A0A087YJP6_POEFO Loading...

UBA domain containing 2

AlphaFold DB , UniProt , Accession A0A087YJP6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 354 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
1M31.1Very low45.8Very low209 Ų209100.5 Ų100.5100%1.0353%0.527SS*.  01120-153.8169.1173.200106.9T3M1-T3 PolarHBondContact O-N 2.86Å
2F30.3Very low47.4Very low194 Ų194102.8 Ų102.885%0.85153%0.529SS*.  trans-68117.7-170.8-63.7-87.5000110T4F2-T4 HydrophobicContact CB-CG2 4.08Å; F2-T4 PolarHBondContact O-N 3.24Å
3T34.9Very low49.6Very low110 Ų11094.9 Ų94.968%0.67549%0.489SS*.  trans-76.270.8165.551.30000108.3M1 T5M1-T3 PolarHBondContact O-N 2.86Å; T3-T5 VanDerWaalsContact C-N 3.27Å; T3-T5 PolarHBondContact O-N 3.17Å
4T38.2Very low51.6Low119 Ų11991.3 Ų91.373%0.7348%0.475SS*.  trans-67.596.2163.552.60000106.7F2 G6F2-T4 HydrophobicContact CB-CG2 4.08Å; F2-T4 PolarHBondContact O-N 3.24Å; T4-G6 PolarHBondContact O-N 3.08Å
5T43.6Very low53.5Low78 Ų7887.9 Ų87.948%0.47946%0.457SS..  trans-36.9127.7164.5540000109.6T3 S7T3-T5 VanDerWaalsContact C-N 3.27Å; T3-T5 PolarHBondContact O-N 3.17Å; T5-S7 PolarHBondContact O-N 2.9Å
6G41.5Very low55.4Low29 Ų2982.5 Ų82.530%0.29943%0.429SS..SBendtrans-66.559.1-174.700000114.3T4T4-G6 PolarHBondContact O-N 3.08Å
7S48Very low57Low19 Ų1980.7 Ų80.713%0.13342%0.417CS..SBendtrans-149.3104.6165.966.70000105.9T5 G9 R84T5-S7 PolarHBondContact O-N 2.9Å; S7-G9 PolarHBondContact O-N 2.81Å; S7-R84 PolarHBondContact OG-NH1 2.66Å; S7-R84 PolarHBondContact OG-NH2 3Å
8R50.8Low58.5Low230 Ų23076.6 Ų76.687%0.86840%0.398SS*.  trans-58.9125178.4-73.2179.9163.8162.7-3.6109.4Y11R8-Y11 WeakPolarHBondContact O-CB 3.44Å
9G63.5Low59.9Low33 Ų3374.6 Ų74.634%0.3439%0.388SS..THydrogen-bonded Turntrans57.4-140.4172.200000115.1S7 Y11 R80 R84S7-G9 PolarHBondContact O-N 2.81Å; G9-Y11 PolarHBondContact O-N 3.38Å; G9-Y11 VanDerWaalsContact O-N 3.13Å; G9-R80 PolarHBondContact O-NH1 3.5Å; G9-R80 PolarHBondContact O-NH2 3.48Å; G9-R84 PolarHBondContact O-NH2 2.87Å
10L60.4Low61.2Low49 Ų4971.7 Ų71.726%0.25737%0.372SS..THydrogen-bonded Turntrans-7614.2-174.1-72.2158.2000114.7K12 A13 C16 K17 L20 Y77L10-K12 PolarHBondContact O-N 2.7Å; L10-A13 PolarHBondContact O-N 3.27Å; L10-C16 HydrophobicContact CD2-CB 4.44Å; L10-K17 HydrophobicContact CB-CB 4.2Å; L10-K17 HydrophobicContact CB-CD 4.34Å; L10-K17 HydrophobicContact CB-CG 4.33Å; L10-K17 HydrophobicContact CD1-CB 4.21Å; L10-K17 HydrophobicContact CD1-CG 4.01Å; L10-K17 HydrophobicContact CD2-CB 4.34Å; L10-K17 HydrophobicContact CG-CB 4.49Å; L10-L20 HydrophobicContact CD1-CD1 4.18Å; L10-L20 HydrophobicContact CD2-CD1 3.86Å; L10-Y77 HydrophobicContact CD2-CD2 4.12Å; L10-Y77 HydrophobicContact CD2-CE2 4.38Å; L10-Y77 HydrophobicContact CG-CD2 4.39Å; L10-Y77 HydrophobicContact CG-CE2 4.27Å
11Y61.1Low62.4Low36 Ų3673 Ų7314%0.14138%0.379CS..THydrogen-bonded Turntrans-58.3137.8179.2-172.3-121.1000111.6R8 G9 A13 R84 P225R8-Y11 WeakPolarHBondContact O-CB 3.44Å; G9-Y11 PolarHBondContact O-N 3.38Å; G9-Y11 VanDerWaalsContact O-N 3.13Å; Y11-A13 VanDerWaalsContact C-N 3.27Å; Y11-A13 PolarHBondContact O-N 2.93Å; Y11-R84 PolarHBondContact O-NE 2.98Å; Y11-R84 PolarHBondContact O-NH2 2.92Å; Y11-P225 HydrophobicContact CE1-CG 4.34Å
12K65.3Low65.1Low127 Ų12767 Ų6755%0.55235%0.354SS*.THydrogen-bonded Turntrans59.924.6-176.5-61.1174.6174.3168.60115.6L10L10-K12 PolarHBondContact O-N 2.7Å
13A76.6Confident67.7Low1 Ų158.5 Ų58.51%0.00832%0.318CS..  trans-137.668.2175.300000111.7L10 Y11 L15 C16 K17 R80 E83L10-A13 PolarHBondContact O-N 3.27Å; Y11-A13 VanDerWaalsContact C-N 3.27Å; Y11-A13 PolarHBondContact O-N 2.93Å; A13-L15 PolarHBondContact O-N 3.08Å; A13-C16 HydrophobicContact CB-CB 4.44Å; A13-K17 WeakPolarHBondContact O-CB 3.31Å; A13-K17 PolarHBondContact O-N 3.36Å; A13-K17 VanDerWaalsContact O-N 3.15Å; A13-R80 HydrophobicContact CB-CG 3.35Å; A13-E83 VanDerWaalsContact C-OE2 3.23Å; A13-E83 VanDerWaalsContact CA-CD 3.48Å; A13-E83 VanDerWaalsContact CA-OE2 3.31Å; A13-E83 WeakPolarHBondContact CA-OE2 3.23Å; A13-E83 HydrophobicContact CB-CB 4.49Å; A13-E83 HydrophobicContact CB-CG 4.5Å; A13-E83 WeakPolarHBondContact CB-OE2 3.39Å
14P77.1Confident70.2Confident44 Ų4455.4 Ų55.429%0.28630%0.297SS..Hα-helixtrans-62.8-35.7-174.425.5-35.9000113.7K17 G18 E83 T88 L216P14-K17 PolarHBondContact O-N 2.84Å; P14-G18 PolarHBondContact O-N 2.97Å; P14-E83 WeakPolarHBondContact CD-OE1 3.44Å; P14-E83 WeakPolarHBondContact CG-OE1 3.46Å; P14-T88 HydrophobicContact CG-CG2 3.96Å; P14-L216 WeakPolarHBondContact O-CD2 3.4Å
15L79.3Confident72.5Confident40 Ų4051.6 Ų51.621%0.20928%0.282CS..Hα-helixtrans-72.2-45.5-178.5-73.6169.1000112.1A13 K17 G18 L19 E83 T88 F91 A92 L216A13-L15 PolarHBondContact O-N 3.08Å; L15-K17 VanDerWaalsContact C-N 3.26Å; L15-K17 PolarHBondContact O-N 2.85Å; L15-G18 PolarHBondContact O-N 3.02Å; L15-L19 WeakPolarHBondContact O-CB 3.1Å; L15-L19 PolarHBondContact O-N 2.96Å; L15-E83 WeakPolarHBondContact CB-OE1 3.38Å; L15-E83 PolarHBondContact N-OE1 2.89Å; L15-E83 PolarHBondContact N-OE2 3.43Å; L15-T88 HydrophobicContact CB-CG2 4.49Å; L15-T88 HydrophobicContact CD1-CG2 3.29Å; L15-T88 WeakPolarHBondContact CD1-O 3.47Å; L15-T88 HydrophobicContact CG-CG2 3.51Å; L15-F91 HydrophobicContact CD1-CD1 4.28Å; L15-A92 HydrophobicContact CD1-CB 3.68Å; L15-L216 HydrophobicContact CD2-CD1 4.5Å; L15-L216 HydrophobicContact CD2-CD2 4.2Å
