.146SC..Hα-helixtrans-71.3-37.2177.3-56.5-175.2000109.8G68 V69 F73 L74 I75 F242 F243 V250G68-I71 WeakPolarHBondContact O-CA 3.35Å; G68-I71 WeakPolarHBondContact O-CB 3.45Å; G68-I71 PolarHBondContact O-N 2.89Å; V69-I71 VanDerWaalsContact C-N 3.31Å; V69-I71 PolarHBondContact O-N 3.46Å; I71-F73 PolarHBondContact O-N 2.88Å; I71-L74 WeakPolarHBondContact O-CB 3.31Å; I71-L74 PolarHBondContact O-N 3.45Å; I71-I75 HydrophobicContact CG2-CD1 3.93Å; I71-I75 HydrophobicContact CG2-CG1 4.32Å; I71-I75 WeakPolarHBondContact O-CG1 3.29Å; I71-I75 PolarHBondContact O-N 3.45Å; I71-F242 HydrophobicContact CD1-CE1 4.08Å; I71-F242 HydrophobicContact CG1-CE1 4.44Å; I71-F243 HydrophobicContact CD1-CE1 3.89Å; I71-F243 HydrophobicContact CD1-CZ 3.86Å; I71-V250 HydrophobicContact CB-CG1 3.86Å; I71-V250 HydrophobicContact CG2-CG1 3.78Å
72S95.9Very high94.9Very high0 Ų028.6 Ų28.60%015%0.152CC..Hα-helixtrans-56.9-47.3173.6-59.90000112.2G68 V69 I75 A76 V250G68-S72 PolarHBondContact O-N 3.42Å; G68-S72 VanDerWaalsContact O-N 3.1Å; V69-S72 WeakPolarHBondContact O-CB 3.48Å; V69-S72 PolarHBondContact O-N 3.31Å; S72-I75 PolarHBondContact O-N 3.12Å; S72-A76 WeakPolarHBondContact O-CB 3.24Å; S72-A76 PolarHBondContact O-N 3.49Å; S72-V250 PolarHBondContact OG-O 3.1Å
73F96.6Very high95Very high0 Ų026.7 Ų26.70%014%0.144CC..Hα-helixtrans-67.7-33.5175.6-84.7-70.6000113.2V57 V69 I70 I71 A76 A77 C257 A260 F261 Y296 S300V57-F73 HydrophobicContact CB-CE2 4.26Å; V57-F73 HydrophobicContact CB-CZ 4.49Å; V57-F73 HydrophobicContact CG1-CE2 4.3Å; V57-F73 HydrophobicContact CG2-CE2 3.72Å; V57-F73 HydrophobicContact CG2-CZ 3.66Å; V69-F73 HydrophobicContact CG2-CD2 3.8Å; V69-F73 HydrophobicContact CG2-CE2 3.71Å; V69-F73 WeakPolarHBondContact O-CD2 3.42Å; V69-F73 PolarHBondContact O-N 3.25Å; I70-F73 PolarHBondContact O-N 3.23Å; I71-F73 PolarHBondContact O-N 2.88Å; F73-A76 PolarHBondContact O-N 2.93Å; F73-A77 VanDerWaalsContact O-CB 3.28Å; F73-A77 WeakPolarHBondContact O-CB 3.29Å; F73-A77 PolarHBondContact O-N 3.24Å; F73-C257 HydrophobicContact CD1-CB 3.75Å; F73-C257 HydrophobicContact CE1-CB 3.82Å; F73-C257 VanDerWaalsContact CE2-SG 3.56Å; F73-C257 HydrophobicContact CG-CB 4.15Å; F73-C257 HydrophobicContact CZ-CB 4.27Å; F73-A260 HydrophobicContact CE1-CB 3.69Å; F73-A260 HydrophobicContact CZ-CB 4.47Å; F73-F261 AromaticContact CD1-CE2 3.84Å; F73-F261 HydrophobicContact CD1-CE2 3.84Å; F73-F261 HydrophobicContact CD1-CZ 4.47Å; F73-Y296 HydrophobicContact CD1-CD1 4.06Å; F73-Y296 HydrophobicContact CD1-CD2 4.28Å; F73-Y296 AromaticContact CD1-CG 3.74Å; F73-Y296 HydrophobicContact CD1-CG 3.74Å; F73-Y296 AromaticContact CE1-CD1 3.4Å; F73-Y296 HydrophobicContact CE1-CD1 3.4Å; F73-Y296 VanDerWaalsContact CE1-CD1 3.4Å; F73-Y296 HydrophobicContact CE1-CD2 4.16Å; F73-Y296 AromaticContact CE1-CE1 3.92Å; F73-Y296 HydrophobicContact CE1-CE1 3.92Å; F73-Y296 AromaticContact CE1-CG 3.55Å; F73-Y296 HydrophobicContact CE1-CG 3.55Å; F73-Y296 AromaticContact CZ-CD1 3.68Å; F73-Y296 HydrophobicContact CZ-CD1 3.68Å; F73-Y296 HydrophobicContact CZ-CE1 4.21Å; F73-Y296 HydrophobicContact CZ-CG 4.22Å; F73-S300 WeakPolarHBondContact CD2-OG 3.37Å; F73-S300 WeakPolarHBondContact CE2-OG 3.37Å
74L96.1Very high95.3Very high82 Ų8221.9 Ų21.943%0.42912%0.123SC..Hα-helixtrans-63.2-47.4173.7177.964.3000111.5I70 I71 A76 A77 V78 F293I70-L74 PolarHBondContact O-N 2.98Å; I71-L74 WeakPolarHBondContact O-CB 3.31Å; I71-L74 PolarHBondContact O-N 3.45Å; L74-A76 VanDerWaalsContact C-N 3.34Å; L74-A77 PolarHBondContact O-N 3.5Å; L74-V78 WeakPolarHBondContact O-CG2 3.3Å; L74-V78 PolarHBondContact O-N 2.88Å; L74-F293 HydrophobicContact CB-CE2 4.34Å; L74-F293 HydrophobicContact CD1-CE2 3.53Å; L74-F293 HydrophobicContact CD1-CZ 3.67Å
75I94.5Very high95.5Very high69 Ų6921.7 Ų21.735%0.35412%0.121SC..Hα-helixtrans-61.8-45.5177.2-66.1167.9000110.1I71 S72 A77 V78 A79 V250 L251 A254I71-I75 HydrophobicContact CG2-CD1 3.93Å; I71-I75 HydrophobicContact CG2-CG1 4.32Å; I71-I75 WeakPolarHBondContact O-CG1 3.29Å; I71-I75 PolarHBondContact O-N 3.45Å; S72-I75 PolarHBondContact O-N 3.12Å; I75-A77 PolarHBondContact O-N 3.29Å; I75-V78 PolarHBondContact O-N 3.39Å; I75-A79 WeakPolarHBondContact O-CB 3.33Å; I75-A79 PolarHBondContact O-N 2.91Å; I75-V250 HydrophobicContact CD1-CG1 4.43Å; I75-L251 HydrophobicContact CD1-CD2 4.2Å; I75-A254 HydrophobicContact CB-CB 3.89Å; I75-A254 HydrophobicContact CD1-CB 4.41Å; I75-A254 HydrophobicContact CG2-CB 3.79Å
76A94.1Very high95.6Very high1 Ų121.6 Ų21.61%0.00812%0.12CC..Hα-helixtrans-60.4-41.9176.600000112.6S72 F73 L74 A79 S80 C257 F258 F261S72-A76 WeakPolarHBondContact O-CB 3.24Å; S72-A76 PolarHBondContact O-N 3.49Å; F73-A76 PolarHBondContact O-N 2.93Å; L74-A76 VanDerWaalsContact C-N 3.34Å; A76-A79 WeakPolarHBondContact O-CB 3.31Å; A76-A79 PolarHBondContact O-N 2.9Å; A76-S80 PolarHBondContact O-N 3.32Å; A76-S80 PolarHBondContact O-OG 2.93Å; A76-C257 HydrophobicContact CB-CB 3.68Å; A76-F258 HydrophobicContact CB-CB 4.39Å; A76-F261 HydrophobicContact CB-CD2 3.84Å; A76-F261 HydrophobicContact CB-CE2 3.89Å
77A96Very high95.7Very high6 Ų621.7 Ų21.75%0.0512%0.12CC..Hα-helixtrans-62.7-45.6177.300000111.8F73 L74 I75 A79 S80 V81 F261 F293F73-A77 VanDerWaalsContact O-CB 3.28Å; F73-A77 WeakPolarHBondContact O-CB 3.29Å; F73-A77 PolarHBondContact O-N 3.24Å; L74-A77 PolarHBondContact O-N 3.5Å; I75-A77 PolarHBondContact O-N 3.29Å; A77-A79 VanDerWaalsContact C-N 3.34Å; A77-A79 PolarHBondContact O-N 2.8Å; A77-S80 PolarHBondContact O-N 3.32Å; A77-V81 VanDerWaalsContact O-CG2 3.31Å; A77-V81 WeakPolarHBondContact O-CG2 3.33Å; A77-V81 PolarHBondContact O-N 3.2Å; A77-F261 HydrophobicContact CB-CE1 3.97Å; A77-F261 HydrophobicContact CB-CE2 3.91Å; A77-F261 HydrophobicContact CB-CZ 3.51Å; A77-F293 HydrophobicContact CB-CB 4.01Å; A77-F293 HydrophobicContact CB-CD2 3.45Å; A77-F293 VanDerWaalsContact CB-CD2 3.45Å; A77-F293 HydrophobicContact CB-CE2 4.26Å; A77-F293 HydrophobicContact CB-CG 3.98Å
78V94.6Very high95.6Very high83 Ų8321.7 Ų21.750%0.50312%0.12SC..Hα-helixtrans-60.3-46.2177172.60000110.4L74 I75 S80 V81 L82L74-V78 WeakPolarHBondContact O-CG2 3.3Å; L74-V78 PolarHBondContact O-N 2.88Å; I75-V78 PolarHBondContact O-N 3.39Å; V78-S80 VanDerWaalsContact C-N 3.35Å; V78-S80 PolarHBondContact O-N 3.32Å; V78-V81 PolarHBondContact O-N 3.4Å; V78-L82 WeakPolarHBondContact O-CG 3.44Å; V78-L82 PolarHBondContact O-N 3.31Å; V78-L82 VanDerWaalsContact O-N 3.17Å
79A93.4Very high95.4Very high6 Ų621.7 Ų21.75%0.0512%0.12CC..Hα-helixtrans-57.3-45.917600000112.6I75 A76 A77 L82 S83 F258 I637I75-A79 WeakPolarHBondContact O-CB 3.33Å; I75-A79 PolarHBondContact O-N 2.91Å; A76-A79 WeakPolarHBondContact O-CB 3.31Å; A76-A79 PolarHBondContact O-N 2.9Å; A77-A79 VanDerWaalsContact C-N 3.34Å; A77-A79 PolarHBondContact O-N 2.8Å; A79-L82 PolarHBondContact O-N 3.36Å; A79-S83 PolarHBondContact O-N 3.21Å; A79-F258 HydrophobicContact CB-CD2 3.68Å; A79-F258 HydrophobicContact CB-CE2 3.73Å; A79-I637 HydrophobicContact CB-CD1 3.75Å; A79-I637 HydrophobicContact CB-CG2 3.87Å
80S94.8Very high95Very high0 Ų021.7 Ų21.70%012%0.12CC..Hα-helixtrans-70.8-33.3-179.4-650000112.8A76 A77 V78 S83 G84 F258 F261A76-S80 PolarHBondContact O-N 3.32Å; A76-S80 PolarHBondContact O-OG 2.93Å; A77-S80 PolarHBondContact O-N 3.32Å; V78-S80 VanDerWaalsContact C-N 3.35Å; V78-S80 PolarHBondContact O-N 3.32Å; S80-S83 PolarHBondContact O-N 2.89Å; S80-G84 PolarHBondContact O-N 2.99Å; S80-F258 WeakPolarHBondContact OG-CD2 3.19Å; S80-F258 VanDerWaalsContact OG-CE2 3.28Å; S80-F258 WeakPolarHBondContact OG-CE2 3.11Å; S80-F261 WeakPolarHBondContact OG-CB 3.47Å
81V95.6Very high94.5Very high60 Ų6020 Ų2036%0.36411%0.112SC..Hα-helixtrans-61-43.7171.8169.20000111A77 V78 S83 G84 L85 L289A77-V81 VanDerWaalsContact O-CG2 3.31Å; A77-V81 WeakPolarHBondContact O-CG2 3.33Å; A77-V81 PolarHBondContact O-N 3.2Å; V78-V81 PolarHBondContact O-N 3.4Å; V81-S83 VanDerWaalsContact C-N 3.32Å; V81-S83 PolarHBondContact O-N 2.93Å; V81-G84 CarbonylContact O-C 3.57Å; V81-G84 PolarHBondContact O-N 3.42Å; V81-G84 VanDerWaalsContact O-N 3.13Å; V81-L85 HydrophobicContact CG1-CD1 4.21Å; V81-L85 HydrophobicContact CG1-CG 4.19Å; V81-L85 VanDerWaalsContact O-CG 3.27Å; V81-L85 WeakPolarHBondContact O-CG 3.16Å; V81-L85 PolarHBondContact O-N 2.85Å; V81-L289 HydrophobicContact CG2-CB 4.25Å; V81-L289 HydrophobicContact CG2-CD1 4.09Å
82L95.8Very high94Very high25 Ų2517.1 Ų17.113%0.13110%0.097CC..Hα-helixtrans-59-43.3178.7-63.4170000112.2V78 A79 C86 I630 I633 I637V78-L82 WeakPolarHBondContact O-CG 3.44Å; V78-L82 PolarHBondContact O-N 3.31Å; V78-L82 VanDerWaalsContact O-N 3.17Å; A79-L82 PolarHBondContact O-N 3.36Å; L82-C86 PolarHBondContact O-SG 2.97Å; L82-C86 VanDerWaalsContact O-SG 3.4Å; L82-I630 HydrophobicContact CB-CG2 4.34Å; L82-I630 HydrophobicContact CD2-CB 4.31Å; L82-I630 HydrophobicContact CD2-CD1 4.25Å; L82-I630 HydrophobicContact CD2-CG1 4.07Å; L82-I630 HydrophobicContact CD2-CG2 3.8Å; L82-I633 HydrophobicContact CD1-CB 4.08Å; L82-I633 HydrophobicContact CD1-CG2 3.48Å; L82-I633 VanDerWaalsContact CD1-CG2 3.48Å; L82-I637 HydrophobicContact CD1-CD1 4.03Å
83S95Very high93.4Very high1 Ų117.1 Ų17.11%0.00710%0.097CC..Hα-helixtrans-68-42.6174-60.20000111.4A79 S80 V81 L85 C86 Y87 S634A79-S83 PolarHBondContact O-N 3.21Å; S80-S83 PolarHBondContact O-N 2.89Å; V81-S83 VanDerWaalsContact C-N 3.32Å; V81-S83 PolarHBondContact O-N 2.93Å; S83-L85 VanDerWaalsContact C-N 3.34Å; S83-L85 PolarHBondContact O-N 2.89Å; S83-C86 WeakPolarHBondContact O-CB 3.31Å; S83-C86 PolarHBondContact O-N 2.97Å; S83-C86 VanDerWaalsContact O-N 3.08Å; S83-Y87 WeakPolarHBondContact O-CD2 3.39Å; S83-Y87 PolarHBondContact O-N 2.98Å; S83-Y87 VanDerWaalsContact O-N 3.15Å; S83-S634 PolarHBondContact OG-OG 3.41Å
84G96.5Very high92.8Very high1 Ų117.2 Ų17.21%0.0110%0.098CC..Hα-helixtrans-59.6-38.5177.600000113.7S80 V81 C86 Y87 A88 F264S80-G84 PolarHBondContact O-N 2.99Å; V81-G84 CarbonylContact O-C 3.57Å; V81-G84 PolarHBondContact O-N 3.42Å; V81-G84 VanDerWaalsContact O-N 3.13Å; G84-C86 VanDerWaalsContact C-N 3.3Å; G84-C86 PolarHBondContact O-N 2.99Å; G84-Y87 PolarHBondContact O-N 3.28Å; G84-A88 WeakPolarHBondContact O-CB 3.39Å; G84-A88 PolarHBondContact O-N 3.22Å; G84-F264 VanDerWaalsContact CA-CE2 3.49Å
85L96.6Very high92Very high23 Ų2314 Ų1412%0.128%0.082CC..Hα-helixtrans-61.2-40.9174.3-65.2171.6000111V81 S83 Y87 A88 E89 I286 F622 V624 I630V81-L85 HydrophobicContact CG1-CD1 4.21Å; V81-L85 HydrophobicContact CG1-CG 4.19Å; V81-L85 VanDerWaalsContact O-CG 3.27Å; V81-L85 WeakPolarHBondContact O-CG 3.16Å; V81-L85 PolarHBondContact O-N 2.85Å; S83-L85 VanDerWaalsContact C-N 3.34Å; S83-L85 PolarHBondContact O-N 2.89Å; L85-Y87 PolarHBondContact O-N 3.11Å; L85-A88 WeakPolarHBondContact O-CB 3.36Å; L85-A88 PolarHBondContact O-N 3.37Å; L85-E89 PolarHBondContact O-N 2.96Å; L85-I286 HydrophobicContact CD2-CD1 4.43Å; L85-F622 HydrophobicContact CD2-CE1 4.36Å; L85-F622 HydrophobicContact CD2-CZ 3.68Å; L85-V624 VanDerWaalsContact C-CG2 3.44Å; L85-V624 HydrophobicContact CB-CG1 4.23Å; L85-V624 HydrophobicContact CB-CG2 4.11Å; L85-V624 WeakPolarHBondContact O-CG2 3.47Å; L85-I630 HydrophobicContact CD1-CD1 3.83Å; L85-I630 HydrophobicContact CD1-CG2 4.3Å
86C95.7Very high91.4Very high0 Ų011.9 Ų11.90%07%0.071CC..Hα-helixtrans-64.1-41177.8-60.60000111.8L82 S83 G84 F90 V418 V422L82-C86 PolarHBondContact O-SG 2.97Å; L82-C86 VanDerWaalsContact O-SG 3.4Å; S83-C86 WeakPolarHBondContact O-CB 3.31Å; S83-C86 PolarHBondContact O-N 2.97Å; S83-C86 VanDerWaalsContact O-N 3.08Å; G84-C86 VanDerWaalsContact C-N 3.3Å; G84-C86 PolarHBondContact O-N 2.99Å; C86-F90 PolarHBondContact O-N 3.45Å; C86-V418 HydrophobicContact CB-CG1 4.16Å; C86-V422 HydrophobicContact CB-CG2 3.85Å
87Y94.9Very high91Very high1 Ų112 Ų120%0.0047%0.071CC..Hα-helixtrans-65.4-38.1172.1-86.5-95.9000112.9S83 G84 L85 F90 G91 S99 A100 Y103 F264 D265 A268 Y415 V418S83-Y87 WeakPolarHBondContact O-CD2 3.39Å; S83-Y87 PolarHBondContact O-N 2.98Å; S83-Y87 VanDerWaalsContact O-N 3.15Å; G84-Y87 PolarHBondContact O-N 3.28Å; L85-Y87 PolarHBondContact O-N 3.11Å; Y87-F90 PolarHBondContact O-N 3.37Å; Y87-G91 PolarHBondContact O-N 2.99Å; Y87-S99 WeakPolarHBondContact CE1-OG 3.42Å; Y87-A100 HydrophobicContact CE1-CB 4.31Å; Y87-A100 WeakPolarHBondContact OH-CB 3.26Å; Y87-Y103 AromaticContact CD1-CE2 4Å; Y87-Y103 HydrophobicContact CD1-CE2 4Å; Y87-Y103 HydrophobicContact CE1-CE2 4.33Å; Y87-F264 AromaticContact CD2-CE2 3.73Å; Y87-F264 HydrophobicContact CD2-CE2 3.73Å; Y87-F264 HydrophobicContact CD2-CZ 4.39Å; Y87-F264 HydrophobicContact CE2-CE2 4.29Å; Y87-F264 HydrophobicContact CG-CE2 4.01Å; Y87-D265 HydrophobicContact CD1-CB 4.24Å; Y87-D265 HydrophobicContact CE1-CB 3.79Å; Y87-A268 HydrophobicContact CD1-CB 3.98Å; Y87-Y415 HydrophobicContact CD2-CD1 4.48Å; Y87-Y415 AromaticContact CE2-CD1 3.4Å; Y87-Y415 HydrophobicContact CE2-CD1 3.4Å; Y87-Y415 AromaticContact CE2-CE1 3.81Å; Y87-Y415 HydrophobicContact CE2-CE1 3.81Å; Y87-Y415 HydrophobicContact CE2-CG 4.29Å; Y87-Y415 AromaticContact CZ-CD1 3.76Å; Y87-Y415 WeakPolarHBondContact OH-CD1 3.41Å; Y87-V418 HydrophobicContact CD2-CB 4.29Å; Y87-V418 HydrophobicContact CD2-CG1 3.82Å; Y87-V418 HydrophobicContact CE1-CG2 4.04Å; Y87-V418 HydrophobicContact CE2-CB 3.85Å; Y87-V418 HydrophobicContact CE2-CG1 3.9Å; Y87-V418 HydrophobicContact CE2-CG2 3.93Å; Y87-V418 HydrophobicContact CG-CG1 4.16Å
88A94.6Very high90.5Very high0 Ų011.7 Ų11.70%07%0.069CC..Hα-helixtrans-62.6-43.2178.500000111.8G84 L85 G91 A92 P282 I285 F622G84-A88 WeakPolarHBondContact O-CB 3.39Å; G84-A88 PolarHBondContact O-N 3.22Å; L85-A88 WeakPolarHBondContact O-CB 3.36Å; L85-A88 PolarHBondContact O-N 3.37Å; A88-G91 PolarHBondContact O-N 3.09Å; A88-A92 WeakPolarHBondContact O-CB 3.41Å; A88-A92 PolarHBondContact O-N 3.22Å; A88-P282 HydrophobicContact CB-CB 3.99Å; A88-P282 HydrophobicContact CB-CG 4.41Å; A88-I285 HydrophobicContact CB-CD1 4.3Å; A88-F622 HydrophobicContact CB-CD1 3.67Å; A88-F622 HydrophobicContact CB-CE1 3.66Å; A88-F622 HydrophobicContact CB-CZ 4.5Å
89E92.2Very high90.3Very high0 Ų07.7 Ų7.70%05%0.045CC..Hα-helixtrans-63.7-44.6176.6174.4166.6-175.700111.8L85 A92 R93 R426 F622 V624L85-E89 PolarHBondContact O-N 2.96Å; E89-A92 PolarHBondContact O-N 3.48Å; E89-R93 WeakPolarHBondContact O-CG 3.4Å; E89-R93 PolarHBondContact O-N 2.96Å; E89-R93 VanDerWaalsContact O-N 3.12Å; E89-R93 IonicContact OE1-CZ 3.08Å; E89-R93 VanDerWaalsContact OE1-CZ 3.25Å; E89-R93 IonicContact OE1-NE 2.79Å; E89-R93 PolarHBondContact OE1-NE 2.95Å; E89-R93 IonicContact OE1-NH2 3.36Å; E89-R93 PolarHBondContact OE1-NH2 3.43Å; E89-R426 IonicContact OE1-CZ 2.87Å; E89-R426 IonicContact OE1-NE 2.84Å; E89-R426 PolarHBondContact OE1-NE 2.96Å; E89-R426 IonicContact OE1-NH2 3.64Å; E89-R426 PolarHBondContact OE1-NH2 3.08Å; E89-R426 IonicContact OE2-CZ 2.89Å; E89-R426 IonicContact OE2-NE 3.34Å; E89-R426 IonicContact OE2-NH2 3.02Å; E89-R426 PolarHBondContact OE2-NH2 3.33Å; E89-F622 HydrophobicContact CB-CD1 4.21Å; E89-V624 HydrophobicContact CB-CG2 3.7Å; E89-V624 WeakPolarHBondContact OE2-CB 3.33Å; E89-V624 VanDerWaalsContact OE2-CG2 3.28Å; E89-V624 WeakPolarHBondContact OE2-CG2 3.31Å; E89-V624 PolarHBondContact OE2-N 3.44Å
90F88.9Confident90.4Very high0 Ų07.4 Ų7.40%04%0.042CC..Hα-helixtrans-66.6-42.4177.3-94.3-67.6000113C86 Y87 A92 R93 V94 Y103 A107 V418 S421 V422 L425C86-F90 PolarHBondContact O-N 3.45Å; Y87-F90 PolarHBondContact O-N 3.37Å; F90-A92 PolarHBondContact O-N 3.28Å; F90-R93 PolarHBondContact O-N 3.46Å; F90-R93 VanDerWaalsContact O-N 3.08Å; F90-V94 HydrophobicContact CD1-CG2 4.42Å; F90-V94 PolarHBondContact O-N 3.27Å; F90-Y103 HydrophobicContact CB-CD1 3.76Å; F90-Y103 HydrophobicContact CB-CD2 3.57Å; F90-Y103 HydrophobicContact CB-CE1 3.78Å; F90-Y103 HydrophobicContact CB-CE2 3.59Å; F90-Y103 HydrophobicContact CB-CG 3.67Å; F90-Y103 AromaticContact CD1-CD1 3.77Å; F90-Y103 HydrophobicContact CD1-CD1 3.77Å; F90-Y103 HydrophobicContact CD1-CD2 4.47Å; F90-Y103 HydrophobicContact CD1-CE1 4.48Å; F90-Y103 AromaticContact CD1-CG 3.76Å; F90-Y103 HydrophobicContact CD1-CG 3.76Å; F90-Y103 HydrophobicContact CD2-CD2 4.32Å; F90-Y103 HydrophobicContact CD2-CG 4.28Å; F90-Y103 AromaticContact CG-CD1 3.96Å; F90-Y103 HydrophobicContact CG-CD1 3.96Å; F90-Y103 AromaticContact CG-CD2 3.9Å; F90-Y103 HydrophobicContact CG-CD2 3.9Å; F90-Y103 HydrophobicContact CG-CE1 4.46Å; F90-Y103 HydrophobicContact CG-CE2 4.41Å; F90-Y103 AromaticContact CG-CG 3.65Å; F90-Y103 HydrophobicContact CG-CG 3.65Å; F90-A107 HydrophobicContact CZ-CB 4.27Å; F90-V418 HydrophobicContact CD2-CG1 3.91Å; F90-V418 HydrophobicContact CE2-CG1 4.46Å; F90-S421 VanDerWaalsContact CE2-C 3.45Å; F90-S421 VanDerWaalsContact CZ-C 3.45Å; F90-S421 WeakPolarHBondContact CZ-O 3.45Å; F90-V422 HydrophobicContact CD2-CG2 3.54Å; F90-V422 HydrophobicContact CE2-CB 4.17Å; F90-V422 HydrophobicContact CE2-CG2 3.4Å; F90-V422 VanDerWaalsContact CE2-N 3.31Å; F90-L425 HydrophobicContact CD1-CD2 4.33Å; F90-L425 HydrophobicContact CE1-CD2 3.73Å; F90-L425 HydrophobicContact CZ-CB 4.31Å; F90-L425 HydrophobicContact CZ-CD2 3.89Å
91G86.2Confident90.4Very high0 Ų07.4 Ų7.40%04%0.042CC..Hα-helixtrans-62-32175.800000112.6Y87 A88 Y103Y87-G91 PolarHBondContact O-N 2.99Å; A88-G91 PolarHBondContact O-N 3.09Å; G91-Y103 WeakPolarHBondContact CA-OH 3.32Å; G91-Y103 PolarHBondContact N-OH 3.32Å
92A86Confident90.2Very high1 Ų14.6 Ų4.61%0.0083%0.025CC..Hα-helixtrans-70.1-35173.400000113.1A88 E89 F90 Q278 P282 A621 F622A88-A92 WeakPolarHBondContact O-CB 3.41Å; A88-A92 PolarHBondContact O-N 3.22Å; E89-A92 PolarHBondContact O-N 3.48Å; F90-A92 PolarHBondContact O-N 3.28Å; A92-Q278 WeakPolarHBondContact CB-O 3.25Å; A92-Q278 WeakPolarHBondContact O-CG 3.39Å; A92-P282 HydrophobicContact CB-CG 3.89Å; A92-A621 HydrophobicContact CB-CB 4.43Å; A92-F622 HydrophobicContact CB-CB 4.13Å
93R83.7Confident90Very high0 Ų03.4 Ų3.40%02%0.019CC..Hα-helixtrans-85.6-43.7-176.5-72.4177.4-176.2-108.310.1112.9E89 F90 P95 G433 Y434 T618 V620E89-R93 WeakPolarHBondContact O-CG 3.4Å; E89-R93 PolarHBondContact O-N 2.96Å; E89-R93 VanDerWaalsContact O-N 3.12Å; E89-R93 IonicContact OE1-CZ 3.08Å; E89-R93 VanDerWaalsContact OE1-CZ 3.25Å; E89-R93 IonicContact OE1-NE 2.79Å; E89-R93 PolarHBondContact OE1-NE 2.95Å; E89-R93 IonicContact OE1-NH2 3.36Å; E89-R93 PolarHBondContact OE1-NH2 3.43Å; F90-R93 PolarHBondContact O-N 3.46Å; F90-R93 VanDerWaalsContact O-N 3.08Å; R93-P95 VanDerWaalsContact O-CD 3.26Å; R93-P95 WeakPolarHBondContact O-CD 3.48Å; R93-G433 WeakPolarHBondContact O-CA 3.04Å; R93-Y434 PolarHBondContact O-N 3.49Å; R93-T618 PolarHBondContact NH1-OG1 3.21Å; R93-V620 HydrophobicContact CG-CB 4.12Å; R93-V620 HydrophobicContact CG-CG1 3.62Å; R93-V620 HydrophobicContact CG-CG2 4.47Å
94V83.3Confident89.9Confident2 Ų23.4 Ų3.41%0.0122%0.019CC..  trans-121.182.1-169.7-173.80000109.4I21 F90 Q96 V102 Y103 I106 I432I21-V94 HydrophobicContact CD1-CG1 3.63Å; F90-V94 HydrophobicContact CD1-CG2 4.42Å; F90-V94 PolarHBondContact O-N 3.27Å; V94-Q96 HydrophobicContact CG1-CB 4.19Å; V94-Q96 HydrophobicContact CG1-CG 4.31Å; V94-Q96 PolarHBondContact O-N 2.94Å; V94-V102 HydrophobicContact CG1-CG1 3.75Å; V94-Y103 HydrophobicContact CB-CD1 4.28Å; V94-Y103 HydrophobicContact CB-CE1 4.1Å; V94-Y103 HydrophobicContact CG1-CE1 4.47Å; V94-I106 HydrophobicContact CB-CD1 4.39Å; V94-I106 HydrophobicContact CG1-CD1 3.62Å; V94-I106 HydrophobicContact CG2-CD1 3.88Å; V94-I432 HydrophobicContact CG2-CG2 4.32Å
95P80Confident89.7Confident16 Ų163.4 Ų3.410%0.1042%0.018CC..  trans-78.858.9178.934.7-37.2000111.1R93 P277 Y434R93-P95 VanDerWaalsContact O-CD 3.26Å; R93-P95 WeakPolarHBondContact O-CD 3.48Å; P95-P277 HydrophobicContact CB-CB 3.67Å; P95-P277 HydrophobicContact CB-CG 3.37Å; P95-P277 HydrophobicContact CG-CG 4.34Å; P95-Y434 HydrophobicContact CG-CD2 3.48Å; P95-Y434 VanDerWaalsContact CG-CD2 3.48Å; P95-Y434 HydrophobicContact CG-CE2 3.79Å; P95-Y434 HydrophobicContact CG-CG 4.47Å
96Q82.3Confident89.3Confident24 Ų242.5 Ų2.511%0.1121%0.013CC..  trans-114.1152174.4-73.5-170.26.300110.4I21 V94 V102 E272I21-Q96 VanDerWaalsContact CG2-NE2 3.33Å; V94-Q96 HydrophobicContact CG1-CB 4.19Å; V94-Q96 HydrophobicContact CG1-CG 4.31Å; V94-Q96 PolarHBondContact O-N 2.94Å; Q96-V102 HydrophobicContact CB-CG1 4.23Å; Q96-E272 WeakPolarHBondContact CA-OE1 3.4Å
97S84.6Confident89Confident2 Ų22.6 Ų2.61%0.0141%0.014CC..THydrogen-bonded Turntrans-72.3140.2170.3-81.70000110.4V102 T269 E272 A359S97-V102 WeakPolarHBondContact O-CG2 3.44Å; S97-T269 WeakPolarHBondContact CA-O 3.33Å; S97-T269 PolarHBondContact OG-O 3.31Å; S97-E272 PolarHBondContact N-OE1 3.02Å; S97-A359 WeakPolarHBondContact O-CB 3.35Å
98G85.1Confident88.8Confident0 Ų02.9 Ų2.90%02%0.016CC..THydrogen-bonded Turntrans127.4-14.3-178.900000115.3A100 Y101 I356G98-A100 PolarHBondContact O-N 3.5Å; G98-Y101 WeakPolarHBondContact O-CB 3.43Å; G98-Y101 PolarHBondContact O-N 3.47Å; G98-I356 VanDerWaalsContact O-CD1 3.23Å; G98-I356 WeakPolarHBondContact O-CD1 3.47Å
99S92.1Very high88.7Confident0 Ų02.9 Ų2.90%02%0.016CC..THydrogen-bonded Turntrans49.5-128.4173.8-170.10000112.2Y87 Y101 V102 Y103 D265 T269Y87-S99 WeakPolarHBondContact CE1-OG 3.42Å; S99-Y101 PolarHBondContact O-N 2.92Å; S99-Y101 VanDerWaalsContact O-N 3.09Å; S99-V102 PolarHBondContact O-N 3.02Å; S99-Y103 VanDerWaalsContact C-CD2 3.49Å; S99-Y103 WeakPolarHBondContact O-CD1 3.27Å; S99-Y103 WeakPolarHBondContact O-CD2 3.19Å; S99-Y103 PolarHBondContact O-N 3.35Å; S99-Y103 VanDerWaalsContact O-N 3.08Å; S99-D265 PolarHBondContact OG-O 3.46Å; S99-T269 VanDerWaalsContact CB-CG2 3.45Å
100A94.3Very high88.7Confident0 Ų02.9 Ų2.90%02%0.016CC..Hα-helixtrans-54.9-30.2-176.700000114.7Y87 G98 S104 I116 L120 A414 V418Y87-A100 HydrophobicContact CE1-CB 4.31Å; Y87-A100 WeakPolarHBondContact OH-CB 3.26Å; G98-A100 PolarHBondContact O-N 3.5Å; A100-S104 WeakPolarHBondContact O-CB 3.32Å; A100-S104 PolarHBondContact O-N 3.41Å; A100-S104 PolarHBondContact O-OG 3.03Å; A100-I116 HydrophobicContact CB-CG2 3.77Å; A100-L120 HydrophobicContact CB-CD1 4.23Å; A100-A414 HydrophobicContact CB-CB 4.05Å; A100-V418 HydrophobicContact CB-CG2 3.48Å; A100-V418 VanDerWaalsContact CB-CG2 3.48Å
101Y95Very high89Confident0 Ų04.2 Ų4.20%02%0.023CC..Hα-helixtrans-59-54.7173.8159.8-108000111G98 S99 S104 Y105 A113 A359 M360 D363 L365G98-Y101 WeakPolarHBondContact O-CB 3.43Å; G98-Y101 PolarHBondContact O-N 3.47Å; S99-Y101 PolarHBondContact O-N 2.92Å; S99-Y101 VanDerWaalsContact O-N 3.09Å; Y101-S104 PolarHBondContact O-N 3.29Å; Y101-Y105 HydrophobicContact CE2-CD1 4.15Å; Y101-Y105 AromaticContact CZ-CD1 3.79Å; Y101-Y105 PolarHBondContact O-N 3.25Å; Y101-Y105 WeakPolarHBondContact OH-CD1 3.47Å; Y101-Y105 WeakPolarHBondContact OH-CE1 3.43Å; Y101-A113 HydrophobicContact CD2-CB 3.97Å; Y101-A113 WeakPolarHBondContact CD2-O 3.32Å; Y101-A113 HydrophobicContact CE2-CB 3.89Å; Y101-A359 HydrophobicContact CD1-CB 4Å; Y101-A359 HydrophobicContact CE1-CB 3.98Å; Y101-M360 HydrophobicContact CD1-CG 3.93Å; Y101-M360 HydrophobicContact CD2-CG 3.85Å; Y101-M360 HydrophobicContact CD2-SD 4.5Å; Y101-M360 HydrophobicContact CE1-CB 4.5Å; Y101-M360 HydrophobicContact CE1-CG 3.84Å; Y101-M360 HydrophobicContact CE2-CG 3.75Å; Y101-M360 HydrophobicContact CG-CG 3.96Å; Y101-D363 WeakPolarHBondContact CE1-OD2 3.42Å; Y101-D363 VanDerWaalsContact OH-CB 3.24Å; Y101-D363 WeakPolarHBondContact OH-CB 3.37Å; Y101-D363 VanDerWaalsContact OH-CG 3.32Å; Y101-D363 PolarHBondContact OH-OD2 3.22Å; Y101-L365 HydrophobicContact CE2-CD1 3.85Å; Y101-L365 WeakPolarHBondContact OH-CD1 3.45Å
102V91.6Very high89.3Confident0 Ų07.7 Ų7.70%04%0.04CC..Hα-helixtrans-66.5-41.7-178.1173.60000110.7V94 Q96 S97 S99 S104 Y105 I106V94-V102 HydrophobicContact CG1-CG1 3.75Å; Q96-V102 HydrophobicContact CB-CG1 4.23Å; S97-V102 WeakPolarHBondContact O-CG2 3.44Å; S99-V102 PolarHBondContact O-N 3.02Å; V102-S104 VanDerWaalsContact C-N 3.3Å; V102-S104 PolarHBondContact O-N 2.89Å; V102-Y105 PolarHBondContact O-N 2.88Å; V102-Y105 VanDerWaalsContact O-N 3.15Å; V102-I106 HydrophobicContact CG1-CD1 3.59Å; V102-I106 HydrophobicContact CG1-CG1 4.4Å; V102-I106 WeakPolarHBondContact O-CD1 3.39Å; V102-I106 VanDerWaalsContact O-CG1 3.29Å; V102-I106 WeakPolarHBondContact O-CG1 3.22Å; V102-I106 PolarHBondContact O-N 3.17Å; V102-I106 VanDerWaalsContact O-N 3.09Å
103Y91.8Very high89.8Confident1 Ų17.7 Ų7.70%0.0044%0.04CC..Hα-helixtrans-58.8-44.8179.2-54.8-21.2000111.3Y87 F90 G91 V94 S99 I106 A107 A268 V418Y87-Y103 AromaticContact CD1-CE2 4Å; Y87-Y103 HydrophobicContact CD1-CE2 4Å; Y87-Y103 HydrophobicContact CE1-CE2 4.33Å; F90-Y103 HydrophobicContact CB-CD1 3.76Å; F90-Y103 HydrophobicContact CB-CD2 3.57Å; F90-Y103 HydrophobicContact CB-CE1 3.78Å; F90-Y103 HydrophobicContact CB-CE2 3.59Å; F90-Y103 HydrophobicContact CB-CG 3.67Å; F90-Y103 AromaticContact CD1-CD1 3.77Å; F90-Y103 HydrophobicContact CD1-CD1 3.77Å; F90-Y103 HydrophobicContact CD1-CD2 4.47Å; F90-Y103 HydrophobicContact CD1-CE1 4.48Å; F90-Y103 AromaticContact CD1-CG 3.76Å; F90-Y103 HydrophobicContact CD1-CG 3.76Å; F90-Y103 HydrophobicContact CD2-CD2 4.32Å; F90-Y103 HydrophobicContact CD2-CG 4.28Å; F90-Y103 AromaticContact CG-CD1 3.96Å; F90-Y103 HydrophobicContact CG-CD1 3.96Å; F90-Y103 AromaticContact CG-CD2 3.9Å; F90-Y103 HydrophobicContact CG-CD2 3.9Å; F90-Y103 HydrophobicContact CG-CE1 4.46Å; F90-Y103 HydrophobicContact CG-CE2 4.41Å; F90-Y103 AromaticContact CG-CG 3.65Å; F90-Y103 HydrophobicContact CG-CG 3.65Å; G91-Y103 WeakPolarHBondContact CA-OH 3.32Å; G91-Y103 PolarHBondContact N-OH 3.32Å; V94-Y103 HydrophobicContact CB-CD1 4.28Å; V94-Y103 HydrophobicContact CB-CE1 4.1Å; V94-Y103 HydrophobicContact CG1-CE1 4.47Å; S99-Y103 VanDerWaalsContact C-CD2 3.49Å; S99-Y103 WeakPolarHBondContact O-CD1 3.27Å; S99-Y103 WeakPolarHBondContact O-CD2 3.19Å; S99-Y103 PolarHBondContact O-N 3.35Å; S99-Y103 VanDerWaalsContact O-N 3.08Å; Y103-I106 PolarHBondContact O-N 3.12Å; Y103-A107 WeakPolarHBondContact O-CB 3.43Å; Y103-A107 PolarHBondContact O-N 2.85Å; Y103-A268 HydrophobicContact CE2-CB 4.36Å; Y103-A268 WeakPolarHBondContact OH-CB 3.28Å; Y103-V418 HydrophobicContact CD2-CG1 4.33Å; Y103-V418 HydrophobicContact CD2-CG2 4Å
104S93.2Very high90.4Very high0 Ų07.7 Ų7.70%04%0.04CC..Hα-helixtrans-69-34.7178.1-54.70000112.2A100 Y101 V102 I106 V108 G109 L417A100-S104 WeakPolarHBondContact O-CB 3.32Å; A100-S104 PolarHBondContact O-N 3.41Å; A100-S104 PolarHBondContact O-OG 3.03Å; Y101-S104 PolarHBondContact O-N 3.29Å; V102-S104 VanDerWaalsContact C-N 3.3Å; V102-S104 PolarHBondContact O-N 2.89Å; S104-I106 VanDerWaalsContact C-N 3.29Å; S104-I106 PolarHBondContact O-N 2.87Å; S104-V108 WeakPolarHBondContact O-CA 3.21Å; S104-V108 VanDerWaalsContact O-CB 3.25Å; S104-V108 WeakPolarHBondContact O-CB 3.5Å; S104-V108 PolarHBondContact O-N 3.29Å; S104-G109 PolarHBondContact O-N 2.86Å; S104-L417 WeakPolarHBondContact OG-CD2 3.04Å
105Y92.1Very high90.9Very high1 Ų18.6 Ų8.60%0.0045%0.045CC..Hα-helixtrans-66.1-35.5178-155170.3000112.2R17 K18 K19 Y101 V102 E110 A113 D363 L365 E674R17-Y105 WeakPolarHBondContact O-CE2 3.39Å; K18-Y105 WeakPolarHBondContact CA-O 3.36Å; K19-Y105 HydrophobicContact CB-CD1 3.84Å; K19-Y105 HydrophobicContact CB-CD2 3.82Å; K19-Y105 HydrophobicContact CB-CE1 4.2Å; K19-Y105 HydrophobicContact CB-CE2 4.16Å; K19-Y105 HydrophobicContact CB-CG 3.64Å; K19-Y105 HydrophobicContact CD-CD1 3.88Å; K19-Y105 HydrophobicContact CD-CE1 4.33Å; K19-Y105 HydrophobicContact CD-CG 4.38Å; K19-Y105 HydrophobicContact CG-CD1 4.39Å; K19-Y105 PolarHBondContact N-O 3.05Å; K19-Y105 VanDerWaalsContact N-O 3.15Å; Y101-Y105 HydrophobicContact CE2-CD1 4.15Å; Y101-Y105 AromaticContact CZ-CD1 3.79Å; Y101-Y105 PolarHBondContact O-N 3.25Å; Y101-Y105 WeakPolarHBondContact OH-CD1 3.47Å; Y101-Y105 WeakPolarHBondContact OH-CE1 3.43Å; V102-Y105 PolarHBondContact O-N 2.88Å; V102-Y105 VanDerWaalsContact O-N 3.15Å; Y105-E110 HydrophobicContact CD2-CB 4.22Å; Y105-E110 HydrophobicContact CE2-CB 3.53Å; Y105-E110 HydrophobicContact CE2-CG 3.81Å; Y105-E110 PolarHBondContact OH-OE2 2.65Å; Y105-E110 VanDerWaalsContact OH-OE2 3.06Å; Y105-A113 VanDerWaalsContact CA-CB 3.49Å; Y105-A113 VanDerWaalsContact CB-CB 3.47Å; Y105-A113 HydrophobicContact CD1-CB 4.32Å; Y105-A113 HydrophobicContact CD2-CB 4.2Å; Y105-A113 HydrophobicContact CG-CB 3.75Å; Y105-D363 HydrophobicContact CE1-CB 3.93Å; Y105-L365 HydrophobicContact CE1-CD1 3.98Å; Y105-E674 HydrophobicContact CE2-CG 4.35Å
106I88Confident91.6Very high4 Ų48 Ų82%0.0214%0.042CC..Hα-helixtrans-79.8-43.5-179-62.6161.3000111.2K18 K19 I21 V94 V102 Y103 S104 I432K18-I106 WeakPolarHBondContact CD-O 3.36Å; K19-I106 HydrophobicContact CB-CG1 4.13Å; I21-I106 HydrophobicContact CD1-CD1 3.45Å; I21-I106 VanDerWaalsContact CD1-CD1 3.45Å; I21-I106 HydrophobicContact CD1-CG1 4.33Å; I21-I106 HydrophobicContact CG1-CD1 4.26Å; V94-I106 HydrophobicContact CB-CD1 4.39Å; V94-I106 HydrophobicContact CG1-CD1 3.62Å; V94-I106 HydrophobicContact CG2-CD1 3.88Å; V102-I106 HydrophobicContact CG1-CD1 3.59Å; V102-I106 HydrophobicContact CG1-CG1 4.4Å; V102-I106 WeakPolarHBondContact O-CD1 3.39Å; V102-I106 VanDerWaalsContact O-CG1 3.29Å; V102-I106 WeakPolarHBondContact O-CG1 3.22Å; V102-I106 PolarHBondContact O-N 3.17Å; V102-I106 VanDerWaalsContact O-N 3.09Å; Y103-I106 PolarHBondContact O-N 3.12Å; S104-I106 VanDerWaalsContact C-N 3.29Å; S104-I106 PolarHBondContact O-N 2.87Å; I106-I432 HydrophobicContact CG2-CD1 3.52Å; I106-I432 HydrophobicContact CG2-CG1 4.46Å; I106-I432 HydrophobicContact CG2-CG2 3.53Å
107A89.6Confident92.3Very high2 Ų26.9 Ų6.92%0.0174%0.036CC..Hα-helixtrans-84.2-45.6-174.900000113K18 F90 Y103 S421 L424K18-A107 VanDerWaalsContact CE-O 3.27Å; K18-A107 WeakPolarHBondContact CE-O 3.42Å; K18-A107 PolarHBondContact NZ-O 3.27Å; F90-A107 HydrophobicContact CZ-CB 4.27Å; Y103-A107 WeakPolarHBondContact O-CB 3.43Å; Y103-A107 PolarHBondContact O-N 2.85Å; A107-S421 VanDerWaalsContact CB-CB 3.49Å; A107-L424 HydrophobicContact CB-CB 4.39Å
108V91Very high92.8Very high7 Ų77.9 Ų7.94%0.0424%0.04CC..THydrogen-bonded Turntrans-99.8-59.7-168.3-172.90000111S104 M112 L417 S421 L424 Y559S104-V108 WeakPolarHBondContact O-CA 3.21Å; S104-V108 VanDerWaalsContact O-CB 3.25Å; S104-V108 WeakPolarHBondContact O-CB 3.5Å; S104-V108 PolarHBondContact O-N 3.29Å; V108-M112 HydrophobicContact CB-CB 4.32Å; V108-M112 HydrophobicContact CG1-CB 3.64Å; V108-M112 HydrophobicContact CG1-CG 3.93Å; V108-L417 HydrophobicContact CG2-CD1 4.03Å; V108-L417 HydrophobicContact CG2-CD2 4.49Å; V108-L417 HydrophobicContact CG2-CG 4.22Å; V108-S421 WeakPolarHBondContact CG2-OG 3.28Å; V108-L424 HydrophobicContact CG2-CD1 3.84Å; V108-Y559 WeakPolarHBondContact CG1-OH 3.4Å
109G90.9Very high93.1Very high0 Ų08 Ų80%04%0.04CC..  trans141.9175.1-179.800000114.2R17 S104 M112 A113R17-G109 CarbonylContact O-C 3.46Å; R17-G109 VanDerWaalsContact O-CA 3.31Å; R17-G109 WeakPolarHBondContact O-CA 3.26Å; S104-G109 PolarHBondContact O-N 2.86Å; G109-M112 PolarHBondContact O-N 2.99Å; G109-A113 WeakPolarHBondContact O-CB 3.3Å; G109-A113 PolarHBondContact O-N 3.44Å
110E93.9Very high93.2Very high0 Ų08 Ų80%04%0.04CC..Hα-helixtrans-59.8-50.6-168.1-169.4178111.400114.5L15 R17 Y105 M112 A113 F114 L365 Y664 S672L15-E110 WeakPolarHBondContact O-CB 3.42Å; R17-E110 HydrophobicContact CB-CB 4.3Å; R17-E110 IonicContact CZ-OE1 2.97Å; R17-E110 IonicContact CZ-OE2 3.66Å; R17-E110 IonicContact NE-OE1 2.84Å; R17-E110 IonicContact NE-OE2 3.75Å; R17-E110 PolarHBondContact NE-OE2 3.29Å; R17-E110 IonicContact NH2-OE1 3.36Å; R17-E110 PolarHBondContact NH2-OE1 3.11Å; R17-E110 IonicContact NH2-OE2 2.76Å; R17-E110 PolarHBondContact NH2-OE2 3.5Å; R17-E110 WeakPolarHBondContact O-CB 3.41Å; R17-E110 PolarHBondContact O-N 3.31Å; Y105-E110 HydrophobicContact CD2-CB 4.22Å; Y105-E110 HydrophobicContact CE2-CB 3.53Å; Y105-E110 HydrophobicContact CE2-CG 3.81Å; Y105-E110 PolarHBondContact OH-OE2 2.65Å; Y105-E110 VanDerWaalsContact OH-OE2 3.06Å; E110-M112 VanDerWaalsContact C-N 3.3Å; E110-M112 PolarHBondContact O-N 3.1Å; E110-A113 WeakPolarHBondContact O-CB 3.45Å; E110-A113 PolarHBondContact O-N 3.44Å; E110-F114 PolarHBondContact O-N 3.23Å; E110-L365 HydrophobicContact CG-CD1 4.12Å; E110-L365 HydrophobicContact CG-CD2 3.83Å; E110-Y664 HydrophobicContact CG-CE2 4.23Å; E110-Y664 PolarHBondContact OE1-OH 3.27Å; E110-S672 PolarHBondContact OE2-OG 2.81Å
111I93.9Very high93.1Very high28 Ų288.6 Ų8.614%0.1444%0.044CC..Hα-helixtrans-63.1-38.7-176.7-173.761.9000112.2L15 T115 F661 Y664 F665L15-I111 HydrophobicContact CB-CB 4.22Å; L15-I111 HydrophobicContact CB-CG2 4.19Å; L15-I111 PolarHBondContact O-N 2.97Å; I111-T115 WeakPolarHBondContact O-CB 3.32Å; I111-T115 PolarHBondContact O-N 2.88Å; I111-T115 PolarHBondContact O-OG1 3.08Å; I111-F661 HydrophobicContact CD1-CD1 4.14Å; I111-F661 HydrophobicContact CD1-CE1 3.75Å; I111-F661 HydrophobicContact CG1-CE1 4.46Å; I111-Y664 HydrophobicContact CD1-CD1 3.78Å; I111-Y664 HydrophobicContact CD1-CE1 3.55Å; I111-F665 HydrophobicContact CD1-CZ 4.41Å
112M93.8Very high92.8Very high74 Ų749.1 Ų9.137%0.3655%0.046SC..Hα-helixtrans-76.1-35.9179.9-156.96564.200111.1V108 G109 E110 T115 I116 L417V108-M112 HydrophobicContact CB-CB 4.32Å; V108-M112 HydrophobicContact CG1-CB 3.64Å; V108-M112 HydrophobicContact CG1-CG 3.93Å; G109-M112 PolarHBondContact O-N 2.99Å; E110-M112 VanDerWaalsContact C-N 3.3Å; E110-M112 PolarHBondContact O-N 3.1Å; M112-T115 WeakPolarHBondContact O-CB 3.45Å; M112-T115 PolarHBondContact O-N 3.31Å; M112-I116 PolarHBondContact O-N 3.45Å; M112-L417 HydrophobicContact CB-CD2 4.26Å; M112-L417 HydrophobicContact CG-CD1 3.91Å; M112-L417 HydrophobicContact CG-CD2 3.3Å; M112-L417 HydrophobicContact CG-CG 4.3Å; M112-L417 HydrophobicContact SD-CD2 4.47Å
113A95Very high92.8Very high0 Ų09.5 Ų9.50%05%0.048CC..Hα-helixtrans-59-50169.700000111.4Y101 Y105 G109 E110 T115 I116 G117Y101-A113 HydrophobicContact CD2-CB 3.97Å; Y101-A113 WeakPolarHBondContact CD2-O 3.32Å; Y101-A113 HydrophobicContact CE2-CB 3.89Å; Y105-A113 VanDerWaalsContact CA-CB 3.49Å; Y105-A113 VanDerWaalsContact CB-CB 3.47Å; Y105-A113 HydrophobicContact CD1-CB 4.32Å; Y105-A113 HydrophobicContact CD2-CB 4.2Å; Y105-A113 HydrophobicContact CG-CB 3.75Å; G109-A113 WeakPolarHBondContact O-CB 3.3Å; G109-A113 PolarHBondContact O-N 3.44Å; E110-A113 WeakPolarHBondContact O-CB 3.45Å; E110-A113 PolarHBondContact O-N 3.44Å; A113-T115 VanDerWaalsContact C-N 3.29Å; A113-T115 PolarHBondContact O-N 2.97Å; A113-I116 PolarHBondContact O-N 3.49Å; A113-G117 PolarHBondContact O-N 3Å
114F96.3Very high92.8Very high0 Ų09.8 Ų9.80%05%0.049CC..Hα-helixtrans-56.7-45.7176.6179.1-90.3000111.4E110 I116 G117 W118 M360 L365 L366 G660 Y664E110-F114 PolarHBondContact O-N 3.23Å; F114-I116 VanDerWaalsContact C-N 3.34Å; F114-I116 PolarHBondContact O-N 3.48Å; F114-G117 PolarHBondContact O-N 2.93Å; F114-W118 HydrophobicContact CE1-CB 4.08Å; F114-W118 HydrophobicContact CE1-CG 4.29Å; F114-W118 HydrophobicContact CZ-CB 4.29Å; F114-W118 HydrophobicContact CZ-CD2 4.37Å; F114-W118 HydrophobicContact CZ-CE3 4.29Å; F114-W118 HydrophobicContact CZ-CG 4.38Å; F114-W118 VanDerWaalsContact O-CB 3.24Å; F114-W118 WeakPolarHBondContact O-CB 3.29Å; F114-W118 PolarHBondContact O-N 3Å; F114-M360 HydrophobicContact CD2-CE 3.67Å; F114-M360 HydrophobicContact CE2-CE 3.91Å; F114-M360 HydrophobicContact CG-CE 4.44Å; F114-L365 HydrophobicContact CB-CD1 4.41Å; F114-L365 HydrophobicContact CD2-CB 4.13Å; F114-L366 HydrophobicContact CE2-CD2 4.22Å; F114-G660 WeakPolarHBondContact CE1-O 3.39Å; F114-G660 WeakPolarHBondContact CZ-O 3.27Å; F114-Y664 HydrophobicContact CB-CD2 3.94Å; F114-Y664 HydrophobicContact CB-CE2 4.22Å; F114-Y664 HydrophobicContact CD1-CD2 4.06Å; F114-Y664 HydrophobicContact CD1-CG 4.04Å; F114-Y664 AromaticContact CD2-CD2 3.69Å; F114-Y664 HydrophobicContact CD2-CD2 3.69Å; F114-Y664 HydrophobicContact CD2-CG 4.35Å; F114-Y664 HydrophobicContact CE1-CG 4.35Å; F114-Y664 HydrophobicContact CE2-CD2 4.23Å; F114-Y664 AromaticContact CG-CD2 3.58Å; F114-Y664 HydrophobicContact CG-CD2 3.58Å; F114-Y664 HydrophobicContact CG-CE2 4.35Å; F114-Y664 HydrophobicContact CG-CG 4.06Å
115T95Very high92.8Very high21 Ų2110.2 Ų10.213%0.1295%0.052CC..Hα-helixtrans-55.3-48.3177.3-61.50000111.6I111 M112 A113 N119 M657I111-T115 WeakPolarHBondContact O-CB 3.32Å; I111-T115 PolarHBondContact O-N 2.88Å; I111-T115 PolarHBondContact O-OG1 3.08Å; M112-T115 WeakPolarHBondContact O-CB 3.45Å; M112-T115 PolarHBondContact O-N 3.31Å; A113-T115 VanDerWaalsContact C-N 3.29Å; A113-T115 PolarHBondContact O-N 2.97Å; T115-N119 PolarHBondContact O-N 2.93Å; T115-N119 VanDerWaalsContact O-N 3.12Å; T115-N119 PolarHBondContact O-ND2 3.21Å; T115-M657 HydrophobicContact CG2-CE 3.61Å; T115-M657 HydrophobicContact CG2-SD 4.28Å
116I95Very high92.6Very high5 Ų510.1 Ų10.13%0.0265%0.051CC..Hα-helixtrans-68.9-44.2177.3-67.7-46.7000112.3A100 M112 A113 F114 W118 N119 L120 L413 A414 L417A100-I116 HydrophobicContact CB-CG2 3.77Å; M112-I116 PolarHBondContact O-N 3.45Å; A113-I116 PolarHBondContact O-N 3.49Å; F114-I116 VanDerWaalsContact C-N 3.34Å; F114-I116 PolarHBondContact O-N 3.48Å; I116-W118 VanDerWaalsContact C-N 3.29Å; I116-W118 PolarHBondContact O-N 3.23Å; I116-N119 PolarHBondContact O-N 2.8Å; I116-N119 VanDerWaalsContact O-N 3.12Å; I116-L120 HydrophobicContact CG2-CD1 4.19Å; I116-L120 HydrophobicContact CG2-CG 4.24Å; I116-L120 WeakPolarHBondContact O-CG 3.27Å; I116-L120 PolarHBondContact O-N 3.34Å; I116-L413 HydrophobicContact CD1-CB 4.03Å; I116-A414 HydrophobicContact CG2-CB 4.15Å; I116-L417 HydrophobicContact CB-CD2 4.46Å; I116-L417 HydrophobicContact CD1-CB 4.26Å; I116-L417 HydrophobicContact CD1-CD2 4.04Å; I116-L417 HydrophobicContact CG1-CB 4.13Å; I116-L417 HydrophobicContact CG1-CD2 3.27Å; I116-L417 HydrophobicContact CG1-CG 4.32Å
117G95.4Very high92.6Very high0 Ų010 Ų100%05%0.05CC..Hα-helixtrans-59.9-40.9178.500000112.3A113 F114 N119 L120 I121 M360A113-G117 PolarHBondContact O-N 3Å; F114-G117 PolarHBondContact O-N 2.93Å; G117-N119 VanDerWaalsContact C-N 3.33Å; G117-N119 PolarHBondContact O-N 3.4Å; G117-L120 PolarHBondContact O-N 3.29Å; G117-I121 WeakPolarHBondContact O-CG1 3.3Å; G117-I121 PolarHBondContact O-N 3.22Å; G117-M360 VanDerWaalsContact C-SD 3.54Å; G117-M360 VanDerWaalsContact CA-SD 3.58Å
118W95.2Very high92.9Very high22 Ų229.9 Ų9.98%0.0835%0.05CC..Hα-helixtrans-66.2-33.7175.4-171.1-110.1000113F114 I116 I121 L122 L366 W656 I659 I663F114-W118 HydrophobicContact CE1-CB 4.08Å; F114-W118 HydrophobicContact CE1-CG 4.29Å; F114-W118 HydrophobicContact CZ-CB 4.29Å; F114-W118 HydrophobicContact CZ-CD2 4.37Å; F114-W118 HydrophobicContact CZ-CE3 4.29Å; F114-W118 HydrophobicContact CZ-CG 4.38Å; F114-W118 VanDerWaalsContact O-CB 3.24Å; F114-W118 WeakPolarHBondContact O-CB 3.29Å; F114-W118 PolarHBondContact O-N 3Å; I116-W118 VanDerWaalsContact C-N 3.29Å; I116-W118 PolarHBondContact O-N 3.23Å; W118-I121 HydrophobicContact CE3-CD1 4.14Å; W118-L122 PolarHBondContact O-N 3.44Å; W118-L366 HydrophobicContact CE3-CD2 4.41Å; W118-L366 HydrophobicContact CZ3-CD2 4.25Å; W118-W656 AromaticContact CD1-CD1 3.5Å; W118-W656 VanDerWaalsContact CD1-CD1 3.5Å; W118-W656 AromaticContact CD1-CE2 3.9Å; W118-W656 AromaticContact CD1-NE1 3.13Å; W118-W656 HydrophobicContact CD2-CZ2 4.21Å; W118-W656 AromaticContact CE2-CE2 3.44Å; W118-W656 VanDerWaalsContact CE2-CE2 3.44Å; W118-W656 AromaticContact CE2-CZ2 3.52Å; W118-W656 AromaticContact CE2-NE1 3.52Å; W118-W656 AromaticContact CG-NE1 3.83Å; W118-W656 HydrophobicContact CH2-CH2 4.14Å; W118-W656 AromaticContact CH2-CZ2 3.98Å; W118-W656 HydrophobicContact CH2-CZ2 3.98Å; W118-W656 HydrophobicContact CZ2-CD2 4.28Å; W118-W656 AromaticContact CZ2-CE2 3.69Å; W118-W656 AromaticContact CZ2-CH2 3.7Å; W118-W656 HydrophobicContact CZ2-CH2 3.7Å; W118-W656 AromaticContact CZ2-CZ2 3.39Å; W118-W656 HydrophobicContact CZ2-CZ2 3.39Å; W118-W656 HydrophobicContact CZ2-CZ3 4.25Å; W118-W656 AromaticContact NE1-CD1 3.32Å; W118-W656 VanDerWaalsContact NE1-CD1 3.32Å; W118-W656 AromaticContact NE1-CD2 3.73Å; W118-W656 AromaticContact NE1-CE2 3.23Å; W118-W656 AromaticContact NE1-CG 3.8Å; W118-W656 AromaticContact NE1-CZ2 3.84Å; W118-W656 AromaticContact NE1-NE1 2.92Å; W118-W656 PolarHBondContact NE1-O 2.73Å; W118-W656 PolarHBondContact O-NE1 3.35Å; W118-W656 VanDerWaalsContact O-NE1 3.15Å; W118-I659 HydrophobicContact CZ2-CG2 4.04Å; W118-I663 HydrophobicContact CH2-CD1 3.48Å; W118-I663 VanDerWaalsContact CH2-CD1 3.48Å; W118-I663 HydrophobicContact CZ2-CD1 4.06Å; W118-I663 HydrophobicContact CZ3-CD1 3.99Å
119N92.5Very high92.9Very high2 Ų29.5 Ų9.51%0.0115%0.048CC..Hα-helixtrans-72.7-41174.4-71.9-17.1000112.6T115 I116 G117 I121 L122 E123 F653 M657T115-N119 PolarHBondContact O-N 2.93Å; T115-N119 VanDerWaalsContact O-N 3.12Å; T115-N119 PolarHBondContact O-ND2 3.21Å; I116-N119 PolarHBondContact O-N 2.8Å; I116-N119 VanDerWaalsContact O-N 3.12Å; G117-N119 VanDerWaalsContact C-N 3.33Å; G117-N119 PolarHBondContact O-N 3.4Å; N119-I121 PolarHBondContact O-N 3.48Å; N119-L122 WeakPolarHBondContact O-CB 3.42Å; N119-L122 PolarHBondContact O-N 3.49Å; N119-L122 VanDerWaalsContact O-N 3.17Å; N119-E123 WeakPolarHBondContact O-CB 3.44Å; N119-E123 PolarHBondContact O-N 3.12Å; N119-F653 WeakPolarHBondContact ND2-CE2 3.46Å; N119-F653 WeakPolarHBondContact ND2-CZ 3.37Å; N119-F653 VanDerWaalsContact OD1-CE2 3.23Å; N119-F653 WeakPolarHBondContact OD1-CE2 3.32Å; N119-M657 PolarHBondContact OD1-SD 3.48Å
120L93.4Very high92.8Very high1 Ų110 Ų101%0.0055%0.051CC..Hα-helixtrans-60.3-37.7173.8-70.7176.9000111.2A100 I116 G117 E123 Y124 I356 A414A100-L120 HydrophobicContact CB-CD1 4.23Å; I116-L120 HydrophobicContact CG2-CD1 4.19Å; I116-L120 HydrophobicContact CG2-CG 4.24Å; I116-L120 WeakPolarHBondContact O-CG 3.27Å; I116-L120 PolarHBondContact O-N 3.34Å; G117-L120 PolarHBondContact O-N 3.29Å; L120-E123 WeakPolarHBondContact CD2-OE2 3.33Å; L120-E123 PolarHBondContact O-N 3.26Å; L120-Y124 HydrophobicContact CB-CD2 4.33Å; L120-Y124 HydrophobicContact CB-CE2 4.01Å; L120-Y124 HydrophobicContact CD2-CE2 4.33Å; L120-Y124 WeakPolarHBondContact O-CD2 3.31Å; L120-Y124 PolarHBondContact O-N 3.3Å; L120-I356 HydrophobicContact CB-CG2 4.4Å; L120-I356 HydrophobicContact CD1-CD1 4.03Å; L120-I356 HydrophobicContact CD1-CG1 4.46Å; L120-A414 HydrophobicContact CD2-CB 4.05Å
121I93.1Very high92.7Very high13 Ų1310.9 Ų10.97%0.0676%0.056CC..Hα-helixtrans-59.5-48.5174.7-71.2163.4000110.7G117 W118 N119 V125 L353 I356 L357 M360 L366 W656G117-I121 WeakPolarHBondContact O-CG1 3.3Å; G117-I121 PolarHBondContact O-N 3.22Å; W118-I121 HydrophobicContact CE3-CD1 4.14Å; N119-I121 PolarHBondContact O-N 3.48Å; I121-V125 HydrophobicContact CG2-CG2 4.46Å; I121-V125 WeakPolarHBondContact O-CB 3.27Å; I121-V125 VanDerWaalsContact O-CG2 3.25Å; I121-V125 WeakPolarHBondContact O-CG2 3.33Å; I121-V125 PolarHBondContact O-N 3.06Å; I121-L353 HydrophobicContact CB-CD1 4.11Å; I121-L353 HydrophobicContact CG1-CD1 3.91Å; I121-L353 HydrophobicContact CG2-CD1 4.08Å; I121-I356 HydrophobicContact CG1-CG2 4.07Å; I121-L357 HydrophobicContact CD1-CD2 3.55Å; I121-L357 HydrophobicContact CG1-CD2 3.91Å; I121-M360 HydrophobicContact CD1-SD 3.73Å; I121-L366 HydrophobicContact CD1-CD1 3.73Å; I121-W656 HydrophobicContact CG2-CZ2 4.44Å
122L88.7Confident92.7Very high11 Ų119.5 Ų9.56%0.0585%0.049CC..Hα-helixtrans-59.9-50.5176.9-176.766.4000111.6W118 N119 Y124 V125 I126 W656W118-L122 PolarHBondContact O-N 3.44Å; N119-L122 WeakPolarHBondContact O-CB 3.42Å; N119-L122 PolarHBondContact O-N 3.49Å; N119-L122 VanDerWaalsContact O-N 3.17Å; L122-Y124 PolarHBondContact O-N 3.12Å; L122-V125 PolarHBondContact O-N 3.48Å; L122-I126 HydrophobicContact CD1-CD1 3.65Å; L122-I126 HydrophobicContact CD1-CG1 4.08Å; L122-I126 HydrophobicContact CD2-CD1 4.26Å; L122-I126 HydrophobicContact CG-CD1 3.65Å; L122-I126 HydrophobicContact CG-CG1 4.3Å; L122-I126 WeakPolarHBondContact O-CB 3.2Å; L122-I126 VanDerWaalsContact O-CG1 3.25Å; L122-I126 WeakPolarHBondContact O-CG1 3.37Å; L122-I126 PolarHBondContact O-N 3.43Å; L122-W656 HydrophobicContact CB-CD2 4.33Å; L122-W656 HydrophobicContact CB-CG 4.49Å; L122-W656 HydrophobicContact CB-CZ2 3.98Å; L122-W656 HydrophobicContact CD1-CD2 3.71Å; L122-W656 HydrophobicContact CD1-CE3 3.94Å; L122-W656 HydrophobicContact CD1-CG 4.15Å; L122-W656 HydrophobicContact CD1-CH2 4.26Å; L122-W656 HydrophobicContact CD1-CZ2 4.05Å; L122-W656 HydrophobicContact CD1-CZ3 4.21Å; L122-W656 HydrophobicContact CD2-CB 4.21Å; L122-W656 HydrophobicContact CD2-CD2 4.19Å; L122-W656 HydrophobicContact CD2-CG 3.73Å; L122-W656 HydrophobicContact CG-CD2 4.28Å; L122-W656 HydrophobicContact CG-CG 4.33Å
123E90.4Very high92.5Very high8 Ų87 Ų74%0.0374%0.035CC..Hα-helixtrans-53-52.5-179.6176.9-17817400111.2N119 L120 I126 G127 M407 T411N119-E123 WeakPolarHBondContact O-CB 3.44Å; N119-E123 PolarHBondContact O-N 3.12Å; L120-E123 WeakPolarHBondContact CD2-OE2 3.33Å; L120-E123 PolarHBondContact O-N 3.26Å; E123-I126 PolarHBondContact O-N 3.32Å; E123-G127 PolarHBondContact O-N 3.23Å; E123-M407 HydrophobicContact CG-CG 3.82Å; E123-T411 WeakPolarHBondContact OE1-CB 3.27Å; E123-T411 PolarHBondContact OE1-OG1 3.15Å; E123-T411 WeakPolarHBondContact OE2-CA 3.24Å; E123-T411 PolarHBondContact OE2-N 3.28Å; E123-T411 PolarHBondContact OE2-OG1 3.1Å
124Y92.7Very high92.2Very high7 Ų77.5 Ų7.53%0.0274%0.04CC..Hα-helixtrans-67.9-41.7-179.9-65.2-49.1000112.1L120 L122 I126 G127 I128 D265 I266 P352 L353 I356L120-Y124 HydrophobicContact CB-CD2 4.33Å; L120-Y124 HydrophobicContact CB-CE2 4.01Å; L120-Y124 HydrophobicContact CD2-CE2 4.33Å; L120-Y124 WeakPolarHBondContact O-CD2 3.31Å; L120-Y124 PolarHBondContact O-N 3.3Å; L122-Y124 PolarHBondContact O-N 3.12Å; Y124-I126 VanDerWaalsContact C-N 3.31Å; Y124-I126 PolarHBondContact O-N 2.87Å; Y124-G127 PolarHBondContact O-N 3.4Å; Y124-I128 WeakPolarHBondContact O-CG1 3.48Å; Y124-I128 PolarHBondContact O-N 3.12Å; Y124-D265 PolarHBondContact OH-OD2 3.14Å; Y124-I266 HydrophobicContact CE1-CG1 4.3Å; Y124-P352 HydrophobicContact CD1-CB 4.05Å; Y124-P352 HydrophobicContact CD1-CG 4.05Å; Y124-P352 HydrophobicContact CD2-CB 3.76Å; Y124-P352 HydrophobicContact CE1-CB 3.7Å; Y124-P352 HydrophobicContact CE1-CG 3.6Å; Y124-P352 HydrophobicContact CE2-CB 3.35Å; Y124-P352 HydrophobicContact CE2-CG 4.2Å; Y124-P352 HydrophobicContact CG-CB 4.11Å; Y124-L353 HydrophobicContact CD2-CB 4.33Å; Y124-L353 HydrophobicContact CD2-CD1 4.5Å; Y124-L353 HydrophobicContact CG-CB 4.36Å; Y124-I356 HydrophobicContact CD2-CG1 4.28Å; Y124-I356 HydrophobicContact CE2-CG1 3.85Å
125V91.7Very high92Very high8 Ų89.3 Ų9.35%0.0485%0.047CC..Hα-helixtrans-58.3-45.1176.3164.40000111.5I121 L122 G127 I128 A129 L353 I390 M394I121-V125 HydrophobicContact CG2-CG2 4.46Å; I121-V125 WeakPolarHBondContact O-CB 3.27Å; I121-V125 VanDerWaalsContact O-CG2 3.25Å; I121-V125 WeakPolarHBondContact O-CG2 3.33Å; I121-V125 PolarHBondContact O-N 3.06Å; L122-V125 PolarHBondContact O-N 3.48Å; V125-G127 VanDerWaalsContact C-N 3.34Å; V125-I128 PolarHBondContact O-N 3.43Å; V125-A129 PolarHBondContact O-N 3.37Å; V125-L353 HydrophobicContact CG2-CD2 3.56Å; V125-I390 HydrophobicContact CG1-CG2 3.61Å; V125-I390 HydrophobicContact CG2-CG2 4.03Å; V125-M394 HydrophobicContact CG1-CB 4.48Å; V125-M394 HydrophobicContact CG1-CG 3.69Å
126I88Confident91.8Very high0 Ų08.4 Ų8.40%04%0.041CC..Hα-helixtrans-65.7-40.8177.7-71.5-178.1000110.5L122 E123 Y124 I128 A129 S130 M394 L403 M406 M407L122-I126 HydrophobicContact CD1-CD1 3.65Å; L122-I126 HydrophobicContact CD1-CG1 4.08Å; L122-I126 HydrophobicContact CD2-CD1 4.26Å; L122-I126 HydrophobicContact CG-CD1 3.65Å; L122-I126 HydrophobicContact CG-CG1 4.3Å; L122-I126 WeakPolarHBondContact O-CB 3.2Å; L122-I126 VanDerWaalsContact O-CG1 3.25Å; L122-I126 WeakPolarHBondContact O-CG1 3.37Å; L122-I126 PolarHBondContact O-N 3.43Å; E123-I126 PolarHBondContact O-N 3.32Å; Y124-I126 VanDerWaalsContact C-N 3.31Å; Y124-I126 PolarHBondContact O-N 2.87Å; I126-I128 VanDerWaalsContact C-N 3.34Å; I126-I128 PolarHBondContact O-N 2.85Å; I126-A129 PolarHBondContact O-N 3.08Å; I126-S130 WeakPolarHBondContact O-CB 3.28Å; I126-S130 PolarHBondContact O-N 2.91Å; I126-S130 PolarHBondContact O-OG 3.49Å; I126-S130 VanDerWaalsContact O-OG 3.11Å; I126-M394 HydrophobicContact CG1-CE 4.44Å; I126-L403 HydrophobicContact CG1-CD2 4.25Å; I126-L403 HydrophobicContact CG2-CB 3.98Å; I126-L403 HydrophobicContact CG2-CD2 4.26Å; I126-L403 WeakPolarHBondContact CG2-O 3.3Å; I126-M406 HydrophobicContact CD1-CB 3.48Å; I126-M406 VanDerWaalsContact CD1-CB 3.48Å; I126-M406 HydrophobicContact CD1-CE 4.06Å; I126-M406 HydrophobicContact CD1-CG 4.5Å; I126-M406 HydrophobicContact CD1-SD 4.35Å; I126-M407 HydrophobicContact CG2-CB 4.06Å; I126-M407 HydrophobicContact CG2-CE 4.48Å
127G89.9Confident91.4Very high0 Ų010.9 Ų10.90%06%0.059CC..Hα-helixtrans-61.6-39.6175.700000113.7E123 Y124 V125 A129 S130 V131 M407E123-G127 PolarHBondContact O-N 3.23Å; Y124-G127 PolarHBondContact O-N 3.4Å; V125-G127 VanDerWaalsContact C-N 3.34Å; G127-A129 VanDerWaalsContact C-N 3.35Å; G127-A129 PolarHBondContact O-N 2.85Å; G127-S130 PolarHBondContact O-OG 3.29Å; G127-V131 VanDerWaalsContact O-CB 3.24Å; G127-V131 WeakPolarHBondContact O-CB 3.47Å; G127-V131 WeakPolarHBondContact O-CG2 3.44Å; G127-V131 PolarHBondContact O-N 2.91Å; G127-M407 VanDerWaalsContact N-CE 3.3Å
128I94.2Very high91Very high0 Ų012.7 Ų12.70%07%0.069CC..Hα-helixtrans-59.7-49.4174.4-64.6166.7000110Y124 V125 I126 A132 I174 L346 M350 L353Y124-I128 WeakPolarHBondContact O-CG1 3.48Å; Y124-I128 PolarHBondContact O-N 3.12Å; V125-I128 PolarHBondContact O-N 3.43Å; I126-I128 VanDerWaalsContact C-N 3.34Å; I126-I128 PolarHBondContact O-N 2.85Å; I128-A132 WeakPolarHBondContact O-CB 3.36Å; I128-A132 PolarHBondContact O-N 3.22Å; I128-A132 VanDerWaalsContact O-N 3.12Å; I128-I174 HydrophobicContact CG2-CD1 3.91Å; I128-I174 HydrophobicContact CG2-CG1 3.86Å; I128-I174 HydrophobicContact CG2-CG2 3.91Å; I128-L346 HydrophobicContact CB-CD1 4.36Å; I128-L346 HydrophobicContact CG2-CD1 3.97Å; I128-L346 WeakPolarHBondContact O-CD1 3.2Å; I128-M350 HydrophobicContact CB-CG 4.3Å; I128-M350 HydrophobicContact CD1-CB 4.32Å; I128-M350 HydrophobicContact CD1-CG 3.68Å; I128-M350 HydrophobicContact CG1-CB 4.36Å; I128-M350 HydrophobicContact CG1-CG 3.44Å; I128-M350 VanDerWaalsContact CG1-CG 3.44Å; I128-M350 HydrophobicContact CG2-CG 3.95Å; I128-M350 HydrophobicContact CG2-SD 4.24Å; I128-L353 HydrophobicContact CD1-CD2 3.81Å
129A91.9Very high90.7Very high0 Ų014.9 Ų14.90%08%0.079CC..Hα-helixtrans-68.1-46.2-177.800000112.7V125 I126 G127 R133 M394 A395 L403V125-A129 PolarHBondContact O-N 3.37Å; I126-A129 PolarHBondContact O-N 3.08Å; G127-A129 VanDerWaalsContact C-N 3.35Å; G127-A129 PolarHBondContact O-N 2.85Å; A129-R133 WeakPolarHBondContact O-CG 3.29Å; A129-R133 PolarHBondContact O-N 3.34Å; A129-R133 VanDerWaalsContact O-N 3.09Å; A129-M394 HydrophobicContact CB-CB 3.72Å; A129-A395 HydrophobicContact CB-CB 4.06Å; A129-L403 HydrophobicContact CB-CD1 3.77Å; A129-L403 HydrophobicContact CB-CD2 4.41Å
130S88.8Confident90.6Very high9 Ų915 Ų156%0.0638%0.08CC..Hα-helixtrans-67-45.1-177.5670000111.7I126 G127 R133 A134 L400I126-S130 WeakPolarHBondContact O-CB 3.28Å; I126-S130 PolarHBondContact O-N 2.91Å; I126-S130 PolarHBondContact O-OG 3.49Å; I126-S130 VanDerWaalsContact O-OG 3.11Å; G127-S130 PolarHBondContact O-OG 3.29Å; S130-R133 PolarHBondContact O-N 3.36Å; S130-A134 WeakPolarHBondContact O-CB 3.4Å; S130-A134 PolarHBondContact O-N 3.38Å; S130-L400 WeakPolarHBondContact O-CD1 3.35Å
131V91.3Very high90Very high19 Ų1917 Ų1712%0.11510%0.101CC..Hα-helixtrans-68.5-37.6179.8-179.70000111.1G127 A134 W135 L342 L346G127-V131 VanDerWaalsContact O-CB 3.24Å; G127-V131 WeakPolarHBondContact O-CB 3.47Å; G127-V131 WeakPolarHBondContact O-CG2 3.44Å; G127-V131 PolarHBondContact O-N 2.91Å; V131-A134 PolarHBondContact O-N 2.94Å; V131-W135 WeakPolarHBondContact O-CB 3.47Å; V131-W135 PolarHBondContact O-N 2.84Å; V131-L342 HydrophobicContact CG1-CD2 4.27Å; V131-L342 VanDerWaalsContact CG1-O 3.22Å; V131-L342 WeakPolarHBondContact CG1-O 3.44Å; V131-L346 HydrophobicContact CG1-CB 3.9Å
132A93.9Very high89.5Confident0 Ų018.5 Ų18.50%011%0.108CC..Hα-helixtrans-64-42.5175.800000112.4I128 W135 S136 A170 I174 L346I128-A132 WeakPolarHBondContact O-CB 3.36Å; I128-A132 PolarHBondContact O-N 3.22Å; I128-A132 VanDerWaalsContact O-N 3.12Å; A132-W135 WeakPolarHBondContact O-CB 3.34Å; A132-W135 PolarHBondContact O-N 2.68Å; A132-S136 PolarHBondContact O-N 3.42Å; A132-A170 HydrophobicContact CB-CB 4Å; A132-I174 HydrophobicContact CB-CD1 3.7Å; A132-I174 HydrophobicContact CB-CG1 3.61Å; A132-L346 HydrophobicContact CB-CD1 4.24Å; A132-L346 HydrophobicContact CB-CD2 4.29Å
133R89.8Confident89.4Confident20 Ų2021.3 Ų21.38%0.07512%0.123CC..Hα-helixtrans-66.2-39.4173.8-69.6-167.975109.86.8112.1A129 S130 W135 S136 S137 A170 A395 F398 L400A129-R133 WeakPolarHBondContact O-CG 3.29Å; A129-R133 PolarHBondContact O-N 3.34Å; A129-R133 VanDerWaalsContact O-N 3.09Å; S130-R133 PolarHBondContact O-N 3.36Å; R133-W135 VanDerWaalsContact C-N 3.31Å; R133-W135 PolarHBondContact O-N 3.42Å; R133-S136 WeakPolarHBondContact O-CB 3.41Å; R133-S136 PolarHBondContact O-N 3.24Å; R133-S137 PolarHBondContact O-N 2.99Å; R133-A170 HydrophobicContact CG-CB 4.17Å; R133-A395 PolarHBondContact NH1-O 2.94Å; R133-F398 PolarHBondContact NH1-O 3.23Å; R133-F398 VanDerWaalsContact NH1-O 3.16Å; R133-L400 HydrophobicContact CB-CD1 4.41Å
134A88.3Confident89Confident11 Ų1127.2 Ų27.29%0.09116%0.155CC..Hα-helixtrans-63.2-3817500000111.9S130 V131 N138 L342S130-A134 WeakPolarHBondContact O-CB 3.4Å; S130-A134 PolarHBondContact O-N 3.38Å; V131-A134 PolarHBondContact O-N 2.94Å; A134-N138 WeakPolarHBondContact O-CB 3.39Å; A134-N138 PolarHBondContact O-N 3.3Å; A134-N138 PolarHBondContact O-ND2 2.95Å; A134-L342 HydrophobicContact CB-CD2 4.19Å
135W92Very high88.5Confident39 Ų3928.1 Ų28.115%0.14817%0.166CC..Hα-helixtrans-61.4-49172.8-167.4107000111.2V131 A132 R133 S137 N138 F139 L169 L173 L339 L342 T343V131-W135 WeakPolarHBondContact O-CB 3.47Å; V131-W135 PolarHBondContact O-N 2.84Å; A132-W135 WeakPolarHBondContact O-CB 3.34Å; A132-W135 PolarHBondContact O-N 2.68Å; R133-W135 VanDerWaalsContact C-N 3.31Å; R133-W135 PolarHBondContact O-N 3.42Å; W135-S137 PolarHBondContact O-N 3.49Å; W135-N138 PolarHBondContact O-N 3.35Å; W135-F139 HydrophobicContact CE3-CB 3.98Å; W135-F139 HydrophobicContact CH2-CB 4.17Å; W135-F139 AromaticContact CH2-CD2 3.81Å; W135-F139 HydrophobicContact CH2-CD2 3.81Å; W135-F139 HydrophobicContact CH2-CE2 4.41Å; W135-F139 AromaticContact CH2-CG 3.98Å; W135-F139 HydrophobicContact CH2-CG 3.98Å; W135-F139 HydrophobicContact CZ3-CB 3.65Å; W135-F139 HydrophobicContact CZ3-CD1 4.33Å; W135-F139 HydrophobicContact CZ3-CD2 4.09Å; W135-F139 AromaticContact CZ3-CG 3.76Å; W135-F139 HydrophobicContact CZ3-CG 3.76Å; W135-F139 WeakPolarHBondContact O-CB 3.47Å; W135-F139 PolarHBondContact O-N 3.3Å; W135-L169 HydrophobicContact CE3-CD2 3.51Å; W135-L169 HydrophobicContact CZ3-CD2 3.4Å; W135-L169 VanDerWaalsContact CZ3-CD2 3.4Å; W135-L169 HydrophobicContact CZ3-CG 4.4Å; W135-L173 HydrophobicContact CB-CD2 3.71Å; W135-L173 HydrophobicContact CD2-CD2 3.59Å; W135-L173 HydrophobicContact CE3-CD2 3.98Å; W135-L173 HydrophobicContact CG-CD2 3.45Å; W135-L173 VanDerWaalsContact CG-CD2 3.45Å; W135-L339 HydrophobicContact CD2-CD2 4.07Å; W135-L339 HydrophobicContact CG-CD2 4.39Å; W135-L339 HydrophobicContact CZ2-CD2 4.16Å; W135-L339 PolarHBondContact NE1-O 2.87Å; W135-L342 HydrophobicContact CB-CB 4.18Å; W135-L342 HydrophobicContact CG-CB 4.26Å; W135-T343 PolarHBondContact NE1-OG1 3.05Å
136S91.8Very high88.4Confident2 Ų233.9 Ų33.91%0.01419%0.193CC..Hα-helixtrans-56.3-49.9177.9-169.90000112.1A132 R133 N138 F139 D140 D167 L169A132-S136 PolarHBondContact O-N 3.42Å; R133-S136 WeakPolarHBondContact O-CB 3.41Å; R133-S136 PolarHBondContact O-N 3.24Å; S136-N138 PolarHBondContact O-N 3.05Å; S136-F139 PolarHBondContact O-N 2.97Å; S136-D140 WeakPolarHBondContact O-CB 3.39Å; S136-D140 PolarHBondContact O-N 2.91Å; S136-D167 WeakPolarHBondContact CB-OD2 3.21Å; S136-D167 VanDerWaalsContact OG-CG 3.31Å; S136-D167 PolarHBondContact OG-OD1 2.88Å; S136-D167 PolarHBondContact OG-OD2 2.93Å; S136-L169 WeakPolarHBondContact OG-CD2 3.21Å
137S86.7Confident88.4Confident57 Ų5735.4 Ų35.440%0.39920%0.2SC..Hα-helixtrans-62.1-40.4177.7179.40000112.8R133 W135 D140 G141R133-S137 PolarHBondContact O-N 2.99Å; W135-S137 PolarHBondContact O-N 3.49Å; S137-D140 PolarHBondContact O-N 3.16Å; S137-G141 PolarHBondContact O-N 3.23Å
138N86.7Confident88.3Confident38 Ų3838.4 Ų38.420%0.20321%0.214CC..Hα-helixtrans-66.7-39.7176.5-88.8-93.9000112.2A134 W135 S136 G141 L339 L342A134-N138 WeakPolarHBondContact O-CB 3.39Å; A134-N138 PolarHBondContact O-N 3.3Å; A134-N138 PolarHBondContact O-ND2 2.95Å; W135-N138 PolarHBondContact O-N 3.35Å; S136-N138 PolarHBondContact O-N 3.05Å; N138-G141 PolarHBondContact O-N 3.05Å; N138-L339 HydrophobicContact CB-CD2 4.1Å; N138-L342 HydrophobicContact CB-CD1 3.86Å
139F90Very high88Confident67 Ų6745.4 Ų45.429%0.29425%0.247SC..Hα-helixtrans-65.5-44.7176.8-175.6-100.1000111.1W135 S136 G141 I142 L143 I147 L169 L339W135-F139 HydrophobicContact CE3-CB 3.98Å; W135-F139 HydrophobicContact CH2-CB 4.17Å; W135-F139 AromaticContact CH2-CD2 3.81Å; W135-F139 HydrophobicContact CH2-CD2 3.81Å; W135-F139 HydrophobicContact CH2-CE2 4.41Å; W135-F139 AromaticContact CH2-CG 3.98Å; W135-F139 HydrophobicContact CH2-CG 3.98Å; W135-F139 HydrophobicContact CZ3-CB 3.65Å; W135-F139 HydrophobicContact CZ3-CD1 4.33Å; W135-F139 HydrophobicContact CZ3-CD2 4.09Å; W135-F139 AromaticContact CZ3-CG 3.76Å; W135-F139 HydrophobicContact CZ3-CG 3.76Å; W135-F139 WeakPolarHBondContact O-CB 3.47Å; W135-F139 PolarHBondContact O-N 3.3Å; S136-F139 PolarHBondContact O-N 2.97Å; F139-G141 VanDerWaalsContact C-N 3.29Å; F139-G141 PolarHBondContact O-N 2.78Å; F139-I142 WeakPolarHBondContact O-CB 3.16Å; F139-I142 PolarHBondContact O-N 3.13Å; F139-I142 VanDerWaalsContact O-N 3.07Å; F139-L143 HydrophobicContact CD1-CD1 4.22Å; F139-L143 HydrophobicContact CE1-CD1 3.69Å; F139-L143 HydrophobicContact CZ-CD1 4.3Å; F139-I147 HydrophobicContact CD1-CD1 3.75Å; F139-I147 HydrophobicContact CE1-CD1 3.84Å; F139-L169 HydrophobicContact CD1-CD1 3.92Å; F139-L169 HydrophobicContact CE1-CD1 4.33Å; F139-L339 HydrophobicContact CB-CD2 3.94Å; F139-L339 HydrophobicContact CD2-CD1 3.86Å; F139-L339 HydrophobicContact CD2-CD2 4.45Å
140D88.9Confident88.1Confident5 Ų550.9 Ų50.93%0.02727%0.271CS..Hα-helixtrans-65.7-31.6176.9-167.728.5000112.9S136 S137 I142 L143 N144 G145 Q146 I147 E148S136-D140 WeakPolarHBondContact O-CB 3.39Å; S136-D140 PolarHBondContact O-N 2.91Å; S137-D140 PolarHBondContact O-N 3.16Å; D140-I142 PolarHBondContact O-N 3.41Å; D140-L143 CarbonylContact O-C 3.34Å; D140-L143 VanDerWaalsContact O-C 3.3Å; D140-L143 WeakPolarHBondContact O-CA 3.37Å; D140-L143 PolarHBondContact O-N 3.46Å; D140-N144 PolarHBondContact O-N 3.4Å; D140-G145 VanDerWaalsContact CG-CA 3.45Å; D140-G145 PolarHBondContact O-N 3.38Å; D140-G145 WeakPolarHBondContact OD1-CA 3.48Å; D140-G145 PolarHBondContact OD1-N 3.25Å; D140-G145 VanDerWaalsContact OD2-C 3.3Å; D140-G145 VanDerWaalsContact OD2-CA 3.23Å; D140-G145 WeakPolarHBondContact OD2-CA 3.19Å; D140-Q146 PolarHBondContact OD1-N 2.88Å; D140-Q146 VanDerWaalsContact OD1-N 3.09Å; D140-I147 HydrophobicContact CB-CB 4.13Å; D140-I147 HydrophobicContact CB-CD1 4.46Å; D140-I147 VanDerWaalsContact OD1-CB 3.27Å; D140-I147 WeakPolarHBondContact OD1-CB 3.36Å; D140-I147 WeakPolarHBondContact OD1-CG1 3.32Å; D140-I147 PolarHBondContact OD1-N 3.36Å; D140-E148 WeakPolarHBondContact OD2-CB 3.02Å; D140-E148 PolarHBondContact OD2-N 2.68Å
141G81.6Confident88.2Confident44 Ų4452 Ų5245%0.45428%0.275SS..Hα-helixtrans-60-24.1171.700000114.1S137 N138 F139S137-G141 PolarHBondContact O-N 3.23Å; N138-G141 PolarHBondContact O-N 3.05Å; F139-G141 VanDerWaalsContact C-N 3.29Å; F139-G141 PolarHBondContact O-N 2.78Å
142I83.3Confident88Confident43 Ų4354.1 Ų54.122%0.22128%0.282CS..Hα-helixtrans-75.3-34.3172.2-56.7170.7000110.5F139 D140 N144 Y332 L339F139-I142 WeakPolarHBondContact O-CB 3.16Å; F139-I142 PolarHBondContact O-N 3.13Å; F139-I142 VanDerWaalsContact O-N 3.07Å; D140-I142 PolarHBondContact O-N 3.41Å; I142-N144 VanDerWaalsContact C-N 3.3Å; I142-Y332 HydrophobicContact CG2-CD1 4.44Å; I142-Y332 HydrophobicContact CG2-CE1 4.48Å; I142-L339 HydrophobicContact CD1-CD1 3.69Å; I142-L339 HydrophobicContact CD1-CG 4.47Å
143L85.9Confident87.8Confident71 Ų7162.2 Ų62.237%0.37232%0.318SS..THydrogen-bonded Turntrans-90.611.5179.5-60.4173.3000113.2F139 D140 G145 Q146 I147F139-L143 HydrophobicContact CD1-CD1 4.22Å; F139-L143 HydrophobicContact CE1-CD1 3.69Å; F139-L143 HydrophobicContact CZ-CD1 4.3Å; D140-L143 CarbonylContact O-C 3.34Å; D140-L143 VanDerWaalsContact O-C 3.3Å; D140-L143 WeakPolarHBondContact O-CA 3.37Å; D140-L143 PolarHBondContact O-N 3.46Å; L143-G145 VanDerWaalsContact C-N 3.35Å; L143-G145 PolarHBondContact O-N 3.48Å; L143-Q146 WeakPolarHBondContact O-CG 3.35Å; L143-I147 HydrophobicContact CD1-CD1 3.57Å; L143-I147 HydrophobicContact CD1-CG1 4.03Å
144N82Confident87.8Confident132 Ų13266.4 Ų66.471%0.70634%0.338SS*.THydrogen-bonded Turntrans59.135.4-178.8-54.4-45.9000114.6D140 I142D140-N144 PolarHBondContact O-N 3.4Å; I142-N144 VanDerWaalsContact C-N 3.3Å
145G82.8Confident87.8Confident25 Ų2569.1 Ų69.126%0.25835%0.35SS..THydrogen-bonded Turntrans84.68.8170.200000115.6D140 L143 I147 E148 E149D140-G145 VanDerWaalsContact CG-CA 3.45Å; D140-G145 PolarHBondContact O-N 3.38Å; D140-G145 WeakPolarHBondContact OD1-CA 3.48Å; D140-G145 PolarHBondContact OD1-N 3.25Å; D140-G145 VanDerWaalsContact OD2-C 3.3Å; D140-G145 VanDerWaalsContact OD2-CA 3.23Å; D140-G145 WeakPolarHBondContact OD2-CA 3.19Å; L143-G145 VanDerWaalsContact C-N 3.35Å; L143-G145 PolarHBondContact O-N 3.48Å; G145-I147 VanDerWaalsContact C-N 3.3Å; G145-I147 PolarHBondContact O-N 3.09Å; G145-E148 PolarHBondContact O-N 2.87Å; G145-E149 PolarHBondContact O-N 2.69Å; G145-E149 VanDerWaalsContact O-N 3.08Å
146Q89.5Confident87.6Confident130 Ų13069.6 Ų69.661%0.60736%0.363SS*.Hα-helixtrans-66.3-31.3-175.6-70.9-177.6-2.200113D140 L143 F150D140-Q146 PolarHBondContact OD1-N 2.88Å; D140-Q146 VanDerWaalsContact OD1-N 3.09Å; L143-Q146 WeakPolarHBondContact O-CG 3.35Å; Q146-F150 VanDerWaalsContact O-CB 3.29Å; Q146-F150 WeakPolarHBondContact O-CB 3.42Å; Q146-F150 PolarHBondContact O-N 3.36Å
147I88.3Confident87.2Confident32 Ų3272 Ų7216%0.16438%0.375CS..Hα-helixtrans-72.2-46.5180-60.2179.2000109.8F139 D140 L143 G145 F150 F151 L169F139-I147 HydrophobicContact CD1-CD1 3.75Å; F139-I147 HydrophobicContact CE1-CD1 3.84Å; D140-I147 HydrophobicContact CB-CB 4.13Å; D140-I147 HydrophobicContact CB-CD1 4.46Å; D140-I147 VanDerWaalsContact OD1-CB 3.27Å; D140-I147 WeakPolarHBondContact OD1-CB 3.36Å; D140-I147 WeakPolarHBondContact OD1-CG1 3.32Å; D140-I147 PolarHBondContact OD1-N 3.36Å; L143-I147 HydrophobicContact CD1-CD1 3.57Å; L143-I147 HydrophobicContact CD1-CG1 4.03Å; G145-I147 VanDerWaalsContact C-N 3.3Å; G145-I147 PolarHBondContact O-N 3.09Å; I147-F150 PolarHBondContact O-N 3.12Å; I147-F151 HydrophobicContact CG2-CD2 3.48Å; I147-F151 VanDerWaalsContact CG2-CD2 3.48Å; I147-F151 HydrophobicContact CG2-CE2 3.17Å; I147-F151 HydrophobicContact CG2-CZ 4.14Å; I147-F151 WeakPolarHBondContact O-CD2 3.4Å; I147-F151 PolarHBondContact O-N 3.2Å; I147-L169 HydrophobicContact CD1-CD1 3.87Å
148E86.3Confident86.7Confident62 Ų6275.3 Ų75.329%0.2939%0.389SS..Hα-helixtrans-59-47.5175.6178.1174.7167.800110.9D140 G145 F150 F151 K152 Y165D140-E148 WeakPolarHBondContact OD2-CB 3.02Å; D140-E148 PolarHBondContact OD2-N 2.68Å; G145-E148 PolarHBondContact O-N 2.87Å; E148-F150 VanDerWaalsContact C-N 3.32Å; E148-F150 PolarHBondContact O-N 3.38Å; E148-F151 PolarHBondContact O-N 3.45Å; E148-K152 HydrophobicContact CG-CD 4.02Å; E148-K152 HydrophobicContact CG-CG 4.32Å; E148-K152 WeakPolarHBondContact O-CB 3.43Å; E148-K152 VanDerWaalsContact O-CG 3.31Å; E148-K152 WeakPolarHBondContact O-CG 3.21Å; E148-K152 PolarHBondContact O-N 2.72Å; E148-K152 WeakPolarHBondContact OE1-CE 3.31Å; E148-K152 IonicContact OE1-NZ 2.68Å; E148-K152 PolarHBondContact OE1-NZ 3.49Å; E148-Y165 HydrophobicContact CG-CE1 3.76Å
149E89Confident86.3Confident147 Ų14778.3 Ų78.369%0.68740%0.404SS*.Hα-helixtrans-59.6-43.2177.8-171.3179.7177.800111.7G145 K153G145-E149 PolarHBondContact O-N 2.69Å; G145-E149 VanDerWaalsContact O-N 3.08Å; E149-K153 PolarHBondContact O-N 2.83Å
150F92.4Very high85.4Confident115 Ų11581.3 Ų81.350%0.50443%0.431SS..Hα-helixtrans-63.4-45.6177.6-179.8-93.4000112.3Q146 I147 E148 K153 H154Q146-F150 VanDerWaalsContact O-CB 3.29Å; Q146-F150 WeakPolarHBondContact O-CB 3.42Å; Q146-F150 PolarHBondContact O-N 3.36Å; I147-F150 PolarHBondContact O-N 3.12Å; E148-F150 VanDerWaalsContact C-N 3.32Å; E148-F150 PolarHBondContact O-N 3.38Å; F150-K153 PolarHBondContact O-N 2.98Å; F150-H154 AromaticContact CD2-CE1 3.7Å; F150-H154 AromaticContact CD2-ND1 3.8Å; F150-H154 AromaticContact CE2-CE1 3.39Å; F150-H154 WeakPolarHBondContact CE2-CE1 3.5Å; F150-H154 AromaticContact CE2-ND1 3.64Å; F150-H154 AromaticContact CZ-CE1 3.85Å; F150-H154 AromaticContact CZ-ND1 3.75Å; F150-H154 PolarHBondContact O-N 2.98Å; F150-H154 PolarHBondContact O-ND1 2.94Å
151F90.8Very high84.3Confident33 Ų3383.6 Ų83.615%0.14546%0.455CS..Hα-helixtrans-75.6-33.3-178.9-67.5-42000113.2I147 E148 K153 H154 L155 Y165 P168 L169I147-F151 HydrophobicContact CG2-CD2 3.48Å; I147-F151 VanDerWaalsContact CG2-CD2 3.48Å; I147-F151 HydrophobicContact CG2-CE2 3.17Å; I147-F151 HydrophobicContact CG2-CZ 4.14Å; I147-F151 WeakPolarHBondContact O-CD2 3.4Å; I147-F151 PolarHBondContact O-N 3.2Å; E148-F151 PolarHBondContact O-N 3.45Å; F151-K153 PolarHBondContact O-N 3.01Å; F151-H154 PolarHBondContact O-N 2.98Å; F151-L155 HydrophobicContact CD1-CD1 3.82Å; F151-L155 HydrophobicContact CE1-CD1 4.36Å; F151-L155 CarbonylContact O-C 3.59Å; F151-L155 WeakPolarHBondContact O-CA 3.23Å; F151-L155 WeakPolarHBondContact O-CB 3.37Å; F151-L155 PolarHBondContact O-N 3.13Å; F151-Y165 HydrophobicContact CB-CD2 3.67Å; F151-Y165 HydrophobicContact CB-CE2 4.19Å; F151-Y165 HydrophobicContact CB-CG 4.37Å; F151-P168 HydrophobicContact CD1-CG 4.07Å; F151-P168 HydrophobicContact CE1-CG 3.76Å; F151-P168 HydrophobicContact CE2-CG 4.26Å; F151-P168 HydrophobicContact CG-CG 4.49Å; F151-P168 HydrophobicContact CZ-CB 4.31Å; F151-P168 HydrophobicContact CZ-CG 3.87Å; F151-L169 HydrophobicContact CE2-CB 4.47Å
152K87.9Confident84.2Confident63 Ų6384 Ų8427%0.27445%0.446SS..Hα-helixtrans-58.4-36.2169.6-76.9-176.2-179.2-170.10111.9E148 E164 Y165E148-K152 HydrophobicContact CG-CD 4.02Å; E148-K152 HydrophobicContact CG-CG 4.32Å; E148-K152 WeakPolarHBondContact O-CB 3.43Å; E148-K152 VanDerWaalsContact O-CG 3.31Å; E148-K152 WeakPolarHBondContact O-CG 3.21Å; E148-K152 PolarHBondContact O-N 2.72Å; E148-K152 WeakPolarHBondContact OE1-CE 3.31Å; E148-K152 IonicContact OE1-NZ 2.68Å; E148-K152 PolarHBondContact OE1-NZ 3.49Å; K152-E164 WeakPolarHBondContact CD-OE1 3.42Å; K152-E164 VanDerWaalsContact CE-OE1 3.22Å; K152-E164 WeakPolarHBondContact CE-OE1 3.31Å; K152-E164 WeakPolarHBondContact CE-OE2 3.45Å; K152-E164 IonicContact NZ-OE1 3.03Å; K152-E164 PolarHBondContact NZ-OE1 3.29Å; K152-E164 IonicContact NZ-OE2 2.76Å; K152-E164 PolarHBondContact NZ-OE2 2.68Å; K152-Y165 HydrophobicContact CD-CD1 4.43Å; K152-Y165 HydrophobicContact CG-CD1 3.65Å; K152-Y165 HydrophobicContact CG-CE1 4.32Å; K152-Y165 HydrophobicContact CG-CG 4.12Å
153K89.1Confident84.1Confident170 Ų17082 Ų8274%0.73944%0.436SS*.Hα-helixtrans-70.4-36.4178.1-174.8175177.7179.30113.7E149 F150 F151E149-K153 PolarHBondContact O-N 2.83Å; F150-K153 PolarHBondContact O-N 2.98Å; F151-K153 PolarHBondContact O-N 3.01Å
154H90.3Very high84Confident108 Ų10883.5 Ų83.550%0.544%0.442SS..Hα-helixtrans-109-20.9-170.4-60.293.9000114.9F150 F151F150-H154 AromaticContact CD2-CE1 3.7Å; F150-H154 AromaticContact CD2-ND1 3.8Å; F150-H154 AromaticContact CE2-CE1 3.39Å; F150-H154 WeakPolarHBondContact CE2-CE1 3.5Å; F150-H154 AromaticContact CE2-ND1 3.64Å; F150-H154 AromaticContact CZ-CE1 3.85Å; F150-H154 AromaticContact CZ-ND1 3.75Å; F150-H154 PolarHBondContact O-N 2.98Å; F150-H154 PolarHBondContact O-ND1 2.94Å; F151-H154 PolarHBondContact O-N 2.98Å
155L89.2Confident84.3Confident68 Ų6878.2 Ų78.236%0.35641%0.412SS..SBendtrans-135.936.5-169.7-63.2175.6000112.4F151 Y165 V166 P168F151-L155 HydrophobicContact CD1-CD1 3.82Å; F151-L155 HydrophobicContact CE1-CD1 4.36Å; F151-L155 CarbonylContact O-C 3.59Å; F151-L155 WeakPolarHBondContact O-CA 3.23Å; F151-L155 WeakPolarHBondContact O-CB 3.37Å; F151-L155 PolarHBondContact O-N 3.13Å; L155-Y165 VanDerWaalsContact O-CA 3.26Å; L155-Y165 WeakPolarHBondContact O-CA 3.36Å; L155-V166 HydrophobicContact CB-CB 4.26Å; L155-V166 PolarHBondContact O-N 3.46Å; L155-P168 HydrophobicContact CD1-CG 3.42Å; L155-P168 VanDerWaalsContact CD1-CG 3.42Å
156A86.9Confident84.6Confident50 Ų5078.9 Ų78.941%0.41341%0.411SS..BIsolated β-bridgetrans-68.6135.6174.900000111.8E164A156-E164 WeakPolarHBondContact CA-O 3.09Å
157L83.2Confident84.6Confident52 Ų5272.8 Ų72.827%0.27238%0.382SS..  trans-98-34.4172.9-74.8163.1000111.6L159 A163 E164 V166L157-L159 WeakPolarHBondContact O-CG 3.02Å; L157-L159 PolarHBondContact O-N 3.32Å; L157-A163 WeakPolarHBondContact CB-O 3.33Å; L157-A163 HydrophobicContact CD1-CB 4.39Å; L157-E164 PolarHBondContact N-O 3.39Å; L157-V166 HydrophobicContact CD1-CG2 3.68Å; L157-V166 HydrophobicContact CD2-CG2 4.08Å; L157-V166 HydrophobicContact CG-CG2 3.8Å
158N75.9Confident84.8Confident126 Ų12673.5 Ų73.567%0.67439%0.389SS*.  trans41.531.9175.1-70-20000115.9
159L78.2Confident85.2Confident101 Ų10172.4 Ų72.453%0.52939%0.385SS..  trans-105.8135.1177.6-78.6159000109.3L157 G161 L162L157-L159 WeakPolarHBondContact O-CG 3.02Å; L157-L159 PolarHBondContact O-N 3.32Å; L159-G161 PolarHBondContact O-N 2.94Å; L159-L162 HydrophobicContact CB-CB 4.26Å; L159-L162 HydrophobicContact CB-CD1 3.88Å; L159-L162 HydrophobicContact CB-CG 4.07Å; L159-L162 HydrophobicContact CD1-CD1 3.85Å; L159-L162 PolarHBondContact O-N 2.94Å; L159-L162 VanDerWaalsContact O-N 3.08Å
160P71.3Confident85.4Confident131 Ų13165.4 Ų65.485%0.85135%0.352SS*.THydrogen-bonded Turntrans-60.7126.8-179.723.8-31.9000110.9
161G67.3Low85.6Confident52 Ų5261.5 Ų61.554%0.53634%0.338SS..THydrogen-bonded Turntrans88.1-3.9-177.900000115.4L159L159-G161 PolarHBondContact O-N 2.94Å
162L79.1Confident85.8Confident53 Ų5361.6 Ų61.628%0.27735%0.348SS..SBendtrans-101.1169.1171.1-61-167.7000111.3L159 V397 F398L159-L162 HydrophobicContact CB-CB 4.26Å; L159-L162 HydrophobicContact CB-CD1 3.88Å; L159-L162 HydrophobicContact CB-CG 4.07Å; L159-L162 HydrophobicContact CD1-CD1 3.85Å; L159-L162 PolarHBondContact O-N 2.94Å; L159-L162 VanDerWaalsContact O-N 3.08Å; L162-V397 WeakPolarHBondContact CA-O 3.24Å; L162-V397 WeakPolarHBondContact CB-O 3.49Å; L162-V397 HydrophobicContact CD1-CG1 4.46Å; L162-V397 HydrophobicContact CD2-CG1 3.51Å; L162-F398 HydrophobicContact CD2-CE1 4.41Å
163A80.9Confident86.2Confident1 Ų159.3 Ų59.31%0.00834%0.339CS..  trans-59150.517000000111.4L157 Y165 V397L157-A163 WeakPolarHBondContact CB-O 3.33Å; L157-A163 HydrophobicContact CD1-CB 4.39Å; A163-Y165 VanDerWaalsContact C-N 3.27Å; A163-Y165 WeakPolarHBondContact CB-O 3.37Å; A163-Y165 PolarHBondContact O-N 3.07Å; A163-V397 PolarHBondContact N-O 3.38Å
164E83.7Confident86.6Confident103 Ų10351.2 Ų51.248%0.48130%0.304SS..SBendtrans-62.5-38.6175-170.2-179.8171.900111.2K152 A156 L157K152-E164 WeakPolarHBondContact CD-OE1 3.42Å; K152-E164 VanDerWaalsContact CE-OE1 3.22Å; K152-E164 WeakPolarHBondContact CE-OE1 3.31Å; K152-E164 WeakPolarHBondContact CE-OE2 3.45Å; K152-E164 IonicContact NZ-OE1 3.03Å; K152-E164 PolarHBondContact NZ-OE1 3.29Å; K152-E164 IonicContact NZ-OE2 2.76Å; K152-E164 PolarHBondContact NZ-OE2 2.68Å; A156-E164 WeakPolarHBondContact CA-O 3.09Å; L157-E164 PolarHBondContact N-O 3.39Å
165Y87.9Confident87Confident20 Ų2050.1 Ų50.18%0.07830%0.301CS..BIsolated β-bridgetrans-139.7152.5176.266-83.5000111.6E148 F151 K152 L155 A163 D167E148-Y165 HydrophobicContact CG-CE1 3.76Å; F151-Y165 HydrophobicContact CB-CD2 3.67Å; F151-Y165 HydrophobicContact CB-CE2 4.19Å; F151-Y165 HydrophobicContact CB-CG 4.37Å; K152-Y165 HydrophobicContact CD-CD1 4.43Å; K152-Y165 HydrophobicContact CG-CD1 3.65Å; K152-Y165 HydrophobicContact CG-CE1 4.32Å; K152-Y165 HydrophobicContact CG-CG 4.12Å; L155-Y165 VanDerWaalsContact O-CA 3.26Å; L155-Y165 WeakPolarHBondContact O-CA 3.36Å; A163-Y165 VanDerWaalsContact C-N 3.27Å; A163-Y165 WeakPolarHBondContact CB-O 3.37Å; A163-Y165 PolarHBondContact O-N 3.07Å; Y165-D167 HydrophobicContact CD2-CB 4.41Å; Y165-D167 HydrophobicContact CE2-CB 3.92Å
166V90.2Very high87.3Confident40 Ų4051.6 Ų51.624%0.24231%0.309CS..  trans-70.7128.5166.6179.40000108L155 L157 P168 A396L155-V166 HydrophobicContact CB-CB 4.26Å; L155-V166 PolarHBondContact O-N 3.46Å; L157-V166 HydrophobicContact CD1-CG2 3.68Å; L157-V166 HydrophobicContact CD2-CG2 4.08Å; L157-V166 HydrophobicContact CG-CG2 3.8Å; V166-P168 WeakPolarHBondContact O-CD 3.46Å; V166-A396 HydrophobicContact CG1-CB 4.02Å
167D89.6Confident87.7Confident1 Ų149.9 Ų49.91%0.00529%0.292CS..  trans-100.593.9-179.3-175.9-12.6000110.8S136 Y165 L169 A170 V171S136-D167 WeakPolarHBondContact CB-OD2 3.21Å; S136-D167 VanDerWaalsContact OG-CG 3.31Å; S136-D167 PolarHBondContact OG-OD1 2.88Å; S136-D167 PolarHBondContact OG-OD2 2.93Å; Y165-D167 HydrophobicContact CD2-CB 4.41Å; Y165-D167 HydrophobicContact CE2-CB 3.92Å; D167-L169 PolarHBondContact O-N 3.44Å; D167-L169 PolarHBondContact OD1-N 3.43Å; D167-L169 VanDerWaalsContact OD1-N 3.15Å; D167-A170 HydrophobicContact CB-CB 4.06Å; D167-A170 VanDerWaalsContact CG-CB 3.46Å; D167-A170 PolarHBondContact O-N 3.17Å; D167-A170 PolarHBondContact OD1-N 3.35Å; D167-A170 WeakPolarHBondContact OD2-CB 2.88Å; D167-V171 WeakPolarHBondContact O-CG2 3.5Å; D167-V171 PolarHBondContact O-N 3.22Å
168P92.7Very high88.3Confident48 Ų4848.1 Ų48.131%0.31228%0.283SS..Hα-helixtrans-70.6-22.9-177.7-16.534.8000112.2F151 L155 V166 G172F151-P168 HydrophobicContact CD1-CG 4.07Å; F151-P168 HydrophobicContact CE1-CG 3.76Å; F151-P168 HydrophobicContact CE2-CG 4.26Å; F151-P168 HydrophobicContact CG-CG 4.49Å; F151-P168 HydrophobicContact CZ-CB 4.31Å; F151-P168 HydrophobicContact CZ-CG 3.87Å; L155-P168 HydrophobicContact CD1-CG 3.42Å; L155-P168 VanDerWaalsContact CD1-CG 3.42Å; V166-P168 WeakPolarHBondContact O-CD 3.46Å; P168-G172 PolarHBondContact O-N 3.03Å
169L93.1Very high89.2Confident39 Ų3946.6 Ų46.620%0.20427%0.274CS..Hα-helixtrans-72.5-43.7179.7-175.1155.4000110.2W135 S136 F139 I147 F151 D167 G172 L173W135-L169 HydrophobicContact CE3-CD2 3.51Å; W135-L169 HydrophobicContact CZ3-CD2 3.4Å; W135-L169 VanDerWaalsContact CZ3-CD2 3.4Å; W135-L169 HydrophobicContact CZ3-CG 4.4Å; S136-L169 WeakPolarHBondContact OG-CD2 3.21Å; F139-L169 HydrophobicContact CD1-CD1 3.92Å; F139-L169 HydrophobicContact CE1-CD1 4.33Å; I147-L169 HydrophobicContact CD1-CD1 3.87Å; F151-L169 HydrophobicContact CE2-CB 4.47Å; D167-L169 PolarHBondContact O-N 3.44Å; D167-L169 PolarHBondContact OD1-N 3.43Å; D167-L169 VanDerWaalsContact OD1-N 3.15Å; L169-G172 PolarHBondContact O-N 2.97Å; L169-L173 WeakPolarHBondContact O-CB 3.14Å; L169-L173 PolarHBondContact O-N 3.33Å
170A94.2Very high89.9Confident0 Ų043 Ų430%026%0.255CS..Hα-helixtrans-60.4-44.5170.900000111.9A132 R133 D167 L173 I174A132-A170 HydrophobicContact CB-CB 4Å; R133-A170 HydrophobicContact CG-CB 4.17Å; D167-A170 HydrophobicContact CB-CB 4.06Å; D167-A170 VanDerWaalsContact CG-CB 3.46Å; D167-A170 PolarHBondContact O-N 3.17Å; D167-A170 PolarHBondContact OD1-N 3.35Å; D167-A170 WeakPolarHBondContact OD2-CB 2.88Å; A170-L173 PolarHBondContact O-N 3.45Å; A170-I174 WeakPolarHBondContact O-CG1 3.47Å; A170-I174 PolarHBondContact O-N 3Å
171V95.7Very high91Very high32 Ų3237.2 Ų37.219%0.19422%0.218CC..Hα-helixtrans-61.2-46.5176.41720000111.3D167 L173 I174 I175 C392 A396D167-V171 WeakPolarHBondContact O-CG2 3.5Å; D167-V171 PolarHBondContact O-N 3.22Å; V171-L173 VanDerWaalsContact C-N 3.29Å; V171-L173 PolarHBondContact O-N 3.34Å; V171-I174 PolarHBondContact O-N 3.29Å; V171-I175 HydrophobicContact CG1-CD1 3.93Å; V171-I175 WeakPolarHBondContact O-CG1 3.2Å; V171-I175 PolarHBondContact O-N 2.99Å; V171-C392 HydrophobicContact CG1-CB 4.13Å; V171-A396 HydrophobicContact CG2-CB 4.09Å
172G96.2Very high92.1Very high36 Ų3635.9 Ų35.937%0.37120%0.2SC..Hα-helixtrans-59.4-39.417700000112.5P168 L169 I175 L176P168-G172 PolarHBondContact O-N 3.03Å; L169-G172 PolarHBondContact O-N 2.97Å; G172-I175 PolarHBondContact O-N 3.22Å; G172-L176 WeakPolarHBondContact O-CB 3.46Å; G172-L176 PolarHBondContact O-N 3.34Å
173L96Very high92.7Very high15 Ų1538.2 Ų38.28%0.07921%0.212CC..Hα-helixtrans-65.2-43.7175.8-17368.1000112.1W135 L169 A170 V171 I175 L176 M177 L346W135-L173 HydrophobicContact CB-CD2 3.71Å; W135-L173 HydrophobicContact CD2-CD2 3.59Å; W135-L173 HydrophobicContact CE3-CD2 3.98Å; W135-L173 HydrophobicContact CG-CD2 3.45Å; W135-L173 VanDerWaalsContact CG-CD2 3.45Å; L169-L173 WeakPolarHBondContact O-CB 3.14Å; L169-L173 PolarHBondContact O-N 3.33Å; A170-L173 PolarHBondContact O-N 3.45Å; V171-L173 VanDerWaalsContact C-N 3.29Å; V171-L173 PolarHBondContact O-N 3.34Å; L173-I175 VanDerWaalsContact C-N 3.34Å; L173-I175 PolarHBondContact O-N 2.76Å; L173-L176 WeakPolarHBondContact O-CB 3.45Å; L173-L176 PolarHBondContact O-N 2.84Å; L173-M177 HydrophobicContact CD1-CE 3.75Å; L173-M177 VanDerWaalsContact O-CG 3.32Å; L173-M177 WeakPolarHBondContact O-CG 3.45Å; L173-M177 PolarHBondContact O-N 3.03Å; L173-L346 HydrophobicContact CD2-CD2 3.52Å; L173-L346 HydrophobicContact CG-CD2 3.57Å
174I97.7Very high93.1Very high0 Ų038.6 Ų38.60%022%0.216CC..Hα-helixtrans-62.6-42.2176.4-64.4165.7000110.6I128 A132 A170 V171 L176 M177 T178 M350 G388 C392 A395I128-I174 HydrophobicContact CG2-CD1 3.91Å; I128-I174 HydrophobicContact CG2-CG1 3.86Å; I128-I174 HydrophobicContact CG2-CG2 3.91Å; A132-I174 HydrophobicContact CB-CD1 3.7Å; A132-I174 HydrophobicContact CB-CG1 3.61Å; A170-I174 WeakPolarHBondContact O-CG1 3.47Å; A170-I174 PolarHBondContact O-N 3Å; V171-I174 PolarHBondContact O-N 3.29Å; I174-L176 PolarHBondContact O-N 2.8Å; I174-M177 PolarHBondContact O-N 3.08Å; I174-T178 WeakPolarHBondContact O-CB 3.3Å; I174-T178 PolarHBondContact O-N 3.18Å; I174-T178 PolarHBondContact O-OG1 2.71Å; I174-M350 HydrophobicContact CG2-CE 4.01Å; I174-M350 HydrophobicContact CG2-SD 4.45Å; I174-G388 WeakPolarHBondContact CG2-O 3.21Å; I174-C392 VanDerWaalsContact CG2-SG 3.53Å; I174-A395 HydrophobicContact CD1-CB 3.63Å
175I97.5Very high93.3Very high84 Ų8434.3 Ų34.343%0.43120%0.196SC..Hα-helixtrans-60.3-47.2175.9-68.3169000110.2V171 G172 L173 M177 T178 I179V171-I175 HydrophobicContact CG1-CD1 3.93Å; V171-I175 WeakPolarHBondContact O-CG1 3.2Å; V171-I175 PolarHBondContact O-N 2.99Å; G172-I175 PolarHBondContact O-N 3.22Å; L173-I175 VanDerWaalsContact C-N 3.34Å; L173-I175 PolarHBondContact O-N 2.76Å; I175-M177 PolarHBondContact O-N 3.3Å; I175-T178 WeakPolarHBondContact O-CB 3.19Å; I175-T178 PolarHBondContact O-N 2.78Å; I175-I179 HydrophobicContact CG2-CD1 3.95Å; I175-I179 WeakPolarHBondContact O-CG1 3.29Å; I175-I179 PolarHBondContact O-N 3.47Å
176L96.2Very high93.4Very high100 Ų10039 Ų3952%0.52421%0.214SC..Hα-helixtrans-58-46.9177.5179.464.5000111.8G172 L173 I174 T178 I179 L180G172-L176 WeakPolarHBondContact O-CB 3.46Å; G172-L176 PolarHBondContact O-N 3.34Å; L173-L176 WeakPolarHBondContact O-CB 3.45Å; L173-L176 PolarHBondContact O-N 2.84Å; I174-L176 PolarHBondContact O-N 2.8Å; L176-T178 VanDerWaalsContact C-N 3.35Å; L176-T178 PolarHBondContact O-N 3.03Å; L176-I179 PolarHBondContact O-N 3.15Å; L176-L180 PolarHBondContact O-N 3Å
177M95.3Very high93.4Very high13 Ų1341.4 Ų41.46%0.06422%0.222CC..Hα-helixtrans-68.5-33.7178.6-65.2-55.5144.600112.5L173 I174 I175 I179 L180 L181 T343 L346 L347 M350L173-M177 HydrophobicContact CD1-CE 3.75Å; L173-M177 VanDerWaalsContact O-CG 3.32Å; L173-M177 WeakPolarHBondContact O-CG 3.45Å; L173-M177 PolarHBondContact O-N 3.03Å; I174-M177 PolarHBondContact O-N 3.08Å; I175-M177 PolarHBondContact O-N 3.3Å; M177-I179 VanDerWaalsContact C-N 3.34Å; M177-L180 PolarHBondContact O-N 3.18Å; M177-L180 HydrophobicContact SD-CD2 4.24Å; M177-L181 WeakPolarHBondContact O-CG 3.42Å; M177-L181 PolarHBondContact O-N 3.02Å; M177-T343 HydrophobicContact CE-CG2 3.72Å; M177-T343 HydrophobicContact SD-CG2 4.33Å; M177-L346 HydrophobicContact CG-CD2 3.75Å; M177-L346 HydrophobicContact CG-CG 4.15Å; M177-L347 HydrophobicContact CB-CD2 4.29Å; M177-L347 HydrophobicContact CG-CD2 4.37Å; M177-L347 HydrophobicContact SD-CD1 4.29Å; M177-L347 HydrophobicContact SD-CD2 3.66Å; M177-L347 HydrophobicContact SD-CG 3.81Å; M177-M350 HydrophobicContact CB-CE 4.1Å; M177-M350 HydrophobicContact CB-SD 3.36Å; M177-M350 WeakPolarHBondContact CB-SD 3.43Å; M177-M350 HydrophobicContact CG-SD 4.33Å
178T96.1Very high93.6Very high15 Ų1541.4 Ų41.49%0.09222%0.223CC..Hα-helixtrans-62-44.3173.2-55.60000110.4I174 I175 L176 S182 M350 T384 G388I174-T178 WeakPolarHBondContact O-CB 3.3Å; I174-T178 PolarHBondContact O-N 3.18Å; I174-T178 PolarHBondContact O-OG1 2.71Å; I175-T178 WeakPolarHBondContact O-CB 3.19Å; I175-T178 PolarHBondContact O-N 2.78Å; L176-T178 VanDerWaalsContact C-N 3.35Å; L176-T178 PolarHBondContact O-N 3.03Å; T178-S182 VanDerWaalsContact O-CB 3.31Å; T178-S182 WeakPolarHBondContact O-CB 3.34Å; T178-S182 PolarHBondContact O-N 2.97Å; T178-S182 PolarHBondContact O-OG 3.14Å; T178-M350 WeakPolarHBondContact OG1-CE 3.18Å; T178-T384 HydrophobicContact CG2-CG2 4.18Å; T178-G388 WeakPolarHBondContact OG1-CA 3.37Å
179I94.5Very high93.6Very high94 Ų9439.6 Ų39.648%0.48221%0.212SC..Hα-helixtrans-62.2-46.3176.4-67.3164.8000109.9I175 L176 M177 L181 S182 I183I175-I179 HydrophobicContact CG2-CD1 3.95Å; I175-I179 WeakPolarHBondContact O-CG1 3.29Å; I175-I179 PolarHBondContact O-N 3.47Å; L176-I179 PolarHBondContact O-N 3.15Å; M177-I179 VanDerWaalsContact C-N 3.34Å; I179-L181 PolarHBondContact O-N 2.75Å; I179-S182 WeakPolarHBondContact O-CB 3.41Å; I179-S182 PolarHBondContact O-N 3.31Å; I179-S182 VanDerWaalsContact O-N 3.1Å; I179-I183 HydrophobicContact CG2-CD1 4.19Å; I179-I183 WeakPolarHBondContact O-CG1 3.46Å; I179-I183 PolarHBondContact O-N 3.28Å; I179-I183 VanDerWaalsContact O-N 3.11Å
180L93.5Very high93.7Very high25 Ų2541.2 Ų41.213%0.13122%0.22CC..Hα-helixtrans-57-50178.8176.456.6000112.2L176 M177 S182 I183 S188 I191 L347L176-L180 PolarHBondContact O-N 3Å; M177-L180 PolarHBondContact O-N 3.18Å; M177-L180 HydrophobicContact SD-CD2 4.24Å; L180-S182 PolarHBondContact O-N 3.06Å; L180-I183 PolarHBondContact O-N 2.88Å; L180-S188 PolarHBondContact O-OG 3.36Å; L180-I191 HydrophobicContact CD1-CD1 3.46Å; L180-I191 VanDerWaalsContact CD1-CD1 3.46Å; L180-I191 HydrophobicContact CD2-CB 4.42Å; L180-I191 HydrophobicContact CD2-CD1 4.05Å; L180-I191 HydrophobicContact CD2-CG2 4.04Å; L180-I191 HydrophobicContact CG-CD1 4.42Å; L180-L347 HydrophobicContact CD2-CD1 4.29Å; L180-L347 HydrophobicContact CD2-CD2 4.07Å
181L93Very high93.8Very high11 Ų1144.1 Ų44.16%0.05824%0.235CC..Hα-helixtrans-66-26.4178-70.4171.2000113.1M177 I179 L347 M350 F351 T384M177-L181 WeakPolarHBondContact O-CG 3.42Å; M177-L181 PolarHBondContact O-N 3.02Å; I179-L181 PolarHBondContact O-N 2.75Å; L181-L347 HydrophobicContact CD1-CD2 4.48Å; L181-L347 HydrophobicContact CD2-CD2 4.31Å; L181-L347 HydrophobicContact CG-CD2 4.21Å; L181-M350 HydrophobicContact CD1-CB 3.37Å; L181-M350 HydrophobicContact CD1-CE 4.46Å; L181-F351 HydrophobicContact CD2-CB 4.45Å; L181-F351 HydrophobicContact CD2-CD2 3.68Å; L181-F351 HydrophobicContact CD2-CE2 4.46Å; L181-F351 HydrophobicContact CD2-CG 4.48Å; L181-T384 HydrophobicContact CB-CG2 3.77Å
182S91.7Very high93.7Very high23 Ų2342.8 Ų42.816%0.16123%0.226CC..Hα-helixtrans-73.5-28.8176.6-62.50000112.8T178 I179 L180 L381T178-S182 VanDerWaalsContact O-CB 3.31Å; T178-S182 WeakPolarHBondContact O-CB 3.34Å; T178-S182 PolarHBondContact O-N 2.97Å; T178-S182 PolarHBondContact O-OG 3.14Å; I179-S182 WeakPolarHBondContact O-CB 3.41Å; I179-S182 PolarHBondContact O-N 3.31Å; I179-S182 VanDerWaalsContact O-N 3.1Å; L180-S182 PolarHBondContact O-N 3.06Å; S182-L381 VanDerWaalsContact CB-CD1 3.43Å; S182-L381 WeakPolarHBondContact OG-CD1 3.29Å
183I90.8Very high93.7Very high103 Ų10341.7 Ų41.753%0.52821%0.212SC..Hα-helixtrans-70.3-42.3178-67.4164.3000110.9I179 L180 V377I179-I183 HydrophobicContact CG2-CD1 4.19Å; I179-I183 WeakPolarHBondContact O-CG1 3.46Å; I179-I183 PolarHBondContact O-N 3.28Å; I179-I183 VanDerWaalsContact O-N 3.11Å; L180-I183 PolarHBondContact O-N 2.88Å; I183-V377 WeakPolarHBondContact O-CG1 3.29Å
184G88.9Confident93.8Very high9 Ų944.9 Ų44.99%0.09323%0.232CC..  trans163.9153.317600000114.7S188G184-S188 WeakPolarHBondContact O-CB 3.36Å; G184-S188 PolarHBondContact O-N 3.42Å; G184-S188 VanDerWaalsContact O-N 3.14Å; G184-S188 PolarHBondContact O-OG 2.87Å
185V89.4Confident93.7Very high12 Ų1248 Ų487%0.07325%0.246CC..Hα-helixtrans-67.3-43.7-177.4-179.80000112.2L35 S188 A189 E273 F351 R355 T379L35-V185 HydrophobicContact CD1-CG1 4.19Å; L35-V185 HydrophobicContact CD2-CG1 4.16Å; L35-V185 HydrophobicContact CG-CG1 4.31Å; V185-S188 PolarHBondContact O-N 3.37Å; V185-A189 WeakPolarHBondContact O-CB 3.37Å; V185-A189 PolarHBondContact O-N 3.09Å; V185-E273 WeakPolarHBondContact CG1-OE2 3.48Å; V185-E273 WeakPolarHBondContact CG2-OE1 3.41Å; V185-F351 HydrophobicContact CG1-CE2 3.75Å; V185-F351 HydrophobicContact CG1-CZ 3.53Å; V185-R355 VanDerWaalsContact CG2-NH2 3.26Å; V185-T379 HydrophobicContact CG2-CG2 3.51Å
186R89.3Confident93.7Very high118 Ų11844.1 Ų44.145%0.44523%0.226SC..Hα-helixtrans-62.1-47.5-179.1-172.4-177.6-176.3-173.1-1.5111.6C34 S188 A189 I190C34-R186 HydrophobicContact CB-CB 4.28Å; R186-S188 VanDerWaalsContact C-N 3.34Å; R186-A189 PolarHBondContact O-N 3.5Å; R186-I190 HydrophobicContact CG-CD1 4.2Å; R186-I190 WeakPolarHBondContact O-CG1 3.4Å; R186-I190 PolarHBondContact O-N 3.07Å
187E91Very high93.7Very high91 Ų9143.1 Ų43.143%0.42522%0.22SC..Hα-helixtrans-65.2-41.4-179.7-51.6-47.3139.900110.9A189 I190 I191E187-A189 VanDerWaalsContact C-N 3.33Å; E187-A189 PolarHBondContact O-N 3.47Å; E187-I190 PolarHBondContact O-N 3.24Å; E187-I191 PolarHBondContact O-N 2.88Å
188S92.9Very high93.8Very high2 Ų245.2 Ų45.21%0.01423%0.234CC..Hα-helixtrans-60.6-41.2174-56.90000112.1L180 G184 V185 R186 I191 N192L180-S188 PolarHBondContact O-OG 3.36Å; G184-S188 WeakPolarHBondContact O-CB 3.36Å; G184-S188 PolarHBondContact O-N 3.42Å; G184-S188 VanDerWaalsContact O-N 3.14Å; G184-S188 PolarHBondContact O-OG 2.87Å; V185-S188 PolarHBondContact O-N 3.37Å; R186-S188 VanDerWaalsContact C-N 3.34Å; S188-I191 PolarHBondContact O-N 2.88Å; S188-N192 WeakPolarHBondContact O-CB 3.46Å; S188-N192 PolarHBondContact O-N 3.36Å
189A93.2Very high93.7Very high9 Ų944.5 Ų44.57%0.07423%0.229CC..Hα-helixtrans-67.2-40.7177.800000112.2L35 V185 R186 E187 N192 N193L35-A189 HydrophobicContact CD2-CB 3.53Å; V185-A189 WeakPolarHBondContact O-CB 3.37Å; V185-A189 PolarHBondContact O-N 3.09Å; R186-A189 PolarHBondContact O-N 3.5Å; E187-A189 VanDerWaalsContact C-N 3.33Å; E187-A189 PolarHBondContact O-N 3.47Å; A189-N192 PolarHBondContact O-N 2.9Å; A189-N193 WeakPolarHBondContact O-CB 3.37Å; A189-N193 PolarHBondContact O-N 2.95Å; A189-N193 PolarHBondContact O-ND2 2.99Å; A189-N193 PolarHBondContact O-OD1 3.32Å; A189-N193 VanDerWaalsContact O-OD1 3.09Å
190I95Very high93.9Very high74 Ų7442.2 Ų42.238%0.37922%0.218SC..Hα-helixtrans-60.8-47.4175.5-68.3165.5000110.4R186 E187 N192 N193 V194R186-I190 HydrophobicContact CG-CD1 4.2Å; R186-I190 WeakPolarHBondContact O-CG1 3.4Å; R186-I190 PolarHBondContact O-N 3.07Å; E187-I190 PolarHBondContact O-N 3.24Å; I190-N192 PolarHBondContact O-N 2.9Å; I190-N193 WeakPolarHBondContact O-CB 3.37Å; I190-N193 PolarHBondContact O-N 3.37Å; I190-V194 WeakPolarHBondContact O-CG2 3.33Å; I190-V194 PolarHBondContact O-N 3.33Å
191I95Very high94Very high61 Ų6144.6 Ų44.631%0.31324%0.236SC..Hα-helixtrans-62.3-44.2178-73.9162.7000111L180 E187 S188 N193 V194 F195L180-I191 HydrophobicContact CD1-CD1 3.46Å; L180-I191 VanDerWaalsContact CD1-CD1 3.46Å; L180-I191 HydrophobicContact CD2-CB 4.42Å; L180-I191 HydrophobicContact CD2-CD1 4.05Å; L180-I191 HydrophobicContact CD2-CG2 4.04Å; L180-I191 HydrophobicContact CG-CD1 4.42Å; E187-I191 PolarHBondContact O-N 2.88Å; S188-I191 PolarHBondContact O-N 2.88Å; I191-N193 VanDerWaalsContact C-N 3.33Å; I191-N193 PolarHBondContact O-N 3.46Å; I191-V194 PolarHBondContact O-N 2.95Å; I191-F195 HydrophobicContact CG2-CD2 3.74Å; I191-F195 HydrophobicContact CG2-CE2 3.51Å; I191-F195 VanDerWaalsContact O-CD2 3.3Å; I191-F195 WeakPolarHBondContact O-CD2 3.21Å; I191-F195 PolarHBondContact O-N 3.49Å; I191-F195 VanDerWaalsContact O-N 3.12Å
192N94.8Very high94.2Very high3 Ų344.6 Ų44.62%0.01624%0.236CC..Hα-helixtrans-57-46.9173.9175.783000111.6A42 L43 S188 A189 I190 V194 F195 T196 L347A42-N192 PolarHBondContact O-ND2 3.33Å; L43-N192 WeakPolarHBondContact CA-ND2 3.21Å; L43-N192 PolarHBondContact N-ND2 2.85Å; S188-N192 WeakPolarHBondContact O-CB 3.46Å; S188-N192 PolarHBondContact O-N 3.36Å; A189-N192 PolarHBondContact O-N 2.9Å; I190-N192 PolarHBondContact O-N 2.9Å; N192-V194 VanDerWaalsContact C-N 3.32Å; N192-V194 PolarHBondContact O-N 2.99Å; N192-F195 PolarHBondContact O-N 3.08Å; N192-T196 PolarHBondContact O-N 2.71Å; N192-T196 PolarHBondContact O-OG1 3.27Å; N192-T196 VanDerWaalsContact O-OG1 3.08Å; N192-L347 HydrophobicContact CB-CD1 4.29Å
193N96.6Very high94.5Very high13 Ų1343.8 Ų43.87%0.0723%0.23CC..Hα-helixtrans-59.3-43.2179.6-66.7-8.8000111.9F38 D39 A42 A189 I190 I191 T196 I197F38-N193 HydrophobicContact CE1-CB 4.11Å; D39-N193 PolarHBondContact OD1-ND2 2.83Å; A42-N193 VanDerWaalsContact CB-OD1 3.22Å; A42-N193 WeakPolarHBondContact CB-OD1 3.3Å; A189-N193 WeakPolarHBondContact O-CB 3.37Å; A189-N193 PolarHBondContact O-N 2.95Å; A189-N193 PolarHBondContact O-ND2 2.99Å; A189-N193 PolarHBondContact O-OD1 3.32Å; A189-N193 VanDerWaalsContact O-OD1 3.09Å; I190-N193 WeakPolarHBondContact O-CB 3.37Å; I190-N193 PolarHBondContact O-N 3.37Å; I191-N193 VanDerWaalsContact C-N 3.33Å; I191-N193 PolarHBondContact O-N 3.46Å; N193-T196 PolarHBondContact O-N 3.03Å; N193-I197 WeakPolarHBondContact O-CB 3.32Å; N193-I197 WeakPolarHBondContact O-CD1 3.22Å; N193-I197 WeakPolarHBondContact O-CG1 3.4Å; N193-I197 PolarHBondContact O-N 2.68Å
194V97Very high94.8Very high83 Ų8343.8 Ų43.850%0.50323%0.23SC..Hα-helixtrans-58.8-50.6177171.70000110.3I190 I191 N192 T196 I197 V198I190-V194 WeakPolarHBondContact O-CG2 3.33Å; I190-V194 PolarHBondContact O-N 3.33Å; I191-V194 PolarHBondContact O-N 2.95Å; N192-V194 VanDerWaalsContact C-N 3.32Å; N192-V194 PolarHBondContact O-N 2.99Å; V194-T196 PolarHBondContact O-N 2.78Å; V194-I197 PolarHBondContact O-N 3.35Å; V194-V198 WeakPolarHBondContact O-CG2 3.26Å; V194-V198 PolarHBondContact O-N 3.22Å
195F96.9Very high95.2Very high64 Ų6445.6 Ų45.628%0.28124%0.235SC..Hα-helixtrans-64.9-38179.1-73.6-57.3000113I191 N192 V198 N199 C340 T343 T344I191-F195 HydrophobicContact CG2-CD2 3.74Å; I191-F195 HydrophobicContact CG2-CE2 3.51Å; I191-F195 VanDerWaalsContact O-CD2 3.3Å; I191-F195 WeakPolarHBondContact O-CD2 3.21Å; I191-F195 PolarHBondContact O-N 3.49Å; I191-F195 VanDerWaalsContact O-N 3.12Å; N192-F195 PolarHBondContact O-N 3.08Å; F195-V198 PolarHBondContact O-N 3.27Å; F195-N199 VanDerWaalsContact O-CB 3.3Å; F195-N199 WeakPolarHBondContact O-CB 3.27Å; F195-N199 PolarHBondContact O-N 3.49Å; F195-C340 HydrophobicContact CB-CB 4.32Å; F195-C340 HydrophobicContact CD1-CB 3.89Å; F195-T343 HydrophobicContact CD2-CG2 4.01Å; F195-T343 HydrophobicContact CE2-CG2 3.87Å; F195-T343 HydrophobicContact CZ-CG2 4.38Å; F195-T344 HydrophobicContact CB-CG2 3.37Å