16C83.9Confident74.5Confident2 Ų250.8 Ų50.81%0.01427%0.274CS..Hα-helixtrans-60.7-40175.1-74.20000110.8L10 A13 L20 I76 R80 E83L10-C16 HydrophobicContact CD2-CB 4.44Å; A13-C16 HydrophobicContact CB-CB 4.44Å; C16-L20 VanDerWaalsContact O-CB 3.29Å; C16-L20 WeakPolarHBondContact O-CB 3.38Å; C16-L20 WeakPolarHBondContact O-CD1 3.39Å; C16-L20 WeakPolarHBondContact O-CG 3.5Å; C16-L20 PolarHBondContact O-N 3.43Å; C16-I76 HydrophobicContact CB-CG2 4.35Å; C16-R80 HydrophobicContact CB-CG 4.45Å; C16-E83 WeakPolarHBondContact CB-OE2 3.09Å; C16-E83 PolarHBondContact N-OE2 2.94Å; C16-E83 PolarHBondContact SG-OE2 2.93Å
17K83.9Confident76.6Confident52 Ų5249.9 Ų49.923%0.22626%0.263CS..Hα-helixtrans-62.6-45.8175.6-173.4178.8173.2-168.10111.9L10 A13 P14 L15 L21 F220L10-K17 HydrophobicContact CB-CB 4.2Å; L10-K17 HydrophobicContact CB-CD 4.34Å; L10-K17 HydrophobicContact CB-CG 4.33Å; L10-K17 HydrophobicContact CD1-CB 4.21Å; L10-K17 HydrophobicContact CD1-CG 4.01Å; L10-K17 HydrophobicContact CD2-CB 4.34Å; L10-K17 HydrophobicContact CG-CB 4.49Å; A13-K17 WeakPolarHBondContact O-CB 3.31Å; A13-K17 PolarHBondContact O-N 3.36Å; A13-K17 VanDerWaalsContact O-N 3.15Å; P14-K17 PolarHBondContact O-N 2.84Å; L15-K17 VanDerWaalsContact C-N 3.26Å; L15-K17 PolarHBondContact O-N 2.85Å; K17-L21 WeakPolarHBondContact O-CB 3.48Å; K17-L21 PolarHBondContact O-N 3.33Å; K17-F220 HydrophobicContact CB-CD1 4.3Å; K17-F220 HydrophobicContact CD-CB 4.17Å; K17-F220 HydrophobicContact CD-CD1 3.81Å; K17-F220 HydrophobicContact CD-CG 4.45Å; K17-F220 HydrophobicContact CG-CD1 3.68Å; K17-F220 HydrophobicContact CG-CE1 4.27Å; K17-F220 PolarHBondContact NZ-O 3.12Å
18G82.9Confident78.4Confident6 Ų652.9 Ų52.96%0.06228%0.28CS..Hα-helixtrans-64.4-47.2178.200000112.6P14 L15 L20 L21 V22 F220P14-G18 PolarHBondContact O-N 2.97Å; L15-G18 PolarHBondContact O-N 3.02Å; G18-L20 VanDerWaalsContact C-N 3.34Å; G18-L20 PolarHBondContact O-N 3.18Å; G18-L21 PolarHBondContact O-N 2.86Å; G18-V22 VanDerWaalsContact O-CB 3.29Å; G18-V22 WeakPolarHBondContact O-CB 3.49Å; G18-V22 VanDerWaalsContact O-CG2 3.24Å; G18-V22 WeakPolarHBondContact O-CG2 3.4Å; G18-V22 PolarHBondContact O-N 3.26Å; G18-F220 VanDerWaalsContact CA-CZ 3.42Å
19L85.1Confident80.1Confident39 Ų3947.4 Ų47.420%0.20427%0.266CS..Hα-helixtrans-63.7-39.8179.3-169.6139.6000111.1L15 L23 I76 L95 L128L15-L19 WeakPolarHBondContact O-CB 3.1Å; L15-L19 PolarHBondContact O-N 2.96Å; L19-L23 HydrophobicContact CD2-CD1 3.28Å; L19-L23 HydrophobicContact CD2-CG 4.36Å; L19-L23 HydrophobicContact CG-CD1 3.57Å; L19-L23 HydrophobicContact CG-CG 4.2Å; L19-L23 WeakPolarHBondContact O-CB 3.11Å; L19-L23 WeakPolarHBondContact O-CD1 2.85Å; L19-L23 WeakPolarHBondContact O-CG 3.19Å; L19-L23 PolarHBondContact O-N 2.79Å; L19-I76 HydrophobicContact CD2-CB 4.32Å; L19-I76 HydrophobicContact CD2-CD1 3.22Å; L19-I76 HydrophobicContact CD2-CG1 3.72Å; L19-I76 HydrophobicContact CD2-CG2 3.69Å; L19-L95 HydrophobicContact CD1-CD1 4.3Å; L19-L128 HydrophobicContact CD1-CD1 4.22Å; L19-L128 HydrophobicContact CD1-CD2 4.25Å; L19-L128 HydrophobicContact CD2-CD2 4.46Å
20L87Confident81Confident16 Ų1646.4 Ų46.48%0.08425%0.253CS..Hα-helixtrans-62.7-48.9172.5-73169.9000112.5L10 C16 G18 N24 S73 I76 Y77L10-L20 HydrophobicContact CD1-CD1 4.18Å; L10-L20 HydrophobicContact CD2-CD1 3.86Å; C16-L20 VanDerWaalsContact O-CB 3.29Å; C16-L20 WeakPolarHBondContact O-CB 3.38Å; C16-L20 WeakPolarHBondContact O-CD1 3.39Å; C16-L20 WeakPolarHBondContact O-CG 3.5Å; C16-L20 PolarHBondContact O-N 3.43Å; G18-L20 VanDerWaalsContact C-N 3.34Å; G18-L20 PolarHBondContact O-N 3.18Å; L20-N24 VanDerWaalsContact O-CB 3.31Å; L20-N24 WeakPolarHBondContact O-CB 3.35Å; L20-N24 PolarHBondContact O-N 3.04Å; L20-N24 VanDerWaalsContact O-N 3.11Å; L20-N24 PolarHBondContact O-ND2 3.11Å; L20-S73 WeakPolarHBondContact CD2-O 3.36Å; L20-S73 VanDerWaalsContact CD2-OG 3.22Å; L20-S73 WeakPolarHBondContact CD2-OG 3.29Å; L20-I76 HydrophobicContact CD1-CG2 4.34Å; L20-I76 HydrophobicContact CD2-CB 3.91Å; L20-I76 HydrophobicContact CD2-CG2 3.82Å; L20-I76 HydrophobicContact CG-CB 4.4Å; L20-I76 HydrophobicContact CG-CG2 3.75Å; L20-Y77 HydrophobicContact CD1-CD2 4.42Å
21L86.5Confident82.1Confident99 Ų9947 Ų4752%0.51826%0.258SS..Hα-helixtrans-67.4-48.1-177.1-163.8163.8000110.9K17 G18 G25 F220K17-L21 WeakPolarHBondContact O-CB 3.48Å; K17-L21 PolarHBondContact O-N 3.33Å; G18-L21 PolarHBondContact O-N 2.86Å; L21-G25 WeakPolarHBondContact O-CA 3.41Å; L21-G25 PolarHBondContact O-N 3.04Å; L21-F220 HydrophobicContact CB-CE1 4.06Å; L21-F220 HydrophobicContact CB-CZ 4.49Å; L21-F220 HydrophobicContact CD1-CE1 3.81Å; L21-F220 HydrophobicContact CD1-CZ 4.49Å
22V86.9Confident83.2Confident83 Ų8351.5 Ų51.550%0.50328%0.284SS..Hα-helixtrans-66.2-47.6-177.3174.40000111G18 G25 L26G18-V22 VanDerWaalsContact O-CB 3.29Å; G18-V22 WeakPolarHBondContact O-CB 3.49Å; G18-V22 VanDerWaalsContact O-CG2 3.24Å; G18-V22 WeakPolarHBondContact O-CG2 3.4Å; G18-V22 PolarHBondContact O-N 3.26Å; V22-G25 PolarHBondContact O-N 3.36Å; V22-L26 WeakPolarHBondContact O-CB 3.4Å; V22-L26 PolarHBondContact O-N 2.91Å
23L85.7Confident84.1Confident16 Ų1648.7 Ų48.78%0.08428%0.275CS..Hα-helixtrans-63.2-52.1179.6-69.2173000111.1L19 G25 L26 T27 L61 I76 L128L19-L23 HydrophobicContact CD2-CD1 3.28Å; L19-L23 HydrophobicContact CD2-CG 4.36Å; L19-L23 HydrophobicContact CG-CD1 3.57Å; L19-L23 HydrophobicContact CG-CG 4.2Å; L19-L23 WeakPolarHBondContact O-CB 3.11Å; L19-L23 WeakPolarHBondContact O-CD1 2.85Å; L19-L23 WeakPolarHBondContact O-CG 3.19Å; L19-L23 PolarHBondContact O-N 2.79Å; L23-G25 VanDerWaalsContact C-N 3.33Å; L23-G25 PolarHBondContact O-N 3.26Å; L23-L26 PolarHBondContact O-N 3.42Å; L23-T27 VanDerWaalsContact O-CG2 3.26Å; L23-T27 WeakPolarHBondContact O-CG2 3.24Å; L23-T27 PolarHBondContact O-N 2.85Å; L23-T27 PolarHBondContact O-OG1 3.36Å; L23-L61 WeakPolarHBondContact CD2-O 3.14Å; L23-I76 HydrophobicContact CD1-CD1 4.01Å; L23-L128 HydrophobicContact CD1-CB 4.32Å
24N86.9Confident84.1Confident45 Ų4552.3 Ų52.324%0.24130%0.298CS..Hα-helixtrans-67.3-34.6-178.6-69.6-77000112.2L20 L26 T27 V28 S69 S73L20-N24 VanDerWaalsContact O-CB 3.31Å; L20-N24 WeakPolarHBondContact O-CB 3.35Å; L20-N24 PolarHBondContact O-N 3.04Å; L20-N24 VanDerWaalsContact O-N 3.11Å; L20-N24 PolarHBondContact O-ND2 3.11Å; N24-L26 VanDerWaalsContact C-N 3.34Å; N24-T27 WeakPolarHBondContact CA-OG1 3.47Å; N24-T27 PolarHBondContact O-OG1 3.15Å; N24-V28 WeakPolarHBondContact O-CB 3.39Å; N24-V28 VanDerWaalsContact O-CG2 3.23Å; N24-V28 WeakPolarHBondContact O-CG2 3.38Å; N24-V28 PolarHBondContact O-N 3.41Å; N24-S69 PolarHBondContact OD1-OG 3.5Å; N24-S73 PolarHBondContact ND2-OG 3.34Å
25G86.4Confident83.9Confident40 Ų4058 Ų5841%0.41232%0.321SS..Hα-helixtrans-64.1-41.8174.200000111.8L21 V22 L23 M29L21-G25 WeakPolarHBondContact O-CA 3.41Å; L21-G25 PolarHBondContact O-N 3.04Å; V22-G25 PolarHBondContact O-N 3.36Å; L23-G25 VanDerWaalsContact C-N 3.33Å; L23-G25 PolarHBondContact O-N 3.26Å; G25-M29 VanDerWaalsContact O-CB 3.31Å; G25-M29 WeakPolarHBondContact O-CB 3.34Å; G25-M29 PolarHBondContact O-N 2.98Å
26L85Confident83.6Confident61 Ų6161.5 Ų61.532%0.31933%0.332SS..Hα-helixtrans-71.2-37.2179.3-17052.5000112.2V22 L23 N24 M29 L30 I62V22-L26 WeakPolarHBondContact O-CB 3.4Å; V22-L26 PolarHBondContact O-N 2.91Å; L23-L26 PolarHBondContact O-N 3.42Å; N24-L26 VanDerWaalsContact C-N 3.34Å; L26-M29 PolarHBondContact O-N 3.27Å; L26-L30 WeakPolarHBondContact O-CB 3.36Å; L26-L30 PolarHBondContact O-N 3.11Å; L26-I62 HydrophobicContact CD1-CD1 4.24Å; L26-I62 HydrophobicContact CD2-CD1 3.56Å; L26-I62 HydrophobicContact CD2-CG1 3.42Å; L26-I62 VanDerWaalsContact CD2-CG1 3.42Å; L26-I62 HydrophobicContact CG-CD1 3.79Å; L26-I62 HydrophobicContact CG-CG1 3.81Å; L26-I62 HydrophobicContact CG-CG2 4.27Å
27T85.9Confident83Confident9 Ų964.7 Ų64.76%0.05535%0.347CS..Hα-helixtrans-65.5-46.2172.860.60000111.4L23 N24 M29 L30 T31 C63 S69L23-T27 VanDerWaalsContact O-CG2 3.26Å; L23-T27 WeakPolarHBondContact O-CG2 3.24Å; L23-T27 PolarHBondContact O-N 2.85Å; L23-T27 PolarHBondContact O-OG1 3.36Å; N24-T27 WeakPolarHBondContact CA-OG1 3.47Å; N24-T27 PolarHBondContact O-OG1 3.15Å; T27-M29 PolarHBondContact O-N 3.17Å; T27-L30 PolarHBondContact O-N 3.12Å; T27-T31 VanDerWaalsContact O-CG2 3.31Å; T27-T31 WeakPolarHBondContact O-CG2 3.1Å; T27-T31 PolarHBondContact O-N 2.96Å; T27-T31 PolarHBondContact O-OG1 3.15Å; T27-C63 HydrophobicContact CG2-CB 3.92Å; T27-C63 WeakPolarHBondContact CG2-O 3.31Å; T27-S69 WeakPolarHBondContact CG2-OG 3.37Å; T27-S69 PolarHBondContact OG1-OG 3.08Å; T27-S69 VanDerWaalsContact OG1-OG 3.1Å
28V86.9Confident82.3Confident82 Ų8267.9 Ų67.950%0.49737%0.366SS..Hα-helixtrans-59.6-46.1175.1171.30000111N24 L30 T31 L32N24-V28 WeakPolarHBondContact O-CB 3.39Å; N24-V28 VanDerWaalsContact O-CG2 3.23Å; N24-V28 WeakPolarHBondContact O-CG2 3.38Å; N24-V28 PolarHBondContact O-N 3.41Å; V28-L30 VanDerWaalsContact C-N 3.29Å; V28-L30 PolarHBondContact O-N 3.08Å; V28-T31 WeakPolarHBondContact CA-OG1 3.42Å; V28-T31 PolarHBondContact O-N 3.33Å; V28-T31 PolarHBondContact O-OG1 3.14Å; V28-L32 HydrophobicContact CG1-CD1 4.19Å; V28-L32 WeakPolarHBondContact O-CG 3.49Å; V28-L32 PolarHBondContact O-N 3.36Å
29M86.1Confident81.5Confident115 Ų11572.7 Ų72.757%0.56739%0.389SS*.Hα-helixtrans-57.8-42.7176.7-176.5-177.7172.300111.7G25 L26 T27 L32 L33G25-M29 VanDerWaalsContact O-CB 3.31Å; G25-M29 WeakPolarHBondContact O-CB 3.34Å; G25-M29 PolarHBondContact O-N 2.98Å; L26-M29 PolarHBondContact O-N 3.27Å; T27-M29 PolarHBondContact O-N 3.17Å; M29-L32 PolarHBondContact O-N 3.12Å; M29-L33 HydrophobicContact CG-CD1 4.33Å; M29-L33 VanDerWaalsContact O-CD1 3.24Å; M29-L33 WeakPolarHBondContact O-CD1 3.45Å; M29-L33 PolarHBondContact O-N 3.24Å; M29-L33 VanDerWaalsContact O-N 3.17Å
30L82.7Confident80.6Confident13 Ų1372.8 Ų72.87%0.06839%0.387CS..Hα-helixtrans-73.8-29.4180-17061.8000113.2L26 T27 V28 L32 L33 Q37 F40 I62 L64L26-L30 WeakPolarHBondContact O-CB 3.36Å; L26-L30 PolarHBondContact O-N 3.11Å; T27-L30 PolarHBondContact O-N 3.12Å; V28-L30 VanDerWaalsContact C-N 3.29Å; V28-L30 PolarHBondContact O-N 3.08Å; L30-L32 VanDerWaalsContact C-N 3.28Å; L30-L33 CarbonylContact O-C 3.39Å; L30-L33 PolarHBondContact O-N 3.04Å; L30-Q37 HydrophobicContact CD1-CG 4.09Å; L30-Q37 HydrophobicContact CG-CG 3.96Å; L30-Q37 PolarHBondContact O-NE2 3.3Å; L30-F40 HydrophobicContact CD1-CD2 3.7Å; L30-F40 HydrophobicContact CD1-CE2 3.86Å; L30-F40 HydrophobicContact CD2-CB 4.31Å; L30-F40 HydrophobicContact CD2-CD2 3.78Å; L30-F40 HydrophobicContact CD2-CE2 4.48Å; L30-F40 HydrophobicContact CD2-CG 4.26Å; L30-F40 HydrophobicContact CG-CD2 4.43Å; L30-I62 HydrophobicContact CD2-CG2 3.81Å; L30-L64 HydrophobicContact CD2-CD2 3.47Å; L30-L64 VanDerWaalsContact CD2-CD2 3.47Å
31T82.8Confident79.9Confident61 Ų6173.7 Ų73.737%0.37439%0.394SS..Hα-helixtrans-67.8-30170.759.60000112.4T27 V28 V66T27-T31 VanDerWaalsContact O-CG2 3.31Å; T27-T31 WeakPolarHBondContact O-CG2 3.1Å; T27-T31 PolarHBondContact O-N 2.96Å; T27-T31 PolarHBondContact O-OG1 3.15Å; V28-T31 WeakPolarHBondContact CA-OG1 3.42Å; V28-T31 PolarHBondContact O-N 3.33Å; V28-T31 PolarHBondContact O-OG1 3.14Å; T31-V66 HydrophobicContact CG2-CG2 3.82Å
32L84.1Confident79.2Confident131 Ų13169.2 Ų69.269%0.68637%0.37SS*.Hα-helixtrans-78.6-24.9176.8-68.9173.1000112.8V28 M29 L30 P34V28-L32 HydrophobicContact CG1-CD1 4.19Å; V28-L32 WeakPolarHBondContact O-CG 3.49Å; V28-L32 PolarHBondContact O-N 3.36Å; M29-L32 PolarHBondContact O-N 3.12Å; L30-L32 VanDerWaalsContact C-N 3.28Å; L32-P34 WeakPolarHBondContact O-CD 3.43Å