196T96.8Very high95.5Very high3 Ų345 Ų452%0.01823%0.232CC..Hα-helixtrans-63.8-42.8175.5-60.40000111.3A42 V45 G46 N192 N193 V194 N199 L200A42-T196 HydrophobicContact CB-CG2 4.28Å; A42-T196 PolarHBondContact O-OG1 3.33Å; V45-T196 HydrophobicContact CB-CG2 4.25Å; V45-T196 HydrophobicContact CG1-CG2 4Å; G46-T196 WeakPolarHBondContact CA-OG1 3.21Å; N192-T196 PolarHBondContact O-N 2.71Å; N192-T196 PolarHBondContact O-OG1 3.27Å; N192-T196 VanDerWaalsContact O-OG1 3.08Å; N193-T196 PolarHBondContact O-N 3.03Å; V194-T196 PolarHBondContact O-N 2.78Å; T196-N199 PolarHBondContact O-N 2.93Å; T196-L200 HydrophobicContact CG2-CD1 4.16Å; T196-L200 HydrophobicContact CG2-CG 4.45Å; T196-L200 WeakPolarHBondContact O-CG 3.16Å; T196-L200 PolarHBondContact O-N 3.49Å
197I97Very high95.9Very high79 Ų7940.3 Ų40.341%0.40522%0.215SC..Hα-helixtrans-62.9-47.4177.2-68.5163000110.3F38 N193 V194 N199 L200 C201F38-I197 HydrophobicContact CZ-CD1 4.06Å; F38-I197 HydrophobicContact CZ-CG1 4.4Å; N193-I197 WeakPolarHBondContact O-CB 3.32Å; N193-I197 WeakPolarHBondContact O-CD1 3.22Å; N193-I197 WeakPolarHBondContact O-CG1 3.4Å; N193-I197 PolarHBondContact O-N 2.68Å; V194-I197 PolarHBondContact O-N 3.35Å; I197-N199 VanDerWaalsContact C-N 3.32Å; I197-N199 PolarHBondContact O-N 3.32Å; I197-L200 PolarHBondContact O-N 3.49Å; I197-C201 PolarHBondContact O-N 3.44Å; I197-C201 PolarHBondContact O-SG 2.74Å
198V96.4Very high96.1Very high57 Ų5740.1 Ų40.135%0.34522%0.22SC..Hα-helixtrans-58.1-46.2177171.40000110.7V194 F195 L200 C201 V202 C340V194-V198 WeakPolarHBondContact O-CG2 3.26Å; V194-V198 PolarHBondContact O-N 3.22Å; F195-V198 PolarHBondContact O-N 3.27Å; V198-L200 PolarHBondContact O-N 3.3Å; V198-C201 WeakPolarHBondContact O-CB 3.38Å; V198-C201 PolarHBondContact O-N 3.47Å; V198-V202 WeakPolarHBondContact O-CG2 3.48Å; V198-V202 PolarHBondContact O-N 3.01Å; V198-C340 HydrophobicContact CG1-CB 4.45Å
199N95.3Very high96.3Very high0 Ų041.1 Ų41.10%023%0.226CC..Hα-helixtrans-57.7-49.3176.2-179.925.1000111.7Y54 F195 T196 I197 C201 V202 I203 A341Y54-N199 WeakPolarHBondContact CE2-OD1 3.19Å; Y54-N199 PolarHBondContact OH-OD1 2.85Å; F195-N199 VanDerWaalsContact O-CB 3.3Å; F195-N199 WeakPolarHBondContact O-CB 3.27Å; F195-N199 PolarHBondContact O-N 3.49Å; T196-N199 PolarHBondContact O-N 2.93Å; I197-N199 VanDerWaalsContact C-N 3.32Å; I197-N199 PolarHBondContact O-N 3.32Å; N199-C201 VanDerWaalsContact C-N 3.32Å; N199-C201 PolarHBondContact O-N 2.93Å; N199-V202 PolarHBondContact O-N 3.13Å; N199-V202 VanDerWaalsContact O-N 3.12Å; N199-I203 WeakPolarHBondContact O-CG1 3.49Å; N199-I203 PolarHBondContact O-N 3.49Å; N199-A341 HydrophobicContact CB-CB 4.43Å; N199-A341 VanDerWaalsContact ND2-CB 3.32Å; N199-A341 WeakPolarHBondContact ND2-CB 3.49Å
200L96.8Very high96.4Very high47 Ų4740.7 Ų40.725%0.24622%0.223CC..Hα-helixtrans-61.1-39.1177.3-71.6174.3000112.5V45 L49 T196 I197 V198 I203 I204 I291V45-L200 HydrophobicContact CG1-CD1 4.29Å; V45-L200 HydrophobicContact CG1-CD2 4.06Å; V45-L200 HydrophobicContact CG1-CG 4.44Å; L49-L200 HydrophobicContact CD1-CD2 3.69Å; T196-L200 HydrophobicContact CG2-CD1 4.16Å; T196-L200 HydrophobicContact CG2-CG 4.45Å; T196-L200 WeakPolarHBondContact O-CG 3.16Å; T196-L200 PolarHBondContact O-N 3.49Å; I197-L200 PolarHBondContact O-N 3.49Å; V198-L200 PolarHBondContact O-N 3.3Å; L200-I203 PolarHBondContact O-N 2.98Å; L200-I204 VanDerWaalsContact O-CG1 3.28Å; L200-I204 WeakPolarHBondContact O-CG1 3.48Å; L200-I204 PolarHBondContact O-N 2.93Å; L200-I291 HydrophobicContact CD2-CG2 4.02Å
201C97.4Very high96.4Very high74 Ų7440.8 Ų40.850%0.522%0.224SC..Hα-helixtrans-62-41.3173.8-70.70000112I197 V198 N199 I204 F205I197-C201 PolarHBondContact O-N 3.44Å; I197-C201 PolarHBondContact O-SG 2.74Å; V198-C201 WeakPolarHBondContact O-CB 3.38Å; V198-C201 PolarHBondContact O-N 3.47Å; N199-C201 VanDerWaalsContact C-N 3.32Å; N199-C201 PolarHBondContact O-N 2.93Å; C201-I204 PolarHBondContact O-N 3.49Å; C201-F205 WeakPolarHBondContact O-CB 3.42Å; C201-F205 PolarHBondContact O-N 3.27Å
202V96.8Very high96.4Very high12 Ų1244 Ų447%0.07324%0.24CC..Hα-helixtrans-66.1-40.5175.51740000111.2V198 N199 I204 F205 V206 I333V198-V202 WeakPolarHBondContact O-CG2 3.48Å; V198-V202 PolarHBondContact O-N 3.01Å; N199-V202 PolarHBondContact O-N 3.13Å; N199-V202 VanDerWaalsContact O-N 3.12Å; V202-I204 PolarHBondContact O-N 3.44Å; V202-F205 WeakPolarHBondContact O-CB 3.4Å; V202-F205 PolarHBondContact O-N 3.25Å; V202-V206 HydrophobicContact CG1-CG2 4.42Å; V202-V206 WeakPolarHBondContact O-CG2 3.25Å; V202-V206 PolarHBondContact O-N 2.95Å; V202-I333 HydrophobicContact CG1-CG2 4.47Å; V202-I333 HydrophobicContact CG2-CG2 4.16Å
203I96.9Very high96.3Very high5 Ų548 Ų483%0.02626%0.256CS..Hα-helixtrans-60.5-45.9174.9-71.1168.1000110.7L49 V53 N199 L200 F205 V206 I207 A295 I299L49-I203 HydrophobicContact CD1-CD1 3.74Å; V53-I203 HydrophobicContact CG1-CD1 4.14Å; V53-I203 HydrophobicContact CG2-CD1 4.24Å; V53-I203 HydrophobicContact CG2-CG1 4.45Å; N199-I203 WeakPolarHBondContact O-CG1 3.49Å; N199-I203 PolarHBondContact O-N 3.49Å; L200-I203 PolarHBondContact O-N 2.98Å; I203-F205 VanDerWaalsContact C-N 3.32Å; I203-F205 PolarHBondContact O-N 3.44Å; I203-V206 PolarHBondContact O-N 3.43Å; I203-I207 HydrophobicContact CG2-CD1 3.7Å; I203-I207 HydrophobicContact CG2-CG1 4.48Å; I203-I207 VanDerWaalsContact O-CG1 3.29Å; I203-I207 WeakPolarHBondContact O-CG1 3.34Å; I203-I207 PolarHBondContact O-N 3.37Å; I203-A295 HydrophobicContact CG2-CB 4.23Å; I203-I299 HydrophobicContact CG2-CD1 4.18Å; I203-I299 HydrophobicContact CG2-CG1 4.07Å
204I97.5Very high96.1Very high103 Ų10349.3 Ų49.353%0.52827%0.268SS..Hα-helixtrans-60.3-44.5175.9-68.4164.4000110.5L200 C201 V202 V206 I207 V208L200-I204 VanDerWaalsContact O-CG1 3.28Å; L200-I204 WeakPolarHBondContact O-CG1 3.48Å; L200-I204 PolarHBondContact O-N 2.93Å; C201-I204 PolarHBondContact O-N 3.49Å; V202-I204 PolarHBondContact O-N 3.44Å; I204-V206 VanDerWaalsContact C-N 3.35Å; I204-V206 PolarHBondContact O-N 3.39Å; I204-I207 PolarHBondContact O-N 2.96Å; I204-V208 HydrophobicContact CG2-CG2 4.2Å; I204-V208 WeakPolarHBondContact O-CB 3.41Å; I204-V208 WeakPolarHBondContact O-CG2 3.49Å; I204-V208 PolarHBondContact O-N 3.48Å
205F96.6Very high96Very high47 Ų4748.9 Ų48.921%0.20626%0.263CS..Hα-helixtrans-58.2-45175.5165-97.8000112.3C201 V202 I203 T209 W329 A330 I333 I334C201-F205 WeakPolarHBondContact O-CB 3.42Å; C201-F205 PolarHBondContact O-N 3.27Å; V202-F205 WeakPolarHBondContact O-CB 3.4Å; V202-F205 PolarHBondContact O-N 3.25Å; I203-F205 VanDerWaalsContact C-N 3.32Å; I203-F205 PolarHBondContact O-N 3.44Å; F205-T209 WeakPolarHBondContact CD2-OG1 3.26Å; F205-T209 VanDerWaalsContact CE2-OG1 3.27Å; F205-T209 WeakPolarHBondContact CE2-OG1 3.5Å; F205-T209 VanDerWaalsContact O-CB 3.23Å; F205-T209 WeakPolarHBondContact O-CB 3.25Å; F205-T209 PolarHBondContact O-N 3.25Å; F205-T209 PolarHBondContact O-OG1 2.89Å; F205-W329 AromaticContact CE2-CH2 3.93Å; F205-W329 HydrophobicContact CE2-CH2 3.93Å; F205-W329 HydrophobicContact CE2-CZ3 4.06Å; F205-W329 AromaticContact CZ-CH2 3.79Å; F205-W329 HydrophobicContact CZ-CH2 3.79Å; F205-W329 AromaticContact CZ-CZ3 3.73Å; F205-W329 HydrophobicContact CZ-CZ3 3.73Å; F205-A330 HydrophobicContact CE1-CB 4.18Å; F205-A330 HydrophobicContact CZ-CB 4.12Å; F205-I333 HydrophobicContact CD1-CG2 4.11Å; F205-I333 HydrophobicContact CE1-CG2 4.21Å; F205-I333 HydrophobicContact CZ-CD1 4.39Å; F205-I334 HydrophobicContact CE1-CG1 4.46Å
206V96.6Very high95.9Very high0 Ų050.1 Ų50.10%027%0.272CS..Hα-helixtrans-61.6-46177.2169.10000110.8V202 I203 I204 G210 I299 L318 F322 I334V202-V206 HydrophobicContact CG1-CG2 4.42Å; V202-V206 WeakPolarHBondContact O-CG2 3.25Å; V202-V206 PolarHBondContact O-N 2.95Å; I203-V206 PolarHBondContact O-N 3.43Å; I204-V206 VanDerWaalsContact C-N 3.35Å; I204-V206 PolarHBondContact O-N 3.39Å; V206-G210 VanDerWaalsContact O-CA 3.31Å; V206-G210 WeakPolarHBondContact O-CA 3.33Å; V206-G210 PolarHBondContact O-N 2.96Å; V206-I299 HydrophobicContact CB-CD1 3.92Å; V206-I299 HydrophobicContact CG1-CD1 3.4Å; V206-I299 VanDerWaalsContact CG1-CD1 3.4Å; V206-L318 HydrophobicContact CG1-CD1 4.35Å; V206-L318 HydrophobicContact CG1-CD2 3.86Å; V206-F322 HydrophobicContact CG1-CE2 3.96Å; V206-F322 HydrophobicContact CG1-CZ 4.2Å; V206-I334 HydrophobicContact CG2-CD1 3.89Å; V206-I334 HydrophobicContact CG2-CG1 3.64Å; V206-I334 HydrophobicContact CG2-CG2 4.47Å
207I97.1Very high95.7Very high19 Ų1954 Ų5410%0.09729%0.292CS..Hα-helixtrans-63.1-53.1179.6-66.3161.8000110.2I203 I204 L211 L298 I299I203-I207 HydrophobicContact CG2-CD1 3.7Å; I203-I207 HydrophobicContact CG2-CG1 4.48Å; I203-I207 VanDerWaalsContact O-CG1 3.29Å; I203-I207 WeakPolarHBondContact O-CG1 3.34Å; I203-I207 PolarHBondContact O-N 3.37Å; I204-I207 PolarHBondContact O-N 2.96Å; I207-L211 HydrophobicContact CG2-CD1 3.78Å; I207-L211 HydrophobicContact CG2-CG 4.43Å; I207-L211 VanDerWaalsContact O-CB 3.31Å; I207-L211 WeakPolarHBondContact O-CB 3.41Å; I207-L211 WeakPolarHBondContact O-CG 3.25Å; I207-L211 PolarHBondContact O-N 3.2Å; I207-L298 HydrophobicContact CD1-CB 3.58Å; I207-L298 HydrophobicContact CD1-CD1 4.06Å; I207-L298 HydrophobicContact CD1-CG 4.49Å; I207-L298 HydrophobicContact CG1-CB 3.98Å; I207-L298 HydrophobicContact CG2-CB 4.29Å; I207-I299 HydrophobicContact CD1-CD1 4.42Å; I207-I299 HydrophobicContact CD1-CG1 4.37Å; I207-I299 HydrophobicContact CG1-CD1 3.83Å; I207-I299 HydrophobicContact CG1-CG1 4.18Å
208V96.5Very high95.4Very high88 Ų8851.3 Ų51.353%0.53328%0.279SS..Hα-helixtrans-62.2-50-176.8172.30000111.1I204 I212I204-V208 HydrophobicContact CG2-CG2 4.2Å; I204-V208 WeakPolarHBondContact O-CB 3.41Å; I204-V208 WeakPolarHBondContact O-CG2 3.49Å; I204-V208 PolarHBondContact O-N 3.48Å; V208-I212 WeakPolarHBondContact O-CG1 3.37Å
209T95.5Very high95.3Very high22 Ų2251.3 Ų51.314%0.13527%0.273CS..Hα-helixtrans-72.2-38.3-177-47.30000111.2F205 I212 Y213 F322 L327F205-T209 WeakPolarHBondContact CD2-OG1 3.26Å; F205-T209 VanDerWaalsContact CE2-OG1 3.27Å; F205-T209 WeakPolarHBondContact CE2-OG1 3.5Å; F205-T209 VanDerWaalsContact O-CB 3.23Å; F205-T209 WeakPolarHBondContact O-CB 3.25Å; F205-T209 PolarHBondContact O-N 3.25Å; F205-T209 PolarHBondContact O-OG1 2.89Å; T209-I212 WeakPolarHBondContact O-CB 3.16Å; T209-I212 PolarHBondContact O-N 3.39Å; T209-Y213 HydrophobicContact CG2-CE2 4.34Å; T209-Y213 WeakPolarHBondContact O-CD2 3.17Å; T209-F322 HydrophobicContact CG2-CE1 3.77Å; T209-L327 HydrophobicContact CG2-CD1 4.08Å
210G95.4Very high95Very high0 Ų058 Ų580%030%0.301CS..Hα-helixtrans-68.9-34.4-179.600000113.1V206 I212 Y213 A214 M306V206-G210 VanDerWaalsContact O-CA 3.31Å; V206-G210 WeakPolarHBondContact O-CA 3.33Å; V206-G210 PolarHBondContact O-N 2.96Å; G210-I212 PolarHBondContact O-N 3.47Å; G210-Y213 CarbonylContact O-C 3.3Å; G210-Y213 PolarHBondContact O-N 3.17Å; G210-Y213 VanDerWaalsContact O-N 3.07Å; G210-A214 PolarHBondContact O-N 3.39Å; G210-M306 WeakPolarHBondContact CA-SD 3.32Å; G210-M306 VanDerWaalsContact O-CG 3.24Å; G210-M306 WeakPolarHBondContact O-CG 3.33Å
211L95.2Very high94.3Very high77 Ų7757.2 Ų57.240%0.40330%0.299SS..Hα-helixtrans-66.6-22.3174.4-72.7173.7000113.2I207 Y213 A214 V301 L305I207-L211 HydrophobicContact CG2-CD1 3.78Å; I207-L211 HydrophobicContact CG2-CG 4.43Å; I207-L211 VanDerWaalsContact O-CB 3.31Å; I207-L211 WeakPolarHBondContact O-CB 3.41Å; I207-L211 WeakPolarHBondContact O-CG 3.25Å; I207-L211 PolarHBondContact O-N 3.2Å; L211-Y213 VanDerWaalsContact C-N 3.26Å; L211-Y213 PolarHBondContact O-N 3.35Å; L211-A214 HydrophobicContact CD2-CB 4.43Å; L211-A214 VanDerWaalsContact O-CB 3.29Å; L211-A214 WeakPolarHBondContact O-CB 3.24Å; L211-A214 PolarHBondContact O-N 3.11Å; L211-V301 HydrophobicContact CD2-CG1 4.46Å; L211-L305 HydrophobicContact CD2-CD1 4.47Å
212I94.9Very high93.5Very high128 Ų12857 Ų5766%0.65629%0.292SS*.Hα-helixtrans-66.8-32.3172.1-62.9168.7000111V208 T209 G210V208-I212 WeakPolarHBondContact O-CG1 3.37Å; T209-I212 WeakPolarHBondContact O-CB 3.16Å; T209-I212 PolarHBondContact O-N 3.39Å; G210-I212 PolarHBondContact O-N 3.47Å
213Y93.1Very high92.5Very high88 Ų8856.5 Ų56.535%0.34529%0.289SS..THydrogen-bonded Turntrans-98.412.7177.7-62.3-83.6000112.7T209 G210 L211 N215 H325 L327T209-Y213 HydrophobicContact CG2-CE2 4.34Å; T209-Y213 WeakPolarHBondContact O-CD2 3.17Å; G210-Y213 CarbonylContact O-C 3.3Å; G210-Y213 PolarHBondContact O-N 3.17Å; G210-Y213 VanDerWaalsContact O-N 3.07Å; L211-Y213 VanDerWaalsContact C-N 3.26Å; L211-Y213 PolarHBondContact O-N 3.35Å; Y213-N215 PolarHBondContact O-N 2.82Å; Y213-H325 HydrophobicContact CD1-CB 4.22Å; Y213-H325 AromaticContact CD1-CD2 3.73Å; Y213-H325 HydrophobicContact CE1-CB 4.38Å; Y213-H325 HydrophobicContact CG-CB 4.49Å; Y213-L327 HydrophobicContact CD2-CD1 4.36Å; Y213-L327 HydrophobicContact CE2-CD1 3.56Å
214A93.6Very high91.2Very high40 Ų4062.4 Ų62.433%0.33132%0.316SS..  trans-68.112717900000111G210 L211 L305G210-A214 PolarHBondContact O-N 3.39Å; L211-A214 HydrophobicContact CD2-CB 4.43Å; L211-A214 VanDerWaalsContact O-CB 3.29Å; L211-A214 WeakPolarHBondContact O-CB 3.24Å; L211-A214 PolarHBondContact O-N 3.11Å; A214-L305 HydrophobicContact CB-CB 3.71Å; A214-L305 HydrophobicContact CB-CD1 4.06Å; A214-L305 HydrophobicContact CB-CG 4.44Å
215N94Very high90.1Very high73 Ų7363.7 Ų63.739%0.3933%0.325SS..  trans-121.3117.5169.7-172.3-12.5000110Y213 D217 N218 L305Y213-N215 PolarHBondContact O-N 2.82Å; N215-D217 PolarHBondContact O-N 2.87Å; N215-D217 WeakPolarHBondContact OD1-CB 3.33Å; N215-D217 PolarHBondContact OD1-N 3.11Å; N215-D217 PolarHBondContact OD1-OD2 2.87Å; N215-N218 VanDerWaalsContact O-CB 3.32Å; N215-N218 WeakPolarHBondContact O-CB 3.33Å; N215-N218 PolarHBondContact O-N 3.28Å; N215-N218 VanDerWaalsContact O-N 3.15Å; N215-L305 PolarHBondContact N-O 2.94Å
216I94.5Very high89Confident91 Ų9165.9 Ų65.947%0.46734%0.341SS..G310 helixtrans-63.4-22.8179.2-16559.8000113N218 W219 L305I216-N218 PolarHBondContact O-N 3.46Å; I216-W219 HydrophobicContact CD1-CD2 4Å; I216-W219 HydrophobicContact CD1-CE3 3.47Å; I216-W219 VanDerWaalsContact CD1-CE3 3.47Å; I216-W219 HydrophobicContact CD1-CZ3 3.84Å; I216-W219 PolarHBondContact O-N 2.89Å; I216-W219 VanDerWaalsContact O-N 3.12Å; I216-L305 HydrophobicContact CD1-CD2 3.87Å
217D91.9Very high87.9Confident83 Ų8368 Ų6844%0.44435%0.352SS..G310 helixtrans-65.4-23.8178.1-64.5-34.5000112N215 W219 K220 V221N215-D217 PolarHBondContact O-N 2.87Å; N215-D217 WeakPolarHBondContact OD1-CB 3.33Å; N215-D217 PolarHBondContact OD1-N 3.11Å; N215-D217 PolarHBondContact OD1-OD2 2.87Å; D217-W219 PolarHBondContact O-N 3.05Å; D217-W219 VanDerWaalsContact O-N 3.12Å; D217-K220 PolarHBondContact O-N 3.2Å; D217-K220 IonicContact OD1-NZ 2.71Å; D217-V221 VanDerWaalsContact O-CG2 3.27Å; D217-V221 WeakPolarHBondContact O-CG2 3.47Å; D217-V221 PolarHBondContact O-N 2.98Å
218N91.9Very high86.5Confident24 Ų2473.3 Ų73.313%0.12838%0.381CS..G310 helixtrans-59-23.8173.8-74-28000113.1N215 I216 K220 L305 M306N215-N218 VanDerWaalsContact O-CB 3.32Å; N215-N218 WeakPolarHBondContact O-CB 3.33Å; N215-N218 PolarHBondContact O-N 3.28Å; N215-N218 VanDerWaalsContact O-N 3.15Å; I216-N218 PolarHBondContact O-N 3.46Å; N218-K220 VanDerWaalsContact C-N 3.34Å; N218-L305 PolarHBondContact ND2-O 3.21Å; N218-M306 PolarHBondContact ND2-O 3.27Å
219W94Very high84.9Confident57 Ų5775 Ų7522%0.21639%0.387CS..G310 helixtrans-84.7-5.6174.8-68.71000114P67 I70 I216 D217 G241 F242 T304 L305P67-W219 HydrophobicContact CB-CD2 4.34Å; P67-W219 HydrophobicContact CB-CG 4.02Å; P67-W219 HydrophobicContact CG-CB 4.46Å; P67-W219 HydrophobicContact CG-CG 4.09Å; I70-W219 HydrophobicContact CD1-CH2 4.02Å; I70-W219 HydrophobicContact CD1-CZ2 3.71Å; I216-W219 HydrophobicContact CD1-CD2 4Å; I216-W219 HydrophobicContact CD1-CE3 3.47Å; I216-W219 VanDerWaalsContact CD1-CE3 3.47Å; I216-W219 HydrophobicContact CD1-CZ3 3.84Å; I216-W219 PolarHBondContact O-N 2.89Å; I216-W219 VanDerWaalsContact O-N 3.12Å; D217-W219 PolarHBondContact O-N 3.05Å; D217-W219 VanDerWaalsContact O-N 3.12Å; W219-G241 CarbonylContact O-C 3.39Å; W219-G241 WeakPolarHBondContact O-CA 3.48Å; W219-F242 HydrophobicContact CB-CD2 4.34Å; W219-F242 AromaticContact CD2-CD2 3.8Å; W219-F242 HydrophobicContact CD2-CD2 3.8Å; W219-F242 AromaticContact CD2-CE2 3.85Å; W219-F242 HydrophobicContact CD2-CE2 3.85Å; W219-F242 AromaticContact CE3-CD2 3.7Å; W219-F242 HydrophobicContact CE3-CD2 3.7Å; W219-F242 AromaticContact CE3-CE2 3.68Å; W219-F242 HydrophobicContact CE3-CE2 3.68Å; W219-F242 HydrophobicContact CG-CD2 4.11Å; W219-F242 HydrophobicContact CH2-CE2 4.05Å; W219-F242 HydrophobicContact CZ2-CE2 4.2Å; W219-F242 HydrophobicContact CZ3-CD2 4.27Å; W219-F242 AromaticContact CZ3-CE2 3.79Å; W219-F242 HydrophobicContact CZ3-CE2 3.79Å; W219-F242 PolarHBondContact O-N 2.98Å; W219-F242 VanDerWaalsContact O-N 3.14Å; W219-T304 PolarHBondContact NE1-O 3.49Å; W219-T304 PolarHBondContact NE1-OG1 3.21Å; W219-T304 VanDerWaalsContact NE1-OG1 3.15Å; W219-L305 HydrophobicContact CD2-CD2 3.88Å; W219-L305 VanDerWaalsContact CE2-CD2 3.46Å; W219-L305 HydrophobicContact CE3-CD2 4.49Å; W219-L305 HydrophobicContact CG-CD2 4.25Å; W219-L305 HydrophobicContact CH2-CD2 4.37Å; W219-L305 HydrophobicContact CZ2-CD1 4.08Å; W219-L305 HydrophobicContact CZ2-CD2 3.75Å; W219-L305 HydrophobicContact CZ2-CG 3.68Å
220K88.6Confident83.3Confident139 Ų13979.9 Ų79.960%0.60441%0.413SS*.THydrogen-bonded Turntrans-109.1-11.2179-60.7175.9-171.4161.20113.1D217 N218 I222D217-K220 PolarHBondContact O-N 3.2Å; D217-K220 IonicContact OD1-NZ 2.71Å; N218-K220 VanDerWaalsContact C-N 3.34Å; K220-I222 PolarHBondContact O-N 3.2Å
221V82.7Confident81.8Confident31 Ų3183.4 Ų83.419%0.18843%0.434CS..  trans-65.1135-173.2-172.70000111.7D217 V226 G240 G241 Y310D217-V221 VanDerWaalsContact O-CG2 3.27Å; D217-V221 WeakPolarHBondContact O-CG2 3.47Å; D217-V221 PolarHBondContact O-N 2.98Å; V221-V226 HydrophobicContact CG1-CG2 3.73Å; V221-G240 WeakPolarHBondContact O-CA 3.37Å; V221-G241 PolarHBondContact O-N 2.74Å; V221-G241 VanDerWaalsContact O-N 3.08Å; V221-Y310 HydrophobicContact CB-CE1 4.24Å; V221-Y310 HydrophobicContact CG1-CE1 3.67Å
222I80.8Confident80Confident69 Ų6980.5 Ų80.535%0.35442%0.421SS..  trans-105118.6173.1-57.7169.8000107.5K220 E224 N225K220-I222 PolarHBondContact O-N 3.2Å; I222-E224 VanDerWaalsContact C-N 3.29Å; I222-E224 HydrophobicContact CG2-CB 4.39Å; I222-E224 PolarHBondContact O-N 3.33Å; I222-N225 PolarHBondContact O-N 2.85Å; I222-N225 VanDerWaalsContact O-N 3.12Å
223P74.5Confident78.1Confident2 Ų283.3 Ų83.31%0.01343%0.428CS..G310 helixtrans-54.7-41.4-175.3-25.431.5000113.6N225 V226 L227 L237 Y309 Y310P223-N225 PolarHBondContact O-N 3.15Å; P223-N225 VanDerWaalsContact O-N 3.17Å; P223-V226 PolarHBondContact O-N 3.13Å; P223-L227 HydrophobicContact CB-CD1 3.77Å; P223-L227 WeakPolarHBondContact O-CB 3.49Å; P223-L227 PolarHBondContact O-N 2.97Å; P223-L237 HydrophobicContact CB-CB 4.32Å; P223-L237 HydrophobicContact CB-CD1 4.22Å; P223-L237 HydrophobicContact CG-CB 4.15Å; P223-Y309 HydrophobicContact CG-CE1 4.41Å; P223-Y309 WeakPolarHBondContact CG-OH 3.36Å; P223-Y310 HydrophobicContact CB-CD1 4.43Å; P223-Y310 HydrophobicContact CG-CD1 4.07Å
224E71Confident76.1Confident129 Ų12987.1 Ų87.160%0.60345%0.449SS*.G310 helixtrans-61.1-24.2-178.4-61.6-177.8170.200113.5I222 A232I222-E224 VanDerWaalsContact C-N 3.29Å; I222-E224 HydrophobicContact CG2-CB 4.39Å; I222-E224 PolarHBondContact O-N 3.33Å; E224-A232 HydrophobicContact CG-CB 4.5Å
225N73.9Confident74.6Confident131 Ų13187.1 Ų87.170%0.70145%0.449SS*.G310 helixtrans-84-14.4178.5-67.1-14.5000113.1I222 P223I222-N225 PolarHBondContact O-N 2.85Å; I222-N225 VanDerWaalsContact O-N 3.12Å; P223-N225 PolarHBondContact O-N 3.15Å; P223-N225 VanDerWaalsContact O-N 3.17Å
226V73.7Confident73.5Confident92 Ų9290.9 Ų90.956%0.55847%0.469SS*.THydrogen-bonded Turntrans-119.4-33.8-170.3-1760000112V221 P223V221-V226 HydrophobicContact CG1-CG2 3.73Å; P223-V226 PolarHBondContact O-N 3.13Å
227L72.9Confident72.6Confident45 Ų4587.5 Ų87.524%0.23645%0.452CS..SBendtrans-96.2140.6179.4-72141.9000110P223 N229 T231 A232 L237 Y310P223-L227 HydrophobicContact CB-CD1 3.77Å; P223-L227 WeakPolarHBondContact O-CB 3.49Å; P223-L227 PolarHBondContact O-N 2.97Å; L227-N229 PolarHBondContact O-N 3.46Å; L227-T231 HydrophobicContact CD2-CG2 4.11Å; L227-A232 HydrophobicContact CB-CB 4.25Å; L227-L237 HydrophobicContact CD1-CD1 3.82Å; L227-Y310 HydrophobicContact CD1-CD2 3.87Å; L227-Y310 HydrophobicContact CD1-CE2 4.12Å; L227-Y310 HydrophobicContact CD1-CG 4.27Å
228D68.4Low72.2Confident131 Ų13184.8 Ų84.870%0.70144%0.444SS*.  trans-53.2141.4171.6-66-36.8000110.8N230 T231 A232D228-N230 PolarHBondContact O-N 2.9Å; D228-T231 PolarHBondContact O-N 2.9Å; D228-T231 PolarHBondContact O-OG1 3.41Å; D228-A232 PolarHBondContact O-N 2.61Å; D228-A232 VanDerWaalsContact O-N 3.09Å
229N63.1Low71.9Confident124 Ų12490 Ų9066%0.66347%0.472SS*.Hα-helixtrans-50.4-33.3-174.4-83.6-24.5000114L227 K233L227-N229 PolarHBondContact O-N 3.46Å; N229-K233 WeakPolarHBondContact O-CB 3.08Å; N229-K233 PolarHBondContact O-N 3.25Å; N229-K233 VanDerWaalsContact O-N 3.11Å
230N62.2Low71.5Confident124 Ų12487.8 Ų87.866%0.66347%0.466SS*.Hα-helixtrans-68.3-43.3177-70.4-9.6000111.7D228 H234D228-N230 PolarHBondContact O-N 2.9Å; N230-H234 PolarHBondContact O-CD2 2.88Å; N230-H234 PolarHBondContact O-N 3.26Å
231T62.8Low71.5Confident74 Ų7482.1 Ų82.145%0.45445%0.447SS..Hα-helixtrans-69.8-39.7-178.6-30.70000111.3L227 D228 A235L227-T231 HydrophobicContact CD2-CG2 4.11Å; D228-T231 PolarHBondContact O-N 2.9Å; D228-T231 PolarHBondContact O-OG1 3.41Å; T231-A235 PolarHBondContact O-N 3.39Å
232A57.1Low72Confident16 Ų1683.2 Ų83.213%0.13245%0.449CS..Hα-helixtrans-69-41.9177.800000112.6E224 L227 D228 H234E224-A232 HydrophobicContact CG-CB 4.5Å; L227-A232 HydrophobicContact CB-CB 4.25Å; D228-A232 PolarHBondContact O-N 2.61Å; D228-A232 VanDerWaalsContact O-N 3.09Å; A232-H234 PolarHBondContact O-N 2.82Å
233K54.7Low72.6Confident186 Ų18684 Ų8481%0.80945%0.45SS*.Hα-helixtrans-67.1-32.3178.5-99.1-178.2175177.50114N229N229-K233 WeakPolarHBondContact O-CB 3.08Å; N229-K233 PolarHBondContact O-N 3.25Å; N229-K233 VanDerWaalsContact O-N 3.11Å
234H50.9Low73.4Confident168 Ų16884 Ų8478%0.77845%0.451SS*.Hα-helixtrans-81.8-21.7-177.6-75.6-54000113.6N230 A232N230-H234 PolarHBondContact O-CD2 2.88Å; N230-H234 PolarHBondContact O-N 3.26Å; A232-H234 PolarHBondContact O-N 2.82Å
235A61.9Low74.4Confident40 Ų4080.3 Ų80.333%0.33143%0.433SS..SBendtrans-104.7119.1179.100000108.9T231 L237T231-A235 PolarHBondContact O-N 3.39Å; A235-L237 HydrophobicContact CB-CD1 3.74Å; A235-L237 HydrophobicContact CB-CD2 4.04Å; A235-L237 HydrophobicContact CB-CG 3.54Å; A235-L237 PolarHBondContact O-N 2.74Å
236N71.1Confident75.2Confident152 Ų15275.6 Ų75.681%0.81342%0.415SS*.  trans-63.773169.9-78.3-29.2000110.1F245N236-F245 WeakPolarHBondContact O-CE1 3.12Å
237L77.4Confident76Confident20 Ų2076.9 Ų76.911%0.10542%0.418CS..  trans-90.8-11.8-175-66.1171.5000112P223 L227 A235 F245 Y309P223-L237 HydrophobicContact CB-CB 4.32Å; P223-L237 HydrophobicContact CB-CD1 4.22Å; P223-L237 HydrophobicContact CG-CB 4.15Å; L227-L237 HydrophobicContact CD1-CD1 3.82Å; A235-L237 HydrophobicContact CB-CD1 3.74Å; A235-L237 HydrophobicContact CB-CD2 4.04Å; A235-L237 HydrophobicContact CB-CG 3.54Å; A235-L237 PolarHBondContact O-N 2.74Å; L237-F245 WeakPolarHBondContact O-CZ 3.18Å; L237-Y309 WeakPolarHBondContact O-CE2 3.4Å; L237-Y309 PolarHBondContact O-OH 3.28Å
238G83Confident76.6Confident26 Ų2681.1 Ų81.127%0.26844%0.441SS..  trans74.3-174.6-177.100000113.1G240 P244G238-G240 VanDerWaalsContact C-N 3.29Å; G238-G240 PolarHBondContact O-N 3.27Å; G238-P244 CarbonylContact C-O 3.59Å; G238-P244 WeakPolarHBondContact CA-O 3.1Å
239N84.4Confident77.6Confident135 Ų13575.3 Ų75.372%0.72241%0.412SS*.SBendtrans-842.4-165.5-62.6-17.6000114.2P244N239-P244 PolarHBondContact N-O 3.31Å
240G85.7Confident79.1Confident10 Ų1069.6 Ų69.610%0.10338%0.382CS..  trans74.6-170.7-173.400000115V221 G238 P244 Y309V221-G240 WeakPolarHBondContact O-CA 3.37Å; G238-G240 VanDerWaalsContact C-N 3.29Å; G238-G240 PolarHBondContact O-N 3.27Å; G240-P244 WeakPolarHBondContact O-CA 3.28Å; G240-Y309 PolarHBondContact N-OH 3.22Å
241G89.1Confident80.3Confident19 Ų1968 Ų6820%0.19637%0.373CS..SBendtrans72.7-158.4-17400000113.5W219 V221W219-G241 CarbonylContact O-C 3.39Å; W219-G241 WeakPolarHBondContact O-CA 3.48Å; V221-G241 PolarHBondContact O-N 2.74Å; V221-G241 VanDerWaalsContact O-N 3.08Å
242F93.6Very high81.5Confident54 Ų5467.6 Ų67.624%0.23737%0.372CS..SBendtrans-75.7-28.6-178.5-166.8-91.1000112.8P67 G68 I70 I71 W219 P244P67-F242 HydrophobicContact CB-CD2 3.42Å; P67-F242 VanDerWaalsContact CB-CD2 3.42Å; P67-F242 HydrophobicContact CB-CE2 3.61Å; P67-F242 HydrophobicContact CB-CG 3.96Å; P67-F242 HydrophobicContact CB-CZ 4.3Å; P67-F242 HydrophobicContact CG-CD2 4.42Å; G68-F242 PolarHBondContact N-O 3.37Å; I70-F242 HydrophobicContact CD1-CE2 4.27Å; I70-F242 HydrophobicContact CD1-CZ 4.19Å; I71-F242 HydrophobicContact CD1-CE1 4.08Å; I71-F242 HydrophobicContact CG1-CE1 4.44Å; W219-F242 HydrophobicContact CB-CD2 4.34Å; W219-F242 AromaticContact CD2-CD2 3.8Å; W219-F242 HydrophobicContact CD2-CD2 3.8Å; W219-F242 AromaticContact CD2-CE2 3.85Å; W219-F242 HydrophobicContact CD2-CE2 3.85Å; W219-F242 AromaticContact CE3-CD2 3.7Å; W219-F242 HydrophobicContact CE3-CD2 3.7Å; W219-F242 AromaticContact CE3-CE2 3.68Å; W219-F242 HydrophobicContact CE3-CE2 3.68Å; W219-F242 HydrophobicContact CG-CD2 4.11Å; W219-F242 HydrophobicContact CH2-CE2 4.05Å; W219-F242 HydrophobicContact CZ2-CE2 4.2Å; W219-F242 HydrophobicContact CZ3-CD2 4.27Å; W219-F242 AromaticContact CZ3-CE2 3.79Å; W219-F242 HydrophobicContact CZ3-CE2 3.79Å; W219-F242 PolarHBondContact O-N 2.98Å; W219-F242 VanDerWaalsContact O-N 3.14Å; F242-P244 VanDerWaalsContact C-CD 3.42Å; F242-P244 WeakPolarHBondContact O-CD 3.11Å
243F93.8Very high83Confident85 Ų8566.8 Ų66.837%0.37337%0.366SS..  trans-121.664.2-179.4-59.3-66000111.7I71 F245 G246 L247 V250I71-F243 HydrophobicContact CD1-CE1 3.89Å; I71-F243 HydrophobicContact CD1-CZ 3.86Å; F243-F245 PolarHBondContact O-N 2.98Å; F243-F245 VanDerWaalsContact O-N 3.13Å; F243-G246 PolarHBondContact O-N 3.27Å; F243-L247 HydrophobicContact CE1-CD2 4.48Å; F243-V250 HydrophobicContact CD1-CG2 3.53Å; F243-V250 HydrophobicContact CE1-CG2 3.76Å
244P91.3Very high84.8Confident3 Ų358.3 Ų58.32%0.01933%0.33CS..THydrogen-bonded Turntrans-59.7-30.1-174.922.6-31.9000113.2G238 N239 G240 F242 Y309G238-P244 CarbonylContact C-O 3.59Å; G238-P244 WeakPolarHBondContact CA-O 3.1Å; N239-P244 PolarHBondContact N-O 3.31Å; G240-P244 WeakPolarHBondContact O-CA 3.28Å; F242-P244 VanDerWaalsContact C-CD 3.42Å; F242-P244 WeakPolarHBondContact O-CD 3.11Å; P244-Y309 HydrophobicContact CB-CE1 4.09Å; P244-Y309 HydrophobicContact CB-CE2 3.87Å; P244-Y309 WeakPolarHBondContact CB-OH 3.22Å; P244-Y309 HydrophobicContact CG-CD1 4.43Å; P244-Y309 HydrophobicContact CG-CD2 4.14Å; P244-Y309 HydrophobicContact CG-CE1 4.14Å; P244-Y309 HydrophobicContact CG-CE2 3.83Å; P244-Y309 HydrophobicContact CG-CG 4.44Å
245F91.1Very high86.5Confident52 Ų5250.9 Ų50.923%0.22830%0.3CS..THydrogen-bonded Turntrans-106.215.1178.6-55-76.9000113T64 N236 L237 F243 G249 Y309T64-F245 WeakPolarHBondContact O-CB 2.83Å; T64-F245 WeakPolarHBondContact O-CD2 3.25Å; T64-F245 WeakPolarHBondContact O-CG 3.32Å; N236-F245 WeakPolarHBondContact O-CE1 3.12Å; L237-F245 WeakPolarHBondContact O-CZ 3.18Å; F243-F245 PolarHBondContact O-N 2.98Å; F243-F245 VanDerWaalsContact O-N 3.13Å; F245-G249 PolarHBondContact O-N 3.46Å; F245-G249 VanDerWaalsContact O-N 3.14Å; F245-Y309 HydrophobicContact CE2-CE2 4.24Å; F245-Y309 HydrophobicContact CZ-CE2 4.45Å
246G90.9Very high87.6Confident32 Ų3251.3 Ų51.333%0.3330%0.298SS..Hα-helixtrans64.1-171.3-176.800000114.3F243 N248 G249 V250F243-G246 PolarHBondContact O-N 3.27Å; G246-N248 PolarHBondContact O-N 2.9Å; G246-G249 PolarHBondContact O-N 3.49Å; G246-V250 PolarHBondContact O-N 3.2Å
247L89.8Confident88.6Confident119 Ų11944 Ų4462%0.62326%0.259SS*.Hα-helixtrans-66.1-29.1178.4-65.9178000112.5F243 G249 V250 L251F243-L247 HydrophobicContact CE1-CD2 4.48Å; L247-G249 VanDerWaalsContact C-N 3.31Å; L247-G249 PolarHBondContact O-N 3.11Å; L247-V250 PolarHBondContact O-N 3.44Å; L247-L251 WeakPolarHBondContact O-CG 3.16Å; L247-L251 PolarHBondContact O-N 2.92Å
248N87.1Confident89.2Confident134 Ų13443.2 Ų43.272%0.71726%0.255SS*.Hα-helixtrans-62.3-40.5174.7-69.7-7.1000111.2G246 L251 S252G246-N248 PolarHBondContact O-N 2.9Å; N248-L251 PolarHBondContact O-N 2.97Å; N248-S252 VanDerWaalsContact O-CB 3.24Å; N248-S252 WeakPolarHBondContact O-CB 3.43Å; N248-S252 PolarHBondContact O-N 2.93Å
249G89.3Confident89.3Confident8 Ų845.2 Ų45.28%0.08226%0.256CS..Hα-helixtrans-62.5-43.217300000112.9T64 F245 G246 L247 L251 S252 G253T64-G249 CarbonylContact O-C 3.51Å; T64-G249 WeakPolarHBondContact O-CA 3.33Å; F245-G249 PolarHBondContact O-N 3.46Å; F245-G249 VanDerWaalsContact O-N 3.14Å; G246-G249 PolarHBondContact O-N 3.49Å; L247-G249 VanDerWaalsContact C-N 3.31Å; L247-G249 PolarHBondContact O-N 3.11Å; G249-L251 PolarHBondContact O-N 2.66Å; G249-S252 PolarHBondContact O-N 2.85Å; G249-G253 PolarHBondContact O-N 3.38Å
250V94.1Very high89.6Confident5 Ų539 Ų393%0.0322%0.223CC..Hα-helixtrans-62.4-44.7176.5177.20000111.9I71 S72 I75 F243 G246 L247 G253 A254I71-V250 HydrophobicContact CB-CG1 3.86Å; I71-V250 HydrophobicContact CG2-CG1 3.78Å; S72-V250 PolarHBondContact OG-O 3.1Å; I75-V250 HydrophobicContact CD1-CG1 4.43Å; F243-V250 HydrophobicContact CD1-CG2 3.53Å; F243-V250 HydrophobicContact CE1-CG2 3.76Å; G246-V250 PolarHBondContact O-N 3.2Å; L247-V250 PolarHBondContact O-N 3.44Å; V250-G253 PolarHBondContact O-N 2.84Å; V250-A254 WeakPolarHBondContact O-CB 3.49Å; V250-A254 PolarHBondContact O-N 2.71Å
251L88Confident89.9Confident91 Ų9138.6 Ų38.648%0.47622%0.219SC..Hα-helixtrans-68-39.4178.4-70.6172000112I75 L247 N248 G249 A254 G255I75-L251 HydrophobicContact CD1-CD2 4.2Å; L247-L251 WeakPolarHBondContact O-CG 3.16Å; L247-L251 PolarHBondContact O-N 2.92Å; N248-L251 PolarHBondContact O-N 2.97Å; G249-L251 PolarHBondContact O-N 2.66Å; L251-A254 WeakPolarHBondContact O-CB 3.42Å; L251-A254 PolarHBondContact O-N 3.36Å; L251-G255 PolarHBondContact O-N 3.14Å
252S86.4Confident89.9Confident64 Ų6438.8 Ų38.845%0.44822%0.216SC..Hα-helixtrans-62.9-45.6173.1-173.30000111.3N248 G249 A254 G255 T256N248-S252 VanDerWaalsContact O-CB 3.24Å; N248-S252 WeakPolarHBondContact O-CB 3.43Å; N248-S252 PolarHBondContact O-N 2.93Å; G249-S252 PolarHBondContact O-N 2.85Å; S252-A254 VanDerWaalsContact C-N 3.29Å; S252-A254 PolarHBondContact O-N 2.94Å; S252-G255 PolarHBondContact O-N 3.47Å; S252-T256 PolarHBondContact O-N 3.04Å
253G90Very high89.8Confident0 Ų036.3 Ų36.30%021%0.206CC..Hα-helixtrans-59.6-38.8174.300000111.9G249 V250 G255 T256 C257G249-G253 PolarHBondContact O-N 3.38Å; V250-G253 PolarHBondContact O-N 2.84Å; G253-G255 VanDerWaalsContact C-N 3.31Å; G253-G255 PolarHBondContact O-N 3.33Å; G253-T256 PolarHBondContact O-N 3.19Å; G253-T256 VanDerWaalsContact O-N 3.12Å; G253-C257 WeakPolarHBondContact O-CB 3.48Å; G253-C257 PolarHBondContact O-N 3.31Å; G253-C257 PolarHBondContact O-SG 3.39Å
254A92Very high89.8Confident7 Ų732.3 Ų32.36%0.05819%0.189CC..Hα-helixtrans-61.6-38.6177.500000112.2I75 V250 L251 S252 T256 C257 F258I75-A254 HydrophobicContact CB-CB 3.89Å; I75-A254 HydrophobicContact CD1-CB 4.41Å; I75-A254 HydrophobicContact CG2-CB 3.79Å; V250-A254 WeakPolarHBondContact O-CB 3.49Å; V250-A254 PolarHBondContact O-N 2.71Å; L251-A254 WeakPolarHBondContact O-CB 3.42Å; L251-A254 PolarHBondContact O-N 3.36Å; S252-A254 VanDerWaalsContact C-N 3.29Å; S252-A254 PolarHBondContact O-N 2.94Å; A254-T256 VanDerWaalsContact C-N 3.31Å; A254-T256 PolarHBondContact O-N 2.89Å; A254-C257 PolarHBondContact O-N 2.85Å; A254-F258 PolarHBondContact O-N 2.92Å
255G86Confident89.9Confident13 Ų1332.2 Ų32.213%0.13419%0.188CC..Hα-helixtrans-64.1-37174.800000112.9L251 S252 G253 F258 L641L251-G255 PolarHBondContact O-N 3.14Å; S252-G255 PolarHBondContact O-N 3.47Å; G253-G255 VanDerWaalsContact C-N 3.31Å; G253-G255 PolarHBondContact O-N 3.33Å; G255-F258 WeakPolarHBondContact O-CB 3.22Å; G255-L641 VanDerWaalsContact CA-CD2 3.46Å
256T86.6Confident90Very high48 Ų4830 Ų3029%0.29418%0.178SC..Hα-helixtrans-71.8-44.3174.7-57.30000111.4L56 V60 S252 G253 A254 F258 F259L56-T256 HydrophobicContact CD1-CG2 3.58Å; L56-T256 HydrophobicContact CG-CG2 4.39Å; V60-T256 HydrophobicContact CG2-CG2 3.62Å; S252-T256 PolarHBondContact O-N 3.04Å; G253-T256 PolarHBondContact O-N 3.19Å; G253-T256 VanDerWaalsContact O-N 3.12Å; A254-T256 VanDerWaalsContact C-N 3.31Å; A254-T256 PolarHBondContact O-N 2.89Å; T256-F258 PolarHBondContact O-N 2.87Å; T256-F259 WeakPolarHBondContact O-CB 3.49Å; T256-F259 PolarHBondContact O-N 3.43Å
257C91.5Very high90.2Very high0 Ų028.4 Ų28.40%016%0.163CC..Hα-helixtrans-63.1-26.1176.1-69.90000113.2F73 A76 G253 A254 F259 A260F73-C257 HydrophobicContact CD1-CB 3.75Å; F73-C257 HydrophobicContact CE1-CB 3.82Å; F73-C257 VanDerWaalsContact CE2-SG 3.56Å; F73-C257 HydrophobicContact CG-CB 4.15Å; F73-C257 HydrophobicContact CZ-CB 4.27Å; A76-C257 HydrophobicContact CB-CB 3.68Å; G253-C257 WeakPolarHBondContact O-CB 3.48Å; G253-C257 PolarHBondContact O-N 3.31Å; G253-C257 PolarHBondContact O-SG 3.39Å; A254-C257 PolarHBondContact O-N 2.85Å; C257-F259 PolarHBondContact O-N 3.05Å; C257-A260 WeakPolarHBondContact O-CA 3.35Å; C257-A260 WeakPolarHBondContact O-CB 3.45Å; C257-A260 PolarHBondContact O-N 2.94Å
258F89.9Confident90.3Very high3 Ų322.8 Ų22.81%0.01313%0.133CC..Hα-helixtrans-57.6-37.5174.6-178-94.4000111.7A76 A79 S80 A254 G255 T256 A260 F261 L412 Y415 L641A76-F258 HydrophobicContact CB-CB 4.39Å; A79-F258 HydrophobicContact CB-CD2 3.68Å; A79-F258 HydrophobicContact CB-CE2 3.73Å; S80-F258 WeakPolarHBondContact OG-CD2 3.19Å; S80-F258 VanDerWaalsContact OG-CE2 3.28Å; S80-F258 WeakPolarHBondContact OG-CE2 3.11Å; A254-F258 PolarHBondContact O-N 2.92Å; G255-F258 WeakPolarHBondContact O-CB 3.22Å; T256-F258 PolarHBondContact O-N 2.87Å; F258-A260 PolarHBondContact O-N 3.33Å; F258-F261 PolarHBondContact O-N 3.4Å; F258-L412 HydrophobicContact CD1-CD2 4.15Å; F258-L412 HydrophobicContact CE1-CD2 3.51Å; F258-L412 HydrophobicContact CZ-CD2 4.32Å; F258-Y415 HydrophobicContact CE1-CD2 4.22Å; F258-Y415 HydrophobicContact CE1-CE2 4.15Å; F258-Y415 AromaticContact CZ-CD2 3.88Å; F258-Y415 HydrophobicContact CZ-CD2 3.88Å; F258-Y415 AromaticContact CZ-CE2 3.94Å; F258-Y415 HydrophobicContact CZ-CE2 3.94Å; F258-L641 HydrophobicContact CB-CD1 3.87Å; F258-L641 HydrophobicContact CD1-CD1 3.35Å; F258-L641 HydrophobicContact CD2-CD1 4.2Å; F258-L641 HydrophobicContact CE1-CD1 3.89Å; F258-L641 HydrophobicContact CG-CD1 3.52Å; F258-L641 HydrophobicContact CZ-CD1 4.48Å
259F84.3Confident90.5Very high68 Ų6816.4 Ų16.430%0.29810%0.099SC..Hα-helixtrans-64.2-25.5175.3-64.9-62.4000113.2T256 C257 F261 V262 S408 L412T256-F259 WeakPolarHBondContact O-CB 3.49Å; T256-F259 PolarHBondContact O-N 3.43Å; C257-F259 PolarHBondContact O-N 3.05Å; F259-F261 PolarHBondContact O-N 3.02Å; F259-V262 HydrophobicContact CD1-CG2 4.42Å; F259-V262 WeakPolarHBondContact O-CB 3.39Å; F259-V262 PolarHBondContact O-N 3.38Å; F259-S408 WeakPolarHBondContact CE1-OG 3.41Å; F259-S408 VanDerWaalsContact CZ-CB 3.45Å; F259-S408 VanDerWaalsContact CZ-OG 3.3Å; F259-S408 WeakPolarHBondContact CZ-OG 3.17Å; F259-L412 HydrophobicContact CE1-CD1 4.35Å; F259-L412 HydrophobicContact CZ-CD1 4.35Å
260A90.3Very high90.6Very high4 Ų416 Ų163%0.03310%0.095CC..THydrogen-bonded Turntrans-68.3-19.2173.700000113.1T48 L56 F73 C257 F258 Y296T48-A260 WeakPolarHBondContact CG2-O 3.5Å; L56-A260 HydrophobicContact CD2-CB 3.5Å; L56-A260 VanDerWaalsContact CD2-CB 3.5Å; F73-A260 HydrophobicContact CE1-CB 3.69Å; F73-A260 HydrophobicContact CZ-CB 4.47Å; C257-A260 WeakPolarHBondContact O-CA 3.35Å; C257-A260 WeakPolarHBondContact O-CB 3.45Å; C257-A260 PolarHBondContact O-N 2.94Å; F258-A260 PolarHBondContact O-N 3.33Å; A260-Y296 HydrophobicContact CB-CE1 3.89Å; A260-Y296 HydrophobicContact CB-CE2 3.88Å; A260-Y296 WeakPolarHBondContact CB-OH 3.34Å; A260-Y296 WeakPolarHBondContact O-CE2 3.34Å; A260-Y296 PolarHBondContact O-OH 3.46Å
261F92.7Very high90.2Very high1 Ų115.8 Ų15.80%0.0049%0.094CC..THydrogen-bonded Turntrans-99.84.9177.9-75.2-81.3000113.1F73 A76 A77 S80 F258 F259 F264 L289 C292 F293 Y296F73-F261 AromaticContact CD1-CE2 3.84Å; F73-F261 HydrophobicContact CD1-CE2 3.84Å; F73-F261 HydrophobicContact CD1-CZ 4.47Å; A76-F261 HydrophobicContact CB-CD2 3.84Å; A76-F261 HydrophobicContact CB-CE2 3.89Å; A77-F261 HydrophobicContact CB-CE1 3.97Å; A77-F261 HydrophobicContact CB-CE2 3.91Å; A77-F261 HydrophobicContact CB-CZ 3.51Å; S80-F261 WeakPolarHBondContact OG-CB 3.47Å; F258-F261 PolarHBondContact O-N 3.4Å; F259-F261 PolarHBondContact O-N 3.02Å; F261-F264 VanDerWaalsContact O-CD1 3.31Å; F261-F264 WeakPolarHBondContact O-CD1 3.32Å; F261-L289 HydrophobicContact CD1-CD2 4.11Å; F261-C292 HydrophobicContact CD1-CB 4.09Å; F261-C292 HydrophobicContact CE1-CB 3.88Å; F261-F293 HydrophobicContact CE1-CB 4.08Å; F261-F293 HydrophobicContact CZ-CB 4.22Å; F261-Y296 HydrophobicContact CE1-CD2 4.05Å; F261-Y296 HydrophobicContact CE2-CD2 4.25Å; F261-Y296 AromaticContact CZ-CD2 3.85Å; F261-Y296 HydrophobicContact CZ-CD2 3.85Å
262V89.8Confident90.1Very high23 Ų2313.5 Ų13.514%0.1398%0.081CC..THydrogen-bonded Turntrans-75.2139172.6173.70000109.4F259 T411 Y415F259-V262 HydrophobicContact CD1-CG2 4.42Å; F259-V262 WeakPolarHBondContact O-CB 3.39Å; F259-V262 PolarHBondContact O-N 3.38Å; V262-T411 HydrophobicContact CB-CG2 4.35Å; V262-T411 HydrophobicContact CG1-CG2 3.51Å; V262-T411 HydrophobicContact CG2-CG2 3.89Å; V262-Y415 HydrophobicContact CG2-CE2 4.38Å
263G90.8Very high90.2Very high3 Ų310.5 Ų10.53%0.0316%0.059CC..THydrogen-bonded Turntrans127.3-13.3-178.700000114.7D265 I266G263-D265 WeakPolarHBondContact CA-OD1 3.23Å; G263-D265 PolarHBondContact N-OD1 2.83Å; G263-D265 PolarHBondContact O-N 3.43Å; G263-I266 WeakPolarHBondContact O-CB 3.24Å; G263-I266 WeakPolarHBondContact O-CD1 3.4Å; G263-I266 WeakPolarHBondContact O-CG1 3.1Å; G263-I266 PolarHBondContact O-N 3.03Å
264F93.7Very high90.2Very high0 Ų010.5 Ų10.50%06%0.06CC..THydrogen-bonded Turntrans-67.8-25174.767.7-99.1000112.6G84 Y87 F261 I266 I267 I285 L289 Y415G84-F264 VanDerWaalsContact CA-CE2 3.49Å; Y87-F264 AromaticContact CD2-CE2 3.73Å; Y87-F264 HydrophobicContact CD2-CE2 3.73Å; Y87-F264 HydrophobicContact CD2-CZ 4.39Å; Y87-F264 HydrophobicContact CE2-CE2 4.29Å; Y87-F264 HydrophobicContact CG-CE2 4.01Å; F261-F264 VanDerWaalsContact O-CD1 3.31Å; F261-F264 WeakPolarHBondContact O-CD1 3.32Å; F264-I266 PolarHBondContact O-N 3.47Å; F264-I267 VanDerWaalsContact O-CB 3.28Å; F264-I267 WeakPolarHBondContact O-CB 3.49Å; F264-I267 WeakPolarHBondContact O-CG1 3.44Å; F264-I267 PolarHBondContact O-N 3.06Å; F264-I285 HydrophobicContact CB-CG2 4.46Å; F264-I285 HydrophobicContact CD2-CG2 4.01Å; F264-I285 HydrophobicContact CG-CG2 4.46Å; F264-L289 HydrophobicContact CB-CD2 4.25Å; F264-L289 HydrophobicContact CB-CG 4.29Å; F264-L289 HydrophobicContact CD1-CD1 4.37Å; F264-L289 HydrophobicContact CD1-CD2 3.69Å; F264-L289 HydrophobicContact CD1-CG 4.34Å; F264-L289 HydrophobicContact CE1-CD2 4.41Å; F264-L289 HydrophobicContact CG-CD1 4.4Å; F264-L289 HydrophobicContact CG-CD2 4.2Å; F264-L289 HydrophobicContact CG-CG 4.4Å; F264-Y415 HydrophobicContact CE1-CE1 4.39Å; F264-Y415 AromaticContact CE1-CE2 3.92Å; F264-Y415 HydrophobicContact CE1-CE2 3.92Å; F264-Y415 AromaticContact CE1-CZ 3.6Å; F264-Y415 VanDerWaalsContact CE1-OH 3.23Å; F264-Y415 WeakPolarHBondContact CE1-OH 3.49Å; F264-Y415 HydrophobicContact CE2-CE1 4.31Å; F264-Y415 HydrophobicContact CZ-CD1 4.48Å; F264-Y415 AromaticContact CZ-CE1 3.8Å; F264-Y415 HydrophobicContact CZ-CE1 3.8Å; F264-Y415 AromaticContact CZ-CE2 3.87Å; F264-Y415 HydrophobicContact CZ-CE2 3.87Å; F264-Y415 AromaticContact CZ-CZ 3.44Å; F264-Y415 VanDerWaalsContact CZ-CZ 3.44Å; F264-Y415 WeakPolarHBondContact CZ-OH 3.36Å
265D93.2Very high90Very high2 Ų217.8 Ų17.81%0.0119%0.086CC..Hα-helixtrans-65.6-24.6179.264-63000112.7Y87 S99 Y124 G263 I267 A268 Y415Y87-D265 HydrophobicContact CD1-CB 4.24Å; Y87-D265 HydrophobicContact CE1-CB 3.79Å; S99-D265 PolarHBondContact OG-O 3.46Å; Y124-D265 PolarHBondContact OH-OD2 3.14Å; G263-D265 WeakPolarHBondContact CA-OD1 3.23Å; G263-D265 PolarHBondContact N-OD1 2.83Å; G263-D265 PolarHBondContact O-N 3.43Å; D265-I267 PolarHBondContact O-N 3.31Å; D265-A268 WeakPolarHBondContact O-CB 3.42Å; D265-A268 PolarHBondContact O-N 3.49Å; D265-Y415 HydrophobicContact CB-CE1 4.01Å
266I93.6Very high90Very high4 Ų421 Ų212%0.02110%0.1CC..Hα-helixtrans-56.5-38.3173.7-64.7167.2000110.6L43 T47 Y124 G263 F264 A268 T269 G348 P352L43-I266 HydrophobicContact CD2-CG2 3.84Å; L43-I266 HydrophobicContact CG-CG2 3.99Å; T47-I266 HydrophobicContact CG2-CD1 3.24Å; Y124-I266 HydrophobicContact CE1-CG1 4.3Å; G263-I266 WeakPolarHBondContact O-CB 3.24Å; G263-I266 WeakPolarHBondContact O-CD1 3.4Å; G263-I266 WeakPolarHBondContact O-CG1 3.1Å; G263-I266 PolarHBondContact O-N 3.03Å; F264-I266 PolarHBondContact O-N 3.47Å; I266-A268 PolarHBondContact O-N 3.49Å; I266-T269 WeakPolarHBondContact O-CB 3.45Å; I266-T269 PolarHBondContact O-N 2.97Å; I266-T269 PolarHBondContact O-OG1 2.79Å; I266-G348 VanDerWaalsContact CD1-O 3.25Å; I266-G348 WeakPolarHBondContact CD1-O 3.32Å; I266-P352 HydrophobicContact CB-CG 4.12Å; I266-P352 HydrophobicContact CD1-CG 4.46Å; I266-P352 HydrophobicContact CG1-CG 3.72Å; I266-P352 HydrophobicContact CG2-CG 3.77Å
267I94.8Very high90.1Very high0 Ų018.9 Ų18.90%09%0.087CC..Hα-helixtrans-55.8-43.5178.3-59.7175000110.2L40 F264 D265 T269 T270 I281 I285 C288L40-I267 HydrophobicContact CB-CG2 4.11Å; L40-I267 HydrophobicContact CD2-CG2 3.77Å; L40-I267 HydrophobicContact CG-CG2 3.96Å; F264-I267 VanDerWaalsContact O-CB 3.28Å; F264-I267 WeakPolarHBondContact O-CB 3.49Å; F264-I267 WeakPolarHBondContact O-CG1 3.44Å; F264-I267 PolarHBondContact O-N 3.06Å; D265-I267 PolarHBondContact O-N 3.31Å; I267-T269 PolarHBondContact O-N 3.17Å; I267-T270 PolarHBondContact O-N 3.46Å; I267-T270 PolarHBondContact O-OG1 2.89Å; I267-I281 HydrophobicContact CG2-CG2 4.21Å; I267-I285 HydrophobicContact CB-CG1 4.14Å; I267-I285 HydrophobicContact CD1-CG1 4.05Å; I267-I285 HydrophobicContact CG2-CG1 4.16Å; I267-C288 HydrophobicContact CD1-CB 3.95Å
268A93.2Very high89.9Confident0 Ų020.8 Ų20.80%010%0.096CC..Hα-helixtrans-69.1-17-179.300000113.6Y87 Y103 D265 I266 T270 I281Y87-A268 HydrophobicContact CD1-CB 3.98Å; Y103-A268 HydrophobicContact CE2-CB 4.36Å; Y103-A268 WeakPolarHBondContact OH-CB 3.28Å; D265-A268 WeakPolarHBondContact O-CB 3.42Å; D265-A268 PolarHBondContact O-N 3.49Å; I266-A268 PolarHBondContact O-N 3.49Å; A268-T270 VanDerWaalsContact C-N 3.27Å; A268-T270 PolarHBondContact O-N 3.39Å; A268-I281 HydrophobicContact CB-CG2 4.41Å
269T91.3Very high89.9Confident0 Ų023.1 Ų23.10%011%0.11CC..Hα-helixtrans-76.2-18.3176.172.90000112.7S97 S99 I266 I267 G271 P352 I356S97-T269 WeakPolarHBondContact CA-O 3.33Å; S97-T269 PolarHBondContact OG-O 3.31Å; S99-T269 VanDerWaalsContact CB-CG2 3.45Å; I266-T269 WeakPolarHBondContact O-CB 3.45Å; I266-T269 PolarHBondContact O-N 2.97Å; I266-T269 PolarHBondContact O-OG1 2.79Å; I267-T269 PolarHBondContact O-N 3.17Å; T269-G271 VanDerWaalsContact C-N 3.34Å; T269-G271 PolarHBondContact O-N 3.3Å; T269-P352 HydrophobicContact CG2-CB 4.03Å; T269-P352 HydrophobicContact CG2-CG 4.48Å; T269-I356 HydrophobicContact CG2-CD1 4.23Å
270T90.2Very high90.4Very high0 Ų019.9 Ų19.90%010%0.096CC..THydrogen-bonded Turntrans-89.37.2-172.573.50000114.1L35 L43 I267 A268 E272 E273 V274 F351L35-T270 HydrophobicContact CD1-CG2 4.44Å; L43-T270 HydrophobicContact CD2-CG2 3.96Å; I267-T270 PolarHBondContact O-N 3.46Å; I267-T270 PolarHBondContact O-OG1 2.89Å; A268-T270 VanDerWaalsContact C-N 3.27Å; A268-T270 PolarHBondContact O-N 3.39Å; T270-E272 VanDerWaalsContact C-N 3.27Å; T270-E272 PolarHBondContact O-N 3.38Å; T270-E273 PolarHBondContact O-N 3.49Å; T270-V274 WeakPolarHBondContact O-CG2 3.3Å; T270-F351 HydrophobicContact CG2-CD1 4.19Å; T270-F351 HydrophobicContact CG2-CE1 3.52Å; T270-F351 HydrophobicContact CG2-CZ 4.43Å
271G86.1Confident90.6Very high1 Ų119.8 Ų19.81%0.0110%0.095CC..G310 helixtrans-53.5-35.2-167.500000116.1T269 E273 P277T269-G271 VanDerWaalsContact C-N 3.34Å; T269-G271 PolarHBondContact O-N 3.3Å; G271-E273 VanDerWaalsContact C-N 3.35Å; G271-P277 WeakPolarHBondContact O-CB 3.3Å
272E86.3Confident90.7Very high42 Ų4220 Ų2020%0.19610%0.096CC..G310 helixtrans-79.1-13.1179.1-74.6171.4-152.200114.3L31 R33 Q96 S97 T270L31-E272 HydrophobicContact CB-CB 4.15Å; L31-E272 HydrophobicContact CD1-CB 3.89Å; L31-E272 HydrophobicContact CG-CB 4.45Å; R33-E272 VanDerWaalsContact CG-O 3.27Å; R33-E272 WeakPolarHBondContact CG-O 3.04Å; Q96-E272 WeakPolarHBondContact CA-OE1 3.4Å; S97-E272 PolarHBondContact N-OE1 3.02Å; T270-E272 VanDerWaalsContact C-N 3.27Å; T270-E272 PolarHBondContact O-N 3.38Å