33L83.3Confident78.3Confident68 Ų6866.4 Ų66.436%0.35635%0.354SS..  trans-119.380177.9-67.288.5000111.3M29 L30 Q35 Y36M29-L33 HydrophobicContact CG-CD1 4.33Å; M29-L33 VanDerWaalsContact O-CD1 3.24Å; M29-L33 WeakPolarHBondContact O-CD1 3.45Å; M29-L33 PolarHBondContact O-N 3.24Å; M29-L33 VanDerWaalsContact O-N 3.17Å; L30-L33 CarbonylContact O-C 3.39Å; L30-L33 PolarHBondContact O-N 3.04Å; L33-Q35 PolarHBondContact O-N 3.42Å; L33-Q35 VanDerWaalsContact O-N 3.12Å; L33-Y36 HydrophobicContact CB-CD2 3.84Å; L33-Y36 HydrophobicContact CB-CE2 4.36Å; L33-Y36 HydrophobicContact CD2-CD2 3.97Å; L33-Y36 HydrophobicContact CD2-CE2 3.68Å; L33-Y36 PolarHBondContact O-N 2.83Å
34P76.9Confident77.4Confident77 Ų7766.3 Ų66.350%0.535%0.353SS..G310 helixtrans-62.7-22.7-176.924.8-34000113.4L32 Y36 Q37L32-P34 WeakPolarHBondContact O-CD 3.43Å; P34-Y36 PolarHBondContact O-N 3.28Å; P34-Y36 VanDerWaalsContact O-N 3.12Å; P34-Q37 WeakPolarHBondContact O-CB 3.15Å; P34-Q37 PolarHBondContact O-N 2.9Å; P34-Q37 VanDerWaalsContact O-N 3.11Å
35Q73.9Confident76.2Confident163 Ų16366.5 Ų66.576%0.76235%0.353SS*.G310 helixtrans-59.4-22.8178.2-65.4175.9-22.700114.1L33L33-Q35 PolarHBondContact O-N 3.42Å; L33-Q35 VanDerWaalsContact O-N 3.12Å
36Y72Confident74.9Confident114 Ų11465.3 Ų65.345%0.44734%0.339SS..G310 helixtrans-97.4-5.2-179.7-65.1-81.3000113.6L33 P34 D38 M39 F40L33-Y36 HydrophobicContact CB-CD2 3.84Å; L33-Y36 HydrophobicContact CB-CE2 4.36Å; L33-Y36 HydrophobicContact CD2-CD2 3.97Å; L33-Y36 HydrophobicContact CD2-CE2 3.68Å; L33-Y36 PolarHBondContact O-N 2.83Å; P34-Y36 PolarHBondContact O-N 3.28Å; P34-Y36 VanDerWaalsContact O-N 3.12Å; Y36-D38 VanDerWaalsContact C-N 3.33Å; Y36-D38 PolarHBondContact O-N 3.2Å; Y36-M39 HydrophobicContact CD1-CE 4.07Å; Y36-M39 PolarHBondContact O-N 3.31Å; Y36-M39 VanDerWaalsContact O-N 3.15Å; Y36-F40 WeakPolarHBondContact O-CD2 3.17Å
37Q72.6Confident74Confident68 Ų6863.8 Ų63.832%0.31833%0.332SS..G310 helixtrans-61.5-39.6-174.5-71.6177.7-5.600112.4L30 P34 M39 F40 V41L30-Q37 HydrophobicContact CD1-CG 4.09Å; L30-Q37 HydrophobicContact CG-CG 3.96Å; L30-Q37 PolarHBondContact O-NE2 3.3Å; P34-Q37 WeakPolarHBondContact O-CB 3.15Å; P34-Q37 PolarHBondContact O-N 2.9Å; P34-Q37 VanDerWaalsContact O-N 3.11Å; Q37-M39 PolarHBondContact O-N 2.63Å; Q37-M39 VanDerWaalsContact O-N 3.15Å; Q37-F40 PolarHBondContact O-N 3.3Å; Q37-V41 PolarHBondContact O-N 2.78Å
38D67.9Low73Confident119 Ų11965.7 Ų65.764%0.63635%0.349SS*.G310 helixtrans-64.1-20179.3-62-20.9000113.8Y36 F40 R55Y36-D38 VanDerWaalsContact C-N 3.33Å; Y36-D38 PolarHBondContact O-N 3.2Å; D38-F40 VanDerWaalsContact C-N 3.33Å; D38-R55 PolarHBondContact O-NH2 3.34Å
39M65.8Low72.1Confident108 Ų10869 Ų6953%0.53236%0.359SS..G310 helixtrans-79.5-18174.8-66.3-134.2-68.400112.9Y36 Q37Y36-M39 HydrophobicContact CD1-CE 4.07Å; Y36-M39 PolarHBondContact O-N 3.31Å; Y36-M39 VanDerWaalsContact O-N 3.15Å; Q37-M39 PolarHBondContact O-N 2.63Å; Q37-M39 VanDerWaalsContact O-N 3.15Å
40F67.6Low71.3Confident40 Ų4069.1 Ų69.118%0.17536%0.358CS..SBendtrans-109.92.5-174.7-63.4-68.6000113.9L30 Y36 Q37 D38 Y42 C58 G59 I62 L64L30-F40 HydrophobicContact CD1-CD2 3.7Å; L30-F40 HydrophobicContact CD1-CE2 3.86Å; L30-F40 HydrophobicContact CD2-CB 4.31Å; L30-F40 HydrophobicContact CD2-CD2 3.78Å; L30-F40 HydrophobicContact CD2-CE2 4.48Å; L30-F40 HydrophobicContact CD2-CG 4.26Å; L30-F40 HydrophobicContact CG-CD2 4.43Å; Y36-F40 WeakPolarHBondContact O-CD2 3.17Å; Q37-F40 PolarHBondContact O-N 3.3Å; D38-F40 VanDerWaalsContact C-N 3.33Å; F40-Y42 PolarHBondContact O-N 2.85Å; F40-C58 HydrophobicContact CD1-CB 3.47Å; F40-C58 VanDerWaalsContact CD1-CB 3.47Å; F40-C58 HydrophobicContact CE1-CB 3.52Å; F40-G59 WeakPolarHBondContact O-CA 3.35Å; F40-I62 HydrophobicContact CD1-CD1 3.64Å; F40-I62 HydrophobicContact CE1-CD1 3.55Å; F40-I62 HydrophobicContact CG-CD1 4.22Å; F40-I62 HydrophobicContact CZ-CD1 4.07Å; F40-L64 HydrophobicContact CB-CD2 4.01Å
41V73Confident70.8Confident36 Ų3675.6 Ų75.622%0.21839%0.388CS..  trans-60.9126.6172.7179.20000109.9Q37 S43 L64 E123Q37-V41 PolarHBondContact O-N 2.78Å; V41-S43 PolarHBondContact O-N 3.05Å; V41-L64 HydrophobicContact CG2-CD1 4.42Å; V41-E123 HydrophobicContact CG1-CG 4.2Å
42Y70.1Confident70.5Confident4 Ų474.4 Ų74.42%0.01638%0.378CS..  trans-89.486.4-177.4-175.5-113.4000110.3F40 L44 L56 R60 L124F40-Y42 PolarHBondContact O-N 2.85Å; Y42-L44 HydrophobicContact CD1-CD1 4.31Å; Y42-L44 HydrophobicContact CE1-CD1 3.55Å; Y42-L56 HydrophobicContact CE2-CB 4.48Å; Y42-L56 HydrophobicContact CE2-CD1 4.21Å; Y42-L56 HydrophobicContact CE2-CG 4.05Å; Y42-R60 HydrophobicContact CD2-CG 3.95Å; Y42-R60 HydrophobicContact CE2-CG 3.45Å; Y42-R60 VanDerWaalsContact CE2-CG 3.45Å; Y42-R60 PolarHBondContact OH-NH1 3.21Å; Y42-L124 HydrophobicContact CD1-CB 3.58Å; Y42-L124 HydrophobicContact CE1-CB 3.83Å; Y42-L124 HydrophobicContact CE1-CD2 4.34Å; Y42-L124 PolarHBondContact O-N 3.5Å
43S69.5Low70.1Confident24 Ų2472 Ų7217%0.16837%0.369CS..  trans-104.8122174.4179.80000111V41 V47 E122V41-S43 PolarHBondContact O-N 3.05Å; S43-V47 WeakPolarHBondContact O-CG2 3.23Å; S43-E122 WeakPolarHBondContact CA-O 3.38Å; S43-E122 WeakPolarHBondContact CB-O 3.48Å; S43-E122 PolarHBondContact OG-O 2.98Å
44L65.3Low69.6Low14 Ų1476 Ų767%0.07338%0.379CS..Hα-helixtrans-73-31174.4-86.493.4000112.2Y42 V47 A48 F107 A110 L124Y42-L44 HydrophobicContact CD1-CD1 4.31Å; Y42-L44 HydrophobicContact CE1-CD1 3.55Å; L44-V47 PolarHBondContact O-N 3.41Å; L44-A48 WeakPolarHBondContact O-CB 3.31Å; L44-A48 PolarHBondContact O-N 3.34Å; L44-F107 HydrophobicContact CD2-CB 4.34Å; L44-F107 HydrophobicContact CD2-CD2 4.23Å; L44-A110 HydrophobicContact CD2-CB 3.77Å; L44-L124 HydrophobicContact CD1-CB 4.46Å; L44-L124 HydrophobicContact CD1-CD1 3.46Å; L44-L124 VanDerWaalsContact CD1-CD1 3.46Å; L44-L124 HydrophobicContact CD1-CD2 3.96Å; L44-L124 HydrophobicContact CD1-CG 4.17Å
45Q62.1Low69.5Low49 Ų4975.6 Ų75.623%0.22937%0.368CS..Hα-helixtrans-61-47.3179.5-163.4106.1-14.700111.4V47 A48 H49 E120Q45-V47 VanDerWaalsContact C-N 3.31Å; Q45-V47 PolarHBondContact O-N 2.84Å; Q45-A48 PolarHBondContact O-N 3.23Å; Q45-H49 PolarHBondContact O-N 3.06Å; Q45-E120 VanDerWaalsContact NE2-CD 3.27Å; Q45-E120 PolarHBondContact NE2-OE1 3.15Å; Q45-E120 PolarHBondContact NE2-OE2 2.85Å
46A60.3Low69.6Low16 Ų1669.2 Ų69.213%0.13234%0.339CS..Hα-helixtrans-66.5-32.8178.700000112.2Q50A46-Q50 WeakPolarHBondContact O-CA 3.18Å; A46-Q50 VanDerWaalsContact O-CB 3.23Å; A46-Q50 WeakPolarHBondContact O-CB 3.08Å; A46-Q50 PolarHBondContact O-N 2.88Å
47V65.3Low69.9Low28 Ų2867.4 Ų67.417%0.1734%0.336CS..Hα-helixtrans-71-41.4176.3176.40000111S43 L44 Q45 H51 L56S43-V47 WeakPolarHBondContact O-CG2 3.23Å; L44-V47 PolarHBondContact O-N 3.41Å; Q45-V47 VanDerWaalsContact C-N 3.31Å; Q45-V47 PolarHBondContact O-N 2.84Å; V47-H51 WeakPolarHBondContact O-CA 3.41Å; V47-H51 PolarHBondContact O-N 3.49Å; V47-L56 HydrophobicContact CG1-CB 4.47Å; V47-L56 HydrophobicContact CG1-CD1 4.15Å; V47-L56 HydrophobicContact CG2-CB 4.05Å
48A64.9Low70.1Confident50 Ų5066.3 Ų66.341%0.41334%0.336SS..Hα-helixtrans-66.7-43.1179.400000112.4L44 Q45 F107L44-A48 WeakPolarHBondContact O-CB 3.31Å; L44-A48 PolarHBondContact O-N 3.34Å; Q45-A48 PolarHBondContact O-N 3.23Å; A48-F107 HydrophobicContact CB-CE2 4.48Å
49H68Low70.5Confident150 Ų15060.7 Ų60.769%0.69431%0.305SS*.Hα-helixtrans-90.9-33.8-176-77.7-73.1000114.8Q45Q45-H49 PolarHBondContact O-N 3.06Å
50Q69.9Low71.3Confident118 Ų11855.9 Ų55.955%0.55128%0.281SS*.Hα-helixtrans-110.13.1-172-54.2-177.9-5.600113.6A46 Q52A46-Q50 WeakPolarHBondContact O-CA 3.18Å; A46-Q50 VanDerWaalsContact O-CB 3.23Å; A46-Q50 WeakPolarHBondContact O-CB 3.08Å; A46-Q50 PolarHBondContact O-N 2.88Å; Q50-Q52 HydrophobicContact CB-CG 3.9Å; Q50-Q52 PolarHBondContact O-N 3.43Å; Q50-Q52 VanDerWaalsContact O-N 3.08Å; Q50-Q52 VanDerWaalsContact OE1-NE2 3.07Å
51H71.1Confident71.9Confident150 Ų15057.5 Ų57.569%0.69429%0.292SS*.  trans51.629.3-179-63.8-58.5000114.8V47 V53V47-H51 WeakPolarHBondContact O-CA 3.41Å; V47-H51 PolarHBondContact O-N 3.49Å; H51-V53 PolarHBondContact O-N 2.82Å
52Q76.8Confident72.3Confident36 Ų3656.2 Ų56.217%0.16828%0.283CS..  trans-79.368-178.9-62-174.9-1300111.5Q50 W54 R55Q50-Q52 HydrophobicContact CB-CG 3.9Å; Q50-Q52 PolarHBondContact O-N 3.43Å; Q50-Q52 VanDerWaalsContact O-N 3.08Å; Q50-Q52 VanDerWaalsContact OE1-NE2 3.07Å; Q52-W54 HydrophobicContact CB-CD2 4.33Å; Q52-W54 HydrophobicContact CB-CH2 4.09Å; Q52-W54 HydrophobicContact CB-CZ2 3.77Å; Q52-W54 HydrophobicContact CB-CZ3 4.48Å; Q52-W54 HydrophobicContact CG-CH2 3.73Å; Q52-W54 HydrophobicContact CG-CZ2 3.5Å; Q52-W54 VanDerWaalsContact CG-CZ2 3.5Å; Q52-W54 PolarHBondContact O-N 2.91Å; Q52-W54 VanDerWaalsContact O-N 3.17Å; Q52-R55 HydrophobicContact CB-CB 4.48Å; Q52-R55 HydrophobicContact CB-CG 4.39Å; Q52-R55 WeakPolarHBondContact O-CB 3.25Å; Q52-R55 PolarHBondContact O-N 3.23Å; Q52-R55 VanDerWaalsContact OE1-CD 3.25Å
53V75.4Confident72.9Confident81 Ų8156.1 Ų56.149%0.49128%0.283SS..Hα-helixtrans-60.2-29.4-175.7-173.30000112.1H51 R55 L56 L57H51-V53 PolarHBondContact O-N 2.82Å; V53-R55 VanDerWaalsContact C-N 3.27Å; V53-R55 PolarHBondContact O-N 3.19Å; V53-L56 WeakPolarHBondContact O-CB 2.9Å; V53-L56 PolarHBondContact O-N 3.44Å; V53-L56 VanDerWaalsContact O-N 3.11Å; V53-L57 WeakPolarHBondContact O-CG 3.49Å; V53-L57 PolarHBondContact O-N 2.89Å
54W72.9Confident73.4Confident152 Ų15257.5 Ų57.558%0.57629%0.288SS*.Hα-helixtrans-62-33.2176.461.186.4000112.9Q52 L56 L57 C58Q52-W54 HydrophobicContact CB-CD2 4.33Å; Q52-W54 HydrophobicContact CB-CH2 4.09Å; Q52-W54 HydrophobicContact CB-CZ2 3.77Å; Q52-W54 HydrophobicContact CB-CZ3 4.48Å; Q52-W54 HydrophobicContact CG-CH2 3.73Å; Q52-W54 HydrophobicContact CG-CZ2 3.5Å; Q52-W54 VanDerWaalsContact CG-CZ2 3.5Å; Q52-W54 PolarHBondContact O-N 2.91Å; Q52-W54 VanDerWaalsContact O-N 3.17Å; W54-L56 VanDerWaalsContact C-N 3.32Å; W54-L57 PolarHBondContact O-N 2.98Å; W54-C58 WeakPolarHBondContact O-CB 3.24Å; W54-C58 PolarHBondContact O-N 2.86Å; W54-C58 PolarHBondContact O-SG 2.88Å; W54-C58 VanDerWaalsContact O-SG 3.36Å
55R75.2Confident74.3Confident68 Ų6860.4 Ų60.426%0.25730%0.304SS..Hα-helixtrans-67-35.5174.7-78.5-170.1157.8167.3-23.2111.8D38 Q52 V53 G59D38-R55 PolarHBondContact O-NH2 3.34Å; Q52-R55 HydrophobicContact CB-CB 4.48Å; Q52-R55 HydrophobicContact CB-CG 4.39Å; Q52-R55 WeakPolarHBondContact O-CB 3.25Å; Q52-R55 PolarHBondContact O-N 3.23Å; Q52-R55 VanDerWaalsContact OE1-CD 3.25Å; V53-R55 VanDerWaalsContact C-N 3.27Å; V53-R55 PolarHBondContact O-N 3.19Å; R55-G59 WeakPolarHBondContact O-CA 3.29Å; R55-G59 PolarHBondContact O-N 2.96Å
56L75.3Confident75.4Confident29 Ų2962.7 Ų62.715%0.15232%0.321CS..Hα-helixtrans-66.8-44174.2-177.1132000111.4Y42 V47 V53 W54 R60Y42-L56 HydrophobicContact CE2-CB 4.48Å; Y42-L56 HydrophobicContact CE2-CD1 4.21Å; Y42-L56 HydrophobicContact CE2-CG 4.05Å; V47-L56 HydrophobicContact CG1-CB 4.47Å; V47-L56 HydrophobicContact CG1-CD1 4.15Å; V47-L56 HydrophobicContact CG2-CB 4.05Å; V53-L56 WeakPolarHBondContact O-CB 2.9Å; V53-L56 PolarHBondContact O-N 3.44Å; V53-L56 VanDerWaalsContact O-N 3.11Å; W54-L56 VanDerWaalsContact C-N 3.32Å; L56-R60 VanDerWaalsContact O-CB 3.31Å; L56-R60 WeakPolarHBondContact O-CB 3.4Å; L56-R60 WeakPolarHBondContact O-CG 3.34Å; L56-R60 PolarHBondContact O-N 3.48Å