273E88.5Confident91Very high1 Ų123.2 Ų23.21%0.00511%0.112CC..G310 helixtrans-105.52.9-177-69.8170.2163.900113.2L31 R33 C34 L35 V185 T270 G271 R355L31-E273 HydrophobicContact CB-CG 3.6Å; L31-E273 HydrophobicContact CD1-CG 4.14Å; L31-E273 HydrophobicContact CG-CG 4.41Å; R33-E273 CarbonylContact C-O 3.48Å; R33-E273 VanDerWaalsContact CA-O 3.28Å; R33-E273 WeakPolarHBondContact CA-O 3.49Å; C34-E273 PolarHBondContact N-O 3.48Å; L35-E273 WeakPolarHBondContact CB-O 3.31Å; L35-E273 HydrophobicContact CD1-CB 3.95Å; L35-E273 HydrophobicContact CG-CB 4.34Å; L35-E273 PolarHBondContact N-O 3.47Å; V185-E273 WeakPolarHBondContact CG1-OE2 3.48Å; V185-E273 WeakPolarHBondContact CG2-OE1 3.41Å; T270-E273 PolarHBondContact O-N 3.49Å; G271-E273 VanDerWaalsContact C-N 3.35Å; E273-R355 IonicContact OE1-CZ 3.14Å; E273-R355 IonicContact OE1-NE 3.38Å; E273-R355 PolarHBondContact OE1-NE 3.16Å; E273-R355 IonicContact OE1-NH2 2.66Å; E273-R355 PolarHBondContact OE1-NH2 3.13Å; E273-R355 IonicContact OE2-CZ 3.7Å; E273-R355 IonicContact OE2-NE 3.82Å; E273-R355 PolarHBondContact OE2-NE 2.78Å; E273-R355 IonicContact OE2-NH2 3.49Å; E273-R355 PolarHBondContact OE2-NH2 3.38Å
274V90.7Very high91.3Very high1 Ų123 Ų231%0.00611%0.11CC..BIsolated β-bridgetrans-101.9141-176.9178.30000110.5R33 L35 L40 T270 P277 A280R33-V274 WeakPolarHBondContact CD-O 3.39Å; L35-V274 HydrophobicContact CB-CG2 4.02Å; L35-V274 HydrophobicContact CD1-CG2 4.44Å; L40-V274 HydrophobicContact CD1-CG2 3.46Å; L40-V274 VanDerWaalsContact CD1-CG2 3.46Å; L40-V274 HydrophobicContact CD2-CG1 4.15Å; L40-V274 HydrophobicContact CD2-CG2 3.59Å; L40-V274 HydrophobicContact CG-CG2 4.09Å; T270-V274 WeakPolarHBondContact O-CG2 3.3Å; V274-P277 HydrophobicContact CB-CB 4.23Å; V274-P277 HydrophobicContact CG1-CB 4.38Å; V274-A280 HydrophobicContact CG1-CB 3.63Å
275R86.5Confident91.5Very high160 Ų16023 Ų2360%0.60411%0.11SC*.SBendtrans-65-42.8-178.4-65.8-177.9-175.1171.64.4113.5L35L35-R275 PolarHBondContact O-N 3.23Å
276N86.8Confident91.6Very high81 Ų8126.7 Ų26.743%0.43313%0.129SC..SBendtrans-13473.7178.6-172.2-1.9000110.5Q278 T279 A280N276-Q278 VanDerWaalsContact C-N 3.25Å; N276-Q278 PolarHBondContact O-N 3.08Å; N276-Q278 PolarHBondContact OD1-OE1 3.42Å; N276-T279 VanDerWaalsContact CG-OG1 3.25Å; N276-T279 PolarHBondContact ND2-OG1 3.15Å; N276-T279 VanDerWaalsContact ND2-OG1 3.11Å; N276-T279 PolarHBondContact O-N 3.13Å; N276-T279 PolarHBondContact OD1-OG1 3.42Å; N276-A280 WeakPolarHBondContact O-CB 3.44Å; N276-A280 PolarHBondContact O-N 3.21Å
277P88Confident91.7Very high2 Ų227.5 Ų27.51%0.01314%0.138CC..Hα-helixtrans-62.5-31.7-170.723.3-32.2000113P95 G271 V274 T279 A280 I281P95-P277 HydrophobicContact CB-CB 3.67Å; P95-P277 HydrophobicContact CB-CG 3.37Å; P95-P277 HydrophobicContact CG-CG 4.34Å; G271-P277 WeakPolarHBondContact O-CB 3.3Å; V274-P277 HydrophobicContact CB-CB 4.23Å; V274-P277 HydrophobicContact CG1-CB 4.38Å; P277-T279 VanDerWaalsContact C-N 3.28Å; P277-T279 PolarHBondContact O-N 2.62Å; P277-A280 PolarHBondContact O-N 3.26Å; P277-I281 HydrophobicContact CB-CD1 3.91Å; P277-I281 HydrophobicContact CB-CG1 4.43Å; P277-I281 WeakPolarHBondContact O-CB 3.33Å; P277-I281 WeakPolarHBondContact O-CG1 3.3Å; P277-I281 PolarHBondContact O-N 2.89Å
278Q87.1Confident91.8Very high41 Ų4127.5 Ų27.519%0.19214%0.138CC..Hα-helixtrans-61.4-36.2-174.9-63.587.2-14.600112.8A92 N276 P282 A621A92-Q278 WeakPolarHBondContact CB-O 3.25Å; A92-Q278 WeakPolarHBondContact O-CG 3.39Å; N276-Q278 VanDerWaalsContact C-N 3.25Å; N276-Q278 PolarHBondContact O-N 3.08Å; N276-Q278 PolarHBondContact OD1-OE1 3.42Å; Q278-P282 WeakPolarHBondContact O-CD 3.48Å; Q278-P282 WeakPolarHBondContact O-CG 3.13Å; Q278-A621 HydrophobicContact CB-CB 4.12Å; Q278-A621 VanDerWaalsContact O-CB 3.29Å; Q278-A621 WeakPolarHBondContact O-CB 2.98Å
279T90.9Very high92Very high51 Ų5127.7 Ų27.731%0.31314%0.139SC..Hα-helixtrans-101.8-34.4177.156.80000112N276 P277 P282 I283 A621N276-T279 VanDerWaalsContact CG-OG1 3.25Å; N276-T279 PolarHBondContact ND2-OG1 3.15Å; N276-T279 VanDerWaalsContact ND2-OG1 3.11Å; N276-T279 PolarHBondContact O-N 3.13Å; N276-T279 PolarHBondContact OD1-OG1 3.42Å; P277-T279 VanDerWaalsContact C-N 3.28Å; P277-T279 PolarHBondContact O-N 2.62Å; T279-P282 WeakPolarHBondContact O-CD 3.32Å; T279-I283 WeakPolarHBondContact O-CB 3.49Å; T279-I283 WeakPolarHBondContact O-CD1 3.38Å; T279-I283 WeakPolarHBondContact O-CG1 3.25Å; T279-I283 PolarHBondContact O-N 2.88Å; T279-A621 HydrophobicContact CG2-CB 4.02Å
280A94.1Very high92.2Very high1 Ų132.3 Ų32.31%0.00816%0.164CC..Hα-helixtrans-66.1-43.8-176.600000113I37 L40 V274 N276 P277 S284I37-A280 HydrophobicContact CD1-CB 4.4Å; I37-A280 HydrophobicContact CG1-CB 3.62Å; L40-A280 HydrophobicContact CD2-CB 4.31Å; V274-A280 HydrophobicContact CG1-CB 3.63Å; N276-A280 WeakPolarHBondContact O-CB 3.44Å; N276-A280 PolarHBondContact O-N 3.21Å; P277-A280 PolarHBondContact O-N 3.26Å; A280-S284 WeakPolarHBondContact O-CB 3.34Å; A280-S284 PolarHBondContact O-N 2.99Å; A280-S284 PolarHBondContact O-OG 2.89Å
281I94Very high92.6Very high1 Ų135.2 Ų35.21%0.00518%0.178CC..Hα-helixtrans-63.5-52.2-177.9-65168.3000110.8L40 I267 A268 P277 I283 S284 I285L40-I281 HydrophobicContact CD2-CG1 4.15Å; I267-I281 HydrophobicContact CG2-CG2 4.21Å; A268-I281 HydrophobicContact CB-CG2 4.41Å; P277-I281 HydrophobicContact CB-CD1 3.91Å; P277-I281 HydrophobicContact CB-CG1 4.43Å; P277-I281 WeakPolarHBondContact O-CB 3.33Å; P277-I281 WeakPolarHBondContact O-CG1 3.3Å; P277-I281 PolarHBondContact O-N 2.89Å; I281-I283 PolarHBondContact O-N 3.42Å; I281-S284 PolarHBondContact O-N 3.42Å; I281-I285 HydrophobicContact CG2-CD1 3.66Å; I281-I285 HydrophobicContact CG2-CG1 4.34Å; I281-I285 WeakPolarHBondContact O-CG1 3.15Å; I281-I285 PolarHBondContact O-N 3.25Å
282P95Very high93.1Very high6 Ų635.1 Ų35.14%0.03918%0.178CC..Hα-helixtrans-56-48.5176.7-26.833.8000113.8A88 A92 Q278 T279 S284 I285 I286 F622A88-P282 HydrophobicContact CB-CB 3.99Å; A88-P282 HydrophobicContact CB-CG 4.41Å; A92-P282 HydrophobicContact CB-CG 3.89Å; Q278-P282 WeakPolarHBondContact O-CD 3.48Å; Q278-P282 WeakPolarHBondContact O-CG 3.13Å; T279-P282 WeakPolarHBondContact O-CD 3.32Å; P282-S284 VanDerWaalsContact C-N 3.3Å; P282-S284 PolarHBondContact O-N 3.47Å; P282-I285 PolarHBondContact O-N 2.97Å; P282-I286 WeakPolarHBondContact O-CG1 3.08Å; P282-I286 PolarHBondContact O-N 3.23Å; P282-I286 VanDerWaalsContact O-N 3.14Å; P282-F622 HydrophobicContact CB-CB 3.97Å; P282-F622 HydrophobicContact CB-CG 4.1Å; P282-F622 HydrophobicContact CG-CB 3.85Å; P282-F622 HydrophobicContact CG-CG 4.41Å
283I96.2Very high93.6Very high90 Ų9036.1 Ų36.146%0.46218%0.181SC..Hα-helixtrans-62.1-42.1-178.5-67.5169.3000110.2I37 T279 I281 G287I37-I283 HydrophobicContact CD1-CD1 4.43Å; I37-I283 HydrophobicContact CG2-CB 4.43Å; I37-I283 HydrophobicContact CG2-CG2 3.87Å; T279-I283 WeakPolarHBondContact O-CB 3.49Å; T279-I283 WeakPolarHBondContact O-CD1 3.38Å; T279-I283 WeakPolarHBondContact O-CG1 3.25Å; T279-I283 PolarHBondContact O-N 2.88Å; I281-I283 PolarHBondContact O-N 3.42Å; I283-G287 PolarHBondContact O-N 3.21Å
284S97.5Very high94Very high0 Ų040.2 Ų40.20%020%0.203CC..Hα-helixtrans-70.4-37.8-178.3-53.50000112.3I37 L40 T41 A280 I281 P282 C288I37-S284 PolarHBondContact O-OG 3.01Å; L40-S284 VanDerWaalsContact CB-OG 3.3Å; L40-S284 WeakPolarHBondContact CB-OG 3.27Å; T41-S284 WeakPolarHBondContact OG1-CA 3.32Å; T41-S284 PolarHBondContact OG1-OG 3.3Å; A280-S284 WeakPolarHBondContact O-CB 3.34Å; A280-S284 PolarHBondContact O-N 2.99Å; A280-S284 PolarHBondContact O-OG 2.89Å; I281-S284 PolarHBondContact O-N 3.42Å; P282-S284 VanDerWaalsContact C-N 3.3Å; P282-S284 PolarHBondContact O-N 3.47Å; S284-C288 WeakPolarHBondContact O-CB 3Å; S284-C288 PolarHBondContact O-N 2.6Å
285I96.6Very high94.3Very high0 Ų040.5 Ų40.50%021%0.206CC..Hα-helixtrans-62.1-49.6175.6-70.6168.8000110.3A88 F264 I267 I281 P282 C288 L289A88-I285 HydrophobicContact CB-CD1 4.3Å; F264-I285 HydrophobicContact CB-CG2 4.46Å; F264-I285 HydrophobicContact CD2-CG2 4.01Å; F264-I285 HydrophobicContact CG-CG2 4.46Å; I267-I285 HydrophobicContact CB-CG1 4.14Å; I267-I285 HydrophobicContact CD1-CG1 4.05Å; I267-I285 HydrophobicContact CG2-CG1 4.16Å; I281-I285 HydrophobicContact CG2-CD1 3.66Å; I281-I285 HydrophobicContact CG2-CG1 4.34Å; I281-I285 WeakPolarHBondContact O-CG1 3.15Å; I281-I285 PolarHBondContact O-N 3.25Å; P282-I285 PolarHBondContact O-N 2.97Å; I285-C288 PolarHBondContact O-N 3.18Å; I285-L289 HydrophobicContact CG2-CD1 4.06Å; I285-L289 WeakPolarHBondContact O-CG 3.43Å; I285-L289 PolarHBondContact O-N 3.12Å
286I95.7Very high94.8Very high78 Ų7832.9 Ų32.940%0.418%0.177SC..Hα-helixtrans-65.8-45.5-179.5-63.7171000110.5L85 P282 C288 L289 L290 F622L85-I286 HydrophobicContact CD2-CD1 4.43Å; P282-I286 WeakPolarHBondContact O-CG1 3.08Å; P282-I286 PolarHBondContact O-N 3.23Å; P282-I286 VanDerWaalsContact O-N 3.14Å; I286-C288 VanDerWaalsContact C-N 3.35Å; I286-C288 PolarHBondContact O-N 3.32Å; I286-L289 PolarHBondContact O-N 3.48Å; I286-L290 WeakPolarHBondContact O-CB 3.46Å; I286-L290 PolarHBondContact O-N 3.29Å; I286-F622 HydrophobicContact CD1-CE2 4.42Å
287G96.3Very high95.2Very high21 Ų2129.6 Ų29.622%0.21616%0.162CC..Hα-helixtrans-60.3-43.3177.200000112.4I283 L290 I291I283-G287 PolarHBondContact O-N 3.21Å; G287-L290 PolarHBondContact O-N 3.4Å; G287-I291 WeakPolarHBondContact O-CD1 3.46Å; G287-I291 VanDerWaalsContact O-CG1 3.27Å; G287-I291 WeakPolarHBondContact O-CG1 3.38Å; G287-I291 PolarHBondContact O-N 2.95Å
288C97.6Very high95.7Very high0 Ų033.3 Ų33.30%018%0.181CC..Hα-helixtrans-59.2-52.9175.7172.50000111.8V45 I267 S284 I285 I286 L290 I291 C292V45-C288 HydrophobicContact CG2-CB 4.09Å; V45-C288 PolarHBondContact N-SG 3.15Å; V45-C288 VanDerWaalsContact N-SG 3.39Å; I267-C288 HydrophobicContact CD1-CB 3.95Å; S284-C288 WeakPolarHBondContact O-CB 3Å; S284-C288 PolarHBondContact O-N 2.6Å; I285-C288 PolarHBondContact O-N 3.18Å; I286-C288 VanDerWaalsContact C-N 3.35Å; I286-C288 PolarHBondContact O-N 3.32Å; C288-L290 VanDerWaalsContact C-N 3.32Å; C288-L290 PolarHBondContact O-N 3.29Å; C288-I291 PolarHBondContact O-N 2.78Å; C288-C292 WeakPolarHBondContact O-CB 3.24Å; C288-C292 PolarHBondContact O-N 3.4Å; C288-C292 PolarHBondContact O-SG 2.87Å
289L96.4Very high96.2Very high5 Ų531.4 Ų31.43%0.02617%0.173CC..Hα-helixtrans-62.5-39.1-178.6-73.2174.1000112.3V81 F261 F264 I285 I286 C292 F293V81-L289 HydrophobicContact CG2-CB 4.25Å; V81-L289 HydrophobicContact CG2-CD1 4.09Å; F261-L289 HydrophobicContact CD1-CD2 4.11Å; F264-L289 HydrophobicContact CB-CD2 4.25Å; F264-L289 HydrophobicContact CB-CG 4.29Å; F264-L289 HydrophobicContact CD1-CD1 4.37Å; F264-L289 HydrophobicContact CD1-CD2 3.69Å; F264-L289 HydrophobicContact CD1-CG 4.34Å; F264-L289 HydrophobicContact CE1-CD2 4.41Å; F264-L289 HydrophobicContact CG-CD1 4.4Å; F264-L289 HydrophobicContact CG-CD2 4.2Å; F264-L289 HydrophobicContact CG-CG 4.4Å; I285-L289 HydrophobicContact CG2-CD1 4.06Å; I285-L289 WeakPolarHBondContact O-CG 3.43Å; I285-L289 PolarHBondContact O-N 3.12Å; I286-L289 PolarHBondContact O-N 3.48Å; L289-C292 PolarHBondContact O-N 3.18Å; L289-F293 VanDerWaalsContact O-CB 3.31Å; L289-F293 WeakPolarHBondContact O-CB 3.4Å; L289-F293 PolarHBondContact O-N 2.79Å
290L96.5Very high96.5Very high97 Ų9729 Ų2951%0.50816%0.158SC..Hα-helixtrans-64.5-47.1176.9-179.562.8000112I286 G287 C288 C292 F293 L294I286-L290 WeakPolarHBondContact O-CB 3.46Å; I286-L290 PolarHBondContact O-N 3.29Å; G287-L290 PolarHBondContact O-N 3.4Å; C288-L290 VanDerWaalsContact C-N 3.32Å; C288-L290 PolarHBondContact O-N 3.29Å; L290-C292 VanDerWaalsContact C-N 3.34Å; L290-C292 PolarHBondContact O-N 3.22Å; L290-F293 PolarHBondContact O-N 3.42Å; L290-L294 HydrophobicContact CG-CD1 4.49Å; L290-L294 WeakPolarHBondContact O-CG 3.49Å; L290-L294 PolarHBondContact O-N 3.38Å
291I97.5Very high96.6Very high60 Ų6030.7 Ų30.731%0.30817%0.168SC..Hα-helixtrans-62.1-44.7177.9-68.5165.8000110.2T41 V45 L200 G287 C288 F293 L294 A295T41-I291 HydrophobicContact CG2-CD1 4.07Å; V45-I291 HydrophobicContact CG1-CG2 3.87Å; V45-I291 HydrophobicContact CG2-CB 3.98Å; V45-I291 HydrophobicContact CG2-CD1 4.04Å; V45-I291 HydrophobicContact CG2-CG2 3.98Å; L200-I291 HydrophobicContact CD2-CG2 4.02Å; G287-I291 WeakPolarHBondContact O-CD1 3.46Å; G287-I291 VanDerWaalsContact O-CG1 3.27Å; G287-I291 WeakPolarHBondContact O-CG1 3.38Å; G287-I291 PolarHBondContact O-N 2.95Å; C288-I291 PolarHBondContact O-N 2.78Å; I291-F293 VanDerWaalsContact C-N 3.34Å; I291-F293 PolarHBondContact O-N 3.38Å; I291-L294 PolarHBondContact O-N 3.28Å; I291-A295 WeakPolarHBondContact O-CB 3.31Å; I291-A295 PolarHBondContact O-N 2.87Å
292C96.9Very high96.8Very high0 Ų030.6 Ų30.60%017%0.167CC..Hα-helixtrans-62.5-42.1177.9-64.50000111.6T48 L49 F261 C288 L289 L290 L294 A295 Y296T48-C292 HydrophobicContact CG2-CB 4.17Å; L49-C292 HydrophobicContact CD2-CB 4.2Å; F261-C292 HydrophobicContact CD1-CB 4.09Å; F261-C292 HydrophobicContact CE1-CB 3.88Å; C288-C292 WeakPolarHBondContact O-CB 3.24Å; C288-C292 PolarHBondContact O-N 3.4Å; C288-C292 PolarHBondContact O-SG 2.87Å; L289-C292 PolarHBondContact O-N 3.18Å; L290-C292 VanDerWaalsContact C-N 3.34Å; L290-C292 PolarHBondContact O-N 3.22Å; C292-L294 PolarHBondContact O-N 3.38Å; C292-A295 PolarHBondContact O-N 3.29Å; C292-Y296 HydrophobicContact CB-CD2 4.22Å; C292-Y296 HydrophobicContact CB-CE2 4.22Å; C292-Y296 WeakPolarHBondContact O-CB 3.39Å; C292-Y296 WeakPolarHBondContact O-CD2 3.33Å; C292-Y296 PolarHBondContact O-N 3.48Å
293F96Very high96.8Very high62 Ų6230.4 Ų30.427%0.27217%0.166SC..Hα-helixtrans-59.4-47.6177.3164.4-112.4000112L74 A77 F261 L289 L290 I291 G297L74-F293 HydrophobicContact CB-CE2 4.34Å; L74-F293 HydrophobicContact CD1-CE2 3.53Å; L74-F293 HydrophobicContact CD1-CZ 3.67Å; A77-F293 HydrophobicContact CB-CB 4.01Å; A77-F293 HydrophobicContact CB-CD2 3.45Å; A77-F293 VanDerWaalsContact CB-CD2 3.45Å; A77-F293 HydrophobicContact CB-CE2 4.26Å; A77-F293 HydrophobicContact CB-CG 3.98Å; F261-F293 HydrophobicContact CE1-CB 4.08Å; F261-F293 HydrophobicContact CZ-CB 4.22Å; L289-F293 VanDerWaalsContact O-CB 3.31Å; L289-F293 WeakPolarHBondContact O-CB 3.4Å; L289-F293 PolarHBondContact O-N 2.79Å; L290-F293 PolarHBondContact O-N 3.42Å; I291-F293 VanDerWaalsContact C-N 3.34Å; I291-F293 PolarHBondContact O-N 3.38Å; F293-G297 PolarHBondContact O-N 2.94Å
294L96.9Very high96.8Very high88 Ų8826.1 Ų26.146%0.46114%0.144SC..Hα-helixtrans-63.7-44.9177.9-66.8174.8000111.4L290 I291 C292 L298L290-L294 HydrophobicContact CG-CD1 4.49Å; L290-L294 WeakPolarHBondContact O-CG 3.49Å; L290-L294 PolarHBondContact O-N 3.38Å; I291-L294 PolarHBondContact O-N 3.28Å; C292-L294 PolarHBondContact O-N 3.38Å; L294-L298 WeakPolarHBondContact O-CB 3.31Å; L294-L298 WeakPolarHBondContact O-CG 3.34Å; L294-L298 PolarHBondContact O-N 3.24Å
295A97.3Very high96.8Very high7 Ų727 Ų276%0.05815%0.148CC..Hα-helixtrans-61.2-51.7178.900000111.9L49 I203 I291 C292 I299L49-A295 HydrophobicContact CD2-CB 3.62Å; I203-A295 HydrophobicContact CG2-CB 4.23Å; I291-A295 WeakPolarHBondContact O-CB 3.31Å; I291-A295 PolarHBondContact O-N 2.87Å; C292-A295 PolarHBondContact O-N 3.29Å; A295-I299 VanDerWaalsContact O-CB 3.27Å; A295-I299 WeakPolarHBondContact O-CB 3.49Å; A295-I299 WeakPolarHBondContact O-CG1 3.31Å; A295-I299 PolarHBondContact O-N 3.47Å
296Y97.2Very high96.7Very high0 Ų027.2 Ų27.20%015%0.15CC..Hα-helixtrans-62.6-45.5178.9-78-58.4000112.6T48 L49 G52 V53 V57 F73 A260 F261 C292 S300T48-Y296 PolarHBondContact O-OH 3.23Å; L49-Y296 HydrophobicContact CD2-CD2 4.41Å; L49-Y296 HydrophobicContact CD2-CE2 4.06Å; L49-Y296 PolarHBondContact O-OH 3.47Å; G52-Y296 VanDerWaalsContact C-CE1 3.48Å; G52-Y296 WeakPolarHBondContact CA-OH 3.37Å; V53-Y296 HydrophobicContact CB-CD1 4.32Å; V53-Y296 HydrophobicContact CB-CE1 3.89Å; V53-Y296 HydrophobicContact CG2-CD1 4.42Å; V53-Y296 HydrophobicContact CG2-CE1 4.48Å; V57-Y296 HydrophobicContact CG2-CD1 3.91Å; V57-Y296 HydrophobicContact CG2-CE1 4.39Å; F73-Y296 HydrophobicContact CD1-CD1 4.06Å; F73-Y296 HydrophobicContact CD1-CD2 4.28Å; F73-Y296 AromaticContact CD1-CG 3.74Å; F73-Y296 HydrophobicContact CD1-CG 3.74Å; F73-Y296 AromaticContact CE1-CD1 3.4Å; F73-Y296 HydrophobicContact CE1-CD1 3.4Å; F73-Y296 VanDerWaalsContact CE1-CD1 3.4Å; F73-Y296 HydrophobicContact CE1-CD2 4.16Å; F73-Y296 AromaticContact CE1-CE1 3.92Å; F73-Y296 HydrophobicContact CE1-CE1 3.92Å; F73-Y296 AromaticContact CE1-CG 3.55Å; F73-Y296 HydrophobicContact CE1-CG 3.55Å; F73-Y296 AromaticContact CZ-CD1 3.68Å; F73-Y296 HydrophobicContact CZ-CD1 3.68Å; F73-Y296 HydrophobicContact CZ-CE1 4.21Å; F73-Y296 HydrophobicContact CZ-CG 4.22Å; A260-Y296 HydrophobicContact CB-CE1 3.89Å; A260-Y296 HydrophobicContact CB-CE2 3.88Å; A260-Y296 WeakPolarHBondContact CB-OH 3.34Å; A260-Y296 WeakPolarHBondContact O-CE2 3.34Å; A260-Y296 PolarHBondContact O-OH 3.46Å; F261-Y296 HydrophobicContact CE1-CD2 4.05Å; F261-Y296 HydrophobicContact CE2-CD2 4.25Å; F261-Y296 AromaticContact CZ-CD2 3.85Å; F261-Y296 HydrophobicContact CZ-CD2 3.85Å; C292-Y296 HydrophobicContact CB-CD2 4.22Å; C292-Y296 HydrophobicContact CB-CE2 4.22Å; C292-Y296 WeakPolarHBondContact O-CB 3.39Å; C292-Y296 WeakPolarHBondContact O-CD2 3.33Å; C292-Y296 PolarHBondContact O-N 3.48Å; Y296-S300 WeakPolarHBondContact O-CB 3.43Å; Y296-S300 PolarHBondContact O-N 3.22Å; Y296-S300 PolarHBondContact O-OG 3.38Å
297G96.4Very high96.6Very high12 Ų1223.7 Ų23.712%0.12413%0.132CC..Hα-helixtrans-62.8-47.8179.100000112.1F293 S300 V301F293-G297 PolarHBondContact O-N 2.94Å; G297-S300 WeakPolarHBondContact O-CB 3.47Å; G297-S300 PolarHBondContact O-N 3.14Å; G297-V301 WeakPolarHBondContact O-CG2 3.31Å; G297-V301 PolarHBondContact O-N 3.25Å
298L97.6Very high96.4Very high80 Ų8023.8 Ų23.842%0.41913%0.128SC..Hα-helixtrans-70.6-37.8-178.6-67.4172.6000112.6I207 L294 S300 V301 T302I207-L298 HydrophobicContact CD1-CB 3.58Å; I207-L298 HydrophobicContact CD1-CD1 4.06Å; I207-L298 HydrophobicContact CD1-CG 4.49Å; I207-L298 HydrophobicContact CG1-CB 3.98Å; I207-L298 HydrophobicContact CG2-CB 4.29Å; L294-L298 WeakPolarHBondContact O-CB 3.31Å; L294-L298 WeakPolarHBondContact O-CG 3.34Å; L294-L298 PolarHBondContact O-N 3.24Å; L298-S300 VanDerWaalsContact C-N 3.34Å; L298-V301 PolarHBondContact O-N 3.31Å; L298-T302 VanDerWaalsContact O-CB 3.31Å; L298-T302 WeakPolarHBondContact O-CB 3.46Å; L298-T302 PolarHBondContact O-N 2.98Å; L298-T302 PolarHBondContact O-OG1 3.01Å
299I97Very high96.2Very high1 Ų123.8 Ų23.81%0.00513%0.129CC..Hα-helixtrans-65.4-40173.7-70.7-73.6000110.7V53 V57 I203 V206 I207 A295 T302 L303 L318V53-I299 HydrophobicContact CG2-CB 4.19Å; V53-I299 HydrophobicContact CG2-CG1 3.81Å; V53-I299 HydrophobicContact CG2-CG2 4.18Å; V57-I299 HydrophobicContact CB-CG2 4.43Å; V57-I299 HydrophobicContact CG1-CG2 4.15Å; V57-I299 HydrophobicContact CG2-CG2 4.24Å; I203-I299 HydrophobicContact CG2-CD1 4.18Å; I203-I299 HydrophobicContact CG2-CG1 4.07Å; V206-I299 HydrophobicContact CB-CD1 3.92Å; V206-I299 HydrophobicContact CG1-CD1 3.4Å; V206-I299 VanDerWaalsContact CG1-CD1 3.4Å; I207-I299 HydrophobicContact CD1-CD1 4.42Å; I207-I299 HydrophobicContact CD1-CG1 4.37Å; I207-I299 HydrophobicContact CG1-CD1 3.83Å; I207-I299 HydrophobicContact CG1-CG1 4.18Å; A295-I299 VanDerWaalsContact O-CB 3.27Å; A295-I299 WeakPolarHBondContact O-CB 3.49Å; A295-I299 WeakPolarHBondContact O-CG1 3.31Å; A295-I299 PolarHBondContact O-N 3.47Å; I299-T302 PolarHBondContact O-N 2.93Å; I299-L303 VanDerWaalsContact O-CB 3.29Å; I299-L303 WeakPolarHBondContact O-CB 3.28Å; I299-L303 PolarHBondContact O-N 2.91Å; I299-L318 HydrophobicContact CD1-CD1 4.45Å; I299-L318 HydrophobicContact CG2-CD1 4.2Å; I299-L318 HydrophobicContact CG2-CD2 4.12Å
300S97.2Very high95.8Very high0 Ų025.3 Ų25.30%013%0.134CC..Hα-helixtrans-59.7-46.3174.7-66.70000112.3V57 F73 Y296 G297 L298 T304V57-S300 WeakPolarHBondContact CG1-OG 3.4Å; F73-S300 WeakPolarHBondContact CD2-OG 3.37Å; F73-S300 WeakPolarHBondContact CE2-OG 3.37Å; Y296-S300 WeakPolarHBondContact O-CB 3.43Å; Y296-S300 PolarHBondContact O-N 3.22Å; Y296-S300 PolarHBondContact O-OG 3.38Å; G297-S300 WeakPolarHBondContact O-CB 3.47Å; G297-S300 PolarHBondContact O-N 3.14Å; L298-S300 VanDerWaalsContact C-N 3.34Å; S300-T304 WeakPolarHBondContact O-CB 3.41Å; S300-T304 VanDerWaalsContact O-CG2 3.29Å; S300-T304 WeakPolarHBondContact O-CG2 3.48Å; S300-T304 PolarHBondContact O-N 3.42Å; S300-T304 PolarHBondContact O-OG1 2.62Å
301V97.2Very high95.5Very high36 Ų3621.8 Ų21.822%0.21812%0.119CC..Hα-helixtrans-59.8-51.6173.8170.70000110.4I70 L211 G297 L298 T304 L305I70-V301 HydrophobicContact CD1-CB 4.36Å; I70-V301 HydrophobicContact CD1-CG2 3.56Å; I70-V301 HydrophobicContact CG1-CG2 3.84Å; I70-V301 HydrophobicContact CG2-CG2 4.2Å; L211-V301 HydrophobicContact CD2-CG1 4.46Å; G297-V301 WeakPolarHBondContact O-CG2 3.31Å; G297-V301 PolarHBondContact O-N 3.25Å; L298-V301 PolarHBondContact O-N 3.31Å; V301-T304 PolarHBondContact O-OG1 3.47Å; V301-L305 HydrophobicContact CG1-CD1 3.59Å; V301-L305 HydrophobicContact CG1-CG 4.48Å; V301-L305 WeakPolarHBondContact O-CB 3.28Å; V301-L305 VanDerWaalsContact O-CG 3.27Å; V301-L305 WeakPolarHBondContact O-CG 3.08Å; V301-L305 PolarHBondContact O-N 2.9Å
302T96.9Very high95.2Very high0 Ų019.1 Ų19.10%011%0.105CC..Hα-helixtrans-60.9-51-175.3-56.30000111.5L298 I299 T304 L305 M306L298-T302 VanDerWaalsContact O-CB 3.31Å; L298-T302 WeakPolarHBondContact O-CB 3.46Å; L298-T302 PolarHBondContact O-N 2.98Å; L298-T302 PolarHBondContact O-OG1 3.01Å; I299-T302 PolarHBondContact O-N 2.93Å; T302-T304 PolarHBondContact O-N 2.73Å; T302-L305 PolarHBondContact O-N 3.31Å; T302-M306 HydrophobicContact CG2-CG 4.43Å; T302-M306 HydrophobicContact CG2-SD 4.11Å; T302-M306 VanDerWaalsContact O-CG 3.31Å; T302-M306 WeakPolarHBondContact O-CG 3.27Å; T302-M306 PolarHBondContact O-N 3.27Å
303L96.4Very high94.7Very high1 Ų120.3 Ų20.31%0.00511%0.114CC..Hα-helixtrans-62.7-46.3-176.9176.162.6000112V57 I299 L305 M306 V307 I312 A317 L318 A321V57-L303 HydrophobicContact CG1-CD2 4.15Å; I299-L303 VanDerWaalsContact O-CB 3.29Å; I299-L303 WeakPolarHBondContact O-CB 3.28Å; I299-L303 PolarHBondContact O-N 2.91Å; L303-L305 VanDerWaalsContact C-N 3.28Å; L303-L305 PolarHBondContact O-N 2.96Å; L303-M306 PolarHBondContact O-N 2.99Å; L303-V307 PolarHBondContact O-N 3.05Å; L303-I312 HydrophobicContact CD1-CD1 4.46Å; L303-I312 HydrophobicContact CD1-CG1 4.44Å; L303-I312 HydrophobicContact CD2-CD1 4.12Å; L303-I312 HydrophobicContact CD2-CG2 4.19Å; L303-I312 HydrophobicContact CG-CD1 3.92Å; L303-I312 HydrophobicContact CG-CG1 4.43Å; L303-A317 HydrophobicContact CD1-CB 4.46Å; L303-A317 HydrophobicContact CD2-CB 3.93Å; L303-L318 HydrophobicContact CB-CD2 4.29Å; L303-L318 HydrophobicContact CD1-CD2 4.2Å; L303-A321 HydrophobicContact CD1-CB 3.9Å
304T96.1Very high93.7Very high1 Ų119.2 Ų19.21%0.00611%0.114CC..Hα-helixtrans-73.9-20.4-177.260.10000113.1A61 V69 W219 S300 V301 T302 I312A61-T304 HydrophobicContact CB-CG2 4.06Å; V69-T304 HydrophobicContact CG1-CG2 4.02Å; W219-T304 PolarHBondContact NE1-O 3.49Å; W219-T304 PolarHBondContact NE1-OG1 3.21Å; W219-T304 VanDerWaalsContact NE1-OG1 3.15Å; S300-T304 WeakPolarHBondContact O-CB 3.41Å; S300-T304 VanDerWaalsContact O-CG2 3.29Å; S300-T304 WeakPolarHBondContact O-CG2 3.48Å; S300-T304 PolarHBondContact O-N 3.42Å; S300-T304 PolarHBondContact O-OG1 2.62Å; V301-T304 PolarHBondContact O-OG1 3.47Å; T302-T304 PolarHBondContact O-N 2.73Å; T304-I312 HydrophobicContact CG2-CD1 4.47Å
305L96.6Very high92.5Very high17 Ų1720.3 Ų20.39%0.08912%0.124CC..Hα-helixtrans-85-29.8170.4-73.8172.8000113L211 A214 N215 I216 N218 W219 V301 T302 L303L211-L305 HydrophobicContact CD2-CD1 4.47Å; A214-L305 HydrophobicContact CB-CB 3.71Å; A214-L305 HydrophobicContact CB-CD1 4.06Å; A214-L305 HydrophobicContact CB-CG 4.44Å; N215-L305 PolarHBondContact N-O 2.94Å; I216-L305 HydrophobicContact CD1-CD2 3.87Å; N218-L305 PolarHBondContact ND2-O 3.21Å; W219-L305 HydrophobicContact CD2-CD2 3.88Å; W219-L305 VanDerWaalsContact CE2-CD2 3.46Å; W219-L305 HydrophobicContact CE3-CD2 4.49Å; W219-L305 HydrophobicContact CG-CD2 4.25Å; W219-L305 HydrophobicContact CH2-CD2 4.37Å; W219-L305 HydrophobicContact CZ2-CD1 4.08Å; W219-L305 HydrophobicContact CZ2-CD2 3.75Å; W219-L305 HydrophobicContact CZ2-CG 3.68Å; V301-L305 HydrophobicContact CG1-CD1 3.59Å; V301-L305 HydrophobicContact CG1-CG 4.48Å; V301-L305 WeakPolarHBondContact O-CB 3.28Å; V301-L305 VanDerWaalsContact O-CG 3.27Å; V301-L305 WeakPolarHBondContact O-CG 3.08Å; V301-L305 PolarHBondContact O-N 2.9Å; T302-L305 PolarHBondContact O-N 3.31Å; L303-L305 VanDerWaalsContact C-N 3.28Å; L303-L305 PolarHBondContact O-N 2.96Å
306M94.5Very high91.9Very high5 Ų521.4 Ų21.43%0.02513%0.133CC..Hα-helixtrans-73-42.9175.9-76.7-177.977.900111.9G210 N218 T302 L303 F322 H325G210-M306 WeakPolarHBondContact CA-SD 3.32Å; G210-M306 VanDerWaalsContact O-CG 3.24Å; G210-M306 WeakPolarHBondContact O-CG 3.33Å; N218-M306 PolarHBondContact ND2-O 3.27Å; T302-M306 HydrophobicContact CG2-CG 4.43Å; T302-M306 HydrophobicContact CG2-SD 4.11Å; T302-M306 VanDerWaalsContact O-CG 3.31Å; T302-M306 WeakPolarHBondContact O-CG 3.27Å; T302-M306 PolarHBondContact O-N 3.27Å; L303-M306 PolarHBondContact O-N 2.99Å; M306-F322 HydrophobicContact CE-CD1 4.12Å; M306-F322 HydrophobicContact CE-CD2 3.81Å; M306-F322 HydrophobicContact CE-CE1 4.02Å; M306-F322 HydrophobicContact CE-CE2 3.72Å; M306-F322 HydrophobicContact CE-CG 4.02Å; M306-F322 HydrophobicContact CE-CZ 3.84Å; M306-F322 HydrophobicContact SD-CD2 4.21Å; M306-F322 HydrophobicContact SD-CE2 3.6Å; M306-F322 HydrophobicContact SD-CZ 3.79Å; M306-H325 PolarHBondContact O-CE1 3.46Å
307V93.4Very high91.5Very high5 Ų521.5 Ų21.53%0.0313%0.134CC..SBendtrans-132.1133.2-172.1-178.70000109.1L303 Y309 A311 I312 A321L303-V307 PolarHBondContact O-N 3.05Å; V307-Y309 PolarHBondContact O-N 2.73Å; V307-A311 HydrophobicContact CG1-CB 3.85Å; V307-I312 HydrophobicContact CB-CG1 4.31Å; V307-I312 HydrophobicContact CG1-CG1 4.17Å; V307-A321 HydrophobicContact CG2-CB 3.66Å
308P93Very high91.3Very high22 Ų2221.1 Ų21.114%0.14313%0.129CC..  trans-60.3139174.226.9-34.8000110Y310 A311P308-Y310 VanDerWaalsContact C-N 3.27Å; P308-Y310 HydrophobicContact CB-CD1 4.14Å; P308-Y310 HydrophobicContact CB-CE1 3.56Å; P308-Y310 HydrophobicContact CB-CE2 4.4Å; P308-Y310 HydrophobicContact CG-CE1 4.14Å; P308-Y310 HydrophobicContact CG-CE2 4.12Å; P308-Y310 PolarHBondContact O-N 3.35Å; P308-Y310 VanDerWaalsContact O-N 3.08Å; P308-A311 HydrophobicContact CG-CB 4.07Å; P308-A311 PolarHBondContact O-N 3.39Å
309Y92.4Very high91Very high1 Ų118 Ų180%0.00411%0.113CC..G310 helixtrans-54.9-38-164.575.2-81.7000114.3P223 L237 G240 P244 F245 V307 A311 I312P223-Y309 HydrophobicContact CG-CE1 4.41Å; P223-Y309 WeakPolarHBondContact CG-OH 3.36Å; L237-Y309 WeakPolarHBondContact O-CE2 3.4Å; L237-Y309 PolarHBondContact O-OH 3.28Å; G240-Y309 PolarHBondContact N-OH 3.22Å; P244-Y309 HydrophobicContact CB-CE1 4.09Å; P244-Y309 HydrophobicContact CB-CE2 3.87Å; P244-Y309 WeakPolarHBondContact CB-OH 3.22Å; P244-Y309 HydrophobicContact CG-CD1 4.43Å; P244-Y309 HydrophobicContact CG-CD2 4.14Å; P244-Y309 HydrophobicContact CG-CE1 4.14Å; P244-Y309 HydrophobicContact CG-CE2 3.83Å; P244-Y309 HydrophobicContact CG-CG 4.44Å; F245-Y309 HydrophobicContact CE2-CE2 4.24Å; F245-Y309 HydrophobicContact CZ-CE2 4.45Å; V307-Y309 PolarHBondContact O-N 2.73Å; Y309-A311 PolarHBondContact O-N 3.48Å; Y309-I312 WeakPolarHBondContact O-CB 3.38Å; Y309-I312 PolarHBondContact O-N 3.19Å
310Y88.9Confident90.7Very high36 Ų3620.9 Ų20.914%0.14113%0.129CC..G310 helixtrans-64.6-25.9179.557.1-98.7000113K62 V221 P223 L227 P308K62-Y310 WeakPolarHBondContact CE-O 3.47Å; V221-Y310 HydrophobicContact CB-CE1 4.24Å; V221-Y310 HydrophobicContact CG1-CE1 3.67Å; P223-Y310 HydrophobicContact CB-CD1 4.43Å; P223-Y310 HydrophobicContact CG-CD1 4.07Å; L227-Y310 HydrophobicContact CD1-CD2 3.87Å; L227-Y310 HydrophobicContact CD1-CE2 4.12Å; L227-Y310 HydrophobicContact CD1-CG 4.27Å; P308-Y310 VanDerWaalsContact C-N 3.27Å; P308-Y310 HydrophobicContact CB-CD1 4.14Å; P308-Y310 HydrophobicContact CB-CE1 3.56Å; P308-Y310 HydrophobicContact CB-CE2 4.4Å; P308-Y310 HydrophobicContact CG-CE1 4.14Å; P308-Y310 HydrophobicContact CG-CE2 4.12Å; P308-Y310 PolarHBondContact O-N 3.35Å; P308-Y310 VanDerWaalsContact O-N 3.08Å
311A89.5Confident90.5Very high24 Ų2421.1 Ų21.120%0.19813%0.13CC..G310 helixtrans-91.4-7.9-178.400000112.6V307 P308 Y309 R324V307-A311 HydrophobicContact CG1-CB 3.85Å; P308-A311 HydrophobicContact CG-CB 4.07Å; P308-A311 PolarHBondContact O-N 3.39Å; Y309-A311 PolarHBondContact O-N 3.48Å; A311-R324 VanDerWaalsContact CB-NH1 3.31Å; A311-R324 PolarHBondContact O-NH1 3.37Å; A311-R324 PolarHBondContact O-NH2 3.42Å
312I92Very high90.3Very high3 Ų319.4 Ų19.42%0.01512%0.12CC..  trans-58.2142.2177.2-64.8173.7000109.7A61 K62 L303 T304 V307 Y309 A317A61-I312 HydrophobicContact CB-CD1 3.86Å; K62-I312 HydrophobicContact CB-CB 4.44Å; K62-I312 WeakPolarHBondContact CD-O 3.49Å; K62-I312 VanDerWaalsContact CE-O 3.32Å; K62-I312 WeakPolarHBondContact CE-O 3.02Å; K62-I312 PolarHBondContact NZ-O 2.89Å; L303-I312 HydrophobicContact CD1-CD1 4.46Å; L303-I312 HydrophobicContact CD1-CG1 4.44Å; L303-I312 HydrophobicContact CD2-CD1 4.12Å; L303-I312 HydrophobicContact CD2-CG2 4.19Å; L303-I312 HydrophobicContact CG-CD1 3.92Å; L303-I312 HydrophobicContact CG-CG1 4.43Å; T304-I312 HydrophobicContact CG2-CD1 4.47Å; V307-I312 HydrophobicContact CB-CG1 4.31Å; V307-I312 HydrophobicContact CG1-CG1 4.17Å; Y309-I312 WeakPolarHBondContact O-CB 3.38Å; Y309-I312 PolarHBondContact O-N 3.19Å; I312-A317 HydrophobicContact CG2-CB 3.86Å
313S85.9Confident89.9Confident26 Ų2620.5 Ų20.518%0.18213%0.128CC..  trans-83.3131.6171.2179.60000109.3V315 A316 A317S313-V315 PolarHBondContact OG-N 3.47Å; S313-A316 PolarHBondContact OG-N 2.93Å; S313-A317 WeakPolarHBondContact O-CA 3.46Å; S313-A317 VanDerWaalsContact O-CB 3.27Å; S313-A317 WeakPolarHBondContact O-CB 3.35Å; S313-A317 PolarHBondContact O-N 3.27Å
314S75Confident89.4Confident38 Ų3827 Ų2727%0.26615%0.152SC..SBendtrans-75.1-26.4176.350.70000112.8
315V72.7Confident89.2Confident112 Ų11230.2 Ų30.268%0.67917%0.167SC*.SBendtrans-88.5-38.9-177.2-173.20000111.6S313S313-V315 PolarHBondContact OG-N 3.47Å
316A83.6Confident88.8Confident30 Ų3032 Ų3225%0.24819%0.19CC..SBendtrans-140.859.3-173.400000111.2S313 L318 P319 L320S313-A316 PolarHBondContact OG-N 2.93Å; A316-L318 PolarHBondContact O-N 3.06Å; A316-P319 HydrophobicContact CB-CG 4.5Å; A316-P319 WeakPolarHBondContact O-CD 3.45Å; A316-L320 WeakPolarHBondContact O-CB 3.45Å; A316-L320 PolarHBondContact O-N 3.35Å; A316-L320 VanDerWaalsContact O-N 3.15Å
317A89.8Confident88.6Confident2 Ų232.8 Ų32.82%0.01719%0.194CC..Hα-helixtrans-53.5-54.5-171.800000113.3L303 I312 S313 A321L303-A317 HydrophobicContact CD1-CB 4.46Å; L303-A317 HydrophobicContact CD2-CB 3.93Å; I312-A317 HydrophobicContact CG2-CB 3.86Å; S313-A317 WeakPolarHBondContact O-CA 3.46Å; S313-A317 VanDerWaalsContact O-CB 3.27Å; S313-A317 WeakPolarHBondContact O-CB 3.35Å; S313-A317 PolarHBondContact O-N 3.27Å; A317-A321 WeakPolarHBondContact O-CB 3.21Å; A317-A321 PolarHBondContact O-N 3.35Å; A317-A321 VanDerWaalsContact O-N 3.14Å
318L92.5Very high88.4Confident3 Ų337.4 Ų37.42%0.01622%0.215CC..Hα-helixtrans-72.3-52.7-177-62.3172.1000112.7Y54 V206 I299 L303 A316 L320 A321 F322 I334Y54-L318 HydrophobicContact CD1-CD1 3.88Å; Y54-L318 HydrophobicContact CE1-CD1 4.24Å; V206-L318 HydrophobicContact CG1-CD1 4.35Å; V206-L318 HydrophobicContact CG1-CD2 3.86Å; I299-L318 HydrophobicContact CD1-CD1 4.45Å; I299-L318 HydrophobicContact CG2-CD1 4.2Å; I299-L318 HydrophobicContact CG2-CD2 4.12Å; L303-L318 HydrophobicContact CB-CD2 4.29Å; L303-L318 HydrophobicContact CD1-CD2 4.2Å; A316-L318 PolarHBondContact O-N 3.06Å; L318-L320 VanDerWaalsContact C-N 3.32Å; L318-L320 PolarHBondContact O-N 3.31Å; L318-A321 PolarHBondContact O-N 3.46Å; L318-F322 WeakPolarHBondContact O-CD2 3.41Å; L318-F322 PolarHBondContact O-N 3.48Å; L318-I334 HydrophobicContact CB-CG2 3.71Å
319P91.3Very high88.3Confident14 Ų1443.1 Ų43.19%0.09123%0.234CC..Hα-helixtrans-60.4-39.9-177.1-21.331.8000113.3A316 S323 K331 I334A316-P319 HydrophobicContact CB-CG 4.5Å; A316-P319 WeakPolarHBondContact O-CD 3.45Å; P319-S323 WeakPolarHBondContact O-CB 3.34Å; P319-S323 PolarHBondContact O-N 3.19Å; P319-K331 HydrophobicContact CB-CB 4.32Å; P319-K331 HydrophobicContact CB-CG 3.66Å; P319-I334 HydrophobicContact CG-CB 4.28Å; P319-I334 HydrophobicContact CG-CG2 3.78Å
320L89.3Confident88.3Confident63 Ų6343 Ų4333%0.3323%0.234SC..Hα-helixtrans-73.9-32178.7-116.566.2000112.7A316 L318 F322 S323 R324A316-L320 WeakPolarHBondContact O-CB 3.45Å; A316-L320 PolarHBondContact O-N 3.35Å; A316-L320 VanDerWaalsContact O-N 3.15Å; L318-L320 VanDerWaalsContact C-N 3.32Å; L318-L320 PolarHBondContact O-N 3.31Å; L320-F322 VanDerWaalsContact C-N 3.3Å; L320-F322 PolarHBondContact O-N 2.84Å; L320-S323 PolarHBondContact O-N 2.92Å; L320-R324 WeakPolarHBondContact O-CG 3.47Å; L320-R324 PolarHBondContact O-N 2.96Å
321A92.9Very high88.2Confident4 Ų443.3 Ų43.33%0.03324%0.236CC..Hα-helixtrans-60.4-40.8174.800000111.9L303 V307 A317 L318 H325L303-A321 HydrophobicContact CD1-CB 3.9Å; V307-A321 HydrophobicContact CG2-CB 3.66Å; A317-A321 WeakPolarHBondContact O-CB 3.21Å; A317-A321 PolarHBondContact O-N 3.35Å; A317-A321 VanDerWaalsContact O-N 3.14Å; L318-A321 PolarHBondContact O-N 3.46Å; A321-H325 PolarHBondContact O-ND1 3.27Å
322F92.7Very high88.2Confident0 Ų048.5 Ų48.50%025%0.251CS..Hα-helixtrans-73.6-40.8175.7-80.2-99.9000112.6V206 T209 M306 L318 L320 R324 H325 G326 L327 A330 I334V206-F322 HydrophobicContact CG1-CE2 3.96Å; V206-F322 HydrophobicContact CG1-CZ 4.2Å; T209-F322 HydrophobicContact CG2-CE1 3.77Å; M306-F322 HydrophobicContact CE-CD1 4.12Å; M306-F322 HydrophobicContact CE-CD2 3.81Å; M306-F322 HydrophobicContact CE-CE1 4.02Å; M306-F322 HydrophobicContact CE-CE2 3.72Å; M306-F322 HydrophobicContact CE-CG 4.02Å; M306-F322 HydrophobicContact CE-CZ 3.84Å; M306-F322 HydrophobicContact SD-CD2 4.21Å; M306-F322 HydrophobicContact SD-CE2 3.6Å; M306-F322 HydrophobicContact SD-CZ 3.79Å; L318-F322 WeakPolarHBondContact O-CD2 3.41Å; L318-F322 PolarHBondContact O-N 3.48Å; L320-F322 VanDerWaalsContact C-N 3.3Å; L320-F322 PolarHBondContact O-N 2.84Å; F322-R324 PolarHBondContact O-N 3.38Å; F322-H325 CarbonylContact O-C 3.54Å; F322-H325 PolarHBondContact O-N 3.14Å; F322-G326 PolarHBondContact O-N 2.93Å; F322-L327 HydrophobicContact CB-CB 4.3Å; F322-L327 HydrophobicContact CD1-CB 4.41Å; F322-L327 HydrophobicContact CD1-CD1 3.76Å; F322-L327 HydrophobicContact CE1-CD1 4.34Å; F322-L327 PolarHBondContact O-N 2.64Å; F322-L327 VanDerWaalsContact O-N 3.09Å; F322-A330 HydrophobicContact CB-CB 4.1Å; F322-A330 HydrophobicContact CD1-CB 3.95Å; F322-A330 HydrophobicContact CG-CB 4.27Å; F322-I334 HydrophobicContact CB-CD1 4.25Å; F322-I334 HydrophobicContact CD1-CD1 4.42Å; F322-I334 HydrophobicContact CD2-CD1 3.49Å; F322-I334 VanDerWaalsContact CD2-CD1 3.49Å; F322-I334 HydrophobicContact CE2-CD1 3.9Å; F322-I334 HydrophobicContact CG-CD1 3.79Å
323S88.7Confident88.3Confident24 Ų2451.3 Ų51.317%0.16827%0.265CS..Hα-helixtrans-56.4-38.7175.9-179.20000112.3P319 L320 H325 G326 Q328P319-S323 WeakPolarHBondContact O-CB 3.34Å; P319-S323 PolarHBondContact O-N 3.19Å; L320-S323 PolarHBondContact O-N 2.92Å; S323-H325 VanDerWaalsContact C-N 3.28Å; S323-H325 PolarHBondContact O-N 2.9Å; S323-G326 PolarHBondContact O-N 3.06Å; S323-Q328 PolarHBondContact O-NE2 3.41Å; S323-Q328 PolarHBondContact OG-NE2 2.87Å; S323-Q328 PolarHBondContact OG-OE1 3.11Å
324R87.2Confident88.7Confident138 Ų13850.1 Ų50.152%0.52126%0.257SS..Hα-helixtrans-65.5-26.8175.5-75.8-175.3-176.9166.46.4114.5A311 L320 F322 G326A311-R324 VanDerWaalsContact CB-NH1 3.31Å; A311-R324 PolarHBondContact O-NH1 3.37Å; A311-R324 PolarHBondContact O-NH2 3.42Å; L320-R324 WeakPolarHBondContact O-CG 3.47Å; L320-R324 PolarHBondContact O-N 2.96Å; F322-R324 PolarHBondContact O-N 3.38Å; R324-G326 PolarHBondContact O-N 3.28Å
325H90.7Very high89.4Confident68 Ų6849.1 Ų49.132%0.31525%0.25SC..THydrogen-bonded Turntrans-8915.6174.1-68.986000112.3Y213 M306 A321 F322 S323 L327Y213-H325 HydrophobicContact CD1-CB 4.22Å; Y213-H325 AromaticContact CD1-CD2 3.73Å; Y213-H325 HydrophobicContact CE1-CB 4.38Å; Y213-H325 HydrophobicContact CG-CB 4.49Å; M306-H325 PolarHBondContact O-CE1 3.46Å; A321-H325 PolarHBondContact O-ND1 3.27Å; F322-H325 CarbonylContact O-C 3.54Å; F322-H325 PolarHBondContact O-N 3.14Å; S323-H325 VanDerWaalsContact C-N 3.28Å; S323-H325 PolarHBondContact O-N 2.9Å; H325-L327 VanDerWaalsContact C-N 3.29Å; H325-L327 PolarHBondContact O-N 3.06Å
326G89.5Confident90.2Very high55 Ų5547.4 Ų47.457%0.56724%0.24SC*.THydrogen-bonded Turntrans81.6-0.6178.700000114.8F322 S323 R324 Q328F322-G326 PolarHBondContact O-N 2.93Å; S323-G326 PolarHBondContact O-N 3.06Å; R324-G326 PolarHBondContact O-N 3.28Å; G326-Q328 VanDerWaalsContact C-N 3.31Å; G326-Q328 PolarHBondContact O-N 2.92Å
327L90.3Very high90.7Very high20 Ų2046 Ų4611%0.10523%0.228CC..  trans-8864.6-178.3-62.1176.2000111.6T209 Y213 F322 H325 W329 A330T209-L327 HydrophobicContact CG2-CD1 4.08Å; Y213-L327 HydrophobicContact CD2-CD1 4.36Å; Y213-L327 HydrophobicContact CE2-CD1 3.56Å; F322-L327 HydrophobicContact CB-CB 4.3Å; F322-L327 HydrophobicContact CD1-CB 4.41Å; F322-L327 HydrophobicContact CD1-CD1 3.76Å; F322-L327 HydrophobicContact CE1-CD1 4.34Å; F322-L327 PolarHBondContact O-N 2.64Å; F322-L327 VanDerWaalsContact O-N 3.09Å; H325-L327 VanDerWaalsContact C-N 3.29Å; H325-L327 PolarHBondContact O-N 3.06Å; L327-W329 VanDerWaalsContact C-N 3.26Å; L327-W329 HydrophobicContact CD2-CZ2 3.95Å; L327-W329 PolarHBondContact O-N 3.48Å; L327-A330 HydrophobicContact CB-CB 3.94Å; L327-A330 WeakPolarHBondContact O-CB 3.34Å; L327-A330 PolarHBondContact O-N 3.38Å; L327-A330 VanDerWaalsContact O-N 3.14Å
328Q87.9Confident90.8Very high102 Ų10246 Ų4648%0.47723%0.229SC..Hα-helixtrans-61.7-34.1-179.8-61.5-61.1-12.200112.8S323 G326 A330 K331S323-Q328 PolarHBondContact O-NE2 3.41Å; S323-Q328 PolarHBondContact OG-NE2 2.87Å; S323-Q328 PolarHBondContact OG-OE1 3.11Å; G326-Q328 VanDerWaalsContact C-N 3.31Å; G326-Q328 PolarHBondContact O-N 2.92Å; Q328-A330 VanDerWaalsContact C-N 3.29Å; Q328-A330 PolarHBondContact O-N 3.5Å; Q328-K331 VanDerWaalsContact O-CB 3.23Å; Q328-K331 WeakPolarHBondContact O-CB 3.33Å; Q328-K331 PolarHBondContact O-N 3.24Å
329W90.7Very high90.9Very high142 Ų14247 Ų4754%0.53823%0.233SC..Hα-helixtrans-66.3-31.4177.561-93000112.5F205 L327 K331 Y332 I333F205-W329 AromaticContact CE2-CH2 3.93Å; F205-W329 HydrophobicContact CE2-CH2 3.93Å; F205-W329 HydrophobicContact CE2-CZ3 4.06Å; F205-W329 AromaticContact CZ-CH2 3.79Å; F205-W329 HydrophobicContact CZ-CH2 3.79Å; F205-W329 AromaticContact CZ-CZ3 3.73Å; F205-W329 HydrophobicContact CZ-CZ3 3.73Å; L327-W329 VanDerWaalsContact C-N 3.26Å; L327-W329 HydrophobicContact CD2-CZ2 3.95Å; L327-W329 PolarHBondContact O-N 3.48Å; W329-K331 VanDerWaalsContact C-N 3.27Å; W329-K331 PolarHBondContact O-N 3.33Å; W329-Y332 PolarHBondContact O-N 3.47Å; W329-I333 HydrophobicContact CE3-CD1 3.6Å; W329-I333 HydrophobicContact CZ3-CD1 3.48Å; W329-I333 VanDerWaalsContact CZ3-CD1 3.48Å
330A92.1Very high91.1Very high0 Ų046.9 Ų46.90%023%0.233CC..Hα-helixtrans-67.8-27.417900000112.1F205 F322 L327 Q328 Y332 I333 I334F205-A330 HydrophobicContact CE1-CB 4.18Å; F205-A330 HydrophobicContact CZ-CB 4.12Å; F322-A330 HydrophobicContact CB-CB 4.1Å; F322-A330 HydrophobicContact CD1-CB 3.95Å; F322-A330 HydrophobicContact CG-CB 4.27Å; L327-A330 HydrophobicContact CB-CB 3.94Å; L327-A330 WeakPolarHBondContact O-CB 3.34Å; L327-A330 PolarHBondContact O-N 3.38Å; L327-A330 VanDerWaalsContact O-N 3.14Å; Q328-A330 VanDerWaalsContact C-N 3.29Å; Q328-A330 PolarHBondContact O-N 3.5Å; A330-Y332 VanDerWaalsContact C-N 3.26Å; A330-Y332 PolarHBondContact O-N 3.38Å; A330-I333 PolarHBondContact O-N 3.44Å; A330-I334 VanDerWaalsContact O-CG1 3.23Å; A330-I334 WeakPolarHBondContact O-CG1 3.39Å; A330-I334 PolarHBondContact O-N 3.48Å
331K88.1Confident91.4Very high42 Ų4243.9 Ų43.918%0.18322%0.217CC..Hα-helixtrans-50-48.5173-174.9-164171.6-175.40110.8P319 Q328 W329 I334 S335P319-K331 HydrophobicContact CB-CB 4.32Å; P319-K331 HydrophobicContact CB-CG 3.66Å; Q328-K331 VanDerWaalsContact O-CB 3.23Å; Q328-K331 WeakPolarHBondContact O-CB 3.33Å; Q328-K331 PolarHBondContact O-N 3.24Å; W329-K331 VanDerWaalsContact C-N 3.27Å; W329-K331 PolarHBondContact O-N 3.33Å; K331-I334 PolarHBondContact O-N 3.08Å; K331-S335 WeakPolarHBondContact O-CB 3.5Å; K331-S335 PolarHBondContact O-N 3.24Å; K331-S335 PolarHBondContact O-OG 3.09Å; K331-S335 VanDerWaalsContact O-OG 3.09Å
332Y90Very high91.4Very high132 Ų13243.8 Ų43.852%0.51822%0.216SC..Hα-helixtrans-68.7-38.3-176.3-60.5-73.1000112.9I142 W329 A330 T336I142-Y332 HydrophobicContact CG2-CD1 4.44Å; I142-Y332 HydrophobicContact CG2-CE1 4.48Å; W329-Y332 PolarHBondContact O-N 3.47Å; A330-Y332 VanDerWaalsContact C-N 3.26Å; A330-Y332 PolarHBondContact O-N 3.38Å; Y332-T336 WeakPolarHBondContact O-CB 3.33Å; Y332-T336 PolarHBondContact O-N 3Å; Y332-T336 PolarHBondContact O-OG1 3.09Å
333I93.5Very high91.6Very high63 Ų6344.2 Ų44.232%0.32322%0.219SC..Hα-helixtrans-63.7-47.4176.3-62.1176.6000110.1V202 F205 W329 A330 T336 G337V202-I333 HydrophobicContact CG1-CG2 4.47Å; V202-I333 HydrophobicContact CG2-CG2 4.16Å; F205-I333 HydrophobicContact CD1-CG2 4.11Å; F205-I333 HydrophobicContact CE1-CG2 4.21Å; F205-I333 HydrophobicContact CZ-CD1 4.39Å; W329-I333 HydrophobicContact CE3-CD1 3.6Å; W329-I333 HydrophobicContact CZ3-CD1 3.48Å; W329-I333 VanDerWaalsContact CZ3-CD1 3.48Å; A330-I333 PolarHBondContact O-N 3.44Å; I333-T336 WeakPolarHBondContact O-CB 3.43Å; I333-T336 PolarHBondContact O-N 3.4Å; I333-G337 PolarHBondContact O-N 3.44Å
334I93.3Very high91.9Very high0 Ų043 Ų430%021%0.211CC..Hα-helixtrans-65.2-44.4-178.8-62.5169000110.6Y54 F205 V206 L318 P319 F322 A330 K331 T336 G337 A338Y54-I334 HydrophobicContact CD1-CG2 4.18Å; Y54-I334 HydrophobicContact CE1-CG2 3.95Å; F205-I334 HydrophobicContact CE1-CG1 4.46Å; V206-I334 HydrophobicContact CG2-CD1 3.89Å; V206-I334 HydrophobicContact CG2-CG1 3.64Å; V206-I334 HydrophobicContact CG2-CG2 4.47Å; L318-I334 HydrophobicContact CB-CG2 3.71Å; P319-I334 HydrophobicContact CG-CB 4.28Å; P319-I334 HydrophobicContact CG-CG2 3.78Å; F322-I334 HydrophobicContact CB-CD1 4.25Å; F322-I334 HydrophobicContact CD1-CD1 4.42Å; F322-I334 HydrophobicContact CD2-CD1 3.49Å; F322-I334 VanDerWaalsContact CD2-CD1 3.49Å; F322-I334 HydrophobicContact CE2-CD1 3.9Å; F322-I334 HydrophobicContact CG-CD1 3.79Å; A330-I334 VanDerWaalsContact O-CG1 3.23Å; A330-I334 WeakPolarHBondContact O-CG1 3.39Å; A330-I334 PolarHBondContact O-N 3.48Å; K331-I334 PolarHBondContact O-N 3.08Å; I334-T336 VanDerWaalsContact C-N 3.3Å; I334-T336 PolarHBondContact O-N 3.1Å; I334-G337 PolarHBondContact O-N 3.29Å; I334-A338 PolarHBondContact O-N 3.44Å
335S90.3Very high92.2Very high17 Ų1736.8 Ų36.812%0.11919%0.188CC..Hα-helixtrans-61.3-37.6174.7-680000112.3K331 A338 L339K331-S335 WeakPolarHBondContact O-CB 3.5Å; K331-S335 PolarHBondContact O-N 3.24Å; K331-S335 PolarHBondContact O-OG 3.09Å; K331-S335 VanDerWaalsContact O-OG 3.09Å; S335-A338 WeakPolarHBondContact O-CB 3.13Å; S335-A338 PolarHBondContact O-N 3.39Å; S335-L339 WeakPolarHBondContact O-CG 3.5Å; S335-L339 PolarHBondContact O-N 2.94Å
336T90.2Very high92.5Very high76 Ų7633.6 Ų33.647%0.46617%0.173SC..Hα-helixtrans-64.2-41.8174.7-55.90000111.3Y332 I333 I334 A338 L339 C340Y332-T336 WeakPolarHBondContact O-CB 3.33Å; Y332-T336 PolarHBondContact O-N 3Å; Y332-T336 PolarHBondContact O-OG1 3.09Å; I333-T336 WeakPolarHBondContact O-CB 3.43Å; I333-T336 PolarHBondContact O-N 3.4Å; I334-T336 VanDerWaalsContact C-N 3.3Å; I334-T336 PolarHBondContact O-N 3.1Å; T336-A338 VanDerWaalsContact C-N 3.34Å; T336-A338 PolarHBondContact O-N 3.27Å; T336-L339 PolarHBondContact O-N 3.29Å; T336-C340 PolarHBondContact O-N 3.16Å; T336-C340 PolarHBondContact O-SG 3.3Å
337G93.5Very high92.7Very high0 Ų031.1 Ų31.10%015%0.147CC..Hα-helixtrans-60-42.9172.800000112.5Y54 I333 I334 L339 C340 A341Y54-G337 VanDerWaalsContact OH-C 3.27Å; Y54-G337 WeakPolarHBondContact OH-CA 3.39Å; I333-G337 PolarHBondContact O-N 3.44Å; I334-G337 PolarHBondContact O-N 3.29Å; G337-L339 PolarHBondContact O-N 3.06Å; G337-C340 WeakPolarHBondContact O-CB 3.39Å; G337-C340 PolarHBondContact O-N 3.28Å; G337-A341 WeakPolarHBondContact O-CB 3.49Å; G337-A341 PolarHBondContact O-N 3.46Å
338A93.1Very high92.9Very high4 Ų430.2 Ų30.23%0.03314%0.142CC..Hα-helixtrans-60.2-43.6175.700000112.3Y54 I334 S335 T336 A341 L342Y54-A338 HydrophobicContact CD1-CB 3.76Å; Y54-A338 HydrophobicContact CD2-CB 3.89Å; Y54-A338 HydrophobicContact CE1-CB 4.05Å; Y54-A338 HydrophobicContact CE2-CB 4.18Å; Y54-A338 HydrophobicContact CG-CB 3.69Å; I334-A338 PolarHBondContact O-N 3.44Å; S335-A338 WeakPolarHBondContact O-CB 3.13Å; S335-A338 PolarHBondContact O-N 3.39Å; T336-A338 VanDerWaalsContact C-N 3.34Å; T336-A338 PolarHBondContact O-N 3.27Å; A338-A341 PolarHBondContact O-N 2.9Å; A338-L342 WeakPolarHBondContact O-CB 3.18Å; A338-L342 VanDerWaalsContact O-CG 3.26Å; A338-L342 WeakPolarHBondContact O-CG 3.48Å; A338-L342 PolarHBondContact O-N 3.15Å
339L93.4Very high93.1Very high22 Ų2225.9 Ų25.912%0.11512%0.124CC..Hα-helixtrans-64.5-40175.6-66.2175.6000112.3W135 N138 F139 I142 S335 T336 G337 T343W135-L339 HydrophobicContact CD2-CD2 4.07Å; W135-L339 HydrophobicContact CG-CD2 4.39Å; W135-L339 HydrophobicContact CZ2-CD2 4.16Å; W135-L339 PolarHBondContact NE1-O 2.87Å; N138-L339 HydrophobicContact CB-CD2 4.1Å; F139-L339 HydrophobicContact CB-CD2 3.94Å; F139-L339 HydrophobicContact CD2-CD1 3.86Å; F139-L339 HydrophobicContact CD2-CD2 4.45Å; I142-L339 HydrophobicContact CD1-CD1 3.69Å; I142-L339 HydrophobicContact CD1-CG 4.47Å; S335-L339 WeakPolarHBondContact O-CG 3.5Å; S335-L339 PolarHBondContact O-N 2.94Å; T336-L339 PolarHBondContact O-N 3.29Å; G337-L339 PolarHBondContact O-N 3.06Å; L339-T343 WeakPolarHBondContact O-CB 3.37Å; L339-T343 PolarHBondContact O-N 3.44Å; L339-T343 PolarHBondContact O-OG1 3.33Å
340C95Very high93.3Very high12 Ų1219.3 Ų19.38%0.08110%0.099CC..Hα-helixtrans-62.1-45.6174.3-64.50000111F195 V198 T336 G337 T343 T344F195-C340 HydrophobicContact CB-CB 4.32Å; F195-C340 HydrophobicContact CD1-CB 3.89Å; V198-C340 HydrophobicContact CG1-CB 4.45Å; T336-C340 PolarHBondContact O-N 3.16Å; T336-C340 PolarHBondContact O-SG 3.3Å; G337-C340 WeakPolarHBondContact O-CB 3.39Å; G337-C340 PolarHBondContact O-N 3.28Å; C340-T343 WeakPolarHBondContact O-CB 3.4Å; C340-T343 PolarHBondContact O-N 2.79Å; C340-T344 PolarHBondContact O-N 3.33Å; C340-T344 PolarHBondContact O-OG1 3.17Å
341A95.4Very high93.3Very high0 Ų019.7 Ų19.70%010%0.1CC..Hα-helixtrans-62.7-44.2178.300000112.7Y54 N199 G337 A338 T343 T344 S345Y54-A341 HydrophobicContact CD2-CB 4.11Å; Y54-A341 HydrophobicContact CE2-CB 3.64Å; N199-A341 HydrophobicContact CB-CB 4.43Å; N199-A341 VanDerWaalsContact ND2-CB 3.32Å; N199-A341 WeakPolarHBondContact ND2-CB 3.49Å; G337-A341 WeakPolarHBondContact O-CB 3.49Å; G337-A341 PolarHBondContact O-N 3.46Å; A338-A341 PolarHBondContact O-N 2.9Å; A341-T343 VanDerWaalsContact C-N 3.27Å; A341-T343 PolarHBondContact O-N 2.82Å; A341-T344 WeakPolarHBondContact CA-OG1 3.44Å; A341-T344 PolarHBondContact O-N 3.42Å; A341-T344 PolarHBondContact O-OG1 3.37Å; A341-S345 PolarHBondContact O-N 3.07Å; A341-S345 PolarHBondContact O-OG 3.17Å
342L94.1Very high93.6Very high2 Ų217.7 Ų17.71%0.019%0.092CC..Hα-helixtrans-66.9-32.6176.8-70168.6000111.4A51 V131 A134 W135 N138 A338 S345 L346A51-L342 HydrophobicContact CB-CD2 3.66Å; V131-L342 HydrophobicContact CG1-CD2 4.27Å; V131-L342 VanDerWaalsContact CG1-O 3.22Å; V131-L342 WeakPolarHBondContact CG1-O 3.44Å; A134-L342 HydrophobicContact CB-CD2 4.19Å; W135-L342 HydrophobicContact CB-CB 4.18Å; W135-L342 HydrophobicContact CG-CB 4.26Å; N138-L342 HydrophobicContact CB-CD1 3.86Å; A338-L342 WeakPolarHBondContact O-CB 3.18Å; A338-L342 VanDerWaalsContact O-CG 3.26Å; A338-L342 WeakPolarHBondContact O-CG 3.48Å; A338-L342 PolarHBondContact O-N 3.15Å; L342-S345 PolarHBondContact O-N 3.17Å; L342-L346 WeakPolarHBondContact O-CB 3.45Å; L342-L346 PolarHBondContact O-N 3.2Å
343T95.7Very high93.8Very high9 Ų911.4 Ų11.46%0.0557%0.067CC..Hα-helixtrans-65.7-44.1173.6-53.60000111.2W135 M177 F195 L339 C340 A341 L346 L347W135-T343 PolarHBondContact NE1-OG1 3.05Å; M177-T343 HydrophobicContact CE-CG2 3.72Å; M177-T343 HydrophobicContact SD-CG2 4.33Å; F195-T343 HydrophobicContact CD2-CG2 4.01Å; F195-T343 HydrophobicContact CE2-CG2 3.87Å; F195-T343 HydrophobicContact CZ-CG2 4.38Å; L339-T343 WeakPolarHBondContact O-CB 3.37Å; L339-T343 PolarHBondContact O-N 3.44Å; L339-T343 PolarHBondContact O-OG1 3.33Å; C340-T343 WeakPolarHBondContact O-CB 3.4Å; C340-T343 PolarHBondContact O-N 2.79Å; A341-T343 VanDerWaalsContact C-N 3.27Å; A341-T343 PolarHBondContact O-N 2.82Å; T343-L346 PolarHBondContact O-N 3.45Å; T343-L347 PolarHBondContact O-N 2.85Å
344T95.8Very high93.8Very high0 Ų08.5 Ų8.50%05%0.053CC..Hα-helixtrans-66.7-37.5176.250.90000112.2G46 F195 C340 A341 L347 G348G46-T344 WeakPolarHBondContact CA-OG1 3.4Å; G46-T344 PolarHBondContact O-OG1 3.5Å; F195-T344 HydrophobicContact CB-CG2 3.37Å; C340-T344 PolarHBondContact O-N 3.33Å; C340-T344 PolarHBondContact O-OG1 3.17Å; A341-T344 WeakPolarHBondContact CA-OG1 3.44Å; A341-T344 PolarHBondContact O-N 3.42Å; A341-T344 PolarHBondContact O-OG1 3.37Å; T344-L347 PolarHBondContact O-N 3.46Å; T344-G348 PolarHBondContact O-N 3.22Å
345S94.6Very high93.8Very high7 Ų79 Ų95%0.0495%0.054CC..Hα-helixtrans-67.5-34173.5-64.30000113.7G46 T47 G50 A341 L342 G348 S349G46-S345 PolarHBondContact O-OG 3.41Å; T47-S345 PolarHBondContact O-OG 2.86Å; G50-S345 WeakPolarHBondContact CA-OG 3.44Å; A341-S345 PolarHBondContact O-N 3.07Å; A341-S345 PolarHBondContact O-OG 3.17Å; L342-S345 PolarHBondContact O-N 3.17Å; S345-G348 PolarHBondContact O-N 2.9Å; S345-S349 PolarHBondContact O-N 2.96Å; S345-S349 PolarHBondContact O-OG 3.24Å
346L95.3Very high94Very high0 Ų08.1 Ų8.10%05%0.048CC..Hα-helixtrans-67.2-48.5175-179.557.3000110.1I128 V131 A132 L173 M177 L342 T343 G348 S349 M350I128-L346 HydrophobicContact CB-CD1 4.36Å; I128-L346 HydrophobicContact CG2-CD1 3.97Å; I128-L346 WeakPolarHBondContact O-CD1 3.2Å; V131-L346 HydrophobicContact CG1-CB 3.9Å; A132-L346 HydrophobicContact CB-CD1 4.24Å; A132-L346 HydrophobicContact CB-CD2 4.29Å; L173-L346 HydrophobicContact CD2-CD2 3.52Å; L173-L346 HydrophobicContact CG-CD2 3.57Å; M177-L346 HydrophobicContact CG-CD2 3.75Å; M177-L346 HydrophobicContact CG-CG 4.15Å; L342-L346 WeakPolarHBondContact O-CB 3.45Å; L342-L346 PolarHBondContact O-N 3.2Å; T343-L346 PolarHBondContact O-N 3.45Å; L346-G348 VanDerWaalsContact C-N 3.27Å; L346-G348 PolarHBondContact O-N 3.23Å; L346-S349 PolarHBondContact O-N 2.96Å; L346-S349 VanDerWaalsContact O-N 3.13Å; L346-M350 HydrophobicContact CD1-CG 4.21Å; L346-M350 HydrophobicContact CD1-SD 4.06Å; L346-M350 HydrophobicContact CG-SD 4.09Å; L346-M350 WeakPolarHBondContact O-CB 3.46Å; L346-M350 VanDerWaalsContact O-CG 3.31Å; L346-M350 WeakPolarHBondContact O-CG 3.23Å; L346-M350 PolarHBondContact O-N 3.37Å
347L94.9Very high94.2Very high4 Ų45.1 Ų5.12%0.0213%0.029CC..Hα-helixtrans-57.2-43.4172.1-76.6173.9000111.4M177 L180 L181 N192 T343 T344 S349 M350 F351M177-L347 HydrophobicContact CB-CD2 4.29Å; M177-L347 HydrophobicContact CG-CD2 4.37Å; M177-L347 HydrophobicContact SD-CD1 4.29Å; M177-L347 HydrophobicContact SD-CD2 3.66Å; M177-L347 HydrophobicContact SD-CG 3.81Å; L180-L347 HydrophobicContact CD2-CD1 4.29Å; L180-L347 HydrophobicContact CD2-CD2 4.07Å; L181-L347 HydrophobicContact CD1-CD2 4.48Å; L181-L347 HydrophobicContact CD2-CD2 4.31Å; L181-L347 HydrophobicContact CG-CD2 4.21Å; N192-L347 HydrophobicContact CB-CD1 4.29Å; T343-L347 PolarHBondContact O-N 2.85Å; T344-L347 PolarHBondContact O-N 3.46Å; L347-S349 VanDerWaalsContact C-N 3.28Å; L347-S349 PolarHBondContact O-N 3.44Å; L347-M350 PolarHBondContact O-N 3.17Å; L347-F351 WeakPolarHBondContact O-CB 3.41Å; L347-F351 PolarHBondContact O-N 2.86Å
348G93.3Very high94.1Very high0 Ų06.5 Ų6.50%04%0.035CC..Hα-helixtrans-56.3-36.4174.700000114.4T47 I266 T344 S345 L346 P352T47-G348 WeakPolarHBondContact OG1-CA 3.4Å; I266-G348 VanDerWaalsContact CD1-O 3.25Å; I266-G348 WeakPolarHBondContact CD1-O 3.32Å; T344-G348 PolarHBondContact O-N 3.22Å; S345-G348 PolarHBondContact O-N 2.9Å; L346-G348 VanDerWaalsContact C-N 3.27Å; L346-G348 PolarHBondContact O-N 3.23Å; G348-P352 WeakPolarHBondContact O-CD 3.47Å; G348-P352 WeakPolarHBondContact O-CG 3.37Å
349S92.6Very high94Very high12 Ų126.5 Ų6.58%0.0844%0.035CC..Hα-helixtrans-81.1-34.6177-550000112.1S345 L346 L347S345-S349 PolarHBondContact O-N 2.96Å; S345-S349 PolarHBondContact O-OG 3.24Å; L346-S349 PolarHBondContact O-N 2.96Å; L346-S349 VanDerWaalsContact O-N 3.13Å; L347-S349 VanDerWaalsContact C-N 3.28Å; L347-S349 PolarHBondContact O-N 3.44Å
350M94.6Very high94.1Very high4 Ų45.5 Ų5.52%0.023%0.03CC..Hα-helixtrans-79.1-24.2-179.8-67.7-174.476.500113.6I128 I174 M177 T178 L181 L346 L347 P354I128-M350 HydrophobicContact CB-CG 4.3Å; I128-M350 HydrophobicContact CD1-CB 4.32Å; I128-M350 HydrophobicContact CD1-CG 3.68Å; I128-M350 HydrophobicContact CG1-CB 4.36Å; I128-M350 HydrophobicContact CG1-CG 3.44Å; I128-M350 VanDerWaalsContact CG1-CG 3.44Å; I128-M350 HydrophobicContact CG2-CG 3.95Å; I128-M350 HydrophobicContact CG2-SD 4.24Å; I174-M350 HydrophobicContact CG2-CE 4.01Å; I174-M350 HydrophobicContact CG2-SD 4.45Å; M177-M350 HydrophobicContact CB-CE 4.1Å; M177-M350 HydrophobicContact CB-SD 3.36Å; M177-M350 WeakPolarHBondContact CB-SD 3.43Å; M177-M350 HydrophobicContact CG-SD 4.33Å; T178-M350 WeakPolarHBondContact OG1-CE 3.18Å; L181-M350 HydrophobicContact CD1-CB 3.37Å; L181-M350 HydrophobicContact CD1-CE 4.46Å; L346-M350 HydrophobicContact CD1-CG 4.21Å; L346-M350 HydrophobicContact CD1-SD 4.06Å; L346-M350 HydrophobicContact CG-SD 4.09Å; L346-M350 WeakPolarHBondContact O-CB 3.46Å; L346-M350 VanDerWaalsContact O-CG 3.31Å; L346-M350 WeakPolarHBondContact O-CG 3.23Å; L346-M350 PolarHBondContact O-N 3.37Å; L347-M350 PolarHBondContact O-N 3.17Å; M350-P354 WeakPolarHBondContact O-CD 3.24Å
351F93.5Very high94Very high7 Ų75 Ų53%0.0313%0.027CC..THydrogen-bonded Turntrans-73.2-49.3-174.9-169-78.3000112.6L35 L43 L181 V185 T270 L347 L353 P354 R355L35-F351 HydrophobicContact CD1-CZ 4.16Å; L43-F351 HydrophobicContact CD2-CD1 4.11Å; L43-F351 HydrophobicContact CD2-CE1 4.09Å; L43-F351 HydrophobicContact CD2-CZ 4.48Å; L181-F351 HydrophobicContact CD2-CB 4.45Å; L181-F351 HydrophobicContact CD2-CD2 3.68Å; L181-F351 HydrophobicContact CD2-CE2 4.46Å; L181-F351 HydrophobicContact CD2-CG 4.48Å; V185-F351 HydrophobicContact CG1-CE2 3.75Å; V185-F351 HydrophobicContact CG1-CZ 3.53Å; T270-F351 HydrophobicContact CG2-CD1 4.19Å; T270-F351 HydrophobicContact CG2-CE1 3.52Å; T270-F351 HydrophobicContact CG2-CZ 4.43Å; L347-F351 WeakPolarHBondContact O-CB 3.41Å; L347-F351 PolarHBondContact O-N 2.86Å; F351-L353 PolarHBondContact O-N 2.89Å; F351-P354 WeakPolarHBondContact O-CD 3.48Å; F351-R355 VanDerWaalsContact CD1-NH1 3.3Å; F351-R355 VanDerWaalsContact CE1-NH2 3.25Å; F351-R355 VanDerWaalsContact CZ-CZ 3.47Å; F351-R355 PolarHBondContact O-NH1 2.78Å
352P93.8Very high93.8Very high0 Ų06.1 Ų6.10%03%0.034CC..Hα-helixtrans-59.5-41.2176.8-2935.7000115Y124 I266 T269 G348 R355 I356Y124-P352 HydrophobicContact CD1-CB 4.05Å; Y124-P352 HydrophobicContact CD1-CG 4.05Å; Y124-P352 HydrophobicContact CD2-CB 3.76Å; Y124-P352 HydrophobicContact CE1-CB 3.7Å; Y124-P352 HydrophobicContact CE1-CG 3.6Å; Y124-P352 HydrophobicContact CE2-CB 3.35Å; Y124-P352 HydrophobicContact CE2-CG 4.2Å; Y124-P352 HydrophobicContact CG-CB 4.11Å; I266-P352 HydrophobicContact CB-CG 4.12Å; I266-P352 HydrophobicContact CD1-CG 4.46Å; I266-P352 HydrophobicContact CG1-CG 3.72Å; I266-P352 HydrophobicContact CG2-CG 3.77Å; T269-P352 HydrophobicContact CG2-CB 4.03Å; T269-P352 HydrophobicContact CG2-CG 4.48Å; G348-P352 WeakPolarHBondContact O-CD 3.47Å; G348-P352 WeakPolarHBondContact O-CG 3.37Å; P352-R355 WeakPolarHBondContact O-CA 3.23Å; P352-R355 VanDerWaalsContact O-CB 3.31Å; P352-R355 WeakPolarHBondContact O-CB 3.28Å; P352-R355 PolarHBondContact O-N 3.43Å; P352-I356 PolarHBondContact O-N 2.76Å
353L94.3Very high93.6Very high1 Ų16.5 Ų6.51%0.0054%0.035CC..Hα-helixtrans-59.3-45.9-161.8178.956.9000113.4I121 Y124 V125 I128 F351 R355 I356 L357 S387I121-L353 HydrophobicContact CB-CD1 4.11Å; I121-L353 HydrophobicContact CG1-CD1 3.91Å; I121-L353 HydrophobicContact CG2-CD1 4.08Å; Y124-L353 HydrophobicContact CD2-CB 4.33Å; Y124-L353 HydrophobicContact CD2-CD1 4.5Å; Y124-L353 HydrophobicContact CG-CB 4.36Å; V125-L353 HydrophobicContact CG2-CD2 3.56Å; I128-L353 HydrophobicContact CD1-CD2 3.81Å; F351-L353 PolarHBondContact O-N 2.89Å; L353-R355 PolarHBondContact O-N 3.18Å; L353-I356 PolarHBondContact O-N 3.31Å; L353-L357 HydrophobicContact CD1-CD1 4.33Å; L353-L357 HydrophobicContact CD1-CG 4.21Å; L353-L357 HydrophobicContact CG-CD1 4.3Å; L353-L357 WeakPolarHBondContact O-CG 3.46Å; L353-L357 PolarHBondContact O-N 3.14Å; L353-S387 WeakPolarHBondContact CD2-OG 3.35Å; L353-S387 VanDerWaalsContact CG-OG 3.32Å; L353-S387 WeakPolarHBondContact CG-OG 3.43Å
354P93.4Very high93.5Very high2 Ų26.5 Ų6.51%0.0134%0.037CC..Hα-helixtrans-60.7-30.4174.5-25.837.5000113.6M350 F351 Y358 P380 T384M350-P354 WeakPolarHBondContact O-CD 3.24Å; F351-P354 WeakPolarHBondContact O-CD 3.48Å; P354-Y358 WeakPolarHBondContact O-CB 3.45Å; P354-Y358 PolarHBondContact O-N 2.96Å; P354-P380 HydrophobicContact CB-CB 4.49Å; P354-P380 HydrophobicContact CB-CG 3.71Å; P354-T384 HydrophobicContact CG-CG2 4.47Å; P354-T384 WeakPolarHBondContact CG-OG1 3.47Å
355R92.5Very high93.4Very high9 Ų96.5 Ų6.53%0.0344%0.037CC..Hα-helixtrans-75.9-38.6179.1-65167.3179.671.83111.5V185 E273 F351 P352 L353 Y358 A359V185-R355 VanDerWaalsContact CG2-NH2 3.26Å; E273-R355 IonicContact OE1-CZ 3.14Å; E273-R355 IonicContact OE1-NE 3.38Å; E273-R355 PolarHBondContact OE1-NE 3.16Å; E273-R355 IonicContact OE1-NH2 2.66Å; E273-R355 PolarHBondContact OE1-NH2 3.13Å; E273-R355 IonicContact OE2-CZ 3.7Å; E273-R355 IonicContact OE2-NE 3.82Å; E273-R355 PolarHBondContact OE2-NE 2.78Å; E273-R355 IonicContact OE2-NH2 3.49Å; E273-R355 PolarHBondContact OE2-NH2 3.38Å; F351-R355 VanDerWaalsContact CD1-NH1 3.3Å; F351-R355 VanDerWaalsContact CE1-NH2 3.25Å; F351-R355 VanDerWaalsContact CZ-CZ 3.47Å; F351-R355 PolarHBondContact O-NH1 2.78Å; P352-R355 WeakPolarHBondContact O-CA 3.23Å; P352-R355 VanDerWaalsContact O-CB 3.31Å; P352-R355 WeakPolarHBondContact O-CB 3.28Å; P352-R355 PolarHBondContact O-N 3.43Å; L353-R355 PolarHBondContact O-N 3.18Å; R355-Y358 PolarHBondContact O-N 3.37Å; R355-A359 VanDerWaalsContact O-CB 3.32Å; R355-A359 WeakPolarHBondContact O-CB 3.45Å; R355-A359 PolarHBondContact O-N 3.02Å
356I94.2Very high93.3Very high0 Ų06.3 Ų6.30%04%0.036CC..Hα-helixtrans-63.1-48.9171.5-57.3-50.6000110.2G98 L120 I121 Y124 T269 P352 L353 Y358 A359 M360G98-I356 VanDerWaalsContact O-CD1 3.23Å; G98-I356 WeakPolarHBondContact O-CD1 3.47Å; L120-I356 HydrophobicContact CB-CG2 4.4Å; L120-I356 HydrophobicContact CD1-CD1 4.03Å; L120-I356 HydrophobicContact CD1-CG1 4.46Å; I121-I356 HydrophobicContact CG1-CG2 4.07Å; Y124-I356 HydrophobicContact CD2-CG1 4.28Å; Y124-I356 HydrophobicContact CE2-CG1 3.85Å; T269-I356 HydrophobicContact CG2-CD1 4.23Å; P352-I356 PolarHBondContact O-N 2.76Å; L353-I356 PolarHBondContact O-N 3.31Å; I356-Y358 VanDerWaalsContact C-N 3.33Å; I356-Y358 PolarHBondContact O-N 3.17Å; I356-A359 PolarHBondContact O-N 3.33Å; I356-M360 HydrophobicContact CG2-CG 4.37Å; I356-M360 HydrophobicContact CG2-SD 3.89Å; I356-M360 WeakPolarHBondContact O-CG 3.44Å; I356-M360 PolarHBondContact O-N 3.43Å
357L94.7Very high93.2Very high13 Ų1310.4 Ų10.47%0.0685%0.054CC..Hα-helixtrans-58.5-45.8177.3-68.6173.5000111.4I121 L353 A361 L366 L370 S387I121-L357 HydrophobicContact CD1-CD2 3.55Å; I121-L357 HydrophobicContact CG1-CD2 3.91Å; L353-L357 HydrophobicContact CD1-CD1 4.33Å; L353-L357 HydrophobicContact CD1-CG 4.21Å; L353-L357 HydrophobicContact CG-CD1 4.3Å; L353-L357 WeakPolarHBondContact O-CG 3.46Å; L353-L357 PolarHBondContact O-N 3.14Å; L357-A361 WeakPolarHBondContact O-CB 3.39Å; L357-A361 PolarHBondContact O-N 3.34Å; L357-L366 HydrophobicContact CD2-CD1 3.86Å; L357-L370 HydrophobicContact CD2-CD1 4.24Å; L357-S387 WeakPolarHBondContact CD1-OG 3.38Å
358Y92.3Very high92.8Very high28 Ų2811.5 Ų11.511%0.117%0.066CC..Hα-helixtrans-59-48.5175.4167.1-102.9000112.1P354 R355 I356 A361 T362 N371 I373P354-Y358 WeakPolarHBondContact O-CB 3.45Å; P354-Y358 PolarHBondContact O-N 2.96Å; R355-Y358 PolarHBondContact O-N 3.37Å; I356-Y358 VanDerWaalsContact C-N 3.33Å; I356-Y358 PolarHBondContact O-N 3.17Å; Y358-A361 PolarHBondContact O-N 3.2Å; Y358-T362 WeakPolarHBondContact CE2-OG1 3.16Å; Y358-T362 VanDerWaalsContact O-CB 3.24Å; Y358-T362 WeakPolarHBondContact O-CB 3.35Å; Y358-T362 PolarHBondContact O-N 2.84Å; Y358-T362 PolarHBondContact O-OG1 2.83Å; Y358-N371 HydrophobicContact CD2-CB 4.28Å; Y358-N371 HydrophobicContact CE2-CB 4.48Å; Y358-N371 WeakPolarHBondContact CE2-O 3.27Å; Y358-I373 HydrophobicContact CD2-CD1 4.41Å; Y358-I373 HydrophobicContact CD2-CG1 4.14Å; Y358-I373 HydrophobicContact CE2-CD1 3.58Å; Y358-I373 HydrophobicContact CE2-CG1 3.7Å
359A91.6Very high92.6Very high5 Ų516 Ų164%0.0419%0.086CC..Hα-helixtrans-62.5-47.3-17900000111.7S97 Y101 R355 I356 T362 D363S97-A359 WeakPolarHBondContact O-CB 3.35Å; Y101-A359 HydrophobicContact CD1-CB 4Å; Y101-A359 HydrophobicContact CE1-CB 3.98Å; R355-A359 VanDerWaalsContact O-CB 3.32Å; R355-A359 WeakPolarHBondContact O-CB 3.45Å; R355-A359 PolarHBondContact O-N 3.02Å; I356-A359 PolarHBondContact O-N 3.33Å; A359-T362 PolarHBondContact O-N 2.82Å; A359-D363 PolarHBondContact O-N 3.42Å; A359-D363 VanDerWaalsContact O-N 3.1Å
360M94.8Very high92.4Very high0 Ų015.9 Ų15.90%08%0.084CC..Hα-helixtrans-66.5-39.8178.6-67.9-179.477.900112.7Y101 F114 G117 I121 I356 D363 G364 L365 L366Y101-M360 HydrophobicContact CD1-CG 3.93Å; Y101-M360 HydrophobicContact CD2-CG 3.85Å; Y101-M360 HydrophobicContact CD2-SD 4.5Å; Y101-M360 HydrophobicContact CE1-CB 4.5Å; Y101-M360 HydrophobicContact CE1-CG 3.84Å; Y101-M360 HydrophobicContact CE2-CG 3.75Å; Y101-M360 HydrophobicContact CG-CG 3.96Å; F114-M360 HydrophobicContact CD2-CE 3.67Å; F114-M360 HydrophobicContact CE2-CE 3.91Å; F114-M360 HydrophobicContact CG-CE 4.44Å; G117-M360 VanDerWaalsContact C-SD 3.54Å; G117-M360 VanDerWaalsContact CA-SD 3.58Å; I121-M360 HydrophobicContact CD1-SD 3.73Å; I356-M360 HydrophobicContact CG2-CG 4.37Å; I356-M360 HydrophobicContact CG2-SD 3.89Å; I356-M360 WeakPolarHBondContact O-CG 3.44Å; I356-M360 PolarHBondContact O-N 3.43Å; M360-D363 PolarHBondContact O-N 3.22Å; M360-G364 PolarHBondContact O-N 3.28Å; M360-L365 PolarHBondContact O-N 2.85Å; M360-L366 HydrophobicContact CB-CB 4.31Å; M360-L366 HydrophobicContact CB-CD1 3.68Å; M360-L366 HydrophobicContact CB-CG 3.88Å; M360-L366 HydrophobicContact CE-CD1 4.11Å; M360-L366 HydrophobicContact CE-CG 4.12Å; M360-L366 HydrophobicContact CG-CD1 4.39Å; M360-L366 PolarHBondContact O-N 3.43Å; M360-L366 HydrophobicContact SD-CD1 3.85Å; M360-L366 HydrophobicContact SD-CG 4.44Å
361A93.8Very high92.1Very high2 Ų218 Ų182%0.01710%0.096CC..Hα-helixtrans-72.4-31.2177.300000112.4L357 Y358 D363 G364 L366 L370 N371L357-A361 WeakPolarHBondContact O-CB 3.39Å; L357-A361 PolarHBondContact O-N 3.34Å; Y358-A361 PolarHBondContact O-N 3.2Å; A361-D363 VanDerWaalsContact C-N 3.34Å; A361-G364 PolarHBondContact O-N 3.32Å; A361-L366 HydrophobicContact CB-CB 4.23Å; A361-L370 HydrophobicContact CB-CB 3.7Å; A361-N371 HydrophobicContact CB-CB 3.88Å; A361-N371 PolarHBondContact O-ND2 3.47Å
362T89.7Confident91.6Very high24 Ų2425.7 Ų25.715%0.14712%0.124CC..Hα-helixtrans-63.3-44172-65.20000110Y358 A359 G364 R673Y358-T362 WeakPolarHBondContact CE2-OG1 3.16Å; Y358-T362 VanDerWaalsContact O-CB 3.24Å; Y358-T362 WeakPolarHBondContact O-CB 3.35Å; Y358-T362 PolarHBondContact O-N 2.84Å; Y358-T362 PolarHBondContact O-OG1 2.83Å; A359-T362 PolarHBondContact O-N 2.82Å; T362-G364 PolarHBondContact O-N 3.47Å; T362-R673 WeakPolarHBondContact O-CD 3.49Å; T362-R673 PolarHBondContact O-NE 3.39Å; T362-R673 PolarHBondContact O-NH2 3.07Å
363D90.8Very high91.1Very high9 Ų927 Ų275%0.04813%0.131CC..THydrogen-bonded Turntrans-73-6.2176.8-66.5-28.6000113.7K19 Y101 Y105 A359 M360 A361 L365 R673K19-D363 VanDerWaalsContact CE-OD1 3.28Å; K19-D363 WeakPolarHBondContact CE-OD1 3.48Å; K19-D363 VanDerWaalsContact NZ-CG 3.28Å; K19-D363 IonicContact NZ-OD1 2.78Å; K19-D363 PolarHBondContact NZ-OD1 3.36Å; K19-D363 IonicContact NZ-OD2 3.52Å; K19-D363 PolarHBondContact NZ-OD2 3.27Å; Y101-D363 WeakPolarHBondContact CE1-OD2 3.42Å; Y101-D363 VanDerWaalsContact OH-CB 3.24Å; Y101-D363 WeakPolarHBondContact OH-CB 3.37Å; Y101-D363 VanDerWaalsContact OH-CG 3.32Å; Y101-D363 PolarHBondContact OH-OD2 3.22Å; Y105-D363 HydrophobicContact CE1-CB 3.93Å; A359-D363 PolarHBondContact O-N 3.42Å; A359-D363 VanDerWaalsContact O-N 3.1Å; M360-D363 PolarHBondContact O-N 3.22Å; A361-D363 VanDerWaalsContact C-N 3.34Å; D363-L365 VanDerWaalsContact C-N 3.34Å; D363-L365 HydrophobicContact CB-CG 4.29Å; D363-R673 PolarHBondContact O-N 2.68Å
364G92.2Very high90.6Very high9 Ų929.1 Ų29.19%0.09314%0.143CC..THydrogen-bonded Turntrans80.712.9178.400000114.2M360 A361 T362 H671M360-G364 PolarHBondContact O-N 3.28Å; A361-G364 PolarHBondContact O-N 3.32Å; T362-G364 PolarHBondContact O-N 3.47Å; G364-H671 WeakPolarHBondContact O-CB 3.47Å
365L93.7Very high89.8Confident0 Ų033 Ų330%017%0.17CC..SBendtrans-84.5-21.5178.4-56.4-172.4000112.8Y101 Y105 E110 F114 M360 D363 Y664 G668Y101-L365 HydrophobicContact CE2-CD1 3.85Å; Y101-L365 WeakPolarHBondContact OH-CD1 3.45Å; Y105-L365 HydrophobicContact CE1-CD1 3.98Å; E110-L365 HydrophobicContact CG-CD1 4.12Å; E110-L365 HydrophobicContact CG-CD2 3.83Å; F114-L365 HydrophobicContact CB-CD1 4.41Å; F114-L365 HydrophobicContact CD2-CB 4.13Å; M360-L365 PolarHBondContact O-N 2.85Å; D363-L365 VanDerWaalsContact C-N 3.34Å; D363-L365 HydrophobicContact CB-CG 4.29Å; L365-Y664 HydrophobicContact CD2-CE2 4.13Å; L365-G668 WeakPolarHBondContact O-CA 3.43Å
366L93.6Very high89Confident4 Ų441.6 Ų41.62%0.02121%0.207CC..SBendtrans-120.5168169.4-71.8-179.9000111.5F114 W118 I121 L357 M360 A361 G368 L370 I663 Y667F114-L366 HydrophobicContact CE2-CD2 4.22Å; W118-L366 HydrophobicContact CE3-CD2 4.41Å; W118-L366 HydrophobicContact CZ3-CD2 4.25Å; I121-L366 HydrophobicContact CD1-CD1 3.73Å; L357-L366 HydrophobicContact CD2-CD1 3.86Å; M360-L366 HydrophobicContact CB-CB 4.31Å; M360-L366 HydrophobicContact CB-CD1 3.68Å; M360-L366 HydrophobicContact CB-CG 3.88Å; M360-L366 HydrophobicContact CE-CD1 4.11Å; M360-L366 HydrophobicContact CE-CG 4.12Å; M360-L366 HydrophobicContact CG-CD1 4.39Å; M360-L366 PolarHBondContact O-N 3.43Å; M360-L366 HydrophobicContact SD-CD1 3.85Å; M360-L366 HydrophobicContact SD-CG 4.44Å; A361-L366 HydrophobicContact CB-CB 4.23Å; L366-G368 PolarHBondContact O-N 3.26Å; L366-L370 HydrophobicContact CB-CD1 4.35Å; L366-I663 HydrophobicContact CD2-CG2 4.23Å; L366-Y667 VanDerWaalsContact C-CE1 3.48Å; L366-Y667 WeakPolarHBondContact O-CE1 3.41Å
367F92.4Very high88.3Confident85 Ų8543.6 Ų43.637%0.37322%0.219SC..  trans-52.8129.8-178-56.1-70.4000112.2F369 L370 I663 Y667F367-F369 HydrophobicContact CB-CD1 3.63Å; F367-F369 HydrophobicContact CB-CE1 3.38Å; F367-F369 HydrophobicContact CB-CZ 4.3Å; F367-F369 HydrophobicContact CD2-CE1 4.28Å; F367-F369 AromaticContact CG-CE1 3.99Å; F367-F369 HydrophobicContact CG-CE1 3.99Å; F367-F369 PolarHBondContact O-N 3.3Å; F367-L370 WeakPolarHBondContact O-CB 3.4Å; F367-L370 PolarHBondContact O-N 2.94Å; F367-L370 VanDerWaalsContact O-N 3.16Å; F367-I663 HydrophobicContact CE2-CG2 4.36Å; F367-I663 HydrophobicContact CZ-CG2 4.29Å; F367-Y667 HydrophobicContact CD1-CD1 4.46Å; F367-Y667 HydrophobicContact CD1-CD2 4.17Å; F367-Y667 HydrophobicContact CD1-CE2 4.27Å; F367-Y667 HydrophobicContact CD1-CG 4.26Å; F367-Y667 HydrophobicContact CE1-CD2 4.34Å; F367-Y667 HydrophobicContact CE1-CG 4.29Å
368G87.7Confident87.6Confident27 Ų2746.2 Ų46.228%0.27823%0.23SC..G310 helixtrans-63.2-19.1-170.100000115.3L366 L370 N371 Y667L366-G368 PolarHBondContact O-N 3.26Å; G368-L370 PolarHBondContact O-N 3.21Å; G368-N371 PolarHBondContact O-N 3.48Å; G368-N371 PolarHBondContact O-ND2 3.29Å; G368-N371 PolarHBondContact O-OD1 3.46Å; G368-Y667 PolarHBondContact N-OH 3.3Å
369F88.6Confident87.2Confident95 Ų9545 Ų4542%0.41723%0.226SC..G310 helixtrans-67.4-21.8178.171.3-97000113.2F367 N371 R372 V382 V386F367-F369 HydrophobicContact CB-CD1 3.63Å; F367-F369 HydrophobicContact CB-CE1 3.38Å; F367-F369 HydrophobicContact CB-CZ 4.3Å; F367-F369 HydrophobicContact CD2-CE1 4.28Å; F367-F369 AromaticContact CG-CE1 3.99Å; F367-F369 HydrophobicContact CG-CE1 3.99Å; F367-F369 PolarHBondContact O-N 3.3Å; F369-N371 VanDerWaalsContact C-N 3.3Å; F369-N371 PolarHBondContact O-N 3.49Å; F369-R372 WeakPolarHBondContact O-CG 3.42Å; F369-V382 HydrophobicContact CD2-CG1 3.8Å; F369-V382 HydrophobicContact CE2-CG1 4.16Å; F369-V386 HydrophobicContact CE2-CG2 4.44Å
370L89.6Confident86.9Confident9 Ų944.9 Ų44.95%0.04723%0.225CC..G310 helixtrans-74.8-16.3179.6-67169.5000113.3L357 A361 L366 F367 G368 R372 V386L357-L370 HydrophobicContact CD2-CD1 4.24Å; A361-L370 HydrophobicContact CB-CB 3.7Å; L366-L370 HydrophobicContact CB-CD1 4.35Å; F367-L370 WeakPolarHBondContact O-CB 3.4Å; F367-L370 PolarHBondContact O-N 2.94Å; F367-L370 VanDerWaalsContact O-N 3.16Å; G368-L370 PolarHBondContact O-N 3.21Å; L370-R372 VanDerWaalsContact C-N 3.3Å; L370-V386 HydrophobicContact CD2-CB 4.48Å; L370-V386 HydrophobicContact CD2-CG2 4.38Å
371N86.4Confident86.7Confident50 Ų5047.5 Ų47.527%0.26724%0.238SC..G310 helixtrans-84.5-1.4177.472.523.4000113.8Y358 A361 G368 F369 I373Y358-N371 HydrophobicContact CD2-CB 4.28Å; Y358-N371 HydrophobicContact CE2-CB 4.48Å; Y358-N371 WeakPolarHBondContact CE2-O 3.27Å; A361-N371 HydrophobicContact CB-CB 3.88Å; A361-N371 PolarHBondContact O-ND2 3.47Å; G368-N371 PolarHBondContact O-N 3.48Å; G368-N371 PolarHBondContact O-ND2 3.29Å; G368-N371 PolarHBondContact O-OD1 3.46Å; F369-N371 VanDerWaalsContact C-N 3.3Å; F369-N371 PolarHBondContact O-N 3.49Å; N371-I373 PolarHBondContact O-N 3.03Å
372R83.9Confident86.6Confident168 Ų16850 Ų5063%0.63425%0.253SS*.PPolyproline II helixtrans-70.2116.5-177.7-69.6-176.6-179.5-171.31.7110.8F369 L370F369-R372 WeakPolarHBondContact O-CG 3.42Å; L370-R372 VanDerWaalsContact C-N 3.3Å
373I84Confident86.7Confident26 Ų2648.8 Ų48.813%0.13325%0.246CC..PPolyproline II helixtrans-89.3135.8172-60.9176000109E29 L31 Y358 N371 S375E29-I373 VanDerWaalsContact O-CD1 3.31Å; E29-I373 WeakPolarHBondContact O-CD1 3.42Å; L31-I373 HydrophobicContact CD2-CD1 4.38Å; Y358-I373 HydrophobicContact CD2-CD1 4.41Å; Y358-I373 HydrophobicContact CD2-CG1 4.14Å; Y358-I373 HydrophobicContact CE2-CD1 3.58Å; Y358-I373 HydrophobicContact CE2-CG1 3.7Å; N371-I373 PolarHBondContact O-N 3.03Å; I373-S375 PolarHBondContact O-N 3.49Å
374N82.3Confident86.8Confident47 Ų4748.7 Ų48.725%0.25125%0.245SC..PPolyproline II helixtrans-72.2126171.5-177.4-6.8000109.9K376 V377 K378 T379 L381N374-K376 VanDerWaalsContact C-N 3.28Å; N374-K376 PolarHBondContact O-N 3.24Å; N374-K376 PolarHBondContact OD1-N 3.38Å; N374-V377 HydrophobicContact CB-CG2 3.68Å; N374-V377 WeakPolarHBondContact ND2-CG2 3.48Å; N374-K378 VanDerWaalsContact O-CA 3.28Å; N374-K378 WeakPolarHBondContact O-CA 3.37Å; N374-K378 PolarHBondContact O-N 3.19Å; N374-T379 PolarHBondContact N-O 3.44Å; N374-L381 HydrophobicContact CB-CB 4.05Å
375S76.5Confident87Confident84 Ų8451.5 Ų51.559%0.58726%0.261SS*.THydrogen-bonded Turntrans-60.5-33.2-175.359.70000113.9I373 K378I373-S375 PolarHBondContact O-N 3.49Å; S375-K378 WeakPolarHBondContact O-CE 3.42Å
376K77.1Confident87Confident189 Ų18953.8 Ų53.882%0.82227%0.274SS*.THydrogen-bonded Turntrans-79.4-52.1-176.6-68.2-173179-177.10113.2N374N374-K376 VanDerWaalsContact C-N 3.28Å; N374-K376 PolarHBondContact O-N 3.24Å; N374-K376 PolarHBondContact OD1-N 3.38Å
377V78.2Confident87Confident42 Ų4253.7 Ų53.726%0.25527%0.274SS..THydrogen-bonded Turntrans-91-13.1-174.2-64.50000113I183 N374 T379I183-V377 WeakPolarHBondContact O-CG1 3.29Å; N374-V377 HydrophobicContact CB-CG2 3.68Å; N374-V377 WeakPolarHBondContact ND2-CG2 3.48Å; V377-T379 VanDerWaalsContact C-N 3.27Å; V377-T379 HydrophobicContact CB-CG2 4.33Å; V377-T379 HydrophobicContact CG2-CG2 4.24Å; V377-T379 WeakPolarHBondContact CG2-OG1 3.36Å; V377-T379 WeakPolarHBondContact O-CG2 3.29Å; V377-T379 PolarHBondContact O-N 3.02Å
378K81.3Confident87.2Confident67 Ų6749.7 Ų49.729%0.29126%0.257SS..  trans55.242-176.5-59.7-66.7-175.5176.30112.5L31 R32 N374 S375L31-K378 WeakPolarHBondContact CD2-O 3.49Å; R32-K378 HydrophobicContact CB-CB 4.21Å; N374-K378 VanDerWaalsContact O-CA 3.28Å; N374-K378 WeakPolarHBondContact O-CA 3.37Å; N374-K378 PolarHBondContact O-N 3.19Å; S375-K378 WeakPolarHBondContact O-CE 3.42Å
379T83.6Confident87.5Confident4 Ų452.2 Ų52.23%0.02527%0.267CS..SBendtrans-127.2152.5176.666.90000111.1V185 N374 V377 L381V185-T379 HydrophobicContact CG2-CG2 3.51Å; N374-T379 PolarHBondContact N-O 3.44Å; V377-T379 VanDerWaalsContact C-N 3.27Å; V377-T379 HydrophobicContact CB-CG2 4.33Å; V377-T379 HydrophobicContact CG2-CG2 4.24Å; V377-T379 WeakPolarHBondContact CG2-OG1 3.36Å; V377-T379 WeakPolarHBondContact O-CG2 3.29Å; V377-T379 PolarHBondContact O-N 3.02Å; T379-L381 PolarHBondContact O-N 3.08Å
380P85.6Confident87.8Confident2 Ų251.1 Ų51.11%0.01327%0.265CS..  trans-75.472.2175.931.9-36.1000111.4P354 V382 G383 T384P354-P380 HydrophobicContact CB-CB 4.49Å; P354-P380 HydrophobicContact CB-CG 3.71Å; P380-V382 VanDerWaalsContact C-N 3.34Å; P380-V382 PolarHBondContact O-N 3.28Å; P380-G383 WeakPolarHBondContact O-CA 3.49Å; P380-G383 PolarHBondContact O-N 2.9Å; P380-T384 PolarHBondContact O-N 3.42Å; P380-T384 PolarHBondContact O-OG1 3.29Å
381L90.2Very high88Confident54 Ų5450.7 Ų50.728%0.28326%0.262SS..Hα-helixtrans-55.4-44-172.5-17965.2000113.2S182 N374 T379 G383 T384 V385S182-L381 VanDerWaalsContact CB-CD1 3.43Å; S182-L381 WeakPolarHBondContact OG-CD1 3.29Å; N374-L381 HydrophobicContact CB-CB 4.05Å; T379-L381 PolarHBondContact O-N 3.08Å; L381-G383 VanDerWaalsContact C-N 3.32Å; L381-G383 PolarHBondContact O-N 2.88Å; L381-T384 WeakPolarHBondContact O-CB 3.34Å; L381-T384 PolarHBondContact O-N 3Å; L381-V385 HydrophobicContact CD1-CG2 4.4Å; L381-V385 WeakPolarHBondContact O-CG2 3.5Å; L381-V385 PolarHBondContact O-N 3.09Å
382V91.3Very high88.4Confident54 Ų5449.1 Ų49.133%0.32726%0.255SS..Hα-helixtrans-64.5-40.5179.6-177.40000110.6F369 P380 T384 V385 V386F369-V382 HydrophobicContact CD2-CG1 3.8Å; F369-V382 HydrophobicContact CE2-CG1 4.16Å; P380-V382 VanDerWaalsContact C-N 3.34Å; P380-V382 PolarHBondContact O-N 3.28Å; V382-T384 VanDerWaalsContact C-N 3.34Å; V382-T384 PolarHBondContact O-N 3.01Å; V382-V385 PolarHBondContact O-N 3.27Å; V382-V386 HydrophobicContact CG1-CG2 4.28Å; V382-V386 WeakPolarHBondContact O-CB 3.39Å; V382-V386 VanDerWaalsContact O-CG2 3.25Å; V382-V386 WeakPolarHBondContact O-CG2 3.49Å; V382-V386 PolarHBondContact O-N 3.49Å
383G92.3Very high88.9Confident0 Ų045.8 Ų45.80%025%0.249CC..Hα-helixtrans-59.5-44.3173.300000111.9P380 L381 S387P380-G383 WeakPolarHBondContact O-CA 3.49Å; P380-G383 PolarHBondContact O-N 2.9Å; L381-G383 VanDerWaalsContact C-N 3.32Å; L381-G383 PolarHBondContact O-N 2.88Å; G383-S387 VanDerWaalsContact O-CB 3.25Å; G383-S387 WeakPolarHBondContact O-CB 3.41Å; G383-S387 PolarHBondContact O-N 3.17Å; G383-S387 PolarHBondContact O-OG 3.5Å
384T93.6Very high89.1Confident6 Ų646.1 Ų46.14%0.03725%0.25CS..Hα-helixtrans-61-48.7176.8-52.60000112.6T178 L181 P354 P380 L381 V382 S387 G388T178-T384 HydrophobicContact CG2-CG2 4.18Å; L181-T384 HydrophobicContact CB-CG2 3.77Å; P354-T384 HydrophobicContact CG-CG2 4.47Å; P354-T384 WeakPolarHBondContact CG-OG1 3.47Å; P380-T384 PolarHBondContact O-N 3.42Å; P380-T384 PolarHBondContact O-OG1 3.29Å; L381-T384 WeakPolarHBondContact O-CB 3.34Å; L381-T384 PolarHBondContact O-N 3Å; V382-T384 VanDerWaalsContact C-N 3.34Å; V382-T384 PolarHBondContact O-N 3.01Å; T384-S387 WeakPolarHBondContact O-CB 3.46Å; T384-S387 PolarHBondContact O-N 2.9Å; T384-G388 PolarHBondContact O-N 3.26Å
385V94.5Very high89.5Confident68 Ų6843.9 Ų43.941%0.41224%0.238SC..Hα-helixtrans-65.3-45.3-179.7173.70000111.4L381 V382 S387 G388 V389L381-V385 HydrophobicContact CD1-CG2 4.4Å; L381-V385 WeakPolarHBondContact O-CG2 3.5Å; L381-V385 PolarHBondContact O-N 3.09Å; V382-V385 PolarHBondContact O-N 3.27Å; V385-S387 VanDerWaalsContact C-N 3.32Å; V385-S387 PolarHBondContact O-N 2.97Å; V385-G388 PolarHBondContact O-N 3.01Å; V385-V389 HydrophobicContact CG1-CG2 4.38Å; V385-V389 WeakPolarHBondContact O-CG2 3.46Å; V385-V389 PolarHBondContact O-N 3.22Å
386V94.3Very high90Very high48 Ų4840.8 Ų40.829%0.29122%0.218SC..Hα-helixtrans-60.9-43.6177.8169.90000110.9F369 L370 V382 G388 V389 I390F369-V386 HydrophobicContact CE2-CG2 4.44Å; L370-V386 HydrophobicContact CD2-CB 4.48Å; L370-V386 HydrophobicContact CD2-CG2 4.38Å; V382-V386 HydrophobicContact CG1-CG2 4.28Å; V382-V386 WeakPolarHBondContact O-CB 3.39Å; V382-V386 VanDerWaalsContact O-CG2 3.25Å; V382-V386 WeakPolarHBondContact O-CG2 3.49Å; V382-V386 PolarHBondContact O-N 3.49Å; V386-G388 PolarHBondContact O-N 3.27Å; V386-V389 PolarHBondContact O-N 3Å; V386-I390 HydrophobicContact CG1-CD1 3.78Å; V386-I390 HydrophobicContact CG1-CG1 4.47Å; V386-I390 VanDerWaalsContact O-CG1 3.3Å; V386-I390 WeakPolarHBondContact O-CG1 3.23Å; V386-I390 PolarHBondContact O-N 2.66Å
387S93.6Very high90.4Very high3 Ų334.1 Ų34.12%0.02119%0.193CC..Hα-helixtrans-59.3-46.5176.3-59.60000112.1L353 L357 G383 T384 V385 I390 G391L353-S387 WeakPolarHBondContact CD2-OG 3.35Å; L353-S387 VanDerWaalsContact CG-OG 3.32Å; L353-S387 WeakPolarHBondContact CG-OG 3.43Å; L357-S387 WeakPolarHBondContact CD1-OG 3.38Å; G383-S387 VanDerWaalsContact O-CB 3.25Å; G383-S387 WeakPolarHBondContact O-CB 3.41Å; G383-S387 PolarHBondContact O-N 3.17Å; G383-S387 PolarHBondContact O-OG 3.5Å; T384-S387 WeakPolarHBondContact O-CB 3.46Å; T384-S387 PolarHBondContact O-N 2.9Å; V385-S387 VanDerWaalsContact C-N 3.32Å; V385-S387 PolarHBondContact O-N 2.97Å; S387-I390 PolarHBondContact O-N 3.25Å; S387-G391 PolarHBondContact O-N 3.2Å
388G95.9Very high90.4Very high1 Ų135.5 Ų35.51%0.0120%0.195CC..Hα-helixtrans-62.4-44.2177.400000112.8I174 T178 T384 V385 V386 G391 C392I174-G388 WeakPolarHBondContact CG2-O 3.21Å; T178-G388 WeakPolarHBondContact OG1-CA 3.37Å; T384-G388 PolarHBondContact O-N 3.26Å; V385-G388 PolarHBondContact O-N 3.01Å; V386-G388 PolarHBondContact O-N 3.27Å; G388-G391 PolarHBondContact O-N 3.35Å; G388-C392 PolarHBondContact O-N 3.37Å; G388-C392 PolarHBondContact O-SG 3.49Å
389V96Very high90Very high79 Ų7933.5 Ų33.548%0.47919%0.19SC..Hα-helixtrans-62.7-46.7178.1170.40000111.3V385 V386 G391 C392 I393V385-V389 HydrophobicContact CG1-CG2 4.38Å; V385-V389 WeakPolarHBondContact O-CG2 3.46Å; V385-V389 PolarHBondContact O-N 3.22Å; V386-V389 PolarHBondContact O-N 3Å; V389-G391 VanDerWaalsContact C-N 3.34Å; V389-G391 PolarHBondContact O-N 3.37Å; V389-C392 WeakPolarHBondContact O-CB 3.45Å; V389-C392 PolarHBondContact O-N 3.28Å; V389-I393 HydrophobicContact CG1-CD1 4.11Å; V389-I393 WeakPolarHBondContact O-CG1 3.48Å; V389-I393 PolarHBondContact O-N 3.27Å
390I93.5Very high89.3Confident72 Ų7236.4 Ų36.437%0.36921%0.205SC..Hα-helixtrans-62.6-44.4177.1-63.4168.8000109.9V125 V386 S387 C392 I393 M394V125-I390 HydrophobicContact CG1-CG2 3.61Å; V125-I390 HydrophobicContact CG2-CG2 4.03Å; V386-I390 HydrophobicContact CG1-CD1 3.78Å; V386-I390 HydrophobicContact CG1-CG1 4.47Å; V386-I390 VanDerWaalsContact O-CG1 3.3Å; V386-I390 WeakPolarHBondContact O-CG1 3.23Å; V386-I390 PolarHBondContact O-N 2.66Å; S387-I390 PolarHBondContact O-N 3.25Å; I390-C392 VanDerWaalsContact C-N 3.32Å; I390-C392 PolarHBondContact O-N 3.41Å; I390-I393 PolarHBondContact O-N 3.05Å; I390-M394 HydrophobicContact CG2-CG 4.26Å; I390-M394 VanDerWaalsContact O-CG 3.25Å; I390-M394 WeakPolarHBondContact O-CG 3.24Å; I390-M394 PolarHBondContact O-N 3.24Å
391G94.3Very high88.3Confident0 Ų043.8 Ų43.80%024%0.239CC..Hα-helixtrans-57.1-41.9174.900000113S387 G388 V389 M394 A395S387-G391 PolarHBondContact O-N 3.2Å; G388-G391 PolarHBondContact O-N 3.35Å; V389-G391 VanDerWaalsContact C-N 3.34Å; V389-G391 PolarHBondContact O-N 3.37Å; G391-M394 PolarHBondContact O-N 2.83Å; G391-A395 WeakPolarHBondContact O-CB 3.27Å; G391-A395 PolarHBondContact O-N 3.26Å
392C95.6Very high87.1Confident18 Ų1843.3 Ų43.312%0.12224%0.237CC..Hα-helixtrans-62.5-45.8176.2-68.90000112.1V171 I174 G388 V389 I390 M394 A395 A396V171-C392 HydrophobicContact CG1-CB 4.13Å; I174-C392 VanDerWaalsContact CG2-SG 3.53Å; G388-C392 PolarHBondContact O-N 3.37Å; G388-C392 PolarHBondContact O-SG 3.49Å; V389-C392 WeakPolarHBondContact O-CB 3.45Å; V389-C392 PolarHBondContact O-N 3.28Å; I390-C392 VanDerWaalsContact C-N 3.32Å; I390-C392 PolarHBondContact O-N 3.41Å; C392-M394 VanDerWaalsContact C-N 3.32Å; C392-M394 PolarHBondContact O-N 3.12Å; C392-A395 PolarHBondContact O-N 3.12Å; C392-A396 VanDerWaalsContact O-CB 3.29Å; C392-A396 WeakPolarHBondContact O-CB 3.38Å; C392-A396 PolarHBondContact O-N 3.41Å
393I92.5Very high85.9Confident98 Ų9840.8 Ų40.850%0.50322%0.222SC..Hα-helixtrans-60.7-46.3177.3-66166.2000109.7V389 I390 A395 A396 V397V389-I393 HydrophobicContact CG1-CD1 4.11Å; V389-I393 WeakPolarHBondContact O-CG1 3.48Å; V389-I393 PolarHBondContact O-N 3.27Å; I390-I393 PolarHBondContact O-N 3.05Å; I393-A395 PolarHBondContact O-N 3Å; I393-A396 PolarHBondContact O-N 3.38Å; I393-V397 HydrophobicContact CG2-CG2 4.25Å; I393-V397 WeakPolarHBondContact O-CB 3.46Å; I393-V397 VanDerWaalsContact O-CG2 3.26Å; I393-V397 WeakPolarHBondContact O-CG2 3.01Å; I393-V397 PolarHBondContact O-N 3.2Å
394M89Confident84.4Confident32 Ų3244.2 Ų44.216%0.15824%0.242CC..Hα-helixtrans-63.6-43-179.8-66.9-66.5-68.700112V125 I126 A129 I390 G391 C392 A396 F398 L403V125-M394 HydrophobicContact CG1-CB 4.48Å; V125-M394 HydrophobicContact CG1-CG 3.69Å; I126-M394 HydrophobicContact CG1-CE 4.44Å; A129-M394 HydrophobicContact CB-CB 3.72Å; I390-M394 HydrophobicContact CG2-CG 4.26Å; I390-M394 VanDerWaalsContact O-CG 3.25Å; I390-M394 WeakPolarHBondContact O-CG 3.24Å; I390-M394 PolarHBondContact O-N 3.24Å; G391-M394 PolarHBondContact O-N 2.83Å; C392-M394 VanDerWaalsContact C-N 3.32Å; C392-M394 PolarHBondContact O-N 3.12Å; M394-A396 VanDerWaalsContact C-N 3.34Å; M394-A396 PolarHBondContact O-N 3.19Å; M394-F398 HydrophobicContact CE-CD2 3.67Å; M394-F398 HydrophobicContact CE-CE2 3.81Å; M394-F398 PolarHBondContact O-N 3.29Å; M394-F398 HydrophobicContact SD-CD2 3.66Å; M394-F398 HydrophobicContact SD-CE2 3.48Å; M394-F398 WeakPolarHBondContact SD-CE2 3.18Å; M394-L403 HydrophobicContact CE-CD2 3.82Å
395A90.1Very high82.9Confident0 Ų047.7 Ų47.70%026%0.261CS..Hα-helixtrans-65.7-35.6177.100000112.6A129 R133 I174 G391 C392 I393A129-A395 HydrophobicContact CB-CB 4.06Å; R133-A395 PolarHBondContact NH1-O 2.94Å; I174-A395 HydrophobicContact CD1-CB 3.63Å; G391-A395 WeakPolarHBondContact O-CB 3.27Å; G391-A395 PolarHBondContact O-N 3.26Å; C392-A395 PolarHBondContact O-N 3.12Å; I393-A395 PolarHBondContact O-N 3Å
396A88.4Confident81.3Confident19 Ų1946.2 Ų46.216%0.15725%0.25CC..Hα-helixtrans-73.2-39.1179.300000113V166 V171 C392 I393 M394V166-A396 HydrophobicContact CG1-CB 4.02Å; V171-A396 HydrophobicContact CG2-CB 4.09Å; C392-A396 VanDerWaalsContact O-CB 3.29Å; C392-A396 WeakPolarHBondContact O-CB 3.38Å; C392-A396 PolarHBondContact O-N 3.41Å; I393-A396 PolarHBondContact O-N 3.38Å; M394-A396 VanDerWaalsContact C-N 3.34Å; M394-A396 PolarHBondContact O-N 3.19Å
397V84.1Confident80.1Confident49 Ų4946 Ų4630%0.29725%0.247SC..Hα-helixtrans-92.2-39.1-169.1174.70000112.5L162 A163 I393L162-V397 WeakPolarHBondContact CA-O 3.24Å; L162-V397 WeakPolarHBondContact CB-O 3.49Å; L162-V397 HydrophobicContact CD1-CG1 4.46Å; L162-V397 HydrophobicContact CD2-CG1 3.51Å; A163-V397 PolarHBondContact N-O 3.38Å; I393-V397 HydrophobicContact CG2-CG2 4.25Å; I393-V397 WeakPolarHBondContact O-CB 3.46Å; I393-V397 VanDerWaalsContact O-CG2 3.26Å; I393-V397 WeakPolarHBondContact O-CG2 3.01Å; I393-V397 PolarHBondContact O-N 3.2Å
398F79.6Confident79.2Confident71 Ų7146.4 Ų46.431%0.31125%0.249SC..SBendtrans-104.3150-170.1-65.6-73.5000113.9R133 L162 M394 L403R133-F398 PolarHBondContact NH1-O 3.23Å; R133-F398 VanDerWaalsContact NH1-O 3.16Å; L162-F398 HydrophobicContact CD2-CE1 4.41Å; M394-F398 HydrophobicContact CE-CD2 3.67Å; M394-F398 HydrophobicContact CE-CE2 3.81Å; M394-F398 PolarHBondContact O-N 3.29Å; M394-F398 HydrophobicContact SD-CD2 3.66Å; M394-F398 HydrophobicContact SD-CE2 3.48Å; M394-F398 WeakPolarHBondContact SD-CE2 3.18Å; F398-L403 HydrophobicContact CB-CD1 4.15Å; F398-L403 HydrophobicContact CB-CD2 4Å; F398-L403 HydrophobicContact CB-CG 3.96Å
399S73.1Confident78.6Confident25 Ų2546.4 Ų46.418%0.17525%0.249CC..  trans-74.1153.7174.887.30000111.3Q401 D402 L403S399-Q401 VanDerWaalsContact C-N 3.34Å; S399-Q401 PolarHBondContact O-N 3.38Å; S399-D402 WeakPolarHBondContact OG-CB 3.14Å; S399-D402 PolarHBondContact OG-N 3.43Å; S399-D402 PolarHBondContact OG-OD2 3.42Å; S399-L403 WeakPolarHBondContact O-CD1 3.42Å; S399-L403 VanDerWaalsContact O-CG 3.26Å; S399-L403 WeakPolarHBondContact O-CG 3.32Å; S399-L403 PolarHBondContact O-N 2.82Å
400L68.4Low78Confident65 Ų6542.9 Ų42.934%0.3423%0.229SC..Hα-helixtrans-60.1-43.3178.4178.363.2000112.1S130 R133 D402 L403 V404S130-L400 WeakPolarHBondContact O-CD1 3.35Å; R133-L400 HydrophobicContact CB-CD1 4.41Å; L400-D402 PolarHBondContact O-N 2.95Å; L400-L403 PolarHBondContact O-N 2.8Å; L400-V404 HydrophobicContact CD1-CG2 4.11Å; L400-V404 HydrophobicContact CG-CG2 4.45Å; L400-V404 WeakPolarHBondContact O-CG2 3.25Å; L400-V404 PolarHBondContact O-N 3.19Å; L400-V404 VanDerWaalsContact O-N 3.13Å
401Q65.1Low77.8Confident157 Ų15739.6 Ų39.673%0.73421%0.212SC*.Hα-helixtrans-67.2-38.6-174.1-168.6157.86.400111.8S399 L403S399-Q401 VanDerWaalsContact C-N 3.34Å; S399-Q401 PolarHBondContact O-N 3.38Å; Q401-L403 VanDerWaalsContact C-N 3.31Å; Q401-L403 PolarHBondContact O-N 3Å
402D63.1Low77.6Confident44 Ų4439.6 Ų39.624%0.23521%0.212CC..Hα-helixtrans-68.5-30.4176.5-74.1-56.9000113.5S399 L400 M406 R652S399-D402 WeakPolarHBondContact OG-CB 3.14Å; S399-D402 PolarHBondContact OG-N 3.43Å; S399-D402 PolarHBondContact OG-OD2 3.42Å; L400-D402 PolarHBondContact O-N 2.95Å; D402-M406 WeakPolarHBondContact O-CG 3.46Å; D402-R652 PolarHBondContact O-NH1 3.29Å; D402-R652 VanDerWaalsContact O-NH1 3.13Å; D402-R652 IonicContact OD1-CZ 2.93Å; D402-R652 IonicContact OD1-NH1 3.38Å; D402-R652 PolarHBondContact OD1-NH1 2.87Å; D402-R652 VanDerWaalsContact OD1-NH1 3.08Å; D402-R652 IonicContact OD1-NH2 2.85Å; D402-R652 PolarHBondContact OD1-NH2 3.32Å
403L66.3Low77.4Confident2 Ų240.6 Ų40.61%0.0122%0.216CC..Hα-helixtrans-72.6-46.3178.6-72.4168.1000111.2I126 A129 M394 F398 S399 L400 Q401 D405 M406I126-L403 HydrophobicContact CG1-CD2 4.25Å; I126-L403 HydrophobicContact CG2-CB 3.98Å; I126-L403 HydrophobicContact CG2-CD2 4.26Å; I126-L403 WeakPolarHBondContact CG2-O 3.3Å; A129-L403 HydrophobicContact CB-CD1 3.77Å; A129-L403 HydrophobicContact CB-CD2 4.41Å; M394-L403 HydrophobicContact CE-CD2 3.82Å; F398-L403 HydrophobicContact CB-CD1 4.15Å; F398-L403 HydrophobicContact CB-CD2 4Å; F398-L403 HydrophobicContact CB-CG 3.96Å; S399-L403 WeakPolarHBondContact O-CD1 3.42Å; S399-L403 VanDerWaalsContact O-CG 3.26Å; S399-L403 WeakPolarHBondContact O-CG 3.32Å; S399-L403 PolarHBondContact O-N 2.82Å; L400-L403 PolarHBondContact O-N 2.8Å; Q401-L403 VanDerWaalsContact C-N 3.31Å; Q401-L403 PolarHBondContact O-N 3Å; L403-D405 PolarHBondContact O-N 2.91Å; L403-M406 PolarHBondContact O-N 3.45Å
404V62.5Low77.5Confident71 Ų7136 Ų3643%0.4319%0.193SC..Hα-helixtrans-62.5-44-172.9173.20000112.3L400 M406 M407L400-V404 HydrophobicContact CD1-CG2 4.11Å; L400-V404 HydrophobicContact CG-CG2 4.45Å; L400-V404 WeakPolarHBondContact O-CG2 3.25Å; L400-V404 PolarHBondContact O-N 3.19Å; L400-V404 VanDerWaalsContact O-N 3.13Å; V404-M406 PolarHBondContact O-N 2.7Å; V404-M406 VanDerWaalsContact O-N 3.15Å; V404-M407 PolarHBondContact O-N 2.95Å
405D61.1Low77.8Confident80 Ų8034.6 Ų34.643%0.42819%0.185SC..Hα-helixtrans-64.5-22.1-178.7-74.2-12.3000113.4L403 T649L403-D405 PolarHBondContact O-N 2.91Å; D405-T649 WeakPolarHBondContact O-CG2 3.33Å
406M61.3Low78.1Confident36 Ų3634.9 Ų34.918%0.17719%0.187CC..Hα-helixtrans-83.5-24.7180-71.7-179.567.700113.4I126 D402 L403 V404 R652I126-M406 HydrophobicContact CD1-CB 3.48Å; I126-M406 VanDerWaalsContact CD1-CB 3.48Å; I126-M406 HydrophobicContact CD1-CE 4.06Å; I126-M406 HydrophobicContact CD1-CG 4.5Å; I126-M406 HydrophobicContact CD1-SD 4.35Å; D402-M406 WeakPolarHBondContact O-CG 3.46Å; L403-M406 PolarHBondContact O-N 3.45Å; V404-M406 PolarHBondContact O-N 2.7Å; V404-M406 VanDerWaalsContact O-N 3.15Å; M406-R652 HydrophobicContact CE-CB 4Å; M406-R652 HydrophobicContact CG-CB 4.36Å; M406-R652 HydrophobicContact SD-CB 4.3Å; M406-R652 HydrophobicContact SD-CG 4.49Å
407M67.8Low78.4Confident45 Ų4534.7 Ų34.722%0.22218%0.184CC..Hα-helixtrans-67.3-41.8-177-178.3-173.3-88.400111.9E123 I126 G127 V404 I409 G410E123-M407 HydrophobicContact CG-CG 3.82Å; I126-M407 HydrophobicContact CG2-CB 4.06Å; I126-M407 HydrophobicContact CG2-CE 4.48Å; G127-M407 VanDerWaalsContact N-CE 3.3Å; V404-M407 PolarHBondContact O-N 2.95Å; M407-I409 VanDerWaalsContact C-N 3.31Å; M407-I409 PolarHBondContact O-N 3.45Å; M407-G410 PolarHBondContact O-N 2.87Å
408S75.8Confident79Confident11 Ų1132.4 Ų32.48%0.07717%0.17CC..Hα-helixtrans-57.7-36.5-167.2-61.30000115F259 L412F259-S408 WeakPolarHBondContact CE1-OG 3.41Å; F259-S408 VanDerWaalsContact CZ-CB 3.45Å; F259-S408 VanDerWaalsContact CZ-OG 3.3Å; F259-S408 WeakPolarHBondContact CZ-OG 3.17Å; S408-L412 WeakPolarHBondContact O-CB 3.42Å; S408-L412 WeakPolarHBondContact O-CD1 3.19Å; S408-L412 WeakPolarHBondContact O-CG 3.21Å; S408-L412 PolarHBondContact O-N 2.74Å
409I82Confident79.8Confident1 Ų129 Ų291%0.00516%0.155CC..Hα-helixtrans-69.9-35.6-177-167.5161.5000112.3M407 L413 L645 W650 F653M407-I409 VanDerWaalsContact C-N 3.31Å; M407-I409 PolarHBondContact O-N 3.45Å; I409-L413 HydrophobicContact CG1-CD1 4.06Å; I409-L413 HydrophobicContact CG1-CG 4.41Å; I409-L413 WeakPolarHBondContact O-CB 3.18Å; I409-L413 VanDerWaalsContact O-CG 3.27Å; I409-L413 WeakPolarHBondContact O-CG 3.29Å; I409-L413 PolarHBondContact O-N 3.44Å; I409-L645 HydrophobicContact CB-CD1 3.8Å; I409-L645 HydrophobicContact CD1-CD1 4.4Å; I409-L645 HydrophobicContact CG1-CD1 4.23Å; I409-W650 HydrophobicContact CD1-CD2 3.86Å; I409-W650 HydrophobicContact CD1-CE3 3.67Å; I409-W650 HydrophobicContact CD1-CH2 3.77Å; I409-W650 HydrophobicContact CD1-CZ2 3.95Å; I409-W650 HydrophobicContact CD1-CZ3 3.64Å; I409-F653 HydrophobicContact CB-CD2 4.47Å; I409-F653 HydrophobicContact CD1-CB 4.08Å; I409-F653 HydrophobicContact CD1-CD1 3.82Å; I409-F653 HydrophobicContact CD1-CD2 4.15Å; I409-F653 HydrophobicContact CD1-CE1 4.3Å; I409-F653 HydrophobicContact CD1-CG 3.74Å; I409-F653 HydrophobicContact CG1-CD2 4.25Å; I409-F653 HydrophobicContact CG1-CE2 4.39Å; I409-F653 HydrophobicContact CG1-CG 4.34Å; I409-F653 HydrophobicContact CG2-CB 4.18Å; I409-F653 HydrophobicContact CG2-CD2 3.44Å; I409-F653 VanDerWaalsContact CG2-CD2 3.44Å; I409-F653 HydrophobicContact CG2-CE2 4.04Å; I409-F653 HydrophobicContact CG2-CG 3.97Å
410G83.6Confident80.9Confident5 Ų527.8 Ų27.85%0.05215%0.146CC..Hα-helixtrans-64.1-50.518000000111.4M407 L412 L413 A414M407-G410 PolarHBondContact O-N 2.87Å; G410-L412 PolarHBondContact O-N 3.38Å; G410-L413 PolarHBondContact O-N 3.38Å; G410-A414 WeakPolarHBondContact O-CB 3.36Å; G410-A414 PolarHBondContact O-N 3.03Å