57L77.9Confident76.8Confident75 Ų7566.8 Ų66.839%0.39334%0.336SS..Hα-helixtrans-63.1-54177.5-63.1-177.3000111.4V53 W54 L61 W99V53-L57 WeakPolarHBondContact O-CG 3.49Å; V53-L57 PolarHBondContact O-N 2.89Å; W54-L57 PolarHBondContact O-N 2.98Å; L57-L61 VanDerWaalsContact O-CG 3.23Å; L57-L61 WeakPolarHBondContact O-CG 3.45Å; L57-L61 PolarHBondContact O-N 3.43Å; L57-W99 HydrophobicContact CD2-CH2 3.32Å; L57-W99 HydrophobicContact CD2-CZ2 3.82Å; L57-W99 HydrophobicContact CD2-CZ3 4.45Å
58C77.9Confident77.8Confident46 Ų4665.6 Ų65.631%0.31133%0.329SS..Hα-helixtrans-74.4-39.2-173.7-61.50000112.7F40 W54 R60 L61 I62F40-C58 HydrophobicContact CD1-CB 3.47Å; F40-C58 VanDerWaalsContact CD1-CB 3.47Å; F40-C58 HydrophobicContact CE1-CB 3.52Å; W54-C58 WeakPolarHBondContact O-CB 3.24Å; W54-C58 PolarHBondContact O-N 2.86Å; W54-C58 PolarHBondContact O-SG 2.88Å; W54-C58 VanDerWaalsContact O-SG 3.36Å; C58-R60 VanDerWaalsContact C-N 3.31Å; C58-R60 PolarHBondContact O-N 3.42Å; C58-L61 PolarHBondContact O-N 2.69Å; C58-L61 VanDerWaalsContact O-N 3.15Å; C58-I62 WeakPolarHBondContact O-CG1 3.39Å; C58-I62 PolarHBondContact O-N 3.07Å
59G77.1Confident78.9Confident0 Ų063.3 Ų63.30%031%0.31CS..Hα-helixtrans-66.7-27.917700000113.5F40 R55 A126 G127F40-G59 WeakPolarHBondContact O-CA 3.35Å; R55-G59 WeakPolarHBondContact O-CA 3.29Å; R55-G59 PolarHBondContact O-N 2.96Å; G59-A126 CarbonylContact O-C 3.49Å; G59-A126 VanDerWaalsContact O-CA 3.28Å; G59-A126 WeakPolarHBondContact O-CA 3.26Å; G59-A126 VanDerWaalsContact O-CB 3.26Å; G59-A126 WeakPolarHBondContact O-CB 3.28Å; G59-G127 PolarHBondContact O-N 3.22Å
60R82.2Confident80Confident7 Ų762.3 Ų62.33%0.02630%0.304CS..Hα-helixtrans-82.6-17.3171.9-69.4-177.57976.7-2.9114.1Y42 L56 C58 S102 D106 G127 L128Y42-R60 HydrophobicContact CD2-CG 3.95Å; Y42-R60 HydrophobicContact CE2-CG 3.45Å; Y42-R60 VanDerWaalsContact CE2-CG 3.45Å; Y42-R60 PolarHBondContact OH-NH1 3.21Å; L56-R60 VanDerWaalsContact O-CB 3.31Å; L56-R60 WeakPolarHBondContact O-CB 3.4Å; L56-R60 WeakPolarHBondContact O-CG 3.34Å; L56-R60 PolarHBondContact O-N 3.48Å; C58-R60 VanDerWaalsContact C-N 3.31Å; C58-R60 PolarHBondContact O-N 3.42Å; R60-S102 PolarHBondContact NH2-OG 3.14Å; R60-D106 IonicContact CZ-OD2 3.79Å; R60-D106 IonicContact NH1-OD2 3.98Å; R60-D106 PolarHBondContact NH1-OD2 3.47Å; R60-D106 IonicContact NH2-OD2 2.63Å; R60-D106 PolarHBondContact NH2-OD2 2.94Å; R60-G127 CarbonylContact O-C 2.95Å; R60-L128 WeakPolarHBondContact O-CA 3.47Å; R60-L128 PolarHBondContact O-N 3.27Å; R60-L128 VanDerWaalsContact O-N 3.17Å
61L79.8Confident80.9Confident75 Ų7557 Ų5739%0.39328%0.28SS..Hα-helixtrans-89.8-34.4179.2-72.3173.4000111.5L23 L57 C58 L128L23-L61 WeakPolarHBondContact CD2-O 3.14Å; L57-L61 VanDerWaalsContact O-CG 3.23Å; L57-L61 WeakPolarHBondContact O-CG 3.45Å; L57-L61 PolarHBondContact O-N 3.43Å; C58-L61 PolarHBondContact O-N 2.69Å; C58-L61 VanDerWaalsContact O-N 3.15Å; L61-L128 HydrophobicContact CD2-CD1 4.22Å
62I81.6Confident81.8Confident8 Ų850 Ų504%0.04125%0.248CC..SBendtrans-107.4124.9-169.4-55.7171.6000110.4L26 L30 F40 C58 A126 G127L26-I62 HydrophobicContact CD1-CD1 4.24Å; L26-I62 HydrophobicContact CD2-CD1 3.56Å; L26-I62 HydrophobicContact CD2-CG1 3.42Å; L26-I62 VanDerWaalsContact CD2-CG1 3.42Å; L26-I62 HydrophobicContact CG-CD1 3.79Å; L26-I62 HydrophobicContact CG-CG1 3.81Å; L26-I62 HydrophobicContact CG-CG2 4.27Å; L30-I62 HydrophobicContact CD2-CG2 3.81Å; F40-I62 HydrophobicContact CD1-CD1 3.64Å; F40-I62 HydrophobicContact CE1-CD1 3.55Å; F40-I62 HydrophobicContact CG-CD1 4.22Å; F40-I62 HydrophobicContact CZ-CD1 4.07Å; C58-I62 WeakPolarHBondContact O-CG1 3.39Å; C58-I62 PolarHBondContact O-N 3.07Å; I62-A126 CarbonylContact O-C 3.45Å; I62-G127 WeakPolarHBondContact O-CA 3.42Å; I62-G127 PolarHBondContact O-N 3.31Å
63C81.4Confident82.4Confident2 Ų249.6 Ų49.61%0.01425%0.249CC..  trans-78.7124.1170-53.50000109.2T27T27-C63 HydrophobicContact CG2-CB 3.92Å; T27-C63 WeakPolarHBondContact CG2-O 3.31Å
64L81.8Confident83.1Confident53 Ų5348.7 Ų48.728%0.27724%0.241SC..SBendtrans-76.6-37175.3-66.2174.1000111.3L30 F40 V41 A126L30-L64 HydrophobicContact CD2-CD2 3.47Å; L30-L64 VanDerWaalsContact CD2-CD2 3.47Å; F40-L64 HydrophobicContact CB-CD2 4.01Å; V41-L64 HydrophobicContact CG2-CD1 4.42Å; L64-A126 HydrophobicContact CB-CB 4.48Å; L64-A126 HydrophobicContact CD1-CB 3.73Å; L64-A126 HydrophobicContact CG-CB 3.75Å
65D83.3Confident83.9Confident75 Ų7541.5 Ų41.540%0.40121%0.213SC..  trans-85.8129.7-178.9-83.9-51.9000112.7K67 D68 S69D65-K67 VanDerWaalsContact C-N 3.32Å; D65-K67 HydrophobicContact CB-CG 3.93Å; D65-K67 PolarHBondContact O-N 2.85Å; D65-D68 HydrophobicContact CB-CB 3.94Å; D65-D68 PolarHBondContact O-N 3.33Å; D65-S69 PolarHBondContact O-N 3.25Å
66V85.8Confident84.6Confident98 Ų9838.6 Ų38.659%0.59420%0.203SC*.Hα-helixtrans-63.7-38.7177.2-178.10000111.4T31 D68 S69 F70T31-V66 HydrophobicContact CG2-CG2 3.82Å; V66-D68 VanDerWaalsContact C-N 3.3Å; V66-D68 PolarHBondContact O-N 3.03Å; V66-S69 PolarHBondContact O-N 3.41Å; V66-F70 WeakPolarHBondContact O-CB 3.49Å; V66-F70 PolarHBondContact O-N 3.22Å
67K88.1Confident85.2Confident101 Ų10141.9 Ų41.944%0.43921%0.214SC..Hα-helixtrans-58.8-41.3175.752.5172.6179.6160.30111.9D65 F70 C71 S173D65-K67 VanDerWaalsContact C-N 3.32Å; D65-K67 HydrophobicContact CB-CG 3.93Å; D65-K67 PolarHBondContact O-N 2.85Å; K67-F70 PolarHBondContact O-N 3Å; K67-C71 WeakPolarHBondContact O-CB 3.31Å; K67-C71 PolarHBondContact O-N 3.21Å; K67-S173 WeakPolarHBondContact CD-OG 3.19Å; K67-S173 WeakPolarHBondContact CE-OG 3.39Å; K67-S173 PolarHBondContact NZ-O 3.24Å; K67-S173 PolarHBondContact NZ-OG 3.43Å