411T89.2Confident82.1Confident2 Ų224.7 Ų24.71%0.01213%0.13CC..Hα-helixtrans-59.7-47.9178.7-42.40000111.7E123 V262 L413 A414 Y415E123-T411 WeakPolarHBondContact OE1-CB 3.27Å; E123-T411 PolarHBondContact OE1-OG1 3.15Å; E123-T411 WeakPolarHBondContact OE2-CA 3.24Å; E123-T411 PolarHBondContact OE2-N 3.28Å; E123-T411 PolarHBondContact OE2-OG1 3.1Å; V262-T411 HydrophobicContact CB-CG2 4.35Å; V262-T411 HydrophobicContact CG1-CG2 3.51Å; V262-T411 HydrophobicContact CG2-CG2 3.89Å; T411-L413 VanDerWaalsContact C-N 3.35Å; T411-L413 PolarHBondContact O-N 3.44Å; T411-A414 WeakPolarHBondContact O-CB 3.4Å; T411-A414 PolarHBondContact O-N 2.89Å; T411-A414 VanDerWaalsContact O-N 3.17Å; T411-Y415 HydrophobicContact CG2-CD1 4.24Å; T411-Y415 HydrophobicContact CG2-CD2 4.27Å; T411-Y415 HydrophobicContact CG2-CE1 3.74Å; T411-Y415 HydrophobicContact CG2-CE2 3.76Å; T411-Y415 VanDerWaalsContact CG2-CZ 3.47Å; T411-Y415 WeakPolarHBondContact O-CD1 3.32Å; T411-Y415 PolarHBondContact O-N 3.24Å
412L90.7Very high83.4Confident1 Ų117.2 Ų17.21%0.00510%0.095CC..Hα-helixtrans-67.2-36.5-176.5-67.3170.5000112F258 F259 S408 G410 T416 N638 L641 M642F258-L412 HydrophobicContact CD1-CD2 4.15Å; F258-L412 HydrophobicContact CE1-CD2 3.51Å; F258-L412 HydrophobicContact CZ-CD2 4.32Å; F259-L412 HydrophobicContact CE1-CD1 4.35Å; F259-L412 HydrophobicContact CZ-CD1 4.35Å; S408-L412 WeakPolarHBondContact O-CB 3.42Å; S408-L412 WeakPolarHBondContact O-CD1 3.19Å; S408-L412 WeakPolarHBondContact O-CG 3.21Å; S408-L412 PolarHBondContact O-N 2.74Å; G410-L412 PolarHBondContact O-N 3.38Å; L412-T416 VanDerWaalsContact O-CB 3.3Å; L412-T416 WeakPolarHBondContact O-CB 3.36Å; L412-T416 PolarHBondContact O-N 2.6Å; L412-T416 PolarHBondContact O-OG1 3.15Å; L412-N638 HydrophobicContact CD2-CB 4.23Å; L412-L641 HydrophobicContact CD1-CB 3.7Å; L412-L641 HydrophobicContact CD2-CB 4.1Å; L412-L641 HydrophobicContact CD2-CD1 4.02Å; L412-M642 HydrophobicContact CB-CE 4.3Å; L412-M642 HydrophobicContact CB-CG 3.46Å; L412-M642 VanDerWaalsContact CB-CG 3.46Å; L412-M642 HydrophobicContact CB-SD 3.83Å; L412-M642 HydrophobicContact CD1-CG 3.67Å; L412-M642 HydrophobicContact CG-CG 4.2Å
413L91.8Very high84.9Confident39 Ų3915.1 Ų15.120%0.2048%0.084CC..Hα-helixtrans-65.2-42.3171.7-76173.5000111.4I116 I409 G410 T411 T416 L417 M642 F653I116-L413 HydrophobicContact CD1-CB 4.03Å; I409-L413 HydrophobicContact CG1-CD1 4.06Å; I409-L413 HydrophobicContact CG1-CG 4.41Å; I409-L413 WeakPolarHBondContact O-CB 3.18Å; I409-L413 VanDerWaalsContact O-CG 3.27Å; I409-L413 WeakPolarHBondContact O-CG 3.29Å; I409-L413 PolarHBondContact O-N 3.44Å; G410-L413 PolarHBondContact O-N 3.38Å; T411-L413 VanDerWaalsContact C-N 3.35Å; T411-L413 PolarHBondContact O-N 3.44Å; L413-T416 PolarHBondContact O-N 2.89Å; L413-L417 WeakPolarHBondContact O-CB 3.32Å; L413-L417 PolarHBondContact O-N 2.87Å; L413-M642 HydrophobicContact CD2-CE 4.42Å; L413-M642 HydrophobicContact CD2-SD 3.62Å; L413-M642 HydrophobicContact CG-SD 3.75Å; L413-F653 HydrophobicContact CD1-CE1 4.03Å; L413-F653 HydrophobicContact CD1-CE2 3.86Å; L413-F653 HydrophobicContact CD1-CZ 3.31Å
414A94.4Very high86.1Confident2 Ų215.5 Ų15.52%0.0179%0.086CC..Hα-helixtrans-61.5-47.4176.100000111.3A100 I116 L120 G410 T411 T416 L417 V418A100-A414 HydrophobicContact CB-CB 4.05Å; I116-A414 HydrophobicContact CG2-CB 4.15Å; L120-A414 HydrophobicContact CD2-CB 4.05Å; G410-A414 WeakPolarHBondContact O-CB 3.36Å; G410-A414 PolarHBondContact O-N 3.03Å; T411-A414 WeakPolarHBondContact O-CB 3.4Å; T411-A414 PolarHBondContact O-N 2.89Å; T411-A414 VanDerWaalsContact O-N 3.17Å; A414-T416 PolarHBondContact O-N 3.05Å; A414-L417 PolarHBondContact O-N 3.09Å; A414-V418 VanDerWaalsContact O-CG2 3.32Å; A414-V418 WeakPolarHBondContact O-CG2 3.26Å; A414-V418 PolarHBondContact O-N 2.64Å
415Y95.5Very high87.3Confident1 Ų112.2 Ų12.20%0.0047%0.066CC..Hα-helixtrans-62.2-44.3178.1-69.10.1000112Y87 F258 V262 F264 D265 T411 L417 V418 S419 N638Y87-Y415 HydrophobicContact CD2-CD1 4.48Å; Y87-Y415 AromaticContact CE2-CD1 3.4Å; Y87-Y415 HydrophobicContact CE2-CD1 3.4Å; Y87-Y415 AromaticContact CE2-CE1 3.81Å; Y87-Y415 HydrophobicContact CE2-CE1 3.81Å; Y87-Y415 HydrophobicContact CE2-CG 4.29Å; Y87-Y415 AromaticContact CZ-CD1 3.76Å; Y87-Y415 WeakPolarHBondContact OH-CD1 3.41Å; F258-Y415 HydrophobicContact CE1-CD2 4.22Å; F258-Y415 HydrophobicContact CE1-CE2 4.15Å; F258-Y415 AromaticContact CZ-CD2 3.88Å; F258-Y415 HydrophobicContact CZ-CD2 3.88Å; F258-Y415 AromaticContact CZ-CE2 3.94Å; F258-Y415 HydrophobicContact CZ-CE2 3.94Å; V262-Y415 HydrophobicContact CG2-CE2 4.38Å; F264-Y415 HydrophobicContact CE1-CE1 4.39Å; F264-Y415 AromaticContact CE1-CE2 3.92Å; F264-Y415 HydrophobicContact CE1-CE2 3.92Å; F264-Y415 AromaticContact CE1-CZ 3.6Å; F264-Y415 VanDerWaalsContact CE1-OH 3.23Å; F264-Y415 WeakPolarHBondContact CE1-OH 3.49Å; F264-Y415 HydrophobicContact CE2-CE1 4.31Å; F264-Y415 HydrophobicContact CZ-CD1 4.48Å; F264-Y415 AromaticContact CZ-CE1 3.8Å; F264-Y415 HydrophobicContact CZ-CE1 3.8Å; F264-Y415 AromaticContact CZ-CE2 3.87Å; F264-Y415 HydrophobicContact CZ-CE2 3.87Å; F264-Y415 AromaticContact CZ-CZ 3.44Å; F264-Y415 VanDerWaalsContact CZ-CZ 3.44Å; F264-Y415 WeakPolarHBondContact CZ-OH 3.36Å; D265-Y415 HydrophobicContact CB-CE1 4.01Å; T411-Y415 HydrophobicContact CG2-CD1 4.24Å; T411-Y415 HydrophobicContact CG2-CD2 4.27Å; T411-Y415 HydrophobicContact CG2-CE1 3.74Å; T411-Y415 HydrophobicContact CG2-CE2 3.76Å; T411-Y415 VanDerWaalsContact CG2-CZ 3.47Å; T411-Y415 WeakPolarHBondContact O-CD1 3.32Å; T411-Y415 PolarHBondContact O-N 3.24Å; Y415-L417 VanDerWaalsContact C-N 3.34Å; Y415-L417 PolarHBondContact O-N 3Å; Y415-V418 PolarHBondContact O-N 2.9Å; Y415-S419 PolarHBondContact O-N 3.28Å; Y415-S419 PolarHBondContact O-OG 3.47Å; Y415-N638 VanDerWaalsContact CB-ND2 3.29Å; Y415-N638 WeakPolarHBondContact CB-ND2 3.33Å
416T95.7Very high88.6Confident7 Ų78.8 Ų8.84%0.0435%0.047CC..Hα-helixtrans-58.5-47.4175.8-59.50000111.2L412 L413 A414 S419 V420 L562 F566 I635 N638 M642L412-T416 VanDerWaalsContact O-CB 3.3Å; L412-T416 WeakPolarHBondContact O-CB 3.36Å; L412-T416 PolarHBondContact O-N 2.6Å; L412-T416 PolarHBondContact O-OG1 3.15Å; L413-T416 PolarHBondContact O-N 2.89Å; A414-T416 PolarHBondContact O-N 3.05Å; T416-S419 PolarHBondContact O-N 3.4Å; T416-V420 WeakPolarHBondContact O-CG2 3.35Å; T416-V420 PolarHBondContact O-N 3.02Å; T416-L562 HydrophobicContact CG2-CD1 3.6Å; T416-F566 HydrophobicContact CG2-CE2 4.23Å; T416-I635 HydrophobicContact CG2-CG1 4.31Å; T416-I635 HydrophobicContact CG2-CG2 4.1Å; T416-N638 WeakPolarHBondContact OG1-CB 3.39Å; T416-M642 VanDerWaalsContact OG1-CE 3.25Å; T416-M642 WeakPolarHBondContact OG1-CE 3.48Å
417L95.2Very high89.6Confident15 Ų157 Ų78%0.0794%0.038CC..Hα-helixtrans-73.4-32-176.4-161.668.3000112.7S104 V108 M112 I116 L413 A414 Y415 V420 S421S104-L417 WeakPolarHBondContact OG-CD2 3.04Å; V108-L417 HydrophobicContact CG2-CD1 4.03Å; V108-L417 HydrophobicContact CG2-CD2 4.49Å; V108-L417 HydrophobicContact CG2-CG 4.22Å; M112-L417 HydrophobicContact CB-CD2 4.26Å; M112-L417 HydrophobicContact CG-CD1 3.91Å; M112-L417 HydrophobicContact CG-CD2 3.3Å; M112-L417 HydrophobicContact CG-CG 4.3Å; M112-L417 HydrophobicContact SD-CD2 4.47Å; I116-L417 HydrophobicContact CB-CD2 4.46Å; I116-L417 HydrophobicContact CD1-CB 4.26Å; I116-L417 HydrophobicContact CD1-CD2 4.04Å; I116-L417 HydrophobicContact CG1-CB 4.13Å; I116-L417 HydrophobicContact CG1-CD2 3.27Å; I116-L417 HydrophobicContact CG1-CG 4.32Å; L413-L417 WeakPolarHBondContact O-CB 3.32Å; L413-L417 PolarHBondContact O-N 2.87Å; A414-L417 PolarHBondContact O-N 3.09Å; Y415-L417 VanDerWaalsContact C-N 3.34Å; Y415-L417 PolarHBondContact O-N 3Å; L417-V420 HydrophobicContact CD1-CB 4.41Å; L417-V420 PolarHBondContact O-N 3.42Å; L417-S421 VanDerWaalsContact O-CB 3.23Å; L417-S421 WeakPolarHBondContact O-CB 3.39Å; L417-S421 PolarHBondContact O-N 3.45Å; L417-S421 PolarHBondContact O-OG 2.96Å
418V96.2Very high90.2Very high0 Ų05.4 Ų5.40%03%0.03CC..Hα-helixtrans-64.3-42.5171.5172.70000110.5C86 Y87 F90 A100 Y103 A414 Y415 V420 S421 V422C86-V418 HydrophobicContact CB-CG1 4.16Å; Y87-V418 HydrophobicContact CD2-CB 4.29Å; Y87-V418 HydrophobicContact CD2-CG1 3.82Å; Y87-V418 HydrophobicContact CE1-CG2 4.04Å; Y87-V418 HydrophobicContact CE2-CB 3.85Å; Y87-V418 HydrophobicContact CE2-CG1 3.9Å; Y87-V418 HydrophobicContact CE2-CG2 3.93Å; Y87-V418 HydrophobicContact CG-CG1 4.16Å; F90-V418 HydrophobicContact CD2-CG1 3.91Å; F90-V418 HydrophobicContact CE2-CG1 4.46Å; A100-V418 HydrophobicContact CB-CG2 3.48Å; A100-V418 VanDerWaalsContact CB-CG2 3.48Å; Y103-V418 HydrophobicContact CD2-CG1 4.33Å; Y103-V418 HydrophobicContact CD2-CG2 4Å; A414-V418 VanDerWaalsContact O-CG2 3.32Å; A414-V418 WeakPolarHBondContact O-CG2 3.26Å; A414-V418 PolarHBondContact O-N 2.64Å; Y415-V418 PolarHBondContact O-N 2.9Å; V418-V420 PolarHBondContact O-N 3.02Å; V418-S421 WeakPolarHBondContact O-CB 3.36Å; V418-S421 PolarHBondContact O-N 3.5Å; V418-S421 VanDerWaalsContact O-N 3.14Å; V418-V422 WeakPolarHBondContact O-CG2 3.5Å; V418-V422 PolarHBondContact O-N 3.08Å
419S96.7Very high89.9Confident0 Ų09.1 Ų9.10%05%0.046CC..Hα-helixtrans-61.6-43.7174.1-64.70000112.3Y415 T416 S421 V422 L423 S634Y415-S419 PolarHBondContact O-N 3.28Å; Y415-S419 PolarHBondContact O-OG 3.47Å; T416-S419 PolarHBondContact O-N 3.4Å; S419-S421 VanDerWaalsContact C-N 3.31Å; S419-S421 PolarHBondContact O-N 3.42Å; S419-V422 PolarHBondContact O-N 2.91Å; S419-L423 PolarHBondContact O-N 2.98Å; S419-S634 PolarHBondContact OG-OG 3.27Å
420V96Very high89Confident0 Ų015.3 Ų15.30%08%0.077CC..Hα-helixtrans-61.2-41.2172.2171.70000111.2T416 L417 V418 V422 L423 L424 L562 I635T416-V420 WeakPolarHBondContact O-CG2 3.35Å; T416-V420 PolarHBondContact O-N 3.02Å; L417-V420 HydrophobicContact CD1-CB 4.41Å; L417-V420 PolarHBondContact O-N 3.42Å; V418-V420 PolarHBondContact O-N 3.02Å; V420-V422 VanDerWaalsContact C-N 3.27Å; V420-V422 PolarHBondContact O-N 2.9Å; V420-L423 WeakPolarHBondContact O-CB 3.34Å; V420-L423 PolarHBondContact O-N 3.4Å; V420-L423 VanDerWaalsContact O-N 3.17Å; V420-L424 HydrophobicContact CG1-CD1 4.16Å; V420-L424 HydrophobicContact CG1-CG 4.36Å; V420-L424 WeakPolarHBondContact O-CG 2.99Å; V420-L424 PolarHBondContact O-N 3.08Å; V420-L562 HydrophobicContact CG2-CD1 4Å; V420-L562 HydrophobicContact CG2-CD2 4.29Å; V420-I635 HydrophobicContact CG2-CD1 3.68Å; V420-I635 HydrophobicContact CG2-CG1 4.27Å
421S93.6Very high87.9Confident0 Ų017.8 Ų17.80%09%0.093CC..Hα-helixtrans-62.7-35.5179.6-62.40000111.3F90 A107 V108 L417 V418 S419 L424 L425F90-S421 VanDerWaalsContact CE2-C 3.45Å; F90-S421 VanDerWaalsContact CZ-C 3.45Å; F90-S421 WeakPolarHBondContact CZ-O 3.45Å; A107-S421 VanDerWaalsContact CB-CB 3.49Å; V108-S421 WeakPolarHBondContact CG2-OG 3.28Å; L417-S421 VanDerWaalsContact O-CB 3.23Å; L417-S421 WeakPolarHBondContact O-CB 3.39Å; L417-S421 PolarHBondContact O-N 3.45Å; L417-S421 PolarHBondContact O-OG 2.96Å; V418-S421 WeakPolarHBondContact O-CB 3.36Å; V418-S421 PolarHBondContact O-N 3.5Å; V418-S421 VanDerWaalsContact O-N 3.14Å; S419-S421 VanDerWaalsContact C-N 3.31Å; S419-S421 PolarHBondContact O-N 3.42Å; S421-L424 PolarHBondContact O-N 3.39Å; S421-L425 VanDerWaalsContact O-CB 3.29Å; S421-L425 WeakPolarHBondContact O-CB 3.09Å; S421-L425 PolarHBondContact O-N 3.33Å
422V93.2Very high86.4Confident0 Ų019 Ų190%010%0.1CC..Hα-helixtrans-65.3-43.3176.5171.60000109.7C86 F90 V418 S419 V420 L424 L425 R426 V624 V627 P631C86-V422 HydrophobicContact CB-CG2 3.85Å; F90-V422 HydrophobicContact CD2-CG2 3.54Å; F90-V422 HydrophobicContact CE2-CB 4.17Å; F90-V422 HydrophobicContact CE2-CG2 3.4Å; F90-V422 VanDerWaalsContact CE2-N 3.31Å; V418-V422 WeakPolarHBondContact O-CG2 3.5Å; V418-V422 PolarHBondContact O-N 3.08Å; S419-V422 PolarHBondContact O-N 2.91Å; V420-V422 VanDerWaalsContact C-N 3.27Å; V420-V422 PolarHBondContact O-N 2.9Å; V422-L424 PolarHBondContact O-N 3.15Å; V422-L425 PolarHBondContact O-N 3.32Å; V422-R426 WeakPolarHBondContact O-CG 3.24Å; V422-R426 PolarHBondContact O-N 3.18Å; V422-V624 HydrophobicContact CG1-CG2 4.5Å; V422-V627 HydrophobicContact CG1-CG2 4.43Å; V422-P631 HydrophobicContact CG1-CG 4.25Å
423L94.1Very high84.6Confident0 Ų020.5 Ų20.50%012%0.115CC..Hα-helixtrans-60.3-45.7176.2-64.3175.2000111.6S419 V420 L425 R426 Y554 S558 L561 V627 P628 P631 I635S419-L423 PolarHBondContact O-N 2.98Å; V420-L423 WeakPolarHBondContact O-CB 3.34Å; V420-L423 PolarHBondContact O-N 3.4Å; V420-L423 VanDerWaalsContact O-N 3.17Å; L423-L425 PolarHBondContact O-N 3.02Å; L423-R426 PolarHBondContact O-N 3.44Å; L423-Y554 WeakPolarHBondContact O-CD1 3.4Å; L423-S558 WeakPolarHBondContact CB-OG 3.1Å; L423-L561 HydrophobicContact CD1-CD2 3.85Å; L423-V627 HydrophobicContact CD2-CG1 4.14Å; L423-P628 HydrophobicContact CD2-CB 3.42Å; L423-P628 VanDerWaalsContact CD2-CB 3.42Å; L423-P631 HydrophobicContact CD1-CB 4.22Å; L423-P631 HydrophobicContact CD2-CB 3.83Å; L423-P631 HydrophobicContact CD2-CG 3.95Å; L423-P631 HydrophobicContact CG-CB 3.82Å; L423-P631 HydrophobicContact CG-CG 4.32Å; L423-I635 HydrophobicContact CD1-CD1 4.11Å
424L92.2Very high82.5Confident10 Ų1021.8 Ų21.85%0.05212%0.117CC..Hα-helixtrans-63.6-42.2178.8-66.7177.4000112.1A107 V108 V420 S421 V422 R426 G427 K555A107-L424 HydrophobicContact CB-CB 4.39Å; V108-L424 HydrophobicContact CG2-CD1 3.84Å; V420-L424 HydrophobicContact CG1-CD1 4.16Å; V420-L424 HydrophobicContact CG1-CG 4.36Å; V420-L424 WeakPolarHBondContact O-CG 2.99Å; V420-L424 PolarHBondContact O-N 3.08Å; S421-L424 PolarHBondContact O-N 3.39Å; V422-L424 PolarHBondContact O-N 3.15Å; L424-R426 PolarHBondContact O-N 2.78Å; L424-G427 PolarHBondContact O-N 3.35Å; L424-K555 HydrophobicContact CD2-CB 4.19Å; L424-K555 HydrophobicContact CD2-CG 4.26Å
425L86.9Confident80.2Confident1 Ų123.8 Ų23.81%0.00513%0.131CC..Hα-helixtrans-60.8-32.9-178.3-175.563.8000112.8F90 S421 V422 L423 G427 Q428 I432F90-L425 HydrophobicContact CD1-CD2 4.33Å; F90-L425 HydrophobicContact CE1-CD2 3.73Å; F90-L425 HydrophobicContact CZ-CB 4.31Å; F90-L425 HydrophobicContact CZ-CD2 3.89Å; S421-L425 VanDerWaalsContact O-CB 3.29Å; S421-L425 WeakPolarHBondContact O-CB 3.09Å; S421-L425 PolarHBondContact O-N 3.33Å; V422-L425 PolarHBondContact O-N 3.32Å; L423-L425 PolarHBondContact O-N 3.02Å; L425-G427 VanDerWaalsContact C-N 3.26Å; L425-G427 PolarHBondContact O-N 2.78Å; L425-Q428 VanDerWaalsContact CD1-OE1 3.23Å; L425-Q428 PolarHBondContact O-N 3.44Å; L425-I432 HydrophobicContact CD1-CB 4.2Å; L425-I432 HydrophobicContact CD1-CD1 4.09Å; L425-I432 HydrophobicContact CD1-CG1 4.5Å
426R88.4Confident77.7Confident8 Ų829.4 Ų29.43%0.0316%0.16CC..Hα-helixtrans-64.5-32179.9-67.3-87.8166.5171.314.1112.6E89 V422 L423 L424 Y554 E615 N616 V624 V627E89-R426 IonicContact OE1-CZ 2.87Å; E89-R426 IonicContact OE1-NE 2.84Å; E89-R426 PolarHBondContact OE1-NE 2.96Å; E89-R426 IonicContact OE1-NH2 3.64Å; E89-R426 PolarHBondContact OE1-NH2 3.08Å; E89-R426 IonicContact OE2-CZ 2.89Å; E89-R426 IonicContact OE2-NE 3.34Å; E89-R426 IonicContact OE2-NH2 3.02Å; E89-R426 PolarHBondContact OE2-NH2 3.33Å; V422-R426 WeakPolarHBondContact O-CG 3.24Å; V422-R426 PolarHBondContact O-N 3.18Å; L423-R426 PolarHBondContact O-N 3.44Å; L424-R426 PolarHBondContact O-N 2.78Å; R426-Y554 HydrophobicContact CB-CD1 4.36Å; R426-Y554 HydrophobicContact CB-CE1 3.73Å; R426-E615 WeakPolarHBondContact CD-OE2 3.48Å; R426-E615 IonicContact CZ-OE2 3.25Å; R426-E615 IonicContact NE-OE2 2.72Å; R426-E615 IonicContact NH1-OE2 3.68Å; R426-E615 PolarHBondContact NH1-OE2 3.48Å; R426-E615 CarbonylContact O-C 3.54Å; R426-E615 WeakPolarHBondContact O-CA 3.2Å; R426-N616 PolarHBondContact O-N 2.93Å; R426-V624 PolarHBondContact NH2-O 3.32Å; R426-V627 HydrophobicContact CG-CG1 3.99Å
427G83.1Confident74.9Confident0 Ų033.9 Ų33.90%018%0.184CC..THydrogen-bonded Turntrans-86.7-8.5177.500000115.5L424 L425 P546 E551 Y554L424-G427 PolarHBondContact O-N 3.35Å; L425-G427 VanDerWaalsContact C-N 3.26Å; L425-G427 PolarHBondContact O-N 2.78Å; G427-P546 WeakPolarHBondContact O-CB 3.43Å; G427-E551 WeakPolarHBondContact O-CA 3.43Å; G427-E551 WeakPolarHBondContact O-CB 3.47Å; G427-Y554 VanDerWaalsContact CA-CG 3.47Å
428Q80.9Confident72.1Confident11 Ų1140.7 Ų40.75%0.05122%0.221CC..  trans-74.9135.2-175.6-70.5-175.1-59.100111.6K18 L425 E551 N616K18-Q428 VanDerWaalsContact NZ-NE2 3.15Å; L425-Q428 VanDerWaalsContact CD1-OE1 3.23Å; L425-Q428 PolarHBondContact O-N 3.44Å; Q428-E551 HydrophobicContact CG-CG 4.48Å; Q428-N616 PolarHBondContact O-ND2 3.44Å
429Q68.1Low69Low88 Ų8846.4 Ų46.441%0.41125%0.25SC..SBendtrans-70.7-38.4177-48.2-169.3-78.100111.9P546 K548Q429-P546 HydrophobicContact CG-CB 4.37Å; Q429-P546 WeakPolarHBondContact CG-O 3.34Å; Q429-P546 PolarHBondContact NE2-O 3.19Å; Q429-K548 VanDerWaalsContact NE2-N 3.17Å; Q429-K548 VanDerWaalsContact OE1-CG 3.26Å
430M64.5Low66.1Low132 Ų13255.3 Ų55.365%0.6529%0.288SS*.SBendtrans-75.8135.7-175.1-161.4171.9-63.300110.8I432 N616M430-I432 PolarHBondContact O-N 3.34Å; M430-N616 PolarHBondContact O-ND2 3.12Å; M430-N616 VanDerWaalsContact O-ND2 3.14Å
431S59.2Low63Low57 Ų5761.6 Ų61.640%0.39932%0.322SS..  trans-71.8111.317047.10000109.4
432I57.5Low60.1Low28 Ų2865.7 Ų65.714%0.14435%0.35CS..  trans-103.3116.7176.4-58.7-177.2000107.7V94 I106 L425 M430V94-I432 HydrophobicContact CG2-CG2 4.32Å; I106-I432 HydrophobicContact CG2-CD1 3.52Å; I106-I432 HydrophobicContact CG2-CG1 4.46Å; I106-I432 HydrophobicContact CG2-CG2 3.53Å; L425-I432 HydrophobicContact CD1-CB 4.2Å; L425-I432 HydrophobicContact CD1-CD1 4.09Å; L425-I432 HydrophobicContact CD1-CG1 4.5Å; M430-I432 PolarHBondContact O-N 3.34Å
433G53.2Low56.8Low31 Ų3170.7 Ų70.732%0.3238%0.38SS..SBendtrans120.5-173172.200000115.9R93R93-G433 WeakPolarHBondContact O-CA 3.04Å
434Y48.6Very low53.6Low66 Ų6678.7 Ų78.726%0.25942%0.418SS..  trans-82.3116.9175.5-80.9-93.9000110.9L26 R93 P95L26-Y434 HydrophobicContact CD1-CE2 4.37Å; L26-Y434 WeakPolarHBondContact CD1-OH 3.4Å; L26-Y434 WeakPolarHBondContact CD2-OH 3.47Å; R93-Y434 PolarHBondContact O-N 3.49Å; P95-Y434 HydrophobicContact CG-CD2 3.48Å; P95-Y434 VanDerWaalsContact CG-CD2 3.48Å; P95-Y434 HydrophobicContact CG-CE2 3.79Å; P95-Y434 HydrophobicContact CG-CG 4.47Å
435C44.6Very low50.3Low44 Ų4484.7 Ų84.730%0.29745%0.454SS..  trans-75.8143170.6-65.20000110.7N437C435-N437 PolarHBondContact O-N 3.06Å; C435-N437 VanDerWaalsContact O-N 3.13Å
436L44.2Very low47.3Very low120 Ų12089.7 Ų89.763%0.62848%0.481SS*.SBendtrans-54.9-27.6173.3-97.4144.4000113.4
437N36.2Very low44.1Very low101 Ų10197 Ų9754%0.5452%0.517SS..  trans-93.9120.1179.4-68.8-9.3000110.2C435 I439C435-N437 PolarHBondContact O-N 3.06Å; C435-N437 VanDerWaalsContact O-N 3.13Å; N437-I439 HydrophobicContact CB-CB 4.35Å; N437-I439 HydrophobicContact CB-CD1 4.24Å; N437-I439 HydrophobicContact CB-CG1 4.16Å; N437-I439 PolarHBondContact O-N 2.97Å
438N37.2Very low41.4Very low158 Ų158101.8 Ų101.885%0.84554%0.543SS*.  trans-65.616.9167.8-98.8-13.9000113.6
439I31.5Very low38.9Very low120 Ų120108.1 Ų108.162%0.61558%0.577SS**SBendtrans-84.8136.6-176.2-58.1174.7000107.7N437 D441N437-I439 HydrophobicContact CB-CB 4.35Å; N437-I439 HydrophobicContact CB-CD1 4.24Å; N437-I439 HydrophobicContact CB-CG1 4.16Å; N437-I439 PolarHBondContact O-N 2.97Å; I439-D441 PolarHBondContact O-N 3.49Å
440K34.3Very low36.9Very low186 Ų186112.6 Ų112.681%0.80960%0.598SS**SBendtrans-54.720.4-167.6-73.6172.7167.9177.40117.7C442 T443K440-C442 PolarHBondContact O-N 3.34Å; K440-C442 VanDerWaalsContact O-N 3.11Å; K440-T443 PolarHBondContact O-N 3.13Å; K440-T443 PolarHBondContact O-OG1 3.2Å
441D30.6Very low35.1Very low132 Ų132115.5 Ų115.571%0.70661%0.607SS**THydrogen-bonded Turntrans-85.224.6-175.8-72.4-13.9000115I439 T443I439-D441 PolarHBondContact O-N 3.49Å; D441-T443 VanDerWaalsContact C-N 3.33Å
442C33Very low33.4Very low86 Ų86124.1 Ų124.158%0.58163%0.631SS**THydrogen-bonded Turntrans-99.520.4158.9-61.60000111.7K440 E444K440-C442 PolarHBondContact O-N 3.34Å; K440-C442 VanDerWaalsContact O-N 3.11Å; C442-E444 PolarHBondContact O-N 2.87Å
443T25.6Very low32Very low105 Ų105128.1 Ų128.164%0.64466%0.659SS**SBendtrans-56.6123164-40.90000106.8K440 D441 V445K440-T443 PolarHBondContact O-N 3.13Å; K440-T443 PolarHBondContact O-OG1 3.2Å; D441-T443 VanDerWaalsContact C-N 3.33Å; T443-V445 PolarHBondContact O-N 2.9Å
444E24.9Very low30.6Very low169 Ų169130.3 Ų130.379%0.7968%0.681SS**  trans-37.3102.9177-70.8169.213300110.9C442 L446C442-E444 PolarHBondContact O-N 2.87Å; E444-L446 PolarHBondContact O-N 3.23Å
445V24.2Very low29.5Very low135 Ų135130.1 Ų130.182%0.81870%0.699SS**  trans-80.368.6167.9-172.70000106.9T443T443-V445 PolarHBondContact O-N 2.9Å
446L23Very low28.5Very low106 Ų106138.3 Ų138.356%0.55573%0.73SS**  trans-98.687.6150.1-77.4172.2000104.9E444 T516E444-L446 PolarHBondContact O-N 3.23Å; L446-T516 HydrophobicContact CD2-CG2 4.4Å
447M21.9Very low27.6Very low161 Ų161140.7 Ų140.779%0.79374%0.742SS**  trans-167100146.4-71.9-135.917100107.1
448D25.4Very low27Very low102 Ų102140.7 Ų140.755%0.54575%0.75SS.*  trans-64.5141161.3-95.1-24000108.7K548D448-K548 IonicContact OD1-NZ 3.05Å; D448-K548 IonicContact OD2-NZ 3.93Å; D448-K548 PolarHBondContact OD2-NZ 2.94Å
449D29.3Very low26.4Very low144 Ų144140.7 Ų140.777%0.7775%0.749SS**  trans39.4104.6148.2-59.7-32.5000119.4
450E27Very low26.1Very low182 Ų182139 Ų13985%0.8575%0.748SS**  176.7130.6118.7-97.4-180-171.600111.1
451K25.9Very low25.6Very low192 Ų192137.7 Ų137.784%0.83575%0.75SS**  trans69.184.8171.5-60.8175.4-178.5172.50116.5P453K451-P453 WeakPolarHBondContact O-CD 3.49Å
452W23.2Very low25.4Very low238 Ų238139.3 Ų139.390%0.90275%0.753SS**  trans-87.2101.8150.3-165.6-89.8000108.9G454W452-G454 PolarHBondContact O-N 3.46Å
453P27.5Very low25.1Very low113 Ų113144.7 Ų144.773%0.73477%0.767SS**  trans-71.1117.5170.129.8-29.8000107.5K451 G455K451-P453 WeakPolarHBondContact O-CD 3.49Å; P453-G455 PolarHBondContact O-N 3.44Å; P453-G455 VanDerWaalsContact O-N 3.09Å
454G25.2Very low25Very low76 Ų76147.5 Ų147.578%0.78478%0.777SS**  trans-56.5113.4-177.400000112.7W452W452-G454 PolarHBondContact O-N 3.46Å
455G24.1Very low24.9Very low62 Ų62148 Ų14864%0.63977%0.773SS**  trans-105.9106.1149.800000107.7P453 L457P453-G455 PolarHBondContact O-N 3.44Å; P453-G455 VanDerWaalsContact O-N 3.09Å; G455-L457 PolarHBondContact O-N 3.42Å
456K24.5Very low25.4Very low217 Ų217147.4 Ų147.494%0.94377%0.772SS**  trans-57.2107.6173.6-76.4176.7175.4177.20109.1S458K456-S458 PolarHBondContact O-N 3.44Å
457L24.4Very low25.6Very low170 Ų170148.9 Ų148.989%0.8978%0.779SS**  trans-81.8112.5164.2-150.777.9000106.9G455 L459G455-L457 PolarHBondContact O-N 3.42Å; L457-L459 PolarHBondContact O-N 3.44Å
458S23.8Very low25.9Very low100 Ų100148.2 Ų148.270%0.69977%0.772SS**  trans-62.1121.3-178.448.10000110.9K456 S460K456-S458 PolarHBondContact O-N 3.44Å; S458-S460 PolarHBondContact O-N 3.39Å
459L25.1Very low26.2Very low158 Ų158149 Ų14983%0.82778%0.775SS**  trans-65.597.1166.3-80.6115.8000109.5L457L457-L459 PolarHBondContact O-N 3.44Å
460S24.7Very low26.2Very low86 Ų86148 Ų14860%0.60177%0.769SS**  trans-137.6134.2156.851.60000107.5S458S458-S460 PolarHBondContact O-N 3.39Å
461D25.2Very low26.5Very low157 Ų157144.5 Ų144.584%0.8476%0.756SS**  trans92.136.4179.6-47.5-27000116.8K463D461-K463 VanDerWaalsContact C-N 3.34Å; D461-K463 PolarHBondContact O-N 2.86Å
462E25.7Very low26.9Very low167 Ų167142.8 Ų142.878%0.7875%0.749SS**  trans-76.289.7144.9-91.5-167.215300109.2
463K25.7Very low27.3Very low199 Ų199137.9 Ų137.987%0.86574%0.737SS**SBendtrans175.3131.7146.5-95.3153.9-170.9-1790107.9D461D461-K463 VanDerWaalsContact C-N 3.34Å; D461-K463 PolarHBondContact O-N 2.86Å
464L24.3Very low27.6Very low163 Ų163136.2 Ų136.285%0.85373%0.726SS**  trans97.749.8165.9-14580.6000118.9
465Y23.2Very low28Very low180 Ų180137.9 Ų137.971%0.70672%0.717SS**  trans-143.294.2156.6-93.4-88.1000110.6K468Y465-K468 HydrophobicContact CE1-CB 4.13Å; Y465-K468 HydrophobicContact CE1-CD 4.1Å
466P34.3Very low28.5Very low122 Ų122140.5 Ų140.579%0.79272%0.716SS**SBend-147.732.6119.735.5-16.7000115.7
467L27.4Very low28.9Very low137 Ų137135 Ų13572%0.71770%0.701SS**SBendtrans-110.3-10.7175.7-92.7155.9000115.6
468K28.6Very low29.1Very low147 Ų147134.8 Ų134.864%0.63970%0.699SS**Hα-helixtrans-78.8-18.8178.4-88.8-176.7176.21770115Y465 K472Y465-K468 HydrophobicContact CE1-CB 4.13Å; Y465-K468 HydrophobicContact CE1-CD 4.1Å; K468-K472 PolarHBondContact O-N 2.76Å
469I32.3Very low29.3Very low118 Ų118134.5 Ų134.561%0.60570%0.697SS**Hα-helixtrans-79.1-29.3179.9-63.4177.1000111.3K472 M473I469-K472 PolarHBondContact O-N 3.45Å; I469-M473 HydrophobicContact CG2-CE 4.14Å; I469-M473 PolarHBondContact O-N 2.86Å
470L27.8Very low29.4Very low123 Ų123131.4 Ų131.464%0.64469%0.689SS**Hα-helixtrans-69.5-40.6178-151.375.8000111.6K472 M473 T474L470-K472 VanDerWaalsContact C-N 3.35Å; L470-K472 PolarHBondContact O-N 2.94Å; L470-M473 PolarHBondContact O-N 3.29Å; L470-T474 PolarHBondContact O-N 3.27Å; L470-T474 PolarHBondContact O-OG1 3.14Å
471N33.7Very low29.4Very low110 Ų110135 Ų13559%0.58870%0.702SS**Hα-helixtrans-70.2-28.9177.6-84.67.4000113.7M473 T474 D475N471-M473 VanDerWaalsContact C-N 3.31Å; N471-M473 PolarHBondContact O-N 2.86Å; N471-T474 WeakPolarHBondContact CA-OG1 3.41Å; N471-T474 PolarHBondContact O-N 3.46Å; N471-T474 PolarHBondContact O-OG1 3.42Å; N471-T474 VanDerWaalsContact O-OG1 3.08Å; N471-D475 PolarHBondContact O-N 2.84Å; N471-D475 VanDerWaalsContact O-N 3.16Å
472K33.6Very low29.3Very low155 Ų155137.5 Ų137.567%0.67471%0.705SS**Hα-helixtrans-76.1-20.2179.2-139.5176.5-173.5-178.80113.1K468 I469 L470K468-K472 PolarHBondContact O-N 2.76Å; I469-K472 PolarHBondContact O-N 3.45Å; L470-K472 VanDerWaalsContact C-N 3.35Å; L470-K472 PolarHBondContact O-N 2.94Å
473M31.6Very low29.2Very low135 Ų135138.9 Ų138.967%0.66571%0.712SS**Hα-helixtrans-79.7-32.4170.8-74.5-167.9-156.500112.4I469 L470 N471 T477I469-M473 HydrophobicContact CG2-CE 4.14Å; I469-M473 PolarHBondContact O-N 2.86Å; L470-M473 PolarHBondContact O-N 3.29Å; N471-M473 VanDerWaalsContact C-N 3.31Å; N471-M473 PolarHBondContact O-N 2.86Å; M473-T477 PolarHBondContact O-OG1 3.21Å
474T34.3Very low29.2Very low79 Ų79141.1 Ų141.149%0.48572%0.715SS.*Hα-helixtrans-72.7-33.4175.229.70000113.1L470 N471 N476 T477L470-T474 PolarHBondContact O-N 3.27Å; L470-T474 PolarHBondContact O-OG1 3.14Å; N471-T474 WeakPolarHBondContact CA-OG1 3.41Å; N471-T474 PolarHBondContact O-N 3.46Å; N471-T474 PolarHBondContact O-OG1 3.42Å; N471-T474 VanDerWaalsContact O-OG1 3.08Å; T474-N476 PolarHBondContact O-N 3.46Å; T474-T477 PolarHBondContact O-N 3.2Å; T474-T477 PolarHBondContact O-OG1 3.37Å
475D34.7Very low29.1Very low111 Ų111137.9 Ų137.959%0.59471%0.706SS**Hα-helixtrans-70.7-29.4178.1-74.2-17.5000113.3N471 T477 L478N471-D475 PolarHBondContact O-N 2.84Å; N471-D475 VanDerWaalsContact O-N 3.16Å; D475-T477 VanDerWaalsContact C-N 3.35Å; D475-T477 PolarHBondContact O-N 3.18Å; D475-L478 PolarHBondContact O-N 3.36Å
476N34.3Very low29Very low116 Ų116136.9 Ų136.962%0.6271%0.712SS**Hα-helixtrans-81.8-10.8-179.2-78.1-5.6000114.1T474T474-N476 PolarHBondContact O-N 3.46Å
477T31.8Very low28.5Very low103 Ų103134.6 Ų134.663%0.63271%0.711SS**THydrogen-bonded Turntrans-85.2-12.8171.730.10000114.1M473 T474 D475M473-T477 PolarHBondContact O-OG1 3.21Å; T474-T477 PolarHBondContact O-N 3.2Å; T474-T477 PolarHBondContact O-OG1 3.37Å; D475-T477 VanDerWaalsContact C-N 3.35Å; D475-T477 PolarHBondContact O-N 3.18Å
478L28.6Very low28.2Very low164 Ų164137.9 Ų137.986%0.85972%0.72SS**SBendtrans-102.75.5-179.4-93.9149000115D475D475-L478 PolarHBondContact O-N 3.36Å
479S28Very low27.9Very low94 Ų94138.4 Ų138.466%0.65773%0.73SS**  trans-117.640.7174.255.80000113
480S26.9Very low27.5Very low93 Ų93142.1 Ų142.165%0.6574%0.744SS**  trans-109.570.2167.259.10000110.5
481N24.7Very low27.2Very low163 Ų163146.5 Ų146.587%0.87275%0.754SS**  trans-159.480.3163.2-96.7-22.5000108.8
482K24.9Very low26.8Very low209 Ų209146.1 Ų146.191%0.90976%0.76SS**  trans-156.8101.2154.8-113.2169.6-173.4178.40109.3
483E23.1Very low26.3Very low196 Ų196144.9 Ų144.992%0.91676%0.76SS**  trans-46.7131.7162.3-60.8169.4147.400110.4
484R24.5Very low25.8Very low246 Ų246148.9 Ų148.993%0.92877%0.768SS**  trans-153.2130.4142.5-150.4161.8-176162.6-0111.4
485S22.4Very low25.4Very low95 Ų95152.5 Ų152.566%0.66479%0.785SS**  trans-73.1153.3-171.845.50000115
486N22Very low24.9Very low159 Ų159156 Ų15685%0.8579%0.794SS**  trans44.1104.3143-59.9-8.4000119
487G24Very low24.3Very low74 Ų74158.1 Ų158.176%0.76381%0.805SS**  trans-153.182.1155.900000108.3
488F20.2Very low23.9Very low205 Ų205158.6 Ų158.690%0.89981%0.812SS**  trans-80.6105165.6-100.5-95.9000106.2
489D23.6Very low23.6Very low159 Ų159156.8 Ų156.885%0.8581%0.808SS**  trans-136.4133.3163.9-80.7-41.6000109.6Y491D489-Y491 PolarHBondContact O-N 2.93Å
490E23.3Very low23.4Very low195 Ų195157.1 Ų157.191%0.91181%0.81SS**  trans-56.8116.9-171.6-65.9168.2133.200112.8S492E490-S492 PolarHBondContact O-N 3.28Å
491Y21.8Very low23.6Very low216 Ų216158 Ų15885%0.84781%0.814SS**  trans-90.289.5167.7-162.1-96.7000109.3D489D489-Y491 PolarHBondContact O-N 2.93Å
492S24.1Very low23.6Very low101 Ų101157.2 Ų157.271%0.70681%0.81SS**  trans-72.1126.4171.2171.10000111.1E490 R494E490-S492 PolarHBondContact O-N 3.28Å; S492-R494 PolarHBondContact O-N 3.11Å
493D22.8Very low23.7Very low129 Ų129155 Ų15569%0.6981%0.807SS**  trans-21.4109164-76.2-45.5000116.2
494R22.9Very low24Very low220 Ų220153.3 Ų153.383%0.8380%0.803SS**  trans-141.2150.2144.9-70.5-162.5-165.2-161.96.2108.8S492S492-R494 PolarHBondContact O-N 3.11Å
495D25.5Very low24.2Very low155 Ų155149.2 Ų149.283%0.82980%0.8SS**  trans9045.6-177.8-50.8-17.7000116.2L497D495-L497 PolarHBondContact O-N 3.36Å
496K24.1Very low24.6Very low183 Ų183149.8 Ų149.880%0.79680%0.796SS**  trans-77.691.5148.4-76.8-178.9-1771670108.5S498K496-S498 PolarHBondContact O-N 2.95Å
497L22.1Very low25.2Very low161 Ų161146.6 Ų146.684%0.84378%0.784SS**  trans-63.496.4170.5-154.584.8000108.9D495 V499D495-L497 PolarHBondContact O-N 3.36Å; L497-V499 PolarHBondContact O-N 3.13Å
498S22.7Very low25.4Very low113 Ų113146.4 Ų146.479%0.7977%0.771SS**  trans-73.7103.817654.70000110.1K496 S500K496-S498 PolarHBondContact O-N 2.95Å; S498-S500 PolarHBondContact O-N 3.32Å
499V23Very low25.9Very low127 Ų127141.7 Ų141.777%0.7775%0.754SS**  trans-76.8107.9169.7178.50000108.2L497L497-V499 PolarHBondContact O-N 3.13Å
500S22.7Very low26.2Very low100 Ų100137.4 Ų137.470%0.69974%0.737SS**  trans-73.5123173.9-172.50000110S498 N502S498-S500 PolarHBondContact O-N 3.32Å; S500-N502 PolarHBondContact O-N 3.08Å
501P31.2Very low26.3Very low112 Ų112135.7 Ų135.773%0.72773%0.726SS**  trans-89.290.7-176.533.1-28.8000109.6
502N25.2Very low26.7Very low147 Ų147126.8 Ų126.879%0.78670%0.697SS**  trans-156.539.1172.7-99.3-13.1000114.8S500S500-N502 PolarHBondContact O-N 3.08Å
503N26.5Very low26.9Very low161 Ų161126.2 Ų126.286%0.86169%0.686SS**  trans-142.140.8173.6-98.1-19.9000113.9D505N503-D505 PolarHBondContact O-N 3.26Å
504I28.4Very low27.2Very low161 Ų161127.5 Ų127.583%0.82669%0.685SS**  trans-96.968.6170.3-50.2176.6000108.5
505D28.9Very low27.4Very low161 Ų161124.1 Ų124.186%0.86168%0.679SS**  trans-147.150.8166-86.7-35.3000109.4N503 P507N503-D505 PolarHBondContact O-N 3.26Å; D505-P507 WeakPolarHBondContact O-CD 3.46Å
506N31Very low27.6Very low107 Ų107118.9 Ų118.957%0.57265%0.652SS**  trans-96.497.1172-150.7-17.6000109.3S508 L509N506-S508 PolarHBondContact O-N 2.91Å; N506-S508 PolarHBondContact OD1-OG 3.4Å; N506-L509 WeakPolarHBondContact O-CB 3.17Å; N506-L509 PolarHBondContact O-N 3.05Å
507P34.6Very low27.7Very low92 Ų92115.4 Ų115.460%0.59764%0.643SS**Hα-helixtrans-60.8-19.5-175.619.6-31000113.5D505 S510 K511D505-P507 WeakPolarHBondContact O-CD 3.46Å; P507-S510 PolarHBondContact O-N 3.36Å; P507-S510 PolarHBondContact O-OG 2.87Å; P507-K511 PolarHBondContact O-N 3.45Å; P507-K511 VanDerWaalsContact O-N 3.07Å
508S28.7Very low28Very low70 Ų70113.3 Ų113.349%0.4963%0.632SS.*Hα-helixtrans-60.5-40.1170.958.20000112.7N506 K511 A512N506-S508 PolarHBondContact O-N 2.91Å; N506-S508 PolarHBondContact OD1-OG 3.4Å; S508-K511 PolarHBondContact O-N 2.88Å; S508-A512 WeakPolarHBondContact O-CB 3.48Å; S508-A512 PolarHBondContact O-N 3.26Å
509L29.9Very low28.3Very low106 Ų106111.2 Ų111.256%0.55562%0.618SS**Hα-helixtrans-70.8-37.2177.5-170.767.2000111.3N506 K511 A512 L513N506-L509 WeakPolarHBondContact O-CB 3.17Å; N506-L509 PolarHBondContact O-N 3.05Å; L509-K511 VanDerWaalsContact C-N 3.33Å; L509-K511 PolarHBondContact O-N 2.83Å; L509-A512 PolarHBondContact O-N 3Å; L509-L513 HydrophobicContact CG-CD1 4.03Å; L509-L513 VanDerWaalsContact O-CB 3.27Å; L509-L513 WeakPolarHBondContact O-CB 3.21Å; L509-L513 VanDerWaalsContact O-CG 3.3Å; L509-L513 WeakPolarHBondContact O-CG 3.17Å; L509-L513 PolarHBondContact O-N 3.34Å
510S29.9Very low28.7Very low69 Ų69109.6 Ų109.648%0.48361%0.612SS.*Hα-helixtrans-66.2-35175.581.50000112.6P507 K514P507-S510 PolarHBondContact O-N 3.36Å; P507-S510 PolarHBondContact O-OG 2.87Å; S510-K514 WeakPolarHBondContact O-CB 3.46Å; S510-K514 PolarHBondContact O-N 3.27Å
511K26.9Very low29.1Very low158 Ų158110.6 Ų110.669%0.68761%0.609SS**Hα-helixtrans-71.9-43.7174.1-106.3-178.6175.7178.80111.3P507 S508 L509 L513 K514 Q515P507-K511 PolarHBondContact O-N 3.45Å; P507-K511 VanDerWaalsContact O-N 3.07Å; S508-K511 PolarHBondContact O-N 2.88Å; L509-K511 VanDerWaalsContact C-N 3.33Å; L509-K511 PolarHBondContact O-N 2.83Å; K511-L513 VanDerWaalsContact C-N 3.33Å; K511-L513 PolarHBondContact O-N 2.92Å; K511-K514 PolarHBondContact O-N 3.28Å; K511-Q515 PolarHBondContact O-N 2.94Å
512A29.4Very low29.2Very low30 Ų30108.8 Ų108.825%0.24860%0.596CS.*Hα-helixtrans-62.7-39.1175.400000111.8S508 L509 Q515 T516S508-A512 WeakPolarHBondContact O-CB 3.48Å; S508-A512 PolarHBondContact O-N 3.26Å; L509-A512 PolarHBondContact O-N 3Å; A512-Q515 PolarHBondContact O-N 3.39Å; A512-T516 PolarHBondContact O-N 3.07Å; A512-T516 PolarHBondContact O-OG1 3.33Å
513L28.1Very low29.9Very low88 Ų88108.7 Ų108.746%0.46160%0.596SS.*Hα-helixtrans-69.6-35.1174.3-76.3168.3000112.8L509 K511 T516 N517L509-L513 HydrophobicContact CG-CD1 4.03Å; L509-L513 VanDerWaalsContact O-CB 3.27Å; L509-L513 WeakPolarHBondContact O-CB 3.21Å; L509-L513 VanDerWaalsContact O-CG 3.3Å; L509-L513 WeakPolarHBondContact O-CG 3.17Å; L509-L513 PolarHBondContact O-N 3.34Å; K511-L513 VanDerWaalsContact C-N 3.33Å; K511-L513 PolarHBondContact O-N 2.92Å; L513-T516 VanDerWaalsContact CA-OG1 3.27Å; L513-T516 WeakPolarHBondContact CA-OG1 3.16Å; L513-T516 PolarHBondContact O-OG1 2.83Å; L513-N517 VanDerWaalsContact O-CB 3.25Å; L513-N517 WeakPolarHBondContact O-CB 3.49Å; L513-N517 PolarHBondContact O-N 3.36Å
514K29Very low30.7Very low156 Ų156105.7 Ų105.768%0.67858%0.579SS**Hα-helixtrans-69.5-35.6171-91.1-178.5175.1176.60112.6S510 K511 N518S510-K514 WeakPolarHBondContact O-CB 3.46Å; S510-K514 PolarHBondContact O-N 3.27Å; K511-K514 PolarHBondContact O-N 3.28Å; K514-N518 WeakPolarHBondContact O-CB 3.43Å; K514-N518 PolarHBondContact O-N 2.98Å; K514-N518 VanDerWaalsContact O-N 3.14Å
515Q27.8Very low31.9Very low149 Ų149101.4 Ų101.470%0.69656%0.558SS**Hα-helixtrans-70.7-38.5174.7-92.7175-47.600112.2K511 A512 N518 S519K511-Q515 PolarHBondContact O-N 2.94Å; A512-Q515 PolarHBondContact O-N 3.39Å; Q515-N518 PolarHBondContact O-N 3.15Å; Q515-S519 PolarHBondContact O-N 2.98Å
516T29Very low33.1Very low45 Ų45101.7 Ų101.728%0.27655%0.553SS.*Hα-helixtrans-73.4-33.6174.539.40000113.1L446 A512 L513 N518 S519 S520L446-T516 HydrophobicContact CD2-CG2 4.4Å; A512-T516 PolarHBondContact O-N 3.07Å; A512-T516 PolarHBondContact O-OG1 3.33Å; L513-T516 VanDerWaalsContact CA-OG1 3.27Å; L513-T516 WeakPolarHBondContact CA-OG1 3.16Å; L513-T516 PolarHBondContact O-OG1 2.83Å; T516-N518 VanDerWaalsContact C-N 3.3Å; T516-N518 PolarHBondContact O-N 3.4Å; T516-S519 WeakPolarHBondContact CA-OG 3.5Å; T516-S519 PolarHBondContact O-N 2.84Å; T516-S519 PolarHBondContact O-OG 2.89Å; T516-S519 VanDerWaalsContact O-OG 3.06Å; T516-S520 PolarHBondContact O-N 3.01Å
517N27.4Very low34.7Very low111 Ų11198.2 Ų98.259%0.59453%0.534SS*.Hα-helixtrans-67.1-32.9172.8-85.1-13.4000112.2L513 S520L513-N517 VanDerWaalsContact O-CB 3.25Å; L513-N517 WeakPolarHBondContact O-CB 3.49Å; L513-N517 PolarHBondContact O-N 3.36Å; N517-S520 PolarHBondContact O-OG 2.67Å
518N28.6Very low36.8Very low117 Ų11799.6 Ų99.663%0.62654%0.537SS*.Hα-helixtrans-79.7-23.5174.7-74.7-8.8000113.6K514 Q515 T516 S520 L521K514-N518 WeakPolarHBondContact O-CB 3.43Å; K514-N518 PolarHBondContact O-N 2.98Å; K514-N518 VanDerWaalsContact O-N 3.14Å; Q515-N518 PolarHBondContact O-N 3.15Å; T516-N518 VanDerWaalsContact C-N 3.3Å; T516-N518 PolarHBondContact O-N 3.4Å; N518-S520 PolarHBondContact O-N 3.42Å; N518-L521 PolarHBondContact O-N 2.78Å
519S28.1Very low39.2Very low69 Ų69102.1 Ų102.148%0.48354%0.543SS..THydrogen-bonded Turntrans-77.8-3.4174.769.80000114.1Q515 T516 L521Q515-S519 PolarHBondContact O-N 2.98Å; T516-S519 WeakPolarHBondContact CA-OG 3.5Å; T516-S519 PolarHBondContact O-N 2.84Å; T516-S519 PolarHBondContact O-OG 2.89Å; T516-S519 VanDerWaalsContact O-OG 3.06Å; S519-L521 VanDerWaalsContact C-N 3.31Å
520S30.8Very low41.5Very low93 Ų93100.6 Ų100.665%0.6554%0.542SS*.THydrogen-bonded Turntrans-80.1-9.9165.977.10000113.6T516 N517 N518 T522T516-S520 PolarHBondContact O-N 3.01Å; N517-S520 PolarHBondContact O-OG 2.67Å; N518-S520 PolarHBondContact O-N 3.42Å; S520-T522 PolarHBondContact O-N 3.37Å
521L31Very low43.9Very low120 Ų12099 Ų9963%0.62853%0.531SS*.SBendtrans-71116.4160-89.1103.2000106.9N518 S519 D523N518-L521 PolarHBondContact O-N 2.78Å; S519-L521 VanDerWaalsContact C-N 3.31Å; L521-D523 VanDerWaalsContact C-N 3.3Å; L521-D523 PolarHBondContact O-N 3.4Å
522T34.6Very low46.5Very low75 Ų7592.7 Ų92.746%0.4650%0.503SS..  trans-34.296.2159.351.90000109.7S520 N524S520-T522 PolarHBondContact O-N 3.37Å; T522-N524 PolarHBondContact O-N 2.94Å; T522-N524 PolarHBondContact OG1-OD1 2.95Å
523D38.3Very low49.1Very low145 Ų14596.9 Ų96.978%0.77552%0.516SS*.  trans-54.9102.5148-83.8-26.5000102.3L521 I525L521-D523 VanDerWaalsContact C-N 3.3Å; L521-D523 PolarHBondContact O-N 3.4Å; D523-I525 PolarHBondContact O-N 3.32Å
524N45Very low51.7Low97 Ų9797.8 Ų97.852%0.51952%0.517SS..  trans-64.691.2178.1-63.3-50.4000103.3T522 H526T522-N524 PolarHBondContact O-N 2.94Å; T522-N524 PolarHBondContact OG1-OD1 2.95Å; N524-H526 PolarHBondContact O-N 3.23Å
525I52.2Low54.1Low72 Ų7294.7 Ų94.737%0.36950%0.502SS..  trans-62.987.6166.1-58.7175.8000103.5D523 L527 K548D523-I525 PolarHBondContact O-N 3.32Å; I525-L527 HydrophobicContact CG2-CD1 3.59Å; I525-L527 HydrophobicContact CG2-CG 3.91Å; I525-L527 PolarHBondContact O-N 2.88Å; I525-K548 HydrophobicContact CD1-CB 4.21Å
526H54.3Low56.7Low167 Ų16787.8 Ų87.877%0.77347%0.47SS*.  trans-72.479.5170.6-88.7-80.2000105.8N524 N528N524-H526 PolarHBondContact O-N 3.23Å; H526-N528 PolarHBondContact O-N 3.35Å; H526-N528 VanDerWaalsContact O-N 3.07Å
527L65.4Low59.2Low33 Ų3389.3 Ų89.317%0.17347%0.472CS..  trans-66.3105.1163.9-95141.3000106.9I525 S531 T549 L552I525-L527 HydrophobicContact CG2-CD1 3.59Å; I525-L527 HydrophobicContact CG2-CG 3.91Å; I525-L527 PolarHBondContact O-N 2.88Å; L527-S531 WeakPolarHBondContact CD2-OG 3.2Å; L527-T549 HydrophobicContact CD1-CG2 4.18Å; L527-L552 HydrophobicContact CD1-CD2 3.75Å
528N77.4Confident61.4Low121 Ų12191.2 Ų91.265%0.64748%0.475SS*.  trans-59.6147.4169.4-155-2.8000108.8H526 S530 S531 Y532H526-N528 PolarHBondContact O-N 3.35Å; H526-N528 VanDerWaalsContact O-N 3.07Å; N528-S530 VanDerWaalsContact C-N 3.25Å; N528-S530 PolarHBondContact O-N 3.5Å; N528-S530 VanDerWaalsContact O-N 3.15Å; N528-S531 PolarHBondContact N-OG 2.96Å; N528-S531 WeakPolarHBondContact O-CA 3.49Å; N528-S531 PolarHBondContact O-N 3.39Å; N528-S531 PolarHBondContact O-OG 3.35Å; N528-Y532 PolarHBondContact O-N 3.27Å
529I79.1Confident63.1Low123 Ų12390.1 Ų90.163%0.63147%0.469SS*.Hα-helixtrans-54.4-43.4-171.3-68.5167.3000111.5S531 Y532 F533I529-S531 PolarHBondContact O-N 3.03Å; I529-Y532 WeakPolarHBondContact O-CB 3.48Å; I529-Y532 PolarHBondContact O-N 3.14Å; I529-F533 HydrophobicContact CG2-CD2 3.75Å; I529-F533 HydrophobicContact CG2-CE2 3.62Å; I529-F533 VanDerWaalsContact O-CD2 3.27Å; I529-F533 WeakPolarHBondContact O-CD2 3.45Å; I529-F533 PolarHBondContact O-N 3.36Å; I529-F533 VanDerWaalsContact O-N 3.08Å
530S78.5Confident64.7Low74 Ų7492.5 Ų92.552%0.51747%0.473SS..Hα-helixtrans-59.2-44.7175.9-178.90000112.4N528 Y532 F533 Q534N528-S530 VanDerWaalsContact C-N 3.25Å; N528-S530 PolarHBondContact O-N 3.5Å; N528-S530 VanDerWaalsContact O-N 3.15Å; S530-Y532 VanDerWaalsContact C-N 3.33Å; S530-Y532 PolarHBondContact O-N 3.45Å; S530-F533 PolarHBondContact O-N 3.03Å; S530-Q534 WeakPolarHBondContact O-CB 3.46Å; S530-Q534 WeakPolarHBondContact O-CG 3.5Å; S530-Q534 PolarHBondContact O-N 3.09Å
531S79.9Confident66Low36 Ų3694.4 Ų94.425%0.25248%0.483SS..Hα-helixtrans-66.8-33177.663.60000113L527 N528 I529 R535L527-S531 WeakPolarHBondContact CD2-OG 3.2Å; N528-S531 PolarHBondContact N-OG 2.96Å; N528-S531 WeakPolarHBondContact O-CA 3.49Å; N528-S531 PolarHBondContact O-N 3.39Å; N528-S531 PolarHBondContact O-OG 3.35Å; I529-S531 PolarHBondContact O-N 3.03Å; S531-R535 WeakPolarHBondContact O-CB 3.35Å; S531-R535 WeakPolarHBondContact O-CG 3.33Å; S531-R535 PolarHBondContact O-N 3.06Å
532Y83.6Confident67.5Low25 Ų2592 Ų9210%0.09849%0.486CS..Hα-helixtrans-61.9-51.4173174.2-95.4000111.3N528 I529 S530 Q534 R535 C536 I553 I556 N557N528-Y532 PolarHBondContact O-N 3.27Å; I529-Y532 WeakPolarHBondContact O-CB 3.48Å; I529-Y532 PolarHBondContact O-N 3.14Å; S530-Y532 VanDerWaalsContact C-N 3.33Å; S530-Y532 PolarHBondContact O-N 3.45Å; Y532-Q534 PolarHBondContact O-N 3.49Å; Y532-R535 PolarHBondContact O-N 3.29Å; Y532-C536 PolarHBondContact O-N 3.35Å; Y532-C536 PolarHBondContact O-SG 3.02Å; Y532-I553 HydrophobicContact CD2-CG1 4.42Å; Y532-I553 HydrophobicContact CE2-CG1 4.22Å; Y532-I556 HydrophobicContact CD2-CD1 4.32Å; Y532-I556 HydrophobicContact CE2-CB 4.1Å; Y532-I556 HydrophobicContact CE2-CD1 3.84Å; Y532-I556 HydrophobicContact CE2-CG2 4.02Å; Y532-I556 VanDerWaalsContact OH-CG2 3.24Å; Y532-I556 WeakPolarHBondContact OH-CG2 3.21Å; Y532-N557 PolarHBondContact OH-OD1 2.94Å
533F82.9Confident69Low119 Ų11991.2 Ų91.252%0.52248%0.479SS..Hα-helixtrans-63.6-41.2178-80.5-72000112.2I529 S530 R535 C536 F537I529-F533 HydrophobicContact CG2-CD2 3.75Å; I529-F533 HydrophobicContact CG2-CE2 3.62Å; I529-F533 VanDerWaalsContact O-CD2 3.27Å; I529-F533 WeakPolarHBondContact O-CD2 3.45Å; I529-F533 PolarHBondContact O-N 3.36Å; I529-F533 VanDerWaalsContact O-N 3.08Å; S530-F533 PolarHBondContact O-N 3.03Å; F533-R535 PolarHBondContact O-N 3.16Å; F533-C536 WeakPolarHBondContact O-CB 3.46Å; F533-C536 PolarHBondContact O-N 2.86Å; F533-F537 WeakPolarHBondContact O-CD2 3.47Å; F533-F537 PolarHBondContact O-N 2.72Å
534Q82.9Confident70.5Confident107 Ų10789.8 Ų89.850%0.547%0.472SS..Hα-helixtrans-59.4-47176.2-76.1179.9-5.100111.5S530 Y532 C536 F537 K538S530-Q534 WeakPolarHBondContact O-CB 3.46Å; S530-Q534 WeakPolarHBondContact O-CG 3.5Å; S530-Q534 PolarHBondContact O-N 3.09Å; Y532-Q534 PolarHBondContact O-N 3.49Å; Q534-C536 VanDerWaalsContact C-N 3.32Å; Q534-C536 PolarHBondContact O-N 3Å; Q534-F537 PolarHBondContact O-N 3.05Å; Q534-K538 WeakPolarHBondContact O-CB 3.45Å; Q534-K538 PolarHBondContact O-N 3.24Å
535R79.4Confident71.9Confident91 Ų9192.6 Ų92.634%0.34348%0.479SS..Hα-helixtrans-68.8-26.4178.6-73.9-176.9170.4173-7.9114.1S531 Y532 F533 F537 T549 I553 Q613S531-R535 WeakPolarHBondContact O-CB 3.35Å; S531-R535 WeakPolarHBondContact O-CG 3.33Å; S531-R535 PolarHBondContact O-N 3.06Å; Y532-R535 PolarHBondContact O-N 3.29Å; F533-R535 PolarHBondContact O-N 3.16Å; R535-F537 VanDerWaalsContact C-N 3.26Å; R535-F537 PolarHBondContact O-N 3.32Å; R535-T549 VanDerWaalsContact CD-CG2 3.48Å; R535-T549 PolarHBondContact NH1-OG1 2.89Å; R535-I553 HydrophobicContact CB-CD1 3.72Å; R535-Q613 PolarHBondContact O-NE2 3.48Å
536C82.6Confident73.2Confident4 Ų489.9 Ų89.93%0.02747%0.466CS..Hα-helixtrans-63.2-33.3174.1-74.80000112.4Y532 F533 Q534 A609 Q613Y532-C536 PolarHBondContact O-N 3.35Å; Y532-C536 PolarHBondContact O-SG 3.02Å; F533-C536 WeakPolarHBondContact O-CB 3.46Å; F533-C536 PolarHBondContact O-N 2.86Å; Q534-C536 VanDerWaalsContact C-N 3.32Å; Q534-C536 PolarHBondContact O-N 3Å; C536-A609 HydrophobicContact CB-CB 4.07Å; C536-Q613 PolarHBondContact O-NE2 2.67Å
537F80.8Confident74.6Confident76 Ų7683.5 Ų83.533%0.33344%0.44SS..Hα-helixtrans-115.7-19.7-172.5-63.7-72.3000115.4F533 Q534 R535 I605 A609 R612F533-F537 WeakPolarHBondContact O-CD2 3.47Å; F533-F537 PolarHBondContact O-N 2.72Å; Q534-F537 PolarHBondContact O-N 3.05Å; R535-F537 VanDerWaalsContact C-N 3.26Å; R535-F537 PolarHBondContact O-N 3.32Å; F537-I605 HydrophobicContact CE1-CG2 4.43Å; F537-I605 HydrophobicContact CZ-CG2 3.76Å; F537-A609 HydrophobicContact CE1-CB 4.09Å; F537-A609 HydrophobicContact CZ-CB 4.2Å; F537-R612 PolarHBondContact O-NH1 3.4Å
538K73.2Confident75.3Confident151 Ų15186.6 Ų86.666%0.65745%0.453SS*.  trans-107107.1175.2-65.7-175.9178.1-176.70109.2Q534Q534-K538 WeakPolarHBondContact O-CB 3.45Å; Q534-K538 PolarHBondContact O-N 3.24Å
539L64.7Low75.6Confident94 Ų9481.8 Ų81.849%0.49243%0.428SS..PPolyproline II helixtrans-79.1126.2168.7-163.473.4000108.4P614L539-P614 HydrophobicContact CD1-CG 4.23Å
540E62Low76Confident120 Ų12076.1 Ų76.156%0.56140%0.399SS*.PPolyproline II helixtrans-67.8131.5170.8-78.8173-171.400109.1G542 L543E540-G542 PolarHBondContact O-N 3.24Å; E540-L543 HydrophobicContact CB-CD1 4.27Å; E540-L543 PolarHBondContact O-N 2.71Å
541P58.2Low76.3Confident133 Ų13375.3 Ų75.386%0.86439%0.387SS*.THydrogen-bonded Turntrans-57.7127.9176.8-20.530.2000111
542G62.4Low76.7Confident68 Ų6876.2 Ų76.270%0.70139%0.388SS*.THydrogen-bonded Turntrans98-0.1176.200000116.3E540 D544E540-G542 PolarHBondContact O-N 3.24Å; G542-D544 PolarHBondContact O-N 3.38Å
543L65.2Low77Confident60 Ų6075.1 Ų75.131%0.31438%0.384SS..  trans-86.774.9170.6-103.786.5000111.6E540 K545 P614E540-L543 HydrophobicContact CB-CD1 4.27Å; E540-L543 PolarHBondContact O-N 2.71Å; L543-K545 VanDerWaalsContact C-N 3.27Å; L543-P614 WeakPolarHBondContact O-CB 3.47Å
544D70.2Confident77.5Confident115 Ų11569.6 Ų69.662%0.61536%0.36SS*.  trans-78.7-15.1176.4-61.8-22.4000112.8G542 Q617G542-D544 PolarHBondContact O-N 3.38Å; D544-Q617 PolarHBondContact O-NE2 3.47Å
545K75.5Confident77.9Confident156 Ų15668.5 Ų68.568%0.67835%0.353SS*.SBendtrans-116.8146.8-176.7-65.1-178.3-177.9177.70111.3L543 S547L543-K545 VanDerWaalsContact C-N 3.27Å; K545-S547 PolarHBondContact O-N 2.98Å
546P80Confident78.5Confident15 Ų1567 Ų6710%0.09735%0.352CS..  trans-61.1133.3178.3-20.331000112.6G427 Q429 T550 N616G427-P546 WeakPolarHBondContact O-CB 3.43Å; Q429-P546 HydrophobicContact CG-CB 4.37Å; Q429-P546 WeakPolarHBondContact CG-O 3.34Å; Q429-P546 PolarHBondContact NE2-O 3.19Å; P546-T550 HydrophobicContact CB-CG2 4.14Å; P546-N616 HydrophobicContact CG-CB 4.43Å
547S82.6Confident79.1Confident32 Ų3267.1 Ų67.122%0.22435%0.352CS..  trans-95.8167.6170.270.40000111.5K545 T549 T550 E551K545-S547 PolarHBondContact O-N 2.98Å; S547-T549 PolarHBondContact O-N 3.34Å; S547-T549 WeakPolarHBondContact OG-CB 3.34Å; S547-T549 PolarHBondContact OG-N 2.89Å; S547-T550 PolarHBondContact N-OG1 3.23Å; S547-T550 WeakPolarHBondContact O-CA 3.2Å; S547-T550 VanDerWaalsContact O-CB 3.3Å; S547-T550 WeakPolarHBondContact O-CB 3.17Å; S547-T550 PolarHBondContact O-N 2.87Å; S547-T550 PolarHBondContact OG-N 3.45Å; S547-T550 PolarHBondContact OG-OG1 3.1Å; S547-E551 PolarHBondContact O-N 2.71Å
548K80.5Confident79.8Confident99 Ų9963.5 Ų63.543%0.4334%0.336SS..Hα-helixtrans-55.3-33.9170.3-69179.6-175.8164.30111.9Q429 D448 I525 L552Q429-K548 VanDerWaalsContact NE2-N 3.17Å; Q429-K548 VanDerWaalsContact OE1-CG 3.26Å; D448-K548 IonicContact OD1-NZ 3.05Å; D448-K548 IonicContact OD2-NZ 3.93Å; D448-K548 PolarHBondContact OD2-NZ 2.94Å; I525-K548 HydrophobicContact CD1-CB 4.21Å; K548-L552 PolarHBondContact O-N 2.92Å; K548-L552 VanDerWaalsContact O-N 3.14Å
549T83.2Confident80.9Confident20 Ų2059.8 Ų59.812%0.12332%0.319CS..Hα-helixtrans-66.7-44.4173.7-71.50000111.6L527 R535 S547 L552 I553L527-T549 HydrophobicContact CD1-CG2 4.18Å; R535-T549 VanDerWaalsContact CD-CG2 3.48Å; R535-T549 PolarHBondContact NH1-OG1 2.89Å; S547-T549 PolarHBondContact O-N 3.34Å; S547-T549 WeakPolarHBondContact OG-CB 3.34Å; S547-T549 PolarHBondContact OG-N 2.89Å; T549-L552 WeakPolarHBondContact O-CB 3.47Å; T549-L552 PolarHBondContact O-N 2.98Å; T549-I553 HydrophobicContact CG2-CD1 3.94Å; T549-I553 WeakPolarHBondContact O-CG1 3.36Å; T549-I553 PolarHBondContact O-N 3.12Å
550T86.6Confident82.4Confident4 Ų458.5 Ų58.53%0.02531%0.312CS..Hα-helixtrans-58.7-47.9176.1-55.50000110.5P546 S547 L552 I553 Y554 Q613 P614P546-T550 HydrophobicContact CB-CG2 4.14Å; S547-T550 PolarHBondContact N-OG1 3.23Å; S547-T550 WeakPolarHBondContact O-CA 3.2Å; S547-T550 VanDerWaalsContact O-CB 3.3Å; S547-T550 WeakPolarHBondContact O-CB 3.17Å; S547-T550 PolarHBondContact O-N 2.87Å; S547-T550 PolarHBondContact OG-N 3.45Å; S547-T550 PolarHBondContact OG-OG1 3.1Å; T550-L552 VanDerWaalsContact C-N 3.27Å; T550-L552 PolarHBondContact O-N 3.37Å; T550-I553 PolarHBondContact O-N 3.02Å; T550-I553 VanDerWaalsContact O-N 3.1Å; T550-Y554 HydrophobicContact CG2-CD2 3.65Å; T550-Y554 HydrophobicContact CG2-CE2 3.62Å; T550-Y554 WeakPolarHBondContact O-CD2 3.28Å; T550-Y554 PolarHBondContact O-N 2.67Å; T550-Q613 HydrophobicContact CG2-CB 4.33Å; T550-P614 HydrophobicContact CG2-CG 3.83Å
551E86.5Confident84.1Confident57 Ų5752.8 Ų52.827%0.26629%0.285SS..Hα-helixtrans-57.5-42.2177-174.1174.3168.900111.4K18 G427 Q428 S547 Y554 K555K18-E551 IonicContact NZ-OE1 2.72Å; K18-E551 PolarHBondContact NZ-OE1 3.27Å; G427-E551 WeakPolarHBondContact O-CA 3.43Å; G427-E551 WeakPolarHBondContact O-CB 3.47Å; Q428-E551 HydrophobicContact CG-CG 4.48Å; S547-E551 PolarHBondContact O-N 2.71Å; E551-Y554 PolarHBondContact O-N 3.49Å; E551-K555 WeakPolarHBondContact O-CB 3.35Å; E551-K555 PolarHBondContact O-N 3.04Å
552L87.9Confident85.9Confident55 Ų5548.2 Ų48.229%0.28825%0.253SS..Hα-helixtrans-63.4-42.4176.1-176.563.7000112.3L527 K548 T549 T550 K555 I556L527-L552 HydrophobicContact CD1-CD2 3.75Å; K548-L552 PolarHBondContact O-N 2.92Å; K548-L552 VanDerWaalsContact O-N 3.14Å; T549-L552 WeakPolarHBondContact O-CB 3.47Å; T549-L552 PolarHBondContact O-N 2.98Å; T550-L552 VanDerWaalsContact C-N 3.27Å; T550-L552 PolarHBondContact O-N 3.37Å; L552-K555 PolarHBondContact O-N 3.29Å; L552-I556 HydrophobicContact CD1-CD1 3.98Å; L552-I556 HydrophobicContact CD1-CG1 4.26Å; L552-I556 HydrophobicContact CG-CD1 3.89Å; L552-I556 WeakPolarHBondContact O-CG1 3.47Å; L552-I556 PolarHBondContact O-N 2.96Å
553I89.9Confident87.5Confident1 Ų148.4 Ų48.41%0.00524%0.243CC..Hα-helixtrans-62.2-48.6176.5-68.9167.5000110.3Y532 R535 T549 T550 K555 I556 N557 Q613Y532-I553 HydrophobicContact CD2-CG1 4.42Å; Y532-I553 HydrophobicContact CE2-CG1 4.22Å; R535-I553 HydrophobicContact CB-CD1 3.72Å; T549-I553 HydrophobicContact CG2-CD1 3.94Å; T549-I553 WeakPolarHBondContact O-CG1 3.36Å; T549-I553 PolarHBondContact O-N 3.12Å; T550-I553 PolarHBondContact O-N 3.02Å; T550-I553 VanDerWaalsContact O-N 3.1Å; I553-K555 VanDerWaalsContact C-N 3.27Å; I553-K555 PolarHBondContact O-N 3.17Å; I553-I556 PolarHBondContact O-N 3.27Å; I553-N557 WeakPolarHBondContact CG2-ND2 3.29Å; I553-N557 VanDerWaalsContact O-CB 3.26Å; I553-N557 WeakPolarHBondContact O-CB 3.37Å; I553-N557 PolarHBondContact O-N 2.9Å; I553-Q613 HydrophobicContact CG2-CG 3.97Å
554Y92.1Very high89.1Confident3 Ų348 Ų481%0.01224%0.239CC..Hα-helixtrans-56.5-43.9175.5-91.5-86.6000111.6L423 R426 G427 T550 E551 S558 L610 Q613 P614 E615L423-Y554 WeakPolarHBondContact O-CD1 3.4Å; R426-Y554 HydrophobicContact CB-CD1 4.36Å; R426-Y554 HydrophobicContact CB-CE1 3.73Å; G427-Y554 VanDerWaalsContact CA-CG 3.47Å; T550-Y554 HydrophobicContact CG2-CD2 3.65Å; T550-Y554 HydrophobicContact CG2-CE2 3.62Å; T550-Y554 WeakPolarHBondContact O-CD2 3.28Å; T550-Y554 PolarHBondContact O-N 2.67Å; E551-Y554 PolarHBondContact O-N 3.49Å; Y554-S558 WeakPolarHBondContact O-CB 3.41Å; Y554-S558 PolarHBondContact O-N 3.25Å; Y554-S558 PolarHBondContact O-OG 3.03Å; Y554-L610 HydrophobicContact CD1-CD2 3.48Å; Y554-L610 VanDerWaalsContact CD1-CD2 3.48Å; Y554-L610 HydrophobicContact CE1-CD2 3.84Å; Y554-L610 HydrophobicContact CG-CD2 3.97Å; Y554-L610 PolarHBondContact OH-O 3.31Å; Y554-Q613 HydrophobicContact CD2-CB 4.04Å; Y554-Q613 HydrophobicContact CD2-CG 4.47Å; Y554-Q613 HydrophobicContact CE2-CB 3.26Å; Y554-Q613 HydrophobicContact CE2-CG 4.12Å; Y554-Q613 PolarHBondContact OH-O 2.91Å; Y554-P614 WeakPolarHBondContact CE2-O 3.25Å; Y554-E615 WeakPolarHBondContact OH-CG 3.38Å
555K92.1Very high90.4Very high84 Ų8443 Ų4337%0.36521%0.212SC..Hα-helixtrans-61.7-52.8178.9-170.7176.5-177.7179.80112.2L424 E551 L552 I553 Y559L424-K555 HydrophobicContact CD2-CB 4.19Å; L424-K555 HydrophobicContact CD2-CG 4.26Å; E551-K555 WeakPolarHBondContact O-CB 3.35Å; E551-K555 PolarHBondContact O-N 3.04Å; L552-K555 PolarHBondContact O-N 3.29Å; I553-K555 VanDerWaalsContact C-N 3.27Å; I553-K555 PolarHBondContact O-N 3.17Å; K555-Y559 HydrophobicContact CD-CE2 4.32Å; K555-Y559 HydrophobicContact CG-CD2 3.98Å; K555-Y559 HydrophobicContact CG-CE2 3.51Å; K555-Y559 WeakPolarHBondContact O-CD2 3.45Å; K555-Y559 PolarHBondContact O-N 3.29Å
556I92.7Very high91.4Very high61 Ų6138.4 Ų38.431%0.31319%0.192SC..Hα-helixtrans-62.6-50.7-179.2-65.2169.3000110.2Y532 L552 I553 S558 Y559 L560Y532-I556 HydrophobicContact CD2-CD1 4.32Å; Y532-I556 HydrophobicContact CE2-CB 4.1Å; Y532-I556 HydrophobicContact CE2-CD1 3.84Å; Y532-I556 HydrophobicContact CE2-CG2 4.02Å; Y532-I556 VanDerWaalsContact OH-CG2 3.24Å; Y532-I556 WeakPolarHBondContact OH-CG2 3.21Å; L552-I556 HydrophobicContact CD1-CD1 3.98Å; L552-I556 HydrophobicContact CD1-CG1 4.26Å; L552-I556 HydrophobicContact CG-CD1 3.89Å; L552-I556 WeakPolarHBondContact O-CG1 3.47Å; L552-I556 PolarHBondContact O-N 2.96Å; I553-I556 PolarHBondContact O-N 3.27Å; I556-S558 PolarHBondContact O-N 3.48Å; I556-Y559 PolarHBondContact O-N 3.24Å; I556-L560 HydrophobicContact CG2-CD1 3.8Å; I556-L560 HydrophobicContact CG2-CG 4.24Å; I556-L560 WeakPolarHBondContact O-CB 3.48Å; I556-L560 WeakPolarHBondContact O-CG 3.23Å; I556-L560 PolarHBondContact O-N 3.3Å
557N95Very high92.2Very high6 Ų641 Ų413%0.03221%0.205CC..Hα-helixtrans-63.8-37-178.3-83.2-24.2000112.8Y532 I553 L560 L561 I606 L610Y532-N557 PolarHBondContact OH-OD1 2.94Å; I553-N557 WeakPolarHBondContact CG2-ND2 3.29Å; I553-N557 VanDerWaalsContact O-CB 3.26Å; I553-N557 WeakPolarHBondContact O-CB 3.37Å; I553-N557 PolarHBondContact O-N 2.9Å; N557-L560 PolarHBondContact O-N 3.28Å; N557-L561 WeakPolarHBondContact O-CB 3.39Å; N557-L561 PolarHBondContact O-N 3.3Å; N557-I606 HydrophobicContact CB-CG2 3.73Å; N557-I606 WeakPolarHBondContact O-CG2 3.4Å; N557-L610 HydrophobicContact CB-CD1 4.16Å; N557-L610 HydrophobicContact CB-CD2 3.7Å; N557-L610 HydrophobicContact CB-CG 3.84Å
558S96Very high92.8Very high0 Ų039.8 Ų39.80%020%0.197CC..Hα-helixtrans-65.8-41177.9-58.60000112.1L423 Y554 I556 L562L423-S558 WeakPolarHBondContact CB-OG 3.1Å; Y554-S558 WeakPolarHBondContact O-CB 3.41Å; Y554-S558 PolarHBondContact O-N 3.25Å; Y554-S558 PolarHBondContact O-OG 3.03Å; I556-S558 PolarHBondContact O-N 3.48Å; S558-L562 PolarHBondContact O-N 3.22Å
559Y95.6Very high93.5Very high73 Ų7335 Ų3529%0.28618%0.176SC..Hα-helixtrans-71.3-39.1175.7-67.8-54000112.6V108 K555 I556 L561 L562 C563V108-Y559 WeakPolarHBondContact CG1-OH 3.4Å; K555-Y559 HydrophobicContact CD-CE2 4.32Å; K555-Y559 HydrophobicContact CG-CD2 3.98Å; K555-Y559 HydrophobicContact CG-CE2 3.51Å; K555-Y559 WeakPolarHBondContact O-CD2 3.45Å; K555-Y559 PolarHBondContact O-N 3.29Å; I556-Y559 PolarHBondContact O-N 3.24Å; Y559-L561 VanDerWaalsContact C-N 3.35Å; Y559-L562 PolarHBondContact O-N 2.68Å; Y559-C563 PolarHBondContact O-N 2.84Å; Y559-C563 PolarHBondContact O-SG 3.08Å
560L96Very high94Very high67 Ų6738.8 Ų38.835%0.35120%0.195SC..Hα-helixtrans-61.1-45.5173.3-73.7177.8000111I556 N557 L562 C563 F564 I606I556-L560 HydrophobicContact CG2-CD1 3.8Å; I556-L560 HydrophobicContact CG2-CG 4.24Å; I556-L560 WeakPolarHBondContact O-CB 3.48Å; I556-L560 WeakPolarHBondContact O-CG 3.23Å; I556-L560 PolarHBondContact O-N 3.3Å; N557-L560 PolarHBondContact O-N 3.28Å; L560-L562 VanDerWaalsContact C-N 3.33Å; L560-L562 PolarHBondContact O-N 3.39Å; L560-C563 PolarHBondContact O-N 3.06Å; L560-F564 HydrophobicContact CB-CD2 4.2Å; L560-F564 HydrophobicContact CB-CE2 4.04Å; L560-F564 HydrophobicContact CD2-CE2 4.13Å; L560-F564 WeakPolarHBondContact O-CD2 3.48Å; L560-F564 PolarHBondContact O-N 3.02Å; L560-I606 HydrophobicContact CB-CD1 3.85Å
561L97.4Very high94.4Very high0 Ų038.8 Ų38.80%020%0.196CC..Hα-helixtrans-56.7-47.5176.7-177.963.3000111.2L423 N557 Y559 C563 F564 I565 I606 L610 A632L423-L561 HydrophobicContact CD1-CD2 3.85Å; N557-L561 WeakPolarHBondContact O-CB 3.39Å; N557-L561 PolarHBondContact O-N 3.3Å; Y559-L561 VanDerWaalsContact C-N 3.35Å; L561-C563 PolarHBondContact O-N 2.76Å; L561-F564 PolarHBondContact O-N 2.8Å; L561-I565 HydrophobicContact CD1-CD1 3.84Å; L561-I565 HydrophobicContact CD1-CG1 4.27Å; L561-I565 HydrophobicContact CG-CD1 3.82Å; L561-I565 WeakPolarHBondContact O-CB 3.3Å; L561-I565 VanDerWaalsContact O-CG1 3.24Å; L561-I565 WeakPolarHBondContact O-CG1 3.41Å; L561-I565 PolarHBondContact O-N 3.43Å; L561-I606 HydrophobicContact CB-CG2 3.94Å; L561-I606 HydrophobicContact CD1-CB 4.44Å; L561-I606 HydrophobicContact CD1-CG2 4.43Å; L561-L610 HydrophobicContact CD2-CD1 4.45Å; L561-A632 HydrophobicContact CD2-CB 4Å
562L97Very high94.6Very high37 Ų3737.3 Ų37.319%0.19419%0.19CC..Hα-helixtrans-56.1-51.3175-17767.9000111.2T416 V420 S558 Y559 L560 F564 I565 F566 I635T416-L562 HydrophobicContact CG2-CD1 3.6Å; V420-L562 HydrophobicContact CG2-CD1 4Å; V420-L562 HydrophobicContact CG2-CD2 4.29Å; S558-L562 PolarHBondContact O-N 3.22Å; Y559-L562 PolarHBondContact O-N 2.68Å; L560-L562 VanDerWaalsContact C-N 3.33Å; L560-L562 PolarHBondContact O-N 3.39Å; L562-F564 PolarHBondContact O-N 3.34Å; L562-I565 PolarHBondContact O-N 3.29Å; L562-F566 HydrophobicContact CD1-CD2 3.86Å; L562-F566 HydrophobicContact CD1-CE2 3.56Å; L562-F566 HydrophobicContact CG-CD2 4.24Å; L562-F566 HydrophobicContact CG-CE2 4.28Å; L562-F566 WeakPolarHBondContact O-CD2 3.49Å; L562-F566 PolarHBondContact O-N 3.5Å; L562-I635 HydrophobicContact CD1-CG2 3.64Å
563C96.6Very high94.8Very high72 Ų7236.4 Ų36.449%0.48619%0.185SC..Hα-helixtrans-59.7-47.1-179.9-69.60000112.7Y559 L560 L561 I565 F566 L567Y559-C563 PolarHBondContact O-N 2.84Å; Y559-C563 PolarHBondContact O-SG 3.08Å; L560-C563 PolarHBondContact O-N 3.06Å; L561-C563 PolarHBondContact O-N 2.76Å; C563-I565 PolarHBondContact O-N 3.05Å; C563-F566 PolarHBondContact O-N 3.4Å; C563-L567 WeakPolarHBondContact O-CB 3.4Å; C563-L567 WeakPolarHBondContact O-CG 3.46Å; C563-L567 PolarHBondContact O-N 3.26Å
564F97.4Very high94.9Very high52 Ų5240.6 Ų40.623%0.22821%0.207CC..Hα-helixtrans-67.1-37-178.7-71.9-58.9000112.5L560 L561 L562 L567 G568 M599 V602 I606L560-F564 HydrophobicContact CB-CD2 4.2Å; L560-F564 HydrophobicContact CB-CE2 4.04Å; L560-F564 HydrophobicContact CD2-CE2 4.13Å; L560-F564 WeakPolarHBondContact O-CD2 3.48Å; L560-F564 PolarHBondContact O-N 3.02Å; L561-F564 PolarHBondContact O-N 2.8Å; L562-F564 PolarHBondContact O-N 3.34Å; F564-L567 HydrophobicContact CD1-CD1 4.39Å; F564-L567 PolarHBondContact O-N 2.91Å; F564-G568 PolarHBondContact O-N 2.99Å; F564-M599 HydrophobicContact CD1-CE 4.46Å; F564-M599 HydrophobicContact CD1-SD 3.53Å; F564-M599 VanDerWaalsContact CD1-SD 3.53Å; F564-M599 HydrophobicContact CE1-SD 4.18Å; F564-V602 HydrophobicContact CD1-CG1 4.16Å; F564-V602 HydrophobicContact CD2-CG1 3.48Å; F564-V602 VanDerWaalsContact CD2-CG1 3.48Å; F564-V602 HydrophobicContact CE1-CG1 4.14Å; F564-V602 HydrophobicContact CE2-CG1 3.47Å; F564-V602 VanDerWaalsContact CE2-CG1 3.47Å; F564-V602 HydrophobicContact CG-CB 4.48Å; F564-V602 HydrophobicContact CG-CG1 3.85Å; F564-V602 HydrophobicContact CZ-CG1 3.81Å; F564-I606 HydrophobicContact CD2-CD1 3.55Å; F564-I606 HydrophobicContact CE2-CD1 3.88Å
565I97.5Very high94.8Very high10 Ų1041.3 Ų41.35%0.05121%0.211CC..Hα-helixtrans-63.2-43.9173.6-72.2171.6000111.2L561 L562 C563 G568 N569 I635 F636 A639L561-I565 HydrophobicContact CD1-CD1 3.84Å; L561-I565 HydrophobicContact CD1-CG1 4.27Å; L561-I565 HydrophobicContact CG-CD1 3.82Å; L561-I565 WeakPolarHBondContact O-CB 3.3Å; L561-I565 VanDerWaalsContact O-CG1 3.24Å; L561-I565 WeakPolarHBondContact O-CG1 3.41Å; L561-I565 PolarHBondContact O-N 3.43Å; L562-I565 PolarHBondContact O-N 3.29Å; C563-I565 PolarHBondContact O-N 3.05Å; I565-G568 PolarHBondContact O-N 3.47Å; I565-N569 PolarHBondContact O-N 3.46Å; I565-N569 PolarHBondContact O-ND2 3.2Å; I565-I635 HydrophobicContact CB-CG2 4.3Å; I565-I635 HydrophobicContact CD1-CB 4.09Å; I565-I635 HydrophobicContact CD1-CG2 3.8Å; I565-I635 HydrophobicContact CG2-CG2 3.96Å; I565-F636 VanDerWaalsContact CG2-CA 3.46Å; I565-F636 HydrophobicContact CG2-CB 3.96Å; I565-F636 HydrophobicContact CG2-CD2 4.21Å; I565-A639 HydrophobicContact CG2-CB 3.99Å
566F96.5Very high94.4Very high58 Ų5841.4 Ų41.425%0.25422%0.216SC..Hα-helixtrans-65.8-41.8177-92.3-98.3000112.4T416 L562 C563 N569 L570 A639 M642T416-F566 HydrophobicContact CG2-CE2 4.23Å; L562-F566 HydrophobicContact CD1-CD2 3.86Å; L562-F566 HydrophobicContact CD1-CE2 3.56Å; L562-F566 HydrophobicContact CG-CD2 4.24Å; L562-F566 HydrophobicContact CG-CE2 4.28Å; L562-F566 WeakPolarHBondContact O-CD2 3.49Å; L562-F566 PolarHBondContact O-N 3.5Å; C563-F566 PolarHBondContact O-N 3.4Å; F566-N569 PolarHBondContact O-N 2.99Å; F566-L570 WeakPolarHBondContact O-CB 3.01Å; F566-L570 PolarHBondContact O-N 3.4Å; F566-A639 HydrophobicContact CD1-CB 4.42Å; F566-A639 HydrophobicContact CD2-CB 3.98Å; F566-A639 HydrophobicContact CE1-CB 4.32Å; F566-A639 HydrophobicContact CE2-CB 3.86Å; F566-A639 HydrophobicContact CG-CB 4.29Å; F566-A639 HydrophobicContact CZ-CB 4.07Å; F566-M642 HydrophobicContact CE1-CE 4.17Å; F566-M642 HydrophobicContact CE2-CE 4.37Å; F566-M642 HydrophobicContact CZ-CE 3.49Å; F566-M642 VanDerWaalsContact CZ-CE 3.49Å; F566-M642 HydrophobicContact CZ-SD 4.47Å
567L96.2Very high94.2Very high71 Ų7146.2 Ų46.237%0.37223%0.234SC..Hα-helixtrans-62.1-43.2175.6-74171.3000111.9C563 F564 N569 L570 G571 F595 M599C563-L567 WeakPolarHBondContact O-CB 3.4Å; C563-L567 WeakPolarHBondContact O-CG 3.46Å; C563-L567 PolarHBondContact O-N 3.26Å; F564-L567 HydrophobicContact CD1-CD1 4.39Å; F564-L567 PolarHBondContact O-N 2.91Å; L567-N569 PolarHBondContact O-N 3.19Å; L567-L570 PolarHBondContact O-N 3.02Å; L567-G571 PolarHBondContact O-N 3.48Å; L567-F595 HydrophobicContact CB-CZ 4.21Å; L567-M599 HydrophobicContact CB-CG 4.18Å; L567-M599 HydrophobicContact CB-SD 3.91Å; L567-M599 HydrophobicContact CD1-SD 4.18Å
568G96.3Very high93.9Very high5 Ų547.8 Ų47.85%0.05224%0.242CC..Hα-helixtrans-59.7-45.4174.300000111.9F564 I565 L570 G571 I572F564-G568 PolarHBondContact O-N 2.99Å; I565-G568 PolarHBondContact O-N 3.47Å; G568-L570 VanDerWaalsContact C-N 3.34Å; G568-L570 PolarHBondContact O-N 3.41Å; G568-G571 PolarHBondContact O-N 2.86Å; G568-I572 WeakPolarHBondContact O-CG1 3.48Å; G568-I572 PolarHBondContact O-N 3.45Å
569N95.2Very high93.6Very high0 Ų052 Ų520%027%0.269CS..Hα-helixtrans-65.1-34.6176.4-83.7-71.3000113.3I565 F566 L567 G571 I572 L573 F636 A639 Y640 V643I565-N569 PolarHBondContact O-N 3.46Å; I565-N569 PolarHBondContact O-ND2 3.2Å; F566-N569 PolarHBondContact O-N 2.99Å; L567-N569 PolarHBondContact O-N 3.19Å; N569-G571 VanDerWaalsContact C-N 3.32Å; N569-I572 PolarHBondContact O-N 2.91Å; N569-L573 PolarHBondContact O-N 3.43Å; N569-F636 WeakPolarHBondContact ND2-CD2 3.3Å; N569-A639 HydrophobicContact CB-CB 4.47Å; N569-Y640 WeakPolarHBondContact OD1-CA 3.44Å; N569-Y640 WeakPolarHBondContact OD1-CB 3.33Å; N569-Y640 WeakPolarHBondContact OD1-CD2 3.44Å; N569-Y640 PolarHBondContact OD1-N 3.22Å; N569-V643 HydrophobicContact CB-CG1 4.31Å; N569-V643 HydrophobicContact CB-CG2 4.09Å
570L94Very high93.1Very high98 Ų9855.8 Ų55.851%0.51329%0.29SS..Hα-helixtrans-65.4-36.7173.3-17264.7000111.7F566 L567 G568 L573 L574F566-L570 WeakPolarHBondContact O-CB 3.01Å; F566-L570 PolarHBondContact O-N 3.4Å; L567-L570 PolarHBondContact O-N 3.02Å; G568-L570 VanDerWaalsContact C-N 3.34Å; G568-L570 PolarHBondContact O-N 3.41Å; L570-L573 HydrophobicContact CD1-CD2 4.28Å; L570-L573 PolarHBondContact O-N 3.42Å; L570-L574 WeakPolarHBondContact O-CB 3.26Å; L570-L574 PolarHBondContact O-N 2.87Å
571G94Very high92.7Very high5 Ų560 Ų605%0.05231%0.308CS..Hα-helixtrans-63.9-39.8171.900000112.8L567 G568 N569 L574 L575 I592L567-G571 PolarHBondContact O-N 3.48Å; G568-G571 PolarHBondContact O-N 2.86Å; N569-G571 VanDerWaalsContact C-N 3.32Å; G571-L574 WeakPolarHBondContact O-CB 3.24Å; G571-L574 PolarHBondContact O-N 3.26Å; G571-L575 PolarHBondContact O-N 3.25Å; G571-I592 WeakPolarHBondContact O-CG2 3.4Å
572I92.3Very high92.2Very high26 Ų2660.9 Ų60.913%0.13332%0.315CS..Hα-helixtrans-65-44.5173.9-61.7167.2000110.6G568 N569 L574 L575 D576 V596 F636 Y640G568-I572 WeakPolarHBondContact O-CG1 3.48Å; G568-I572 PolarHBondContact O-N 3.45Å; N569-I572 PolarHBondContact O-N 2.91Å; I572-L574 VanDerWaalsContact C-N 3.28Å; I572-L574 PolarHBondContact O-N 2.97Å; I572-L575 WeakPolarHBondContact O-CB 3.41Å; I572-L575 PolarHBondContact O-N 3.15Å; I572-D576 PolarHBondContact O-N 3.06Å; I572-V596 HydrophobicContact CD1-CG1 4.26Å; I572-V596 HydrophobicContact CG1-CG1 3.9Å; I572-V596 HydrophobicContact CG1-CG2 4.17Å; I572-F636 HydrophobicContact CD1-CE2 4.31Å; I572-F636 HydrophobicContact CD1-CZ 4.33Å; I572-Y640 HydrophobicContact CG2-CD2 4.49Å; I572-Y640 HydrophobicContact CG2-CE2 3.93Å
573L91Very high91.7Very high35 Ų3562 Ų6218%0.18332%0.323CS..Hα-helixtrans-59.7-40.5175.8-179.569.7000111.8N569 L570 L575 D576 K577 V643N569-L573 PolarHBondContact O-N 3.43Å; L570-L573 HydrophobicContact CD1-CD2 4.28Å; L570-L573 PolarHBondContact O-N 3.42Å; L573-L575 VanDerWaalsContact C-N 3.31Å; L573-L575 PolarHBondContact O-N 3.39Å; L573-D576 PolarHBondContact O-N 3.42Å; L573-K577 HydrophobicContact CD1-CG 4.27Å; L573-K577 HydrophobicContact CG-CG 4.37Å; L573-K577 WeakPolarHBondContact O-CG 3.47Å; L573-K577 PolarHBondContact O-N 3.37Å; L573-V643 HydrophobicContact CB-CB 4.48Å; L573-V643 HydrophobicContact CB-CG2 4.27Å; L573-V643 WeakPolarHBondContact CD1-O 3.32Å; L573-V643 HydrophobicContact CD2-CB 4.19Å; L573-V643 WeakPolarHBondContact CD2-O 3.49Å
574L91.5Very high91.2Very high90 Ų9066.2 Ų66.247%0.47133%0.333SS..Hα-helixtrans-59.5-44.9177.6-178.463.6000110.8L570 G571 I572 K577 L578 I592L570-L574 WeakPolarHBondContact O-CB 3.26Å; L570-L574 PolarHBondContact O-N 2.87Å; G571-L574 WeakPolarHBondContact O-CB 3.24Å; G571-L574 PolarHBondContact O-N 3.26Å; I572-L574 VanDerWaalsContact C-N 3.28Å; I572-L574 PolarHBondContact O-N 2.97Å; L574-K577 PolarHBondContact O-N 2.77Å; L574-L578 WeakPolarHBondContact O-CG 3.16Å; L574-L578 PolarHBondContact O-N 2.84Å; L574-I592 HydrophobicContact CD2-CD1 3.76Å; L574-I592 HydrophobicContact CD2-CG1 4.05Å; L574-I592 HydrophobicContact CD2-CG2 4.33Å; L574-I592 HydrophobicContact CG-CD1 4.08Å
575L89.7Confident90.8Very high17 Ų1767.6 Ų67.69%0.08934%0.343CS..Hα-helixtrans-60.1-45.2174.4-71.5163.9000111.9G571 I572 L573 K577 L578 T589 I592 W593G571-L575 PolarHBondContact O-N 3.25Å; I572-L575 WeakPolarHBondContact O-CB 3.41Å; I572-L575 PolarHBondContact O-N 3.15Å; L573-L575 VanDerWaalsContact C-N 3.31Å; L573-L575 PolarHBondContact O-N 3.39Å; L575-K577 PolarHBondContact O-N 3.46Å; L575-L578 HydrophobicContact CD2-CD1 4.29Å; L575-L578 PolarHBondContact O-N 3.42Å; L575-T589 HydrophobicContact CD2-CG2 4.11Å; L575-I592 HydrophobicContact CD1-CG2 3.9Å; L575-I592 HydrophobicContact CD2-CB 3.96Å; L575-I592 HydrophobicContact CD2-CD1 4.07Å; L575-I592 HydrophobicContact CD2-CG2 3.98Å; L575-I592 HydrophobicContact CG-CB 4.15Å; L575-I592 HydrophobicContact CG-CG2 3.59Å; L575-W593 HydrophobicContact CD1-CD2 3.7Å; L575-W593 VanDerWaalsContact CD1-CE2 3.45Å; L575-W593 HydrophobicContact CD1-CE3 4.19Å; L575-W593 HydrophobicContact CD1-CG 4.1Å; L575-W593 HydrophobicContact CD1-CH2 4.24Å; L575-W593 HydrophobicContact CD1-CZ2 3.75Å; L575-W593 HydrophobicContact CD1-CZ3 4.44Å
576D85.4Confident90.5Very high87 Ų8773.8 Ų73.847%0.46537%0.373SS..Hα-helixtrans-63.7-25.1179-83.110.7000113I572 L573 K644I572-D576 PolarHBondContact O-N 3.06Å; L573-D576 PolarHBondContact O-N 3.42Å; D576-K644 WeakPolarHBondContact OD2-CE 3.48Å; D576-K644 IonicContact OD2-NZ 3.4Å; D576-K644 PolarHBondContact OD2-NZ 3.46Å
577K87.5Confident90.3Very high161 Ų16178.4 Ų78.470%0.740%0.399SS*.Hα-helixtrans-95-8.3-179.8-69.3-66.2-176.1-173.50114.1L573 L574 L575L573-K577 HydrophobicContact CD1-CG 4.27Å; L573-K577 HydrophobicContact CG-CG 4.37Å; L573-K577 WeakPolarHBondContact O-CG 3.47Å; L573-K577 PolarHBondContact O-N 3.37Å; L574-K577 PolarHBondContact O-N 2.77Å; L575-K577 PolarHBondContact O-N 3.46Å
578L89.9Confident90.1Very high39 Ų3977.7 Ų77.720%0.20440%0.398CS..SBendtrans-66.5139.8177.2-77.4174.3000110.5L574 L575 A582 T583 V588 T589 I592L574-L578 WeakPolarHBondContact O-CG 3.16Å; L574-L578 PolarHBondContact O-N 2.84Å; L575-L578 HydrophobicContact CD2-CD1 4.29Å; L575-L578 PolarHBondContact O-N 3.42Å; L578-A582 HydrophobicContact CB-CB 4.29Å; L578-A582 HydrophobicContact CD2-CB 4.06Å; L578-T583 HydrophobicContact CB-CG2 3.66Å; L578-V588 HydrophobicContact CD1-CG1 3.92Å; L578-V588 HydrophobicContact CD2-CG1 4.31Å; L578-T589 HydrophobicContact CD1-CG2 4.35Å; L578-I592 HydrophobicContact CD1-CD1 3.91Å
579P88.6Confident90Very high88 Ų8878.2 Ų78.257%0.57140%0.4SS*.  trans-62.1150.9171.126.5-32.8000110E581 A582 T583P579-E581 PolarHBondContact O-N 3.17Å; P579-E581 VanDerWaalsContact O-N 3.08Å; P579-A582 HydrophobicContact CG-CB 3.78Å; P579-A582 WeakPolarHBondContact O-CA 3.49Å; P579-A582 WeakPolarHBondContact O-CB 3.46Å; P579-A582 PolarHBondContact O-N 3.31Å; P579-T583 PolarHBondContact O-N 3.37Å
580E84.9Confident89.9Confident153 Ų15381.7 Ų81.772%0.71542%0.421SS*.Hα-helixtrans-53-37.9-175-71.7-168.5174.400113.1A582 T583 K584E580-A582 PolarHBondContact O-N 3.37Å; E580-T583 WeakPolarHBondContact CA-OG1 3.33Å; E580-T583 PolarHBondContact O-N 3Å; E580-T583 PolarHBondContact O-OG1 3.29Å; E580-K584 PolarHBondContact O-N 3.49Å
581E87.4Confident90Very high157 Ų15780.5 Ų80.573%0.73442%0.419SS*.Hα-helixtrans-61.2-42.6176.2-170.1170.3-169.400112.3P579 K584 N585P579-E581 PolarHBondContact O-N 3.17Å; P579-E581 VanDerWaalsContact O-N 3.08Å; E581-K584 PolarHBondContact O-N 2.94Å; E581-N585 VanDerWaalsContact O-CG 3.32Å; E581-N585 PolarHBondContact O-N 3.23Å; E581-N585 PolarHBondContact O-ND2 3.24Å; E581-N585 PolarHBondContact O-OD1 3.22Å
582A87.8Confident90.1Very high18 Ų1881.3 Ų81.315%0.14942%0.422CS..Hα-helixtrans-71.3-32.2176.500000112.5L578 P579 E580 K584 N585L578-A582 HydrophobicContact CB-CB 4.29Å; L578-A582 HydrophobicContact CD2-CB 4.06Å; P579-A582 HydrophobicContact CG-CB 3.78Å; P579-A582 WeakPolarHBondContact O-CA 3.49Å; P579-A582 WeakPolarHBondContact O-CB 3.46Å; P579-A582 PolarHBondContact O-N 3.31Å; E580-A582 PolarHBondContact O-N 3.37Å; A582-K584 PolarHBondContact O-N 3.29Å; A582-N585 WeakPolarHBondContact O-CB 3.48Å; A582-N585 PolarHBondContact O-N 3.41Å; A582-N585 VanDerWaalsContact O-N 3.11Å
583T85.3Confident90.2Very high59 Ų5987.2 Ų87.236%0.36244%0.443SS..Hα-helixtrans-64.9-28.5175.863.80000112.9L578 P579 E580 N585 T589L578-T583 HydrophobicContact CB-CG2 3.66Å; P579-T583 PolarHBondContact O-N 3.37Å; E580-T583 WeakPolarHBondContact CA-OG1 3.33Å; E580-T583 PolarHBondContact O-N 3Å; E580-T583 PolarHBondContact O-OG1 3.29Å; T583-N585 VanDerWaalsContact C-N 3.35Å; T583-T589 WeakPolarHBondContact O-CG2 3.39Å
584K85.8Confident90.4Very high161 Ų16189.8 Ų89.870%0.746%0.46SS*.Hα-helixtrans-78.5-20.9174.5-67.7175.4-176171.30112.6E580 E581 A582 M586E580-K584 PolarHBondContact O-N 3.49Å; E581-K584 PolarHBondContact O-N 2.94Å; A582-K584 PolarHBondContact O-N 3.29Å; K584-M586 PolarHBondContact O-N 3.48Å; K584-M586 VanDerWaalsContact O-N 3.13Å
585N90.2Very high90.7Very high82 Ų8289.3 Ų89.344%0.43945%0.454SS..  trans-77.3100-179.2-68.5-18.3000111.1E581 A582 T583 I587 V588 T589E581-N585 VanDerWaalsContact O-CG 3.32Å; E581-N585 PolarHBondContact O-N 3.23Å; E581-N585 PolarHBondContact O-ND2 3.24Å; E581-N585 PolarHBondContact O-OD1 3.22Å; A582-N585 WeakPolarHBondContact O-CB 3.48Å; A582-N585 PolarHBondContact O-N 3.41Å; A582-N585 VanDerWaalsContact O-N 3.11Å; T583-N585 VanDerWaalsContact C-N 3.35Å; N585-I587 PolarHBondContact O-N 3.36Å; N585-I587 VanDerWaalsContact O-N 3.12Å; N585-V588 HydrophobicContact CB-CB 4.49Å; N585-V588 HydrophobicContact CB-CG2 4.21Å; N585-V588 PolarHBondContact O-N 3.14Å; N585-T589 PolarHBondContact O-N 2.97Å; N585-T589 VanDerWaalsContact O-N 3.1Å; N585-T589 PolarHBondContact O-OG1 3.2Å
586M91.5Very high91Very high139 Ų13988.6 Ų88.669%0.68545%0.451SS*.Hα-helixtrans-55-32.6-179.6-68.2-18072.200113.7K584 V588 T589 V590K584-M586 PolarHBondContact O-N 3.48Å; K584-M586 VanDerWaalsContact O-N 3.13Å; M586-V588 PolarHBondContact O-N 2.67Å; M586-T589 PolarHBondContact O-N 2.89Å; M586-V590 HydrophobicContact CB-CG2 4.28Å; M586-V590 VanDerWaalsContact O-CB 3.26Å; M586-V590 WeakPolarHBondContact O-CB 3.5Å; M586-V590 VanDerWaalsContact O-CG2 3.24Å; M586-V590 WeakPolarHBondContact O-CG2 3.36Å; M586-V590 PolarHBondContact O-N 3.25Å
587I92.6Very high91.5Very high155 Ų15586.2 Ų86.280%0.79545%0.447SS*.Hα-helixtrans-61-31.1177.5-62.8174.1000111.4N585 P591N585-I587 PolarHBondContact O-N 3.36Å; N585-I587 VanDerWaalsContact O-N 3.12Å; I587-P591 WeakPolarHBondContact O-CD 3.48Å; I587-P591 VanDerWaalsContact O-CG 3.26Å; I587-P591 WeakPolarHBondContact O-CG 3.31Å
588V92Very high91.9Very high56 Ų5682.9 Ų82.934%0.33944%0.436SS..Hα-helixtrans-88.5-44.9178.8-179.80000110.9L578 N585 M586 P591 I592L578-V588 HydrophobicContact CD1-CG1 3.92Å; L578-V588 HydrophobicContact CD2-CG1 4.31Å; N585-V588 HydrophobicContact CB-CB 4.49Å; N585-V588 HydrophobicContact CB-CG2 4.21Å; N585-V588 PolarHBondContact O-N 3.14Å; M586-V588 PolarHBondContact O-N 2.67Å; V588-P591 WeakPolarHBondContact O-CD 3.49Å; V588-I592 HydrophobicContact CG1-CD1 4.22Å; V588-I592 WeakPolarHBondContact O-CD1 3.4Å; V588-I592 WeakPolarHBondContact O-CG1 3.24Å
589T93.3Very high92.3Very high17 Ų1781.7 Ų81.710%0.10443%0.43CS..Hα-helixtrans-78.9-34.9-171.554.40000114L575 L578 T583 N585 M586 I592 W593L575-T589 HydrophobicContact CD2-CG2 4.11Å; L578-T589 HydrophobicContact CD1-CG2 4.35Å; T583-T589 WeakPolarHBondContact O-CG2 3.39Å; N585-T589 PolarHBondContact O-N 2.97Å; N585-T589 VanDerWaalsContact O-N 3.1Å; N585-T589 PolarHBondContact O-OG1 3.2Å; M586-T589 PolarHBondContact O-N 2.89Å; T589-I592 PolarHBondContact O-N 2.75Å; T589-W593 VanDerWaalsContact O-CD1 3.31Å; T589-W593 PolarHBondContact O-N 3.23Å
590V94.3Very high92.6Very high73 Ų7381.3 Ų81.344%0.44242%0.422SS..Hα-helixtrans-61.3-48.1-179.5172.20000111.9M586 I592 W593 T594M586-V590 HydrophobicContact CB-CG2 4.28Å; M586-V590 VanDerWaalsContact O-CB 3.26Å; M586-V590 WeakPolarHBondContact O-CB 3.5Å; M586-V590 VanDerWaalsContact O-CG2 3.24Å; M586-V590 WeakPolarHBondContact O-CG2 3.36Å; M586-V590 PolarHBondContact O-N 3.25Å; V590-I592 VanDerWaalsContact C-N 3.27Å; V590-I592 PolarHBondContact O-N 3.33Å; V590-W593 PolarHBondContact O-N 2.74Å; V590-T594 HydrophobicContact CG1-CG2 4.19Å; V590-T594 VanDerWaalsContact O-CG2 3.31Å; V590-T594 WeakPolarHBondContact O-CG2 3.38Å; V590-T594 PolarHBondContact O-N 3.15Å; V590-T594 PolarHBondContact O-OG1 3.48Å
591P95.6Very high93.2Very high73 Ų7378.6 Ų78.647%0.47441%0.412SS..Hα-helixtrans-59.1-34.6176-26.335.7000114.2I587 V588 T594 F595I587-P591 WeakPolarHBondContact O-CD 3.48Å; I587-P591 VanDerWaalsContact O-CG 3.26Å; I587-P591 WeakPolarHBondContact O-CG 3.31Å; V588-P591 WeakPolarHBondContact O-CD 3.49Å; P591-T594 WeakPolarHBondContact CA-OG1 3.2Å; P591-T594 PolarHBondContact O-OG1 2.59Å; P591-F595 WeakPolarHBondContact O-CB 3.41Å; P591-F595 PolarHBondContact O-N 3.32Å
592I95Very high93.6Very high21 Ų2172.8 Ų72.811%0.10839%0.387CS..Hα-helixtrans-73.5-44179.4-56.1165.4000109.9G571 L574 L575 L578 V588 T589 V590 T594 F595 V596G571-I592 WeakPolarHBondContact O-CG2 3.4Å; L574-I592 HydrophobicContact CD2-CD1 3.76Å; L574-I592 HydrophobicContact CD2-CG1 4.05Å; L574-I592 HydrophobicContact CD2-CG2 4.33Å; L574-I592 HydrophobicContact CG-CD1 4.08Å; L575-I592 HydrophobicContact CD1-CG2 3.9Å; L575-I592 HydrophobicContact CD2-CB 3.96Å; L575-I592 HydrophobicContact CD2-CD1 4.07Å; L575-I592 HydrophobicContact CD2-CG2 3.98Å; L575-I592 HydrophobicContact CG-CB 4.15Å; L575-I592 HydrophobicContact CG-CG2 3.59Å; L578-I592 HydrophobicContact CD1-CD1 3.91Å; V588-I592 HydrophobicContact CG1-CD1 4.22Å; V588-I592 WeakPolarHBondContact O-CD1 3.4Å; V588-I592 WeakPolarHBondContact O-CG1 3.24Å; T589-I592 PolarHBondContact O-N 2.75Å; V590-I592 VanDerWaalsContact C-N 3.27Å; V590-I592 PolarHBondContact O-N 3.33Å; I592-T594 PolarHBondContact O-N 3.35Å; I592-F595 WeakPolarHBondContact O-CB 3.38Å; I592-F595 PolarHBondContact O-N 3.11Å; I592-V596 WeakPolarHBondContact O-CG2 3.49Å; I592-V596 PolarHBondContact O-N 3.19Å
593W94.9Very high94.1Very high151 Ų15172.5 Ų72.557%0.57238%0.384SS*.Hα-helixtrans-63.4-38.5174.9-82.7115.5000112.9L575 T589 V590 V596 G597L575-W593 HydrophobicContact CD1-CD2 3.7Å; L575-W593 VanDerWaalsContact CD1-CE2 3.45Å; L575-W593 HydrophobicContact CD1-CE3 4.19Å; L575-W593 HydrophobicContact CD1-CG 4.1Å; L575-W593 HydrophobicContact CD1-CH2 4.24Å; L575-W593 HydrophobicContact CD1-CZ2 3.75Å; L575-W593 HydrophobicContact CD1-CZ3 4.44Å; T589-W593 VanDerWaalsContact O-CD1 3.31Å; T589-W593 PolarHBondContact O-N 3.23Å; V590-W593 PolarHBondContact O-N 2.74Å; W593-V596 PolarHBondContact O-N 3.43Å; W593-G597 PolarHBondContact O-N 3.18Å
594T95.6Very high94.6Very high88 Ų8873.6 Ų73.654%0.5439%0.387SS..Hα-helixtrans-66.5-38.717556.30000111.6V590 P591 I592 G597 L598V590-T594 HydrophobicContact CG1-CG2 4.19Å; V590-T594 VanDerWaalsContact O-CG2 3.31Å; V590-T594 WeakPolarHBondContact O-CG2 3.38Å; V590-T594 PolarHBondContact O-N 3.15Å; V590-T594 PolarHBondContact O-OG1 3.48Å; P591-T594 WeakPolarHBondContact CA-OG1 3.2Å; P591-T594 PolarHBondContact O-OG1 2.59Å; I592-T594 PolarHBondContact O-N 3.35Å; T594-G597 PolarHBondContact O-N 3.04Å; T594-L598 WeakPolarHBondContact O-CB 3.48Å; T594-L598 PolarHBondContact O-N 3.47Å
595F96.9Very high95.1Very high81 Ų8169.5 Ų69.536%0.35537%0.372SS..Hα-helixtrans-61-49.9172.3176.1-98.3000111.8L567 P591 I592 G597 L598 M599L567-F595 HydrophobicContact CB-CZ 4.21Å; P591-F595 WeakPolarHBondContact O-CB 3.41Å; P591-F595 PolarHBondContact O-N 3.32Å; I592-F595 WeakPolarHBondContact O-CB 3.38Å; I592-F595 PolarHBondContact O-N 3.11Å; F595-G597 VanDerWaalsContact C-N 3.34Å; F595-G597 PolarHBondContact O-N 2.88Å; F595-L598 WeakPolarHBondContact O-CB 3.27Å; F595-L598 PolarHBondContact O-N 3.33Å; F595-M599 HydrophobicContact CD1-CG 4.34Å; F595-M599 HydrophobicContact CD2-CE 4.06Å; F595-M599 HydrophobicContact CE1-CG 3.96Å; F595-M599 HydrophobicContact CE2-CE 3.68Å; F595-M599 HydrophobicContact CE2-CG 4.36Å; F595-M599 HydrophobicContact CE2-SD 4.15Å; F595-M599 HydrophobicContact CZ-CE 4.14Å; F595-M599 HydrophobicContact CZ-CG 3.97Å; F595-M599 HydrophobicContact CZ-SD 3.98Å; F595-M599 WeakPolarHBondContact O-CG 3.29Å; F595-M599 PolarHBondContact O-N 3.18Å
596V96Very high95.4Very high2 Ų266.1 Ų66.11%0.01235%0.354CS..Hα-helixtrans-57.8-46.9176.5172.40000110.8I572 I592 W593 L598 M599 I600I572-V596 HydrophobicContact CD1-CG1 4.26Å; I572-V596 HydrophobicContact CG1-CG1 3.9Å; I572-V596 HydrophobicContact CG1-CG2 4.17Å; I592-V596 WeakPolarHBondContact O-CG2 3.49Å; I592-V596 PolarHBondContact O-N 3.19Å; W593-V596 PolarHBondContact O-N 3.43Å; V596-L598 VanDerWaalsContact C-N 3.32Å; V596-L598 PolarHBondContact O-N 3.03Å; V596-M599 PolarHBondContact O-N 3.06Å; V596-I600 HydrophobicContact CG1-CD1 3.93Å; V596-I600 WeakPolarHBondContact O-CG1 3.43Å; V596-I600 PolarHBondContact O-N 2.91Å
597G96.2Very high95.6Very high37 Ų3759.7 Ų59.738%0.38132%0.322SS..Hα-helixtrans-59.7-39.817700000113W593 T594 F595 I600 L601W593-G597 PolarHBondContact O-N 3.18Å; T594-G597 PolarHBondContact O-N 3.04Å; F595-G597 VanDerWaalsContact C-N 3.34Å; F595-G597 PolarHBondContact O-N 2.88Å; G597-I600 PolarHBondContact O-N 3.42Å; G597-L601 WeakPolarHBondContact O-CB 3.38Å; G597-L601 PolarHBondContact O-N 3.5Å
598L97.2Very high95.6Very high91 Ų9154 Ų5448%0.47630%0.296SS..Hα-helixtrans-64.2-43.7175-177.367.2000111.7T594 F595 V596 I600 L601 V602T594-L598 WeakPolarHBondContact O-CB 3.48Å; T594-L598 PolarHBondContact O-N 3.47Å; F595-L598 WeakPolarHBondContact O-CB 3.27Å; F595-L598 PolarHBondContact O-N 3.33Å; V596-L598 VanDerWaalsContact C-N 3.32Å; V596-L598 PolarHBondContact O-N 3.03Å; L598-I600 VanDerWaalsContact C-N 3.33Å; L598-I600 PolarHBondContact O-N 3.29Å; L598-L601 PolarHBondContact O-N 3.3Å; L598-V602 HydrophobicContact CD1-CG2 4.49Å; L598-V602 VanDerWaalsContact O-CG2 3.3Å; L598-V602 WeakPolarHBondContact O-CG2 3.42Å; L598-V602 PolarHBondContact O-N 3.34Å
599M97.5Very high95.6Very high14 Ų1451.4 Ų51.47%0.06928%0.281CS..Hα-helixtrans-63.1-39.8177.9-63.5-55.7106.400111.8F564 L567 F595 V596 S603F564-M599 HydrophobicContact CD1-CE 4.46Å; F564-M599 HydrophobicContact CD1-SD 3.53Å; F564-M599 VanDerWaalsContact CD1-SD 3.53Å; F564-M599 HydrophobicContact CE1-SD 4.18Å; L567-M599 HydrophobicContact CB-CG 4.18Å; L567-M599 HydrophobicContact CB-SD 3.91Å; L567-M599 HydrophobicContact CD1-SD 4.18Å; F595-M599 HydrophobicContact CD1-CG 4.34Å; F595-M599 HydrophobicContact CD2-CE 4.06Å; F595-M599 HydrophobicContact CE1-CG 3.96Å; F595-M599 HydrophobicContact CE2-CE 3.68Å; F595-M599 HydrophobicContact CE2-CG 4.36Å; F595-M599 HydrophobicContact CE2-SD 4.15Å; F595-M599 HydrophobicContact CZ-CE 4.14Å; F595-M599 HydrophobicContact CZ-CG 3.97Å; F595-M599 HydrophobicContact CZ-SD 3.98Å; F595-M599 WeakPolarHBondContact O-CG 3.29Å; F595-M599 PolarHBondContact O-N 3.18Å; V596-M599 PolarHBondContact O-N 3.06Å; M599-S603 WeakPolarHBondContact O-CB 3.2Å; M599-S603 PolarHBondContact O-N 2.9Å; M599-S603 PolarHBondContact O-OG 3.19Å
600I95.5Very high95.6Very high80 Ų8050.7 Ų50.741%0.4128%0.276SS..Hα-helixtrans-64.2-47.5174.6-67.4168.4000110.3V596 G597 L598 V602 S603 I604V596-I600 HydrophobicContact CG1-CD1 3.93Å; V596-I600 WeakPolarHBondContact O-CG1 3.43Å; V596-I600 PolarHBondContact O-N 2.91Å; G597-I600 PolarHBondContact O-N 3.42Å; L598-I600 VanDerWaalsContact C-N 3.33Å; L598-I600 PolarHBondContact O-N 3.29Å; I600-V602 PolarHBondContact O-N 3.3Å; I600-S603 WeakPolarHBondContact O-CB 3.18Å; I600-S603 PolarHBondContact O-N 3.43Å; I600-S603 VanDerWaalsContact O-N 3.16Å; I600-I604 HydrophobicContact CG2-CD1 3.92Å; I600-I604 WeakPolarHBondContact O-CG1 3.42Å; I600-I604 PolarHBondContact O-N 3.33Å
601L96.8Very high95.5Very high95 Ų9549.5 Ų49.550%0.49727%0.274SS..Hα-helixtrans-58.7-46.4178.8-17868.3000111.6G597 L598 S603 I604 I605G597-L601 WeakPolarHBondContact O-CB 3.38Å; G597-L601 PolarHBondContact O-N 3.5Å; L598-L601 PolarHBondContact O-N 3.3Å; L601-S603 VanDerWaalsContact C-N 3.31Å; L601-S603 PolarHBondContact O-N 3Å; L601-I604 PolarHBondContact O-N 2.91Å; L601-I605 HydrophobicContact CG-CD1 4.19Å; L601-I605 WeakPolarHBondContact O-CG1 3.33Å; L601-I605 PolarHBondContact O-N 3.26Å
602V96.7Very high95.2Very high35 Ų3552.6 Ų52.621%0.21228%0.276CS..Hα-helixtrans-62-40.7176.8173.70000111.1F564 L598 I600 I604 I605 I606F564-V602 HydrophobicContact CD1-CG1 4.16Å; F564-V602 HydrophobicContact CD2-CG1 3.48Å; F564-V602 VanDerWaalsContact CD2-CG1 3.48Å; F564-V602 HydrophobicContact CE1-CG1 4.14Å; F564-V602 HydrophobicContact CE2-CG1 3.47Å; F564-V602 VanDerWaalsContact CE2-CG1 3.47Å; F564-V602 HydrophobicContact CG-CB 4.48Å; F564-V602 HydrophobicContact CG-CG1 3.85Å; F564-V602 HydrophobicContact CZ-CG1 3.81Å; L598-V602 HydrophobicContact CD1-CG2 4.49Å; L598-V602 VanDerWaalsContact O-CG2 3.3Å; L598-V602 WeakPolarHBondContact O-CG2 3.42Å; L598-V602 PolarHBondContact O-N 3.34Å; I600-V602 PolarHBondContact O-N 3.3Å; V602-I604 VanDerWaalsContact C-N 3.34Å; V602-I604 PolarHBondContact O-N 3.45Å; V602-I605 PolarHBondContact O-N 3.44Å; V602-I606 HydrophobicContact CG1-CD1 3.87Å; V602-I606 HydrophobicContact CG1-CG1 4.42Å; V602-I606 WeakPolarHBondContact O-CG1 3.31Å; V602-I606 PolarHBondContact O-N 3.4Å
603S97.1Very high94.9Very high13 Ų1352.2 Ų52.29%0.09127%0.274CS..Hα-helixtrans-62.2-39.8176.6-59.10000112.3M599 I600 L601 I606 C607M599-S603 WeakPolarHBondContact O-CB 3.2Å; M599-S603 PolarHBondContact O-N 2.9Å; M599-S603 PolarHBondContact O-OG 3.19Å; I600-S603 WeakPolarHBondContact O-CB 3.18Å; I600-S603 PolarHBondContact O-N 3.43Å; I600-S603 VanDerWaalsContact O-N 3.16Å; L601-S603 VanDerWaalsContact C-N 3.31Å; L601-S603 PolarHBondContact O-N 3Å; S603-I606 PolarHBondContact O-N 3.01Å; S603-C607 PolarHBondContact O-N 3.29Å; S603-C607 PolarHBondContact O-SG 2.95Å
604I96.6Very high94.5Very high82 Ų8245.6 Ų45.642%0.42125%0.251SS..Hα-helixtrans-64.4-43.4174.3-67.7168.2000110.7I600 L601 V602 I606 C607 S608 W629I600-I604 HydrophobicContact CG2-CD1 3.92Å; I600-I604 WeakPolarHBondContact O-CG1 3.42Å; I600-I604 PolarHBondContact O-N 3.33Å; L601-I604 PolarHBondContact O-N 2.91Å; V602-I604 VanDerWaalsContact C-N 3.34Å; V602-I604 PolarHBondContact O-N 3.45Å; I604-I606 VanDerWaalsContact C-N 3.34Å; I604-I606 PolarHBondContact O-N 3.44Å; I604-C607 PolarHBondContact O-N 2.93Å; I604-S608 WeakPolarHBondContact O-CB 3.45Å; I604-S608 PolarHBondContact O-N 3.49Å; I604-W629 HydrophobicContact CB-CZ3 4.5Å; I604-W629 HydrophobicContact CG1-CZ3 4.44Å; I604-W629 HydrophobicContact CG2-CH2 3.98Å; I604-W629 HydrophobicContact CG2-CZ3 4.2Å
605I95.5Very high94Very high75 Ų7544.3 Ų44.339%0.38524%0.238SC..Hα-helixtrans-60.8-45.3176.8-68166.5000110.3F537 L601 V602 S608 A609F537-I605 HydrophobicContact CE1-CG2 4.43Å; F537-I605 HydrophobicContact CZ-CG2 3.76Å; L601-I605 HydrophobicContact CG-CD1 4.19Å; L601-I605 WeakPolarHBondContact O-CG1 3.33Å; L601-I605 PolarHBondContact O-N 3.26Å; V602-I605 PolarHBondContact O-N 3.44Å; I605-S608 PolarHBondContact O-N 2.93Å; I605-S608 PolarHBondContact O-OG 3.31Å; I605-A609 PolarHBondContact O-N 2.83Å
606I96.2Very high93.1Very high11 Ų1140.9 Ų40.96%0.05622%0.224CC..Hα-helixtrans-63.5-43177.8-67.2166.6000111.2N557 L560 L561 F564 V602 S603 I604 S608 A609 L610N557-I606 HydrophobicContact CB-CG2 3.73Å; N557-I606 WeakPolarHBondContact O-CG2 3.4Å; L560-I606 HydrophobicContact CB-CD1 3.85Å; L561-I606 HydrophobicContact CB-CG2 3.94Å; L561-I606 HydrophobicContact CD1-CB 4.44Å; L561-I606 HydrophobicContact CD1-CG2 4.43Å; F564-I606 HydrophobicContact CD2-CD1 3.55Å; F564-I606 HydrophobicContact CE2-CD1 3.88Å; V602-I606 HydrophobicContact CG1-CD1 3.87Å; V602-I606 HydrophobicContact CG1-CG1 4.42Å; V602-I606 WeakPolarHBondContact O-CG1 3.31Å; V602-I606 PolarHBondContact O-N 3.4Å; S603-I606 PolarHBondContact O-N 3.01Å; I604-I606 VanDerWaalsContact C-N 3.34Å; I604-I606 PolarHBondContact O-N 3.44Å; I606-S608 VanDerWaalsContact C-N 3.31Å; I606-S608 PolarHBondContact O-N 3.16Å; I606-A609 PolarHBondContact O-N 3.43Å; I606-L610 HydrophobicContact CG2-CD1 4.07Å; I606-L610 HydrophobicContact CG2-CG 4.42Å; I606-L610 WeakPolarHBondContact O-CB 3.13Å; I606-L610 WeakPolarHBondContact O-CG 3.18Å; I606-L610 PolarHBondContact O-N 2.93Å
607C95.8Very high92Very high3 Ų346.7 Ų46.72%0.0225%0.251CS..Hα-helixtrans-60.2-42.1174.3-70.90000111.6S603 I604 A609 L610 A611 P628 W629 A632S603-C607 PolarHBondContact O-N 3.29Å; S603-C607 PolarHBondContact O-SG 2.95Å; I604-C607 PolarHBondContact O-N 2.93Å; C607-A609 VanDerWaalsContact C-N 3.32Å; C607-A609 PolarHBondContact O-N 2.92Å; C607-L610 PolarHBondContact O-N 2.9Å; C607-A611 WeakPolarHBondContact O-CB 3.33Å; C607-A611 PolarHBondContact O-N 3.21Å; C607-P628 HydrophobicContact CB-CG 3.88Å; C607-P628 WeakPolarHBondContact O-CG 3.39Å; C607-W629 HydrophobicContact CB-CD2 4.07Å; C607-W629 HydrophobicContact CB-CE3 3.71Å; C607-W629 HydrophobicContact CB-CH2 3.61Å; C607-W629 HydrophobicContact CB-CZ2 3.96Å; C607-W629 HydrophobicContact CB-CZ3 3.47Å; C607-W629 VanDerWaalsContact CB-CZ3 3.47Å; C607-A632 VanDerWaalsContact SG-CB 3.58Å
608S93.6Very high90.9Very high36 Ų3645.6 Ų45.625%0.25224%0.236SC..Hα-helixtrans-64.7-36.2176.778.90000112.7I604 I605 I606 R612I604-S608 WeakPolarHBondContact O-CB 3.45Å; I604-S608 PolarHBondContact O-N 3.49Å; I605-S608 PolarHBondContact O-N 2.93Å; I605-S608 PolarHBondContact O-OG 3.31Å; I606-S608 VanDerWaalsContact C-N 3.31Å; I606-S608 PolarHBondContact O-N 3.16Å; S608-R612 WeakPolarHBondContact O-CG 3.26Å; S608-R612 PolarHBondContact O-N 3.3Å
609A92.4Very high89.7Confident2 Ų244.2 Ų44.22%0.01723%0.233CC..Hα-helixtrans-67.8-47.1175.900000111.1C536 F537 I605 I606 C607 A611 R612 Q613C536-A609 HydrophobicContact CB-CB 4.07Å; F537-A609 HydrophobicContact CE1-CB 4.09Å; F537-A609 HydrophobicContact CZ-CB 4.2Å; I605-A609 PolarHBondContact O-N 2.83Å; I606-A609 PolarHBondContact O-N 3.43Å; C607-A609 VanDerWaalsContact C-N 3.32Å; C607-A609 PolarHBondContact O-N 2.92Å; A609-A611 PolarHBondContact O-N 3.44Å; A609-R612 PolarHBondContact O-N 3.35Å; A609-Q613 WeakPolarHBondContact O-CG 3.24Å; A609-Q613 PolarHBondContact O-N 2.65Å
610L92.9Very high88.9Confident1 Ų144.6 Ų44.61%0.00524%0.236CC..Hα-helixtrans-60.4-42.2176.2-77.1173.7000112.1Y554 N557 L561 I606 C607 R612 Q613 P628Y554-L610 HydrophobicContact CD1-CD2 3.48Å; Y554-L610 VanDerWaalsContact CD1-CD2 3.48Å; Y554-L610 HydrophobicContact CE1-CD2 3.84Å; Y554-L610 HydrophobicContact CG-CD2 3.97Å; Y554-L610 PolarHBondContact OH-O 3.31Å; N557-L610 HydrophobicContact CB-CD1 4.16Å; N557-L610 HydrophobicContact CB-CD2 3.7Å; N557-L610 HydrophobicContact CB-CG 3.84Å; L561-L610 HydrophobicContact CD2-CD1 4.45Å; I606-L610 HydrophobicContact CG2-CD1 4.07Å; I606-L610 HydrophobicContact CG2-CG 4.42Å; I606-L610 WeakPolarHBondContact O-CB 3.13Å; I606-L610 WeakPolarHBondContact O-CG 3.18Å; I606-L610 PolarHBondContact O-N 2.93Å; C607-L610 PolarHBondContact O-N 2.9Å; L610-R612 PolarHBondContact O-N 2.94Å; L610-R612 VanDerWaalsContact O-N 3.14Å; L610-Q613 WeakPolarHBondContact O-CB 3.17Å; L610-Q613 PolarHBondContact O-N 2.91Å; L610-P628 HydrophobicContact CB-CB 4.03Å; L610-P628 HydrophobicContact CB-CG 3.75Å; L610-P628 HydrophobicContact CD1-CB 4.11Å
611A91.6Very high88.3Confident48 Ų4842.9 Ų42.940%0.39723%0.234SC..Hα-helixtrans-62.7-19.1177.700000114C607 A609 P628C607-A611 WeakPolarHBondContact O-CB 3.33Å; C607-A611 PolarHBondContact O-N 3.21Å; A609-A611 PolarHBondContact O-N 3.44Å; A611-P628 HydrophobicContact CB-CG 4.39Å
612R88.7Confident87.9Confident138 Ų13840.4 Ų40.452%0.52122%0.219SC..THydrogen-bonded Turntrans-91.5-13.6176.1-70.1177.4179.2-169.53.7113.2F537 S608 A609 L610F537-R612 PolarHBondContact O-NH1 3.4Å; S608-R612 WeakPolarHBondContact O-CG 3.26Å; S608-R612 PolarHBondContact O-N 3.3Å; A609-R612 PolarHBondContact O-N 3.35Å; L610-R612 PolarHBondContact O-N 2.94Å; L610-R612 VanDerWaalsContact O-N 3.14Å
613Q88.8Confident87.5Confident13 Ų1342 Ų426%0.06122%0.223CC..SBendtrans-78.6146.7-177.1-65.9-58.9-57.500111R535 C536 T550 I553 Y554 A609 L610 E615R535-Q613 PolarHBondContact O-NE2 3.48Å; C536-Q613 PolarHBondContact O-NE2 2.67Å; T550-Q613 HydrophobicContact CG2-CB 4.33Å; I553-Q613 HydrophobicContact CG2-CG 3.97Å; Y554-Q613 HydrophobicContact CD2-CB 4.04Å; Y554-Q613 HydrophobicContact CD2-CG 4.47Å; Y554-Q613 HydrophobicContact CE2-CB 3.26Å; Y554-Q613 HydrophobicContact CE2-CG 4.12Å; Y554-Q613 PolarHBondContact OH-O 2.91Å; A609-Q613 WeakPolarHBondContact O-CG 3.24Å; A609-Q613 PolarHBondContact O-N 2.65Å; L610-Q613 WeakPolarHBondContact O-CB 3.17Å; L610-Q613 PolarHBondContact O-N 2.91Å; Q613-E615 PolarHBondContact O-N 3.22Å