68D88.1Confident85.7Confident3 Ų340.3 Ų40.32%0.01621%0.206CC..Hα-helixtrans-77-38-177.6-66.7-10.2000110.5D65 V66 S72 L129 L170 S173 M177D65-D68 HydrophobicContact CB-CB 3.94Å; D65-D68 PolarHBondContact O-N 3.33Å; V66-D68 VanDerWaalsContact C-N 3.3Å; V66-D68 PolarHBondContact O-N 3.03Å; D68-S72 WeakPolarHBondContact O-CB 3.44Å; D68-S72 PolarHBondContact O-N 3.29Å; D68-S72 PolarHBondContact O-OG 3.5Å; D68-L129 HydrophobicContact CB-CD2 4.4Å; D68-L170 HydrophobicContact CB-CD1 4.29Å; D68-S173 WeakPolarHBondContact OD1-CB 3.36Å; D68-S173 PolarHBondContact OD1-OG 3.08Å; D68-S173 PolarHBondContact OD2-OG 2.89Å; D68-M177 WeakPolarHBondContact OD2-CE 3.46Å
69S88.3Confident86.1Confident3 Ų338.1 Ų38.12%0.02119%0.192CC..Hα-helixtrans-59.4-45170.1-169.20000111.6N24 T27 D65 V66 S72 S73N24-S69 PolarHBondContact OD1-OG 3.5Å; T27-S69 WeakPolarHBondContact CG2-OG 3.37Å; T27-S69 PolarHBondContact OG1-OG 3.08Å; T27-S69 VanDerWaalsContact OG1-OG 3.1Å; D65-S69 PolarHBondContact O-N 3.25Å; V66-S69 PolarHBondContact O-N 3.41Å; S69-S72 WeakPolarHBondContact CA-OG 3.18Å; S69-S72 PolarHBondContact O-OG 2.89Å; S69-S73 WeakPolarHBondContact O-CB 3.43Å; S69-S73 PolarHBondContact O-N 3.37Å
70F89.7Confident86.5Confident128 Ų12839.3 Ų39.356%0.56120%0.196SC*.Hα-helixtrans-65.9-47.8179.4179.8-103.7000112V66 K67 S73 L74V66-F70 WeakPolarHBondContact O-CB 3.49Å; V66-F70 PolarHBondContact O-N 3.22Å; K67-F70 PolarHBondContact O-N 3Å; F70-S73 WeakPolarHBondContact O-CB 3.31Å; F70-S73 PolarHBondContact O-N 3.04Å; F70-L74 HydrophobicContact CD1-CD1 4.11Å; F70-L74 HydrophobicContact CE1-CD1 3.52Å; F70-L74 HydrophobicContact CE1-CG 4.28Å; F70-L74 HydrophobicContact CZ-CD1 3.83Å; F70-L74 HydrophobicContact CZ-CG 4.27Å; F70-L74 WeakPolarHBondContact O-CG 3.4Å; F70-L74 PolarHBondContact O-N 3.45Å
71C89.5Confident86.5Confident7 Ų741.4 Ų41.45%0.04721%0.207CC..Hα-helixtrans-65.9-44.3-179.9-175.10000112.1K67 S73 L74 L75 V166 L170K67-C71 WeakPolarHBondContact O-CB 3.31Å; K67-C71 PolarHBondContact O-N 3.21Å; C71-S73 VanDerWaalsContact C-N 3.34Å; C71-S73 PolarHBondContact O-N 3.4Å; C71-L74 PolarHBondContact O-N 3.36Å; C71-L75 WeakPolarHBondContact O-CG 3.38Å; C71-L75 PolarHBondContact O-N 2.91Å; C71-V166 WeakPolarHBondContact SG-CG1 3.45Å; C71-V166 PolarHBondContact SG-O 3.43Å; C71-L170 HydrophobicContact CB-CD1 3.9Å
72S89.6Confident86.7Confident4 Ų437.9 Ų37.93%0.02819%0.189CC..Hα-helixtrans-61.7-41.3174.1590000111.7D68 S69 L74 L75 I76D68-S72 WeakPolarHBondContact O-CB 3.44Å; D68-S72 PolarHBondContact O-N 3.29Å; D68-S72 PolarHBondContact O-OG 3.5Å; S69-S72 WeakPolarHBondContact CA-OG 3.18Å; S69-S72 PolarHBondContact O-OG 2.89Å; S72-L74 PolarHBondContact O-N 3.45Å; S72-L75 PolarHBondContact O-N 2.88Å; S72-L75 VanDerWaalsContact O-N 3.13Å; S72-I76 WeakPolarHBondContact O-CB 3.27Å; S72-I76 VanDerWaalsContact O-CD1 3.29Å; S72-I76 WeakPolarHBondContact O-CD1 3.47Å; S72-I76 VanDerWaalsContact O-CG1 3.25Å; S72-I76 WeakPolarHBondContact O-CG1 3.41Å; S72-I76 PolarHBondContact O-N 2.94Å
73S89.5Confident86.8Confident26 Ų2637.6 Ų37.618%0.18219%0.187CC..Hα-helixtrans-57.6-45.5174.1179.10000112.2L20 N24 S69 F70 C71 L75 I76 Y77L20-S73 WeakPolarHBondContact CD2-O 3.36Å; L20-S73 VanDerWaalsContact CD2-OG 3.22Å; L20-S73 WeakPolarHBondContact CD2-OG 3.29Å; N24-S73 PolarHBondContact ND2-OG 3.34Å; S69-S73 WeakPolarHBondContact O-CB 3.43Å; S69-S73 PolarHBondContact O-N 3.37Å; F70-S73 WeakPolarHBondContact O-CB 3.31Å; F70-S73 PolarHBondContact O-N 3.04Å; C71-S73 VanDerWaalsContact C-N 3.34Å; C71-S73 PolarHBondContact O-N 3.4Å; S73-L75 VanDerWaalsContact C-N 3.34Å; S73-L75 PolarHBondContact O-N 3.11Å; S73-I76 PolarHBondContact O-N 3.18Å; S73-Y77 WeakPolarHBondContact O-CB 3.45Å; S73-Y77 PolarHBondContact O-N 3.43Å
74L90.1Very high86.9Confident63 Ų6341 Ų4133%0.3320%0.2SC..Hα-helixtrans-60.9-41.6173.9-71.6177.9000112.2F70 C71 S72 Y77 N78 V166F70-L74 HydrophobicContact CD1-CD1 4.11Å; F70-L74 HydrophobicContact CE1-CD1 3.52Å; F70-L74 HydrophobicContact CE1-CG 4.28Å; F70-L74 HydrophobicContact CZ-CD1 3.83Å; F70-L74 HydrophobicContact CZ-CG 4.27Å; F70-L74 WeakPolarHBondContact O-CG 3.4Å; F70-L74 PolarHBondContact O-N 3.45Å; C71-L74 PolarHBondContact O-N 3.36Å; S72-L74 PolarHBondContact O-N 3.45Å; L74-Y77 PolarHBondContact O-N 2.99Å; L74-N78 PolarHBondContact O-N 3.27Å; L74-N78 PolarHBondContact O-ND2 2.82Å; L74-V166 HydrophobicContact CB-CG1 4.23Å
75L90.5Very high86.9Confident0 Ų045.1 Ų45.10%021%0.211CC..Hα-helixtrans-66.5-46.7177.9-72.2169.3000112.1C71 S72 S73 Y77 N78 F79 V132 F136 V163 V166 L170C71-L75 WeakPolarHBondContact O-CG 3.38Å; C71-L75 PolarHBondContact O-N 2.91Å; S72-L75 PolarHBondContact O-N 2.88Å; S72-L75 VanDerWaalsContact O-N 3.13Å; S73-L75 VanDerWaalsContact C-N 3.34Å; S73-L75 PolarHBondContact O-N 3.11Å; L75-Y77 VanDerWaalsContact C-N 3.27Å; L75-Y77 PolarHBondContact O-N 3.26Å; L75-N78 PolarHBondContact O-N 3.4Å; L75-N78 VanDerWaalsContact O-N 3.11Å; L75-F79 HydrophobicContact CB-CD2 4.21Å; L75-F79 HydrophobicContact CB-CE2 3.98Å; L75-F79 HydrophobicContact CD2-CE2 4.18Å; L75-F79 HydrophobicContact CD2-CZ 4.32Å; L75-F79 WeakPolarHBondContact O-CB 3.14Å; L75-F79 WeakPolarHBondContact O-CD2 3.13Å; L75-F79 VanDerWaalsContact O-CG 3.3Å; L75-F79 WeakPolarHBondContact O-CG 3.13Å; L75-F79 PolarHBondContact O-N 3.08Å; L75-V132 HydrophobicContact CB-CG1 3.69Å; L75-V132 HydrophobicContact CD1-CG1 3.59Å; L75-V132 HydrophobicContact CG-CG1 4.26Å; L75-F136 HydrophobicContact CD1-CE2 4.17Å; L75-F136 HydrophobicContact CD1-CZ 4.18Å; L75-F136 HydrophobicContact CD2-CE1 4.41Å; L75-F136 HydrophobicContact CD2-CE2 4.16Å; L75-F136 HydrophobicContact CD2-CZ 3.54Å; L75-V163 HydrophobicContact CD2-CG1 3.97Å; L75-V166 HydrophobicContact CD1-CG1 4.29Å; L75-V166 HydrophobicContact CD2-CB 4.19Å; L75-V166 HydrophobicContact CD2-CG1 3.91Å; L75-V166 HydrophobicContact CG-CG1 3.74Å; L75-L170 HydrophobicContact CD1-CD2 3.8Å