614P86.2Confident87.3Confident13 Ų1341.6 Ų41.68%0.08422%0.22CC..PPolyproline II helixtrans-66.4136.6179.821.6-22.5000110.6L539 L543 T550 Y554L539-P614 HydrophobicContact CD1-CG 4.23Å; L543-P614 WeakPolarHBondContact O-CB 3.47Å; T550-P614 HydrophobicContact CG2-CG 3.83Å; Y554-P614 WeakPolarHBondContact CE2-O 3.25Å
615E85.1Confident87.1Confident61 Ų6141.3 Ų41.329%0.28522%0.224SC..PPolyproline II helixtrans-100.6154.9-176.4-70.3-168.6-170.700112.7R426 Y554 Q613 Q617R426-E615 WeakPolarHBondContact CD-OE2 3.48Å; R426-E615 IonicContact CZ-OE2 3.25Å; R426-E615 IonicContact NE-OE2 2.72Å; R426-E615 IonicContact NH1-OE2 3.68Å; R426-E615 PolarHBondContact NH1-OE2 3.48Å; R426-E615 CarbonylContact O-C 3.54Å; R426-E615 WeakPolarHBondContact O-CA 3.2Å; Y554-E615 WeakPolarHBondContact OH-CG 3.38Å; Q613-E615 PolarHBondContact O-N 3.22Å; E615-Q617 PolarHBondContact O-N 3.03Å
616N79Confident86.9Confident8 Ų840 Ų404%0.04323%0.229CC..  trans-63.3115.3170.4-171.8-37.9000111.6R426 Q428 M430 P546 T618 K623R426-N616 PolarHBondContact O-N 2.93Å; Q428-N616 PolarHBondContact O-ND2 3.44Å; M430-N616 PolarHBondContact O-ND2 3.12Å; M430-N616 VanDerWaalsContact O-ND2 3.14Å; P546-N616 HydrophobicContact CG-CB 4.43Å; N616-T618 VanDerWaalsContact C-N 3.29Å; N616-T618 PolarHBondContact O-N 3.21Å; N616-T618 VanDerWaalsContact OD1-CB 3.31Å; N616-T618 WeakPolarHBondContact OD1-CB 3.48Å; N616-T618 WeakPolarHBondContact OD1-CG2 3.46Å; N616-T618 PolarHBondContact OD1-N 3.25Å; N616-T618 PolarHBondContact OD1-OG1 2.89Å; N616-K623 PolarHBondContact O-NZ 2.98Å; N616-K623 VanDerWaalsContact O-NZ 3.15Å
617Q73.3Confident86.7Confident125 Ų12540.2 Ų40.258%0.58423%0.23SC*.  trans-83.58.9-175.5-59.9-170.2-1.400114.8D544 E615D544-Q617 PolarHBondContact O-NE2 3.47Å; E615-Q617 PolarHBondContact O-N 3.03Å
618T72.5Confident86.7Confident13 Ų1340.1 Ų40.18%0.0823%0.23CC..  trans-49.7128.1177.535.50000112.8R93 N616 V620 K623R93-T618 PolarHBondContact NH1-OG1 3.21Å; N616-T618 VanDerWaalsContact C-N 3.29Å; N616-T618 PolarHBondContact O-N 3.21Å; N616-T618 VanDerWaalsContact OD1-CB 3.31Å; N616-T618 WeakPolarHBondContact OD1-CB 3.48Å; N616-T618 WeakPolarHBondContact OD1-CG2 3.46Å; N616-T618 PolarHBondContact OD1-N 3.25Å; N616-T618 PolarHBondContact OD1-OG1 2.89Å; T618-V620 PolarHBondContact O-N 3.48Å; T618-K623 WeakPolarHBondContact O-CE 3.33Å; T618-K623 PolarHBondContact O-NZ 3.14Å
619P72.3Confident86.8Confident62 Ų6243.5 Ų43.540%0.40324%0.237SC..  trans-76115.817629.8-32.3000109.4
620V80.1Confident87Confident22 Ų2244.8 Ų44.813%0.13324%0.243CC..  trans-129.4152.9-178.8-59.20000108.6R93 T618 F622 K623R93-V620 HydrophobicContact CG-CB 4.12Å; R93-V620 HydrophobicContact CG-CG1 3.62Å; R93-V620 HydrophobicContact CG-CG2 4.47Å; T618-V620 PolarHBondContact O-N 3.48Å; V620-F622 VanDerWaalsContact CG2-O 3.24Å; V620-F622 WeakPolarHBondContact CG2-O 3.36Å; V620-F622 PolarHBondContact O-N 3.39Å; V620-K623 HydrophobicContact CG2-CD 4.05Å; V620-K623 HydrophobicContact CG2-CG 3.29Å
621A82.3Confident87.2Confident44 Ų4444.7 Ų44.736%0.36424%0.243SC..SBendtrans-61.7-27.7-17600000113.4A92 Q278 T279A92-A621 HydrophobicContact CB-CB 4.43Å; Q278-A621 HydrophobicContact CB-CB 4.12Å; Q278-A621 VanDerWaalsContact O-CB 3.29Å; Q278-A621 WeakPolarHBondContact O-CB 2.98Å; T279-A621 HydrophobicContact CG2-CB 4.02Å
622F88.5Confident87.5Confident43 Ų4342.9 Ų42.919%0.18923%0.228CC..  trans-147.5136.3178-177.9-96.4000111.2L85 A88 E89 A92 P282 I286 V620 V624L85-F622 HydrophobicContact CD2-CE1 4.36Å; L85-F622 HydrophobicContact CD2-CZ 3.68Å; A88-F622 HydrophobicContact CB-CD1 3.67Å; A88-F622 HydrophobicContact CB-CE1 3.66Å; A88-F622 HydrophobicContact CB-CZ 4.5Å; E89-F622 HydrophobicContact CB-CD1 4.21Å; A92-F622 HydrophobicContact CB-CB 4.13Å; P282-F622 HydrophobicContact CB-CB 3.97Å; P282-F622 HydrophobicContact CB-CG 4.1Å; P282-F622 HydrophobicContact CG-CB 3.85Å; P282-F622 HydrophobicContact CG-CG 4.41Å; I286-F622 HydrophobicContact CD1-CE2 4.42Å; V620-F622 VanDerWaalsContact CG2-O 3.24Å; V620-F622 WeakPolarHBondContact CG2-O 3.36Å; V620-F622 PolarHBondContact O-N 3.39Å; F622-V624 HydrophobicContact CE1-CG2 4.33Å
623K89.8Confident87.8Confident69 Ų6940.2 Ų40.230%0.322%0.223SC..  trans-127136173.9-74.8-169.1177-173.70108.5N616 T618 V620 P625N616-K623 PolarHBondContact O-NZ 2.98Å; N616-K623 VanDerWaalsContact O-NZ 3.15Å; T618-K623 WeakPolarHBondContact O-CE 3.33Å; T618-K623 PolarHBondContact O-NZ 3.14Å; V620-K623 HydrophobicContact CG2-CD 4.05Å; V620-K623 HydrophobicContact CG2-CG 3.29Å; K623-P625 WeakPolarHBondContact O-CD 3.34Å
624V92Very high88.2Confident5 Ų539.6 Ų39.63%0.0322%0.221CC..  trans-60.9127.4172.9-179.20000109.2L85 E89 V422 R426 F622 V627 I630L85-V624 VanDerWaalsContact C-CG2 3.44Å; L85-V624 HydrophobicContact CB-CG1 4.23Å; L85-V624 HydrophobicContact CB-CG2 4.11Å; L85-V624 WeakPolarHBondContact O-CG2 3.47Å; E89-V624 HydrophobicContact CB-CG2 3.7Å; E89-V624 WeakPolarHBondContact OE2-CB 3.33Å; E89-V624 VanDerWaalsContact OE2-CG2 3.28Å; E89-V624 WeakPolarHBondContact OE2-CG2 3.31Å; E89-V624 PolarHBondContact OE2-N 3.44Å; V422-V624 HydrophobicContact CG1-CG2 4.5Å; R426-V624 PolarHBondContact NH2-O 3.32Å; F622-V624 HydrophobicContact CE1-CG2 4.33Å; V624-V627 HydrophobicContact CB-CG2 3.89Å; V624-V627 HydrophobicContact CG1-CG2 3.97Å; V624-V627 WeakPolarHBondContact O-CG2 3.46Å; V624-I630 HydrophobicContact CG1-CB 3.94Å; V624-I630 HydrophobicContact CG1-CD1 4.28Å; V624-I630 HydrophobicContact CG1-CG2 3.64Å
625P91.9Very high88.7Confident75 Ų7539 Ų3949%0.48722%0.217SC..THydrogen-bonded Turntrans-76.8156.617431.1-34.1000111.2K623 V627 I630K623-P625 WeakPolarHBondContact O-CD 3.34Å; P625-V627 PolarHBondContact O-N 2.87Å; P625-I630 HydrophobicContact CG-CD1 4.11Å; P625-I630 WeakPolarHBondContact O-CD1 3.37Å; P625-I630 WeakPolarHBondContact O-CG1 3.38Å
626G91.6Very high89.2Confident48 Ų4839.8 Ų39.850%0.49522%0.219SC..THydrogen-bonded Turntrans64.323.2172.900000115W629 I630G626-W629 WeakPolarHBondContact O-CA 3.03Å; G626-W629 VanDerWaalsContact O-CB 3.3Å; G626-W629 WeakPolarHBondContact O-CB 3.36Å; G626-W629 PolarHBondContact O-N 3.45Å; G626-I630 PolarHBondContact O-N 3.29Å
627V92.2Very high89.9Confident15 Ų1541.2 Ų41.29%0.09123%0.227CC..THydrogen-bonded Turntrans-60.7136.2168.5174.20000108.4V422 L423 R426 V624 P625 P631V422-V627 HydrophobicContact CG1-CG2 4.43Å; L423-V627 HydrophobicContact CD2-CG1 4.14Å; R426-V627 HydrophobicContact CG-CG1 3.99Å; V624-V627 HydrophobicContact CB-CG2 3.89Å; V624-V627 HydrophobicContact CG1-CG2 3.97Å; V624-V627 WeakPolarHBondContact O-CG2 3.46Å; P625-V627 PolarHBondContact O-N 2.87Å; V627-P631 HydrophobicContact CG2-CG 4.25Å
628P95Very high90.8Very high2 Ų235.3 Ų35.31%0.01320%0.199CC..THydrogen-bonded Turncis-92.11.88.537.9-38.2000115.3L423 C607 L610 A611 P631 A632L423-P628 HydrophobicContact CD2-CB 3.42Å; L423-P628 VanDerWaalsContact CD2-CB 3.42Å; C607-P628 HydrophobicContact CB-CG 3.88Å; C607-P628 WeakPolarHBondContact O-CG 3.39Å; L610-P628 HydrophobicContact CB-CB 4.03Å; L610-P628 HydrophobicContact CB-CG 3.75Å; L610-P628 HydrophobicContact CD1-CB 4.11Å; A611-P628 HydrophobicContact CB-CG 4.39Å; P628-P631 WeakPolarHBondContact O-CD 3.5Å; P628-A632 WeakPolarHBondContact O-CB 3.02Å; P628-A632 PolarHBondContact O-N 2.88Å
629W96.7Very high91.8Very high107 Ų10734.7 Ų34.741%0.40520%0.195SC..Hα-helixtrans-66-44.4-172.2-54.5100000113.3I604 C607 G626 A632 I633I604-W629 HydrophobicContact CB-CZ3 4.5Å; I604-W629 HydrophobicContact CG1-CZ3 4.44Å; I604-W629 HydrophobicContact CG2-CH2 3.98Å; I604-W629 HydrophobicContact CG2-CZ3 4.2Å; C607-W629 HydrophobicContact CB-CD2 4.07Å; C607-W629 HydrophobicContact CB-CE3 3.71Å; C607-W629 HydrophobicContact CB-CH2 3.61Å; C607-W629 HydrophobicContact CB-CZ2 3.96Å; C607-W629 HydrophobicContact CB-CZ3 3.47Å; C607-W629 VanDerWaalsContact CB-CZ3 3.47Å; G626-W629 WeakPolarHBondContact O-CA 3.03Å; G626-W629 VanDerWaalsContact O-CB 3.3Å; G626-W629 WeakPolarHBondContact O-CB 3.36Å; G626-W629 PolarHBondContact O-N 3.45Å; W629-A632 PolarHBondContact O-N 2.86Å; W629-I633 VanDerWaalsContact O-CG1 3.3Å; W629-I633 WeakPolarHBondContact O-CG1 3.4Å; W629-I633 PolarHBondContact O-N 3.45Å
630I96.4Very high92.7Very high28 Ų2834.4 Ų34.414%0.14419%0.186CC..Hα-helixtrans-59.7-52.9178.2-70.8-165000111.6L82 L85 V624 P625 G626 A632 I633 S634L82-I630 HydrophobicContact CB-CG2 4.34Å; L82-I630 HydrophobicContact CD2-CB 4.31Å; L82-I630 HydrophobicContact CD2-CD1 4.25Å; L82-I630 HydrophobicContact CD2-CG1 4.07Å; L82-I630 HydrophobicContact CD2-CG2 3.8Å; L85-I630 HydrophobicContact CD1-CD1 3.83Å; L85-I630 HydrophobicContact CD1-CG2 4.3Å; V624-I630 HydrophobicContact CG1-CB 3.94Å; V624-I630 HydrophobicContact CG1-CD1 4.28Å; V624-I630 HydrophobicContact CG1-CG2 3.64Å; P625-I630 HydrophobicContact CG-CD1 4.11Å; P625-I630 WeakPolarHBondContact O-CD1 3.37Å; P625-I630 WeakPolarHBondContact O-CG1 3.38Å; G626-I630 PolarHBondContact O-N 3.29Å; I630-A632 VanDerWaalsContact C-N 3.3Å; I630-A632 PolarHBondContact O-N 2.85Å; I630-I633 PolarHBondContact O-N 3.22Å; I630-S634 PolarHBondContact O-N 2.93Å
631P96.8Very high93.1Very high0 Ų034.2 Ų34.20%018%0.184CC..Hα-helixtrans-57.9-39.6173.9-26.433.6000113.4V422 L423 V627 P628 S634 I635V422-P631 HydrophobicContact CG1-CG 4.25Å; L423-P631 HydrophobicContact CD1-CB 4.22Å; L423-P631 HydrophobicContact CD2-CB 3.83Å; L423-P631 HydrophobicContact CD2-CG 3.95Å; L423-P631 HydrophobicContact CG-CB 3.82Å; L423-P631 HydrophobicContact CG-CG 4.32Å; V627-P631 HydrophobicContact CG2-CG 4.25Å; P628-P631 WeakPolarHBondContact O-CD 3.5Å; P631-S634 PolarHBondContact O-N 2.94Å; P631-I635 WeakPolarHBondContact O-CD1 3.3Å; P631-I635 WeakPolarHBondContact O-CG1 3.36Å; P631-I635 PolarHBondContact O-N 2.85Å
632A97.5Very high93.4Very high10 Ų1032.1 Ų32.18%0.08317%0.167CC..Hα-helixtrans-62.6-44.2179.400000112.5L561 C607 P628 W629 I630 I635 F636L561-A632 HydrophobicContact CD2-CB 4Å; C607-A632 VanDerWaalsContact SG-CB 3.58Å; P628-A632 WeakPolarHBondContact O-CB 3.02Å; P628-A632 PolarHBondContact O-N 2.88Å; W629-A632 PolarHBondContact O-N 2.86Å; I630-A632 VanDerWaalsContact C-N 3.3Å; I630-A632 PolarHBondContact O-N 2.85Å; A632-I635 PolarHBondContact O-N 3.44Å; A632-F636 PolarHBondContact O-N 3.23Å
633I96.2Very high93.4Very high82 Ų8231 Ų3142%0.42116%0.163SC..Hα-helixtrans-66.7-40.5177.1-62.4165.2000110.3L82 W629 I630 I635 F636 I637L82-I633 HydrophobicContact CD1-CB 4.08Å; L82-I633 HydrophobicContact CD1-CG2 3.48Å; L82-I633 VanDerWaalsContact CD1-CG2 3.48Å; W629-I633 VanDerWaalsContact O-CG1 3.3Å; W629-I633 WeakPolarHBondContact O-CG1 3.4Å; W629-I633 PolarHBondContact O-N 3.45Å; I630-I633 PolarHBondContact O-N 3.22Å; I633-I635 PolarHBondContact O-N 2.86Å; I633-F636 PolarHBondContact O-N 2.92Å; I633-I637 HydrophobicContact CG2-CD1 3.84Å; I633-I637 HydrophobicContact CG2-CG1 4.42Å; I633-I637 WeakPolarHBondContact O-CG1 3.19Å; I633-I637 PolarHBondContact O-N 2.91Å
634S96.1Very high93.1Very high0 Ų032 Ų320%017%0.168CC..Hα-helixtrans-58.6-47173.4170.40000111.6S83 S419 I630 P631 F636 I637 N638S83-S634 PolarHBondContact OG-OG 3.41Å; S419-S634 PolarHBondContact OG-OG 3.27Å; I630-S634 PolarHBondContact O-N 2.93Å; P631-S634 PolarHBondContact O-N 2.94Å; S634-F636 VanDerWaalsContact C-N 3.32Å; S634-F636 PolarHBondContact O-N 3.05Å; S634-I637 PolarHBondContact O-N 2.92Å; S634-N638 WeakPolarHBondContact O-CB 3.26Å; S634-N638 VanDerWaalsContact O-CG 3.27Å; S634-N638 PolarHBondContact O-N 3.44Å; S634-N638 PolarHBondContact O-ND2 2.93Å; S634-N638 PolarHBondContact OG-ND2 3.32Å
635I96.9Very high92.6Very high0 Ų033.2 Ų33.20%017%0.174CC..Hα-helixtrans-59.8-43175.8-67162000110.7T416 V420 L423 L562 I565 P631 A632 I633 N638 A639T416-I635 HydrophobicContact CG2-CG1 4.31Å; T416-I635 HydrophobicContact CG2-CG2 4.1Å; V420-I635 HydrophobicContact CG2-CD1 3.68Å; V420-I635 HydrophobicContact CG2-CG1 4.27Å; L423-I635 HydrophobicContact CD1-CD1 4.11Å; L562-I635 HydrophobicContact CD1-CG2 3.64Å; I565-I635 HydrophobicContact CB-CG2 4.3Å; I565-I635 HydrophobicContact CD1-CB 4.09Å; I565-I635 HydrophobicContact CD1-CG2 3.8Å; I565-I635 HydrophobicContact CG2-CG2 3.96Å; P631-I635 WeakPolarHBondContact O-CD1 3.3Å; P631-I635 WeakPolarHBondContact O-CG1 3.36Å; P631-I635 PolarHBondContact O-N 2.85Å; A632-I635 PolarHBondContact O-N 3.44Å; I633-I635 PolarHBondContact O-N 2.86Å; I635-N638 PolarHBondContact O-N 2.89Å; I635-A639 WeakPolarHBondContact O-CB 3.47Å; I635-A639 PolarHBondContact O-N 3.23Å
636F96Very high92.1Very high78 Ų7832.3 Ų32.334%0.34217%0.17SC..Hα-helixtrans-60.4-48.1177.4173.4-94.5000112.7I565 N569 I572 A632 I633 S634 A639 Y640I565-F636 VanDerWaalsContact CG2-CA 3.46Å; I565-F636 HydrophobicContact CG2-CB 3.96Å; I565-F636 HydrophobicContact CG2-CD2 4.21Å; N569-F636 WeakPolarHBondContact ND2-CD2 3.3Å; I572-F636 HydrophobicContact CD1-CE2 4.31Å; I572-F636 HydrophobicContact CD1-CZ 4.33Å; A632-F636 PolarHBondContact O-N 3.23Å; I633-F636 PolarHBondContact O-N 2.92Å; S634-F636 VanDerWaalsContact C-N 3.32Å; S634-F636 PolarHBondContact O-N 3.05Å; F636-A639 PolarHBondContact O-N 3.14Å; F636-Y640 WeakPolarHBondContact O-CB 3.4Å; F636-Y640 PolarHBondContact O-N 3.2Å
637I93.1Very high91.6Very high38 Ų3832.5 Ų32.520%0.19517%0.171CC..Hα-helixtrans-64.3-46.3-179.8-65.2163.3000110.6A79 L82 I633 S634 A639 Y640 L641A79-I637 HydrophobicContact CB-CD1 3.75Å; A79-I637 HydrophobicContact CB-CG2 3.87Å; L82-I637 HydrophobicContact CD1-CD1 4.03Å; I633-I637 HydrophobicContact CG2-CD1 3.84Å; I633-I637 HydrophobicContact CG2-CG1 4.42Å; I633-I637 WeakPolarHBondContact O-CG1 3.19Å; I633-I637 PolarHBondContact O-N 2.91Å; S634-I637 PolarHBondContact O-N 2.92Å; I637-A639 VanDerWaalsContact C-N 3.34Å; I637-A639 PolarHBondContact O-N 2.89Å; I637-Y640 WeakPolarHBondContact O-CB 3.33Å; I637-Y640 PolarHBondContact O-N 2.94Å; I637-L641 HydrophobicContact CG2-CD1 4.2Å; I637-L641 WeakPolarHBondContact O-CG 3.38Å; I637-L641 PolarHBondContact O-N 3.37Å
638N92.8Very high90.9Very high0 Ų034.1 Ų34.10%019%0.187CC..Hα-helixtrans-63.9-41179-65.3-37.6000111.5L412 Y415 T416 S634 I635 L641 M642L412-N638 HydrophobicContact CD2-CB 4.23Å; Y415-N638 VanDerWaalsContact CB-ND2 3.29Å; Y415-N638 WeakPolarHBondContact CB-ND2 3.33Å; T416-N638 WeakPolarHBondContact OG1-CB 3.39Å; S634-N638 WeakPolarHBondContact O-CB 3.26Å; S634-N638 VanDerWaalsContact O-CG 3.27Å; S634-N638 PolarHBondContact O-N 3.44Å; S634-N638 PolarHBondContact O-ND2 2.93Å; S634-N638 PolarHBondContact OG-ND2 3.32Å; I635-N638 PolarHBondContact O-N 2.89Å; N638-L641 PolarHBondContact O-N 3.1Å; N638-M642 HydrophobicContact CB-CE 4.21Å; N638-M642 WeakPolarHBondContact O-CB 3.48Å; N638-M642 WeakPolarHBondContact O-CE 3.41Å; N638-M642 WeakPolarHBondContact O-CG 3.36Å; N638-M642 PolarHBondContact O-N 2.97Å
639A93.4Very high90.2Very high0 Ų034.3 Ų34.30%019%0.188CC..Hα-helixtrans-61.3-44.917500000111.9I565 F566 N569 I635 F636 I637 L641 M642 V643I565-A639 HydrophobicContact CG2-CB 3.99Å; F566-A639 HydrophobicContact CD1-CB 4.42Å; F566-A639 HydrophobicContact CD2-CB 3.98Å; F566-A639 HydrophobicContact CE1-CB 4.32Å; F566-A639 HydrophobicContact CE2-CB 3.86Å; F566-A639 HydrophobicContact CG-CB 4.29Å; F566-A639 HydrophobicContact CZ-CB 4.07Å; N569-A639 HydrophobicContact CB-CB 4.47Å; I635-A639 WeakPolarHBondContact O-CB 3.47Å; I635-A639 PolarHBondContact O-N 3.23Å; F636-A639 PolarHBondContact O-N 3.14Å; I637-A639 VanDerWaalsContact C-N 3.34Å; I637-A639 PolarHBondContact O-N 2.89Å; A639-L641 PolarHBondContact O-N 2.65Å; A639-M642 PolarHBondContact O-N 3.02Å; A639-V643 WeakPolarHBondContact O-CG1 3.42Å; A639-V643 WeakPolarHBondContact O-CG2 3.3Å; A639-V643 PolarHBondContact O-N 3.34Å
640Y91.5Very high89.7Confident57 Ų5733.2 Ų33.222%0.22418%0.183CC..Hα-helixtrans-57.1-47.1176-179-102.9000112.1N569 I572 F636 I637 V643 K644N569-Y640 WeakPolarHBondContact OD1-CA 3.44Å; N569-Y640 WeakPolarHBondContact OD1-CB 3.33Å; N569-Y640 WeakPolarHBondContact OD1-CD2 3.44Å; N569-Y640 PolarHBondContact OD1-N 3.22Å; I572-Y640 HydrophobicContact CG2-CD2 4.49Å; I572-Y640 HydrophobicContact CG2-CE2 3.93Å; F636-Y640 WeakPolarHBondContact O-CB 3.4Å; F636-Y640 PolarHBondContact O-N 3.2Å; I637-Y640 WeakPolarHBondContact O-CB 3.33Å; I637-Y640 PolarHBondContact O-N 2.94Å; Y640-V643 VanDerWaalsContact O-CG2 3.24Å; Y640-V643 WeakPolarHBondContact O-CG2 3.43Å; Y640-K644 HydrophobicContact CE1-CD 4.03Å; Y640-K644 VanDerWaalsContact CZ-CE 3.4Å; Y640-K644 PolarHBondContact O-N 3.18Å; Y640-K644 WeakPolarHBondContact OH-CE 3.1Å; Y640-K644 PolarHBondContact OH-NZ 3.42Å
641L88Confident89.1Confident17 Ų1737.2 Ų37.29%0.08920%0.204CC..Hα-helixtrans-67.7-37179-64.5177.1000112.1G255 F258 L412 I637 N638 A639 K644G255-L641 VanDerWaalsContact CA-CD2 3.46Å; F258-L641 HydrophobicContact CB-CD1 3.87Å; F258-L641 HydrophobicContact CD1-CD1 3.35Å; F258-L641 HydrophobicContact CD2-CD1 4.2Å; F258-L641 HydrophobicContact CE1-CD1 3.89Å; F258-L641 HydrophobicContact CG-CD1 3.52Å; F258-L641 HydrophobicContact CZ-CD1 4.48Å; L412-L641 HydrophobicContact CD1-CB 3.7Å; L412-L641 HydrophobicContact CD2-CB 4.1Å; L412-L641 HydrophobicContact CD2-CD1 4.02Å; I637-L641 HydrophobicContact CG2-CD1 4.2Å; I637-L641 WeakPolarHBondContact O-CG 3.38Å; I637-L641 PolarHBondContact O-N 3.37Å; N638-L641 PolarHBondContact O-N 3.1Å; A639-L641 PolarHBondContact O-N 2.65Å; L641-K644 PolarHBondContact O-N 2.97Å
642M88.8Confident88.4Confident0 Ų041.4 Ų41.40%022%0.22CC..Hα-helixtrans-65.8-43.9177.3-78.2-174.3-77.700112.9L412 L413 T416 F566 N638 A639 K644 L645 W650L412-M642 HydrophobicContact CB-CE 4.3Å; L412-M642 HydrophobicContact CB-CG 3.46Å; L412-M642 VanDerWaalsContact CB-CG 3.46Å; L412-M642 HydrophobicContact CB-SD 3.83Å; L412-M642 HydrophobicContact CD1-CG 3.67Å; L412-M642 HydrophobicContact CG-CG 4.2Å; L413-M642 HydrophobicContact CD2-CE 4.42Å; L413-M642 HydrophobicContact CD2-SD 3.62Å; L413-M642 HydrophobicContact CG-SD 3.75Å; T416-M642 VanDerWaalsContact OG1-CE 3.25Å; T416-M642 WeakPolarHBondContact OG1-CE 3.48Å; F566-M642 HydrophobicContact CE1-CE 4.17Å; F566-M642 HydrophobicContact CE2-CE 4.37Å; F566-M642 HydrophobicContact CZ-CE 3.49Å; F566-M642 VanDerWaalsContact CZ-CE 3.49Å; F566-M642 HydrophobicContact CZ-SD 4.47Å; N638-M642 HydrophobicContact CB-CE 4.21Å; N638-M642 WeakPolarHBondContact O-CB 3.48Å; N638-M642 WeakPolarHBondContact O-CE 3.41Å; N638-M642 WeakPolarHBondContact O-CG 3.36Å; N638-M642 PolarHBondContact O-N 2.97Å; A639-M642 PolarHBondContact O-N 3.02Å; M642-K644 PolarHBondContact O-N 2.97Å; M642-L645 WeakPolarHBondContact O-CB 3.29Å; M642-L645 WeakPolarHBondContact O-CG 3.35Å; M642-L645 PolarHBondContact O-N 3.2Å; M642-W650 HydrophobicContact CB-CZ2 4.4Å; M642-W650 PolarHBondContact O-NE1 2.89Å
643V88.2Confident87.8Confident19 Ų1941.9 Ų41.912%0.11522%0.22CC..Hα-helixtrans-68.8-21.4-178.4-61.70000112.5N569 L573 A639 Y640 L645N569-V643 HydrophobicContact CB-CG1 4.31Å; N569-V643 HydrophobicContact CB-CG2 4.09Å; L573-V643 HydrophobicContact CB-CB 4.48Å; L573-V643 HydrophobicContact CB-CG2 4.27Å; L573-V643 WeakPolarHBondContact CD1-O 3.32Å; L573-V643 HydrophobicContact CD2-CB 4.19Å; L573-V643 WeakPolarHBondContact CD2-O 3.49Å; A639-V643 WeakPolarHBondContact O-CG1 3.42Å; A639-V643 WeakPolarHBondContact O-CG2 3.3Å; A639-V643 PolarHBondContact O-N 3.34Å; Y640-V643 VanDerWaalsContact O-CG2 3.24Å; Y640-V643 WeakPolarHBondContact O-CG2 3.43Å; V643-L645 VanDerWaalsContact C-N 3.34Å
644K83.7Confident87.4Confident91 Ų9142.7 Ų42.740%0.39623%0.225SC..THydrogen-bonded Turntrans-79.7-11.6175.4-76.3-159.8165.6-164.20114.6D576 Y640 L641 M642D576-K644 WeakPolarHBondContact OD2-CE 3.48Å; D576-K644 IonicContact OD2-NZ 3.4Å; D576-K644 PolarHBondContact OD2-NZ 3.46Å; Y640-K644 HydrophobicContact CE1-CD 4.03Å; Y640-K644 VanDerWaalsContact CZ-CE 3.4Å; Y640-K644 PolarHBondContact O-N 3.18Å; Y640-K644 WeakPolarHBondContact OH-CE 3.1Å; Y640-K644 PolarHBondContact OH-NZ 3.42Å; L641-K644 PolarHBondContact O-N 2.97Å; M642-K644 PolarHBondContact O-N 2.97Å
645L81.6Confident87.1Confident31 Ų3146.7 Ų46.716%0.16225%0.249CC..SBendtrans-63.5150.7176.6-63.7173.2000111.4I409 M642 V643 T649I409-L645 HydrophobicContact CB-CD1 3.8Å; I409-L645 HydrophobicContact CD1-CD1 4.4Å; I409-L645 HydrophobicContact CG1-CD1 4.23Å; M642-L645 WeakPolarHBondContact O-CB 3.29Å; M642-L645 WeakPolarHBondContact O-CG 3.35Å; M642-L645 PolarHBondContact O-N 3.2Å; V643-L645 VanDerWaalsContact C-N 3.34Å; L645-T649 HydrophobicContact CB-CG2 4.32Å; L645-T649 HydrophobicContact CD1-CG2 4.27Å
646S81.9Confident86.7Confident56 Ų5649.4 Ų49.439%0.39226%0.259SS..  trans-64.6153-178.882.90000112.1A648 T649 W650S646-A648 PolarHBondContact O-N 3.33Å; S646-A648 PolarHBondContact OG-N 3.25Å; S646-T649 WeakPolarHBondContact O-CB 3.24Å; S646-T649 PolarHBondContact O-N 2.91Å; S646-T649 VanDerWaalsContact O-N 3.1Å; S646-T649 PolarHBondContact OG-N 2.9Å; S646-T649 VanDerWaalsContact OG-N 3.09Å; S646-T649 PolarHBondContact OG-OG1 2.94Å; S646-W650 PolarHBondContact O-N 3.44Å
647G81Confident86.5Confident51 Ų5146.3 Ų46.353%0.52625%0.246SC..Hα-helixtrans-59.7-31.8173.300000112.9W650 I651G647-W650 PolarHBondContact O-N 2.93Å; G647-I651 WeakPolarHBondContact O-CG1 3.3Å; G647-I651 PolarHBondContact O-N 3.49Å
648A78Confident86.6Confident50 Ų5050 Ų5041%0.41327%0.265SS..Hα-helixtrans-63.4-40.7174.900000111.8S646 W650 I651 R652S646-A648 PolarHBondContact O-N 3.33Å; S646-A648 PolarHBondContact OG-N 3.25Å; A648-W650 VanDerWaalsContact C-N 3.34Å; A648-W650 PolarHBondContact O-N 3.05Å; A648-I651 PolarHBondContact O-N 3.33Å; A648-R652 WeakPolarHBondContact O-CG 3.3Å; A648-R652 PolarHBondContact O-N 2.82Å
649T80.1Confident86.6Confident6 Ų653.9 Ų53.94%0.03729%0.285CS..Hα-helixtrans-58.5-45.9174.6-54.10000111.1D405 L645 S646 I651 R652 F653D405-T649 WeakPolarHBondContact O-CG2 3.33Å; L645-T649 HydrophobicContact CB-CG2 4.32Å; L645-T649 HydrophobicContact CD1-CG2 4.27Å; S646-T649 WeakPolarHBondContact O-CB 3.24Å; S646-T649 PolarHBondContact O-N 2.91Å; S646-T649 VanDerWaalsContact O-N 3.1Å; S646-T649 PolarHBondContact OG-N 2.9Å; S646-T649 VanDerWaalsContact OG-N 3.09Å; S646-T649 PolarHBondContact OG-OG1 2.94Å; T649-I651 PolarHBondContact O-N 3.38Å; T649-R652 PolarHBondContact O-N 3.18Å; T649-F653 WeakPolarHBondContact O-CB 3.47Å; T649-F653 PolarHBondContact O-N 3.4Å
650W85.1Confident86.7Confident83 Ų8353.9 Ų53.931%0.31429%0.285SS..Hα-helixtrans-64.1-39.6177.7-78.399.6000113.1I409 M642 S646 G647 A648 F653 L654I409-W650 HydrophobicContact CD1-CD2 3.86Å; I409-W650 HydrophobicContact CD1-CE3 3.67Å; I409-W650 HydrophobicContact CD1-CH2 3.77Å; I409-W650 HydrophobicContact CD1-CZ2 3.95Å; I409-W650 HydrophobicContact CD1-CZ3 3.64Å; M642-W650 HydrophobicContact CB-CZ2 4.4Å; M642-W650 PolarHBondContact O-NE1 2.89Å; S646-W650 PolarHBondContact O-N 3.44Å; G647-W650 PolarHBondContact O-N 2.93Å; A648-W650 VanDerWaalsContact C-N 3.34Å; A648-W650 PolarHBondContact O-N 3.05Å; W650-F653 HydrophobicContact CE3-CD1 4.39Å; W650-F653 PolarHBondContact O-N 3.42Å; W650-L654 WeakPolarHBondContact O-CB 3.46Å; W650-L654 VanDerWaalsContact O-CG 3.29Å; W650-L654 WeakPolarHBondContact O-CG 3.42Å; W650-L654 PolarHBondContact O-N 3.21Å
651I85.5Confident86.9Confident112 Ų11254.2 Ų54.257%0.57429%0.287SS*.Hα-helixtrans-63.6-48.9176.3-67.4164.9000110.5G647 A648 T649 F653 L654 V655G647-I651 WeakPolarHBondContact O-CG1 3.3Å; G647-I651 PolarHBondContact O-N 3.49Å; A648-I651 PolarHBondContact O-N 3.33Å; T649-I651 PolarHBondContact O-N 3.38Å; I651-F653 VanDerWaalsContact C-N 3.29Å; I651-F653 PolarHBondContact O-N 3.17Å; I651-L654 PolarHBondContact O-N 2.92Å; I651-V655 WeakPolarHBondContact O-CG2 3.4Å; I651-V655 PolarHBondContact O-N 3.45Å
652R81.8Confident87.3Confident89 Ų8956.6 Ų56.634%0.33631%0.309SS..Hα-helixtrans-59.2-42.2177.9-67.2176.1-172.3-174.5-0.2111.2D402 M406 A648 T649 V655 W656D402-R652 PolarHBondContact O-NH1 3.29Å; D402-R652 VanDerWaalsContact O-NH1 3.13Å; D402-R652 IonicContact OD1-CZ 2.93Å; D402-R652 IonicContact OD1-NH1 3.38Å; D402-R652 PolarHBondContact OD1-NH1 2.87Å; D402-R652 VanDerWaalsContact OD1-NH1 3.08Å; D402-R652 IonicContact OD1-NH2 2.85Å; D402-R652 PolarHBondContact OD1-NH2 3.32Å; M406-R652 HydrophobicContact CE-CB 4Å; M406-R652 HydrophobicContact CG-CB 4.36Å; M406-R652 HydrophobicContact SD-CB 4.3Å; M406-R652 HydrophobicContact SD-CG 4.49Å; A648-R652 WeakPolarHBondContact O-CG 3.3Å; A648-R652 PolarHBondContact O-N 2.82Å; T649-R652 PolarHBondContact O-N 3.18Å; R652-V655 PolarHBondContact O-N 3.24Å; R652-W656 PolarHBondContact O-N 3.41Å; R652-W656 VanDerWaalsContact O-N 3.09Å
653F84.1Confident87.6Confident20 Ų2058.3 Ų58.39%0.08832%0.318CS..Hα-helixtrans-61.6-45.1175.2178.4-103.6000112.7N119 I409 L413 T649 W650 I651 V655 W656 M657N119-F653 WeakPolarHBondContact ND2-CE2 3.46Å; N119-F653 WeakPolarHBondContact ND2-CZ 3.37Å; N119-F653 VanDerWaalsContact OD1-CE2 3.23Å; N119-F653 WeakPolarHBondContact OD1-CE2 3.32Å; I409-F653 HydrophobicContact CB-CD2 4.47Å; I409-F653 HydrophobicContact CD1-CB 4.08Å; I409-F653 HydrophobicContact CD1-CD1 3.82Å; I409-F653 HydrophobicContact CD1-CD2 4.15Å; I409-F653 HydrophobicContact CD1-CE1 4.3Å; I409-F653 HydrophobicContact CD1-CG 3.74Å; I409-F653 HydrophobicContact CG1-CD2 4.25Å; I409-F653 HydrophobicContact CG1-CE2 4.39Å; I409-F653 HydrophobicContact CG1-CG 4.34Å; I409-F653 HydrophobicContact CG2-CB 4.18Å; I409-F653 HydrophobicContact CG2-CD2 3.44Å; I409-F653 VanDerWaalsContact CG2-CD2 3.44Å; I409-F653 HydrophobicContact CG2-CE2 4.04Å; I409-F653 HydrophobicContact CG2-CG 3.97Å; L413-F653 HydrophobicContact CD1-CE1 4.03Å; L413-F653 HydrophobicContact CD1-CE2 3.86Å; L413-F653 HydrophobicContact CD1-CZ 3.31Å; T649-F653 WeakPolarHBondContact O-CB 3.47Å; T649-F653 PolarHBondContact O-N 3.4Å; W650-F653 HydrophobicContact CE3-CD1 4.39Å; W650-F653 PolarHBondContact O-N 3.42Å; I651-F653 VanDerWaalsContact C-N 3.29Å; I651-F653 PolarHBondContact O-N 3.17Å; F653-V655 VanDerWaalsContact C-N 3.34Å; F653-V655 PolarHBondContact O-N 3.44Å; F653-W656 WeakPolarHBondContact O-CB 3.36Å; F653-W656 PolarHBondContact O-N 3.06Å; F653-M657 HydrophobicContact CD1-CG 4.14Å; F653-M657 HydrophobicContact CD2-CG 4.49Å; F653-M657 HydrophobicContact CE1-CG 3.67Å; F653-M657 HydrophobicContact CE2-CG 4.07Å; F653-M657 HydrophobicContact CE2-SD 4.24Å; F653-M657 HydrophobicContact CZ-CG 3.62Å; F653-M657 HydrophobicContact CZ-SD 3.9Å; F653-M657 WeakPolarHBondContact O-CG 3.36Å; F653-M657 PolarHBondContact O-N 3.32Å
654L88.7Confident88Confident99 Ų9957.4 Ų57.452%0.51831%0.313SS..Hα-helixtrans-61.3-41.8177.2-75.3171.1000112W650 I651 W656 M657 I658W650-L654 WeakPolarHBondContact O-CB 3.46Å; W650-L654 VanDerWaalsContact O-CG 3.29Å; W650-L654 WeakPolarHBondContact O-CG 3.42Å; W650-L654 PolarHBondContact O-N 3.21Å; I651-L654 PolarHBondContact O-N 2.92Å; L654-W656 VanDerWaalsContact C-N 3.33Å; L654-W656 PolarHBondContact O-N 3.49Å; L654-M657 PolarHBondContact O-N 3.02Å; L654-I658 VanDerWaalsContact O-CG1 3.29Å; L654-I658 WeakPolarHBondContact O-CG1 3.35Å; L654-I658 PolarHBondContact O-N 2.99Å
655V88.5Confident88.6Confident83 Ų8357 Ų5750%0.50331%0.311SS..Hα-helixtrans-59.3-45.7175173.30000110.7I651 R652 F653 M657 I658 I659I651-V655 WeakPolarHBondContact O-CG2 3.4Å; I651-V655 PolarHBondContact O-N 3.45Å; R652-V655 PolarHBondContact O-N 3.24Å; F653-V655 VanDerWaalsContact C-N 3.34Å; F653-V655 PolarHBondContact O-N 3.44Å; V655-M657 VanDerWaalsContact C-N 3.35Å; V655-M657 PolarHBondContact O-N 3.14Å; V655-I658 PolarHBondContact O-N 3.34Å; V655-I659 WeakPolarHBondContact O-CG1 3.25Å; V655-I659 PolarHBondContact O-N 3.47Å
656W89.1Confident89.2Confident58 Ų5858.4 Ų58.422%0.2233%0.333CS..Hα-helixtrans-61.9-41.4176.3-178.3-106.3000113W118 I121 L122 R652 F653 L654 I658 I659 G660W118-W656 AromaticContact CD1-CD1 3.5Å; W118-W656 VanDerWaalsContact CD1-CD1 3.5Å; W118-W656 AromaticContact CD1-CE2 3.9Å; W118-W656 AromaticContact CD1-NE1 3.13Å; W118-W656 HydrophobicContact CD2-CZ2 4.21Å; W118-W656 AromaticContact CE2-CE2 3.44Å; W118-W656 VanDerWaalsContact CE2-CE2 3.44Å; W118-W656 AromaticContact CE2-CZ2 3.52Å; W118-W656 AromaticContact CE2-NE1 3.52Å; W118-W656 AromaticContact CG-NE1 3.83Å; W118-W656 HydrophobicContact CH2-CH2 4.14Å; W118-W656 AromaticContact CH2-CZ2 3.98Å; W118-W656 HydrophobicContact CH2-CZ2 3.98Å; W118-W656 HydrophobicContact CZ2-CD2 4.28Å; W118-W656 AromaticContact CZ2-CE2 3.69Å; W118-W656 AromaticContact CZ2-CH2 3.7Å; W118-W656 HydrophobicContact CZ2-CH2 3.7Å; W118-W656 AromaticContact CZ2-CZ2 3.39Å; W118-W656 HydrophobicContact CZ2-CZ2 3.39Å; W118-W656 HydrophobicContact CZ2-CZ3 4.25Å; W118-W656 AromaticContact NE1-CD1 3.32Å; W118-W656 VanDerWaalsContact NE1-CD1 3.32Å; W118-W656 AromaticContact NE1-CD2 3.73Å; W118-W656 AromaticContact NE1-CE2 3.23Å; W118-W656 AromaticContact NE1-CG 3.8Å; W118-W656 AromaticContact NE1-CZ2 3.84Å; W118-W656 AromaticContact NE1-NE1 2.92Å; W118-W656 PolarHBondContact NE1-O 2.73Å; W118-W656 PolarHBondContact O-NE1 3.35Å; W118-W656 VanDerWaalsContact O-NE1 3.15Å; I121-W656 HydrophobicContact CG2-CZ2 4.44Å; L122-W656 HydrophobicContact CB-CD2 4.33Å; L122-W656 HydrophobicContact CB-CG 4.49Å; L122-W656 HydrophobicContact CB-CZ2 3.98Å; L122-W656 HydrophobicContact CD1-CD2 3.71Å; L122-W656 HydrophobicContact CD1-CE3 3.94Å; L122-W656 HydrophobicContact CD1-CG 4.15Å; L122-W656 HydrophobicContact CD1-CH2 4.26Å; L122-W656 HydrophobicContact CD1-CZ2 4.05Å; L122-W656 HydrophobicContact CD1-CZ3 4.21Å; L122-W656 HydrophobicContact CD2-CB 4.21Å; L122-W656 HydrophobicContact CD2-CD2 4.19Å; L122-W656 HydrophobicContact CD2-CG 3.73Å; L122-W656 HydrophobicContact CG-CD2 4.28Å; L122-W656 HydrophobicContact CG-CG 4.33Å; R652-W656 PolarHBondContact O-N 3.41Å; R652-W656 VanDerWaalsContact O-N 3.09Å; F653-W656 WeakPolarHBondContact O-CB 3.36Å; F653-W656 PolarHBondContact O-N 3.06Å; L654-W656 VanDerWaalsContact C-N 3.33Å; L654-W656 PolarHBondContact O-N 3.49Å; W656-I658 VanDerWaalsContact C-N 3.35Å; W656-I658 PolarHBondContact O-N 3.08Å; W656-I659 PolarHBondContact O-N 2.82Å; W656-G660 PolarHBondContact O-N 2.71Å
657M92.6Very high89.8Confident12 Ų1258.3 Ų58.36%0.05932%0.324CS..Hα-helixtrans-65.2-36.6177.3-75.2-54.4-5200112.5T115 N119 F653 L654 V655 I659 G660 F661T115-M657 HydrophobicContact CG2-CE 3.61Å; T115-M657 HydrophobicContact CG2-SD 4.28Å; N119-M657 PolarHBondContact OD1-SD 3.48Å; F653-M657 HydrophobicContact CD1-CG 4.14Å; F653-M657 HydrophobicContact CD2-CG 4.49Å; F653-M657 HydrophobicContact CE1-CG 3.67Å; F653-M657 HydrophobicContact CE2-CG 4.07Å; F653-M657 HydrophobicContact CE2-SD 4.24Å; F653-M657 HydrophobicContact CZ-CG 3.62Å; F653-M657 HydrophobicContact CZ-SD 3.9Å; F653-M657 WeakPolarHBondContact O-CG 3.36Å; F653-M657 PolarHBondContact O-N 3.32Å; L654-M657 PolarHBondContact O-N 3.02Å; V655-M657 VanDerWaalsContact C-N 3.35Å; V655-M657 PolarHBondContact O-N 3.14Å; M657-I659 VanDerWaalsContact C-N 3.33Å; M657-I659 PolarHBondContact O-N 3.39Å; M657-G660 PolarHBondContact O-N 2.88Å; M657-F661 HydrophobicContact CB-CD2 4.42Å; M657-F661 HydrophobicContact CB-CE2 4.27Å; M657-F661 HydrophobicContact CE-CD2 4.02Å; M657-F661 HydrophobicContact CE-CE1 3.93Å; M657-F661 HydrophobicContact CE-CE2 3.32Å; M657-F661 HydrophobicContact CE-CZ 3.26Å; M657-F661 WeakPolarHBondContact O-CB 3.27Å; M657-F661 WeakPolarHBondContact O-CD2 3.45Å; M657-F661 WeakPolarHBondContact O-CG 3.44Å; M657-F661 PolarHBondContact O-N 2.91Å
658I95.2Very high90.3Very high117 Ų11755.9 Ų55.960%0.630%0.299SS*.Hα-helixtrans-60.6-44.6174.9-70.7163.9000110.4L654 V655 W656 F661 A662L654-I658 VanDerWaalsContact O-CG1 3.29Å; L654-I658 WeakPolarHBondContact O-CG1 3.35Å; L654-I658 PolarHBondContact O-N 2.99Å; V655-I658 PolarHBondContact O-N 3.34Å; W656-I658 VanDerWaalsContact C-N 3.35Å; W656-I658 PolarHBondContact O-N 3.08Å; I658-F661 PolarHBondContact O-N 2.97Å; I658-A662 WeakPolarHBondContact O-CB 3.36Å; I658-A662 PolarHBondContact O-N 3.36Å
659I92.8Very high91Very high80 Ų8054.7 Ų54.741%0.4128%0.284SS..Hα-helixtrans-61.7-46.7176.4-61.9167.4000110.3W118 V655 W656 M657 F661 A662 I663W118-I659 HydrophobicContact CZ2-CG2 4.04Å; V655-I659 WeakPolarHBondContact O-CG1 3.25Å; V655-I659 PolarHBondContact O-N 3.47Å; W656-I659 PolarHBondContact O-N 2.82Å; M657-I659 VanDerWaalsContact C-N 3.33Å; M657-I659 PolarHBondContact O-N 3.39Å; I659-F661 PolarHBondContact O-N 3.25Å; I659-A662 WeakPolarHBondContact O-CB 3.42Å; I659-A662 PolarHBondContact O-N 3.47Å; I659-I663 HydrophobicContact CG2-CD1 4.22Å; I659-I663 WeakPolarHBondContact O-CG1 3.34Å; I659-I663 PolarHBondContact O-N 3.37Å; I659-I663 VanDerWaalsContact O-N 3.09Å
660G95.1Very high91.5Very high0 Ų060.9 Ų60.90%031%0.307CS..Hα-helixtrans-58.9-48.8177.700000112.6F114 W656 M657 A662 I663 Y664F114-G660 WeakPolarHBondContact CE1-O 3.39Å; F114-G660 WeakPolarHBondContact CZ-O 3.27Å; W656-G660 PolarHBondContact O-N 2.71Å; M657-G660 PolarHBondContact O-N 2.88Å; G660-A662 VanDerWaalsContact C-N 3.32Å; G660-A662 PolarHBondContact O-N 2.72Å; G660-I663 WeakPolarHBondContact O-CB 3.32Å; G660-I663 PolarHBondContact O-N 3Å; G660-I663 VanDerWaalsContact O-N 3.14Å; G660-Y664 PolarHBondContact O-N 3.46Å
661F96.2Very high91.8Very high65 Ų6560.6 Ų60.629%0.28531%0.309SS..Hα-helixtrans-65.9-33.7178.7-71.6-47.3000112.6I111 M657 I658 I659 I663 Y664 F665I111-F661 HydrophobicContact CD1-CD1 4.14Å; I111-F661 HydrophobicContact CD1-CE1 3.75Å; I111-F661 HydrophobicContact CG1-CE1 4.46Å; M657-F661 HydrophobicContact CB-CD2 4.42Å; M657-F661 HydrophobicContact CB-CE2 4.27Å; M657-F661 HydrophobicContact CE-CD2 4.02Å; M657-F661 HydrophobicContact CE-CE1 3.93Å; M657-F661 HydrophobicContact CE-CE2 3.32Å; M657-F661 HydrophobicContact CE-CZ 3.26Å; M657-F661 WeakPolarHBondContact O-CB 3.27Å; M657-F661 WeakPolarHBondContact O-CD2 3.45Å; M657-F661 WeakPolarHBondContact O-CG 3.44Å; M657-F661 PolarHBondContact O-N 2.91Å; I658-F661 PolarHBondContact O-N 2.97Å; I659-F661 PolarHBondContact O-N 3.25Å; F661-I663 VanDerWaalsContact C-N 3.31Å; F661-I663 PolarHBondContact O-N 3.41Å; F661-Y664 PolarHBondContact O-N 3.26Å; F661-F665 HydrophobicContact CB-CD2 4.14Å; F661-F665 HydrophobicContact CB-CE2 4.14Å; F661-F665 HydrophobicContact CD1-CE2 4.26Å; F661-F665 HydrophobicContact CG-CE2 4.42Å; F661-F665 WeakPolarHBondContact O-CD2 3.27Å; F661-F665 PolarHBondContact O-N 2.82Å
662A96.6Very high92Very high66 Ų6655.2 Ų55.255%0.54528%0.281SS..Hα-helixtrans-60.1-42.6171.700000111.5I658 I659 G660 G666I658-A662 WeakPolarHBondContact O-CB 3.36Å; I658-A662 PolarHBondContact O-N 3.36Å; I659-A662 WeakPolarHBondContact O-CB 3.42Å; I659-A662 PolarHBondContact O-N 3.47Å; G660-A662 VanDerWaalsContact C-N 3.32Å; G660-A662 PolarHBondContact O-N 2.72Å; A662-G666 WeakPolarHBondContact O-CA 3.49Å; A662-G666 PolarHBondContact O-N 3.39Å
663I94.8Very high92.2Very high37 Ų3756.3 Ų56.319%0.1929%0.285CS..Hα-helixtrans-66.8-42.9175.1-64.9166.8000111.1W118 L366 F367 I659 G660 F661 Y667 G668W118-I663 HydrophobicContact CH2-CD1 3.48Å; W118-I663 VanDerWaalsContact CH2-CD1 3.48Å; W118-I663 HydrophobicContact CZ2-CD1 4.06Å; W118-I663 HydrophobicContact CZ3-CD1 3.99Å; L366-I663 HydrophobicContact CD2-CG2 4.23Å; F367-I663 HydrophobicContact CE2-CG2 4.36Å; F367-I663 HydrophobicContact CZ-CG2 4.29Å; I659-I663 HydrophobicContact CG2-CD1 4.22Å; I659-I663 WeakPolarHBondContact O-CG1 3.34Å; I659-I663 PolarHBondContact O-N 3.37Å; I659-I663 VanDerWaalsContact O-N 3.09Å; G660-I663 WeakPolarHBondContact O-CB 3.32Å; G660-I663 PolarHBondContact O-N 3Å; G660-I663 VanDerWaalsContact O-N 3.14Å; F661-I663 VanDerWaalsContact C-N 3.31Å; F661-I663 PolarHBondContact O-N 3.41Å; I663-Y667 WeakPolarHBondContact O-CB 3.37Å; I663-Y667 PolarHBondContact O-N 2.96Å; I663-G668 PolarHBondContact O-N 2.98Å
664Y95.9Very high92.2Very high0 Ų056 Ų560%028%0.284CS..Iπ-helixtrans-62.5-54.3178.6178.1-102.1000111.8L15 E110 I111 F114 L365 G660 F661 G666 G668 Y669L15-Y664 HydrophobicContact CD2-CE1 3.77Å; E110-Y664 HydrophobicContact CG-CE2 4.23Å; E110-Y664 PolarHBondContact OE1-OH 3.27Å; I111-Y664 HydrophobicContact CD1-CD1 3.78Å; I111-Y664 HydrophobicContact CD1-CE1 3.55Å; F114-Y664 HydrophobicContact CB-CD2 3.94Å; F114-Y664 HydrophobicContact CB-CE2 4.22Å; F114-Y664 HydrophobicContact CD1-CD2 4.06Å; F114-Y664 HydrophobicContact CD1-CG 4.04Å; F114-Y664 AromaticContact CD2-CD2 3.69Å; F114-Y664 HydrophobicContact CD2-CD2 3.69Å; F114-Y664 HydrophobicContact CD2-CG 4.35Å; F114-Y664 HydrophobicContact CE1-CG 4.35Å; F114-Y664 HydrophobicContact CE2-CD2 4.23Å; F114-Y664 AromaticContact CG-CD2 3.58Å; F114-Y664 HydrophobicContact CG-CD2 3.58Å; F114-Y664 HydrophobicContact CG-CE2 4.35Å; F114-Y664 HydrophobicContact CG-CG 4.06Å; L365-Y664 HydrophobicContact CD2-CE2 4.13Å; G660-Y664 PolarHBondContact O-N 3.46Å; F661-Y664 PolarHBondContact O-N 3.26Å; Y664-G666 VanDerWaalsContact C-N 3.33Å; Y664-G666 PolarHBondContact O-N 3.05Å; Y664-G668 CarbonylContact O-C 3.02Å; Y664-G668 WeakPolarHBondContact O-CA 3.48Å; Y664-G668 PolarHBondContact O-N 3.47Å; Y664-Y669 HydrophobicContact CE1-CD2 4.23Å; Y664-Y669 WeakPolarHBondContact O-CB 3.06Å; Y664-Y669 PolarHBondContact O-N 3.43Å
665F95.5Very high92Very high83 Ų8353.3 Ų53.336%0.36427%0.267SS..Iπ-helixtrans-71.5-28.3-178.7-69.1-64.7000112.8F11 L15 I111 F661 W670F11-F665 HydrophobicContact CE2-CE1 4.5Å; F11-F665 AromaticContact CZ-CE1 3.83Å; F11-F665 HydrophobicContact CZ-CE1 3.83Å; L15-F665 HydrophobicContact CD2-CE1 3.97Å; I111-F665 HydrophobicContact CD1-CZ 4.41Å; F661-F665 HydrophobicContact CB-CD2 4.14Å; F661-F665 HydrophobicContact CB-CE2 4.14Å; F661-F665 HydrophobicContact CD1-CE2 4.26Å; F661-F665 HydrophobicContact CG-CE2 4.42Å; F661-F665 WeakPolarHBondContact O-CD2 3.27Å; F661-F665 PolarHBondContact O-N 2.82Å; F665-W670 VanDerWaalsContact O-CD1 3.25Å; F665-W670 PolarHBondContact O-NE1 3.37Å
666G94Very high91.7Very high59 Ų5955.4 Ų55.461%0.60827%0.269SS*.Iπ-helixtrans-75.8-35.117600000114A662 Y664A662-G666 WeakPolarHBondContact O-CA 3.49Å; A662-G666 PolarHBondContact O-N 3.39Å; Y664-G666 VanDerWaalsContact C-N 3.33Å; Y664-G666 PolarHBondContact O-N 3.05Å
667Y94.7Very high90.9Very high54 Ų5459 Ų5921%0.21228%0.283CS..Iπ-helixtrans-132.2-57.4-174.4178.2-85.8000113.2L366 F367 G368 I663 Y669 W670 H671L366-Y667 VanDerWaalsContact C-CE1 3.48Å; L366-Y667 WeakPolarHBondContact O-CE1 3.41Å; F367-Y667 HydrophobicContact CD1-CD1 4.46Å; F367-Y667 HydrophobicContact CD1-CD2 4.17Å; F367-Y667 HydrophobicContact CD1-CE2 4.27Å; F367-Y667 HydrophobicContact CD1-CG 4.26Å; F367-Y667 HydrophobicContact CE1-CD2 4.34Å; F367-Y667 HydrophobicContact CE1-CG 4.29Å; G368-Y667 PolarHBondContact N-OH 3.3Å; I663-Y667 WeakPolarHBondContact O-CB 3.37Å; I663-Y667 PolarHBondContact O-N 2.96Å; Y667-Y669 PolarHBondContact O-N 2.79Å; Y667-W670 PolarHBondContact O-N 3.44Å; Y667-H671 HydrophobicContact CD1-CB 4.48Å; Y667-H671 AromaticContact CD2-CE1 3.72Å; Y667-H671 AromaticContact CD2-ND1 3.57Å; Y667-H671 HydrophobicContact CE1-CB 3.97Å; Y667-H671 AromaticContact CE2-CE1 3.72Å; Y667-H671 AromaticContact CE2-CG 3.86Å; Y667-H671 AromaticContact CE2-ND1 3.64Å; Y667-H671 AromaticContact CG-ND1 3.89Å; Y667-H671 AromaticContact CZ-CG 3.8Å; Y667-H671 AromaticContact CZ-ND1 3.98Å; Y667-H671 PolarHBondContact O-N 2.99Å; Y667-H671 VanDerWaalsContact O-N 3.08Å; Y667-H671 PolarHBondContact O-ND1 3.05Å
668G92.6Very high89.8Confident0 Ų064.8 Ų64.80%031%0.308CS..Iπ-helixtrans-60.7-44.7-167.400000114.2L365 I663 Y664 W670 H671 S672L365-G668 WeakPolarHBondContact O-CA 3.43Å; I663-G668 PolarHBondContact O-N 2.98Å; Y664-G668 CarbonylContact O-C 3.02Å; Y664-G668 WeakPolarHBondContact O-CA 3.48Å; Y664-G668 PolarHBondContact O-N 3.47Å; G668-W670 PolarHBondContact O-N 3.09Å; G668-H671 PolarHBondContact O-N 3.47Å; G668-S672 WeakPolarHBondContact O-CB 3.49Å; G668-S672 PolarHBondContact O-N 3.49Å
669Y91.7Very high88.2Confident25 Ų2568.6 Ų68.610%0.09832%0.32CS..Hα-helixtrans-57.2-37.3175.5178.2-99000112.1F11 S14 L15 Y664 Y667 R675F11-Y669 HydrophobicContact CE2-CE2 4.31Å; S14-Y669 VanDerWaalsContact OG-CE2 3.24Å; S14-Y669 WeakPolarHBondContact OG-CE2 3.45Å; S14-Y669 PolarHBondContact OG-OH 3.29Å; L15-Y669 HydrophobicContact CD2-CD2 3.91Å; L15-Y669 HydrophobicContact CD2-CE2 3.95Å; Y664-Y669 HydrophobicContact CE1-CD2 4.23Å; Y664-Y669 WeakPolarHBondContact O-CB 3.06Å; Y664-Y669 PolarHBondContact O-N 3.43Å; Y667-Y669 PolarHBondContact O-N 2.79Å; Y669-R675 WeakPolarHBondContact O-CD 3.33Å
670W90.5Very high88Confident136 Ų13668.1 Ų68.152%0.51532%0.316SS..Hα-helixtrans-79.7-34.6-176.1-61.396.5000112.6F665 Y667 G668 R675F665-W670 VanDerWaalsContact O-CD1 3.25Å; F665-W670 PolarHBondContact O-NE1 3.37Å; Y667-W670 PolarHBondContact O-N 3.44Å; G668-W670 PolarHBondContact O-N 3.09Å; W670-R675 VanDerWaalsContact CA-NH1 3.34Å; W670-R675 VanDerWaalsContact CE3-NH1 3.31Å; W670-R675 VanDerWaalsContact CE3-NH2 3.33Å; W670-R675 PolarHBondContact O-NH1 3.07Å
671H91.6Very high87.6Confident77 Ų7771.6 Ų71.636%0.35633%0.332SS..Hα-helixtrans-98.8-7.4-173.4-66.483.1000114.5G364 Y667 G668 R673G364-H671 WeakPolarHBondContact O-CB 3.47Å; Y667-H671 HydrophobicContact CD1-CB 4.48Å; Y667-H671 AromaticContact CD2-CE1 3.72Å; Y667-H671 AromaticContact CD2-ND1 3.57Å; Y667-H671 HydrophobicContact CE1-CB 3.97Å; Y667-H671 AromaticContact CE2-CE1 3.72Å; Y667-H671 AromaticContact CE2-CG 3.86Å; Y667-H671 AromaticContact CE2-ND1 3.64Å; Y667-H671 AromaticContact CG-ND1 3.89Å; Y667-H671 AromaticContact CZ-CG 3.8Å; Y667-H671 AromaticContact CZ-ND1 3.98Å; Y667-H671 PolarHBondContact O-N 2.99Å; Y667-H671 VanDerWaalsContact O-N 3.08Å; Y667-H671 PolarHBondContact O-ND1 3.05Å; G668-H671 PolarHBondContact O-N 3.47Å; H671-R673 PolarHBondContact O-N 2.83Å
672S90.7Very high87.2Confident0 Ų072 Ų720%034%0.335CS..  trans-42.6127176164.30000112.3E110 G668 E674 R675 K676E110-S672 PolarHBondContact OE2-OG 2.81Å; G668-S672 WeakPolarHBondContact O-CB 3.49Å; G668-S672 PolarHBondContact O-N 3.49Å; S672-E674 VanDerWaalsContact C-N 3.34Å; S672-E674 PolarHBondContact OG-N 2.69Å; S672-R675 WeakPolarHBondContact O-CB 3.44Å; S672-R675 PolarHBondContact O-N 2.99Å; S672-R675 PolarHBondContact OG-N 2.89Å; S672-K676 PolarHBondContact O-N 3.4Å
673R85.7Confident86.6Confident112 Ų11272.4 Ų72.442%0.42332%0.322SS..Hα-helixtrans-62.4-41.2176.1-76.5-167.3176.4173.211.9111.9T362 D363 H671 R675 K676 R677T362-R673 WeakPolarHBondContact O-CD 3.49Å; T362-R673 PolarHBondContact O-NE 3.39Å; T362-R673 PolarHBondContact O-NH2 3.07Å; D363-R673 PolarHBondContact O-N 2.68Å; H671-R673 PolarHBondContact O-N 2.83Å; R673-R675 PolarHBondContact O-N 3.43Å; R673-K676 CarbonylContact O-C 3.6Å; R673-K676 WeakPolarHBondContact O-CA 3.46Å; R673-K676 WeakPolarHBondContact O-CB 3.18Å; R673-K676 PolarHBondContact O-N 2.82Å; R673-R677 PolarHBondContact O-N 2.87Å
674E83.7Confident86.1Confident13 Ų1374.6 Ų74.66%0.06133%0.331CS..Hα-helixtrans-65.1-29.3178-68.5-59.1154.200112.2R17 V20 Y105 S672 R677 K678R17-E674 HydrophobicContact CB-CB 4.12Å; V20-E674 PolarHBondContact N-OE1 3.43Å; Y105-E674 HydrophobicContact CE2-CG 4.35Å; S672-E674 VanDerWaalsContact C-N 3.34Å; S672-E674 PolarHBondContact OG-N 2.69Å; E674-R677 IonicContact OE1-NE 3.49Å; E674-R677 IonicContact OE2-CZ 2.75Å; E674-R677 IonicContact OE2-NE 3.93Å; E674-R677 PolarHBondContact OE2-NE 3.22Å; E674-R677 IonicContact OE2-NH2 3.94Å; E674-R677 PolarHBondContact OE2-NH2 2.63Å; E674-K678 PolarHBondContact O-N 2.94Å
675R84.6Confident85.4Confident42 Ų4279.5 Ų79.516%0.15835%0.353CS..Hα-helixtrans-65.7-43.8170.6-173.4177.6-179.7-137.714.3111.5Y669 W670 S672 R673 R677 K678 K679Y669-R675 WeakPolarHBondContact O-CD 3.33Å; W670-R675 VanDerWaalsContact CA-NH1 3.34Å; W670-R675 VanDerWaalsContact CE3-NH1 3.31Å; W670-R675 VanDerWaalsContact CE3-NH2 3.33Å; W670-R675 PolarHBondContact O-NH1 3.07Å; S672-R675 WeakPolarHBondContact O-CB 3.44Å; S672-R675 PolarHBondContact O-N 2.99Å; S672-R675 PolarHBondContact OG-N 2.89Å; R673-R675 PolarHBondContact O-N 3.43Å; R675-R677 VanDerWaalsContact C-N 3.34Å; R675-K678 PolarHBondContact O-N 3.15Å; R675-K679 PolarHBondContact O-N 2.91Å
676K81.9Confident84.7Confident127 Ų12779.3 Ų79.355%0.55235%0.352SS*.Hα-helixtrans-67.6-34.2178.4-66.9179.2-177.7177.80112S672 R673 K678 K679S672-K676 PolarHBondContact O-N 3.4Å; R673-K676 CarbonylContact O-C 3.6Å; R673-K676 WeakPolarHBondContact O-CA 3.46Å; R673-K676 WeakPolarHBondContact O-CB 3.18Å; R673-K676 PolarHBondContact O-N 2.82Å; K676-K678 VanDerWaalsContact C-N 3.34Å; K676-K679 PolarHBondContact O-N 3.25Å; K676-K679 VanDerWaalsContact O-OXT 3.07Å
677R72.5Confident84Confident135 Ų13580.8 Ų80.851%0.50933%0.332SS..Hα-helixtrans-69.3-29.5178-165.2177.970.794.32.4113.4R673 E674 R675R673-R677 PolarHBondContact O-N 2.87Å; E674-R677 IonicContact OE1-NE 3.49Å; E674-R677 IonicContact OE2-CZ 2.75Å; E674-R677 IonicContact OE2-NE 3.93Å; E674-R677 PolarHBondContact OE2-NE 3.22Å; E674-R677 IonicContact OE2-NH2 3.94Å; E674-R677 PolarHBondContact OE2-NH2 2.63Å; R675-R677 VanDerWaalsContact C-N 3.34Å
678K69Low83.1Confident133 Ų13383.1 Ų83.158%0.57834%0.342SS*.Hα-helixtrans-84.1-19.1176.8-77-167.8176.3-167.80114.2R17 E674 R675 K676R17-K678 HydrophobicContact CG-CD 4.3Å; E674-K678 PolarHBondContact O-N 2.94Å; R675-K678 PolarHBondContact O-N 3.15Å; K676-K678 VanDerWaalsContact C-N 3.34Å
679K63.1Low82.3Confident197 Ų19790.6 Ų90.686%0.85737%0.373SS*.  trans-82.30171.8-76.1-174.8174.2-169.50108.8R675 K676R675-K679 PolarHBondContact O-N 2.91Å; K676-K679 PolarHBondContact O-N 3.25Å; K676-K679 VanDerWaalsContact O-OXT 3.07Å

Retrieved 679 of 679 residues in 164.7 ms (Link to these results)

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