76I90.1Very high86.6Confident8 Ų845.1 Ų45.14%0.04121%0.208CC..Hα-helixtrans-58.6-41.8176.6-68.2153.3000110.4C16 L19 L20 L23 S72 S73 N78 F79 R80 V132C16-I76 HydrophobicContact CB-CG2 4.35Å; L19-I76 HydrophobicContact CD2-CB 4.32Å; L19-I76 HydrophobicContact CD2-CD1 3.22Å; L19-I76 HydrophobicContact CD2-CG1 3.72Å; L19-I76 HydrophobicContact CD2-CG2 3.69Å; L20-I76 HydrophobicContact CD1-CG2 4.34Å; L20-I76 HydrophobicContact CD2-CB 3.91Å; L20-I76 HydrophobicContact CD2-CG2 3.82Å; L20-I76 HydrophobicContact CG-CB 4.4Å; L20-I76 HydrophobicContact CG-CG2 3.75Å; L23-I76 HydrophobicContact CD1-CD1 4.01Å; S72-I76 WeakPolarHBondContact O-CB 3.27Å; S72-I76 VanDerWaalsContact O-CD1 3.29Å; S72-I76 WeakPolarHBondContact O-CD1 3.47Å; S72-I76 VanDerWaalsContact O-CG1 3.25Å; S72-I76 WeakPolarHBondContact O-CG1 3.41Å; S72-I76 PolarHBondContact O-N 2.94Å; S73-I76 PolarHBondContact O-N 3.18Å; I76-N78 PolarHBondContact O-N 3.47Å; I76-F79 PolarHBondContact O-N 3.31Å; I76-R80 PolarHBondContact O-N 3.35Å; I76-R80 VanDerWaalsContact O-N 3.16Å; I76-V132 HydrophobicContact CD1-CG2 4.18Å; I76-V132 HydrophobicContact CG1-CG2 3.88Å
77Y87.6Confident86.2Confident97 Ų9742 Ų4238%0.3820%0.196SC..Hα-helixtrans-61.9-42.1175.7-179.3-95.7000112.5L10 L20 S73 L74 L75 R80L10-Y77 HydrophobicContact CD2-CD2 4.12Å; L10-Y77 HydrophobicContact CD2-CE2 4.38Å; L10-Y77 HydrophobicContact CG-CD2 4.39Å; L10-Y77 HydrophobicContact CG-CE2 4.27Å; L20-Y77 HydrophobicContact CD1-CD2 4.42Å; S73-Y77 WeakPolarHBondContact O-CB 3.45Å; S73-Y77 PolarHBondContact O-N 3.43Å; L74-Y77 PolarHBondContact O-N 2.99Å; L75-Y77 VanDerWaalsContact C-N 3.27Å; L75-Y77 PolarHBondContact O-N 3.26Å; Y77-R80 WeakPolarHBondContact O-CB 3.31Å; Y77-R80 PolarHBondContact O-N 2.87Å; Y77-R80 PolarHBondContact OH-NH1 3.5Å
78N86.9Confident85.9Confident43 Ų4339.7 Ų39.723%0.2319%0.19CC..Hα-helixtrans-68.9-39.1176.4-80.3-69.2000112.4L74 L75 I76 R80 V163L74-N78 PolarHBondContact O-N 3.27Å; L74-N78 PolarHBondContact O-ND2 2.82Å; L75-N78 PolarHBondContact O-N 3.4Å; L75-N78 VanDerWaalsContact O-N 3.11Å; I76-N78 PolarHBondContact O-N 3.47Å; N78-R80 PolarHBondContact O-N 3.38Å; N78-V163 HydrophobicContact CB-CG2 3.72Å
79F87.4Confident85.5Confident0 Ų045.4 Ų45.40%021%0.212CC..Hα-helixtrans-75.2-2.6179.1-66.1-38.3000114.5L75 I76 I81 F82 V132 L135 F136 F139 V163L75-F79 HydrophobicContact CB-CD2 4.21Å; L75-F79 HydrophobicContact CB-CE2 3.98Å; L75-F79 HydrophobicContact CD2-CE2 4.18Å; L75-F79 HydrophobicContact CD2-CZ 4.32Å; L75-F79 WeakPolarHBondContact O-CB 3.14Å; L75-F79 WeakPolarHBondContact O-CD2 3.13Å; L75-F79 VanDerWaalsContact O-CG 3.3Å; L75-F79 WeakPolarHBondContact O-CG 3.13Å; L75-F79 PolarHBondContact O-N 3.08Å; I76-F79 PolarHBondContact O-N 3.31Å; F79-I81 PolarHBondContact O-N 3Å; F79-F82 HydrophobicContact CB-CD2 3.89Å; F79-F82 HydrophobicContact CB-CE2 4.09Å; F79-F82 HydrophobicContact CD1-CD2 4.15Å; F79-F82 AromaticContact CD1-CE2 3.45Å; F79-F82 HydrophobicContact CD1-CE2 3.45Å; F79-F82 VanDerWaalsContact CD1-CE2 3.45Å; F79-F82 HydrophobicContact CD1-CZ 4.34Å; F79-F82 HydrophobicContact CE1-CE2 4.15Å; F79-F82 HydrophobicContact CG-CD2 4.29Å; F79-F82 HydrophobicContact CG-CE2 4Å; F79-F82 WeakPolarHBondContact O-CB 3.43Å; F79-F82 WeakPolarHBondContact O-CD2 3.35Å; F79-F82 PolarHBondContact O-N 2.99Å; F79-V132 HydrophobicContact CE2-CG1 4.2Å; F79-L135 HydrophobicContact CB-CD1 3.99Å; F79-L135 HydrophobicContact CD1-CB 4.44Å; F79-L135 HydrophobicContact CD2-CB 3.71Å; F79-L135 HydrophobicContact CD2-CD1 3.61Å; F79-L135 HydrophobicContact CD2-CG 4.31Å; F79-L135 HydrophobicContact CE1-CB 4.5Å; F79-L135 HydrophobicContact CE2-CB 3.77Å; F79-L135 HydrophobicContact CE2-CD1 4.36Å; F79-L135 HydrophobicContact CG-CB 4.06Å; F79-L135 HydrophobicContact CG-CD1 4.04Å; F79-L135 HydrophobicContact CZ-CB 4.18Å; F79-F136 HydrophobicContact CE2-CD2 4.16Å; F79-F136 AromaticContact CE2-CE2 3.94Å; F79-F136 HydrophobicContact CE2-CE2 3.94Å; F79-F136 HydrophobicContact CE2-CZ 4.33Å; F79-F136 HydrophobicContact CZ-CD1 4.04Å; F79-F136 AromaticContact CZ-CD2 3.78Å; F79-F136 HydrophobicContact CZ-CD2 3.78Å; F79-F136 AromaticContact CZ-CE1 3.98Å; F79-F136 HydrophobicContact CZ-CE1 3.98Å; F79-F136 AromaticContact CZ-CE2 3.74Å; F79-F136 HydrophobicContact CZ-CE2 3.74Å; F79-F136 AromaticContact CZ-CG 3.98Å; F79-F136 HydrophobicContact CZ-CG 3.98Å; F79-F136 AromaticContact CZ-CZ 3.84Å; F79-F136 HydrophobicContact CZ-CZ 3.84Å; F79-F139 AromaticContact CD1-CD2 3.91Å; F79-F139 HydrophobicContact CD1-CD2 3.91Å; F79-F139 HydrophobicContact CD1-CE2 4.49Å; F79-F139 HydrophobicContact CD1-CG 4.44Å; F79-F139 HydrophobicContact CE1-CB 3.92Å; F79-F139 HydrophobicContact CE1-CD1 4.4Å; F79-F139 AromaticContact CE1-CD2 3.6Å; F79-F139 HydrophobicContact CE1-CD2 3.6Å; F79-F139 HydrophobicContact CE1-CE2 4.2Å; F79-F139 AromaticContact CE1-CG 3.74Å; F79-F139 HydrophobicContact CE1-CG 3.74Å; F79-V163 HydrophobicContact CE1-CG1 3.79Å; F79-V163 HydrophobicContact CZ-CG1 3.93Å
80R85.9Confident85.2Confident24 Ų2450.7 Ų50.79%0.09123%0.234CC..Hα-helixtrans-48.1-28.3166.9-172.6-176.173.3-153.68.4113.6G9 A13 C16 I76 Y77 N78 F82 E83 R84G9-R80 PolarHBondContact O-NH1 3.5Å; G9-R80 PolarHBondContact O-NH2 3.48Å; A13-R80 HydrophobicContact CB-CG 3.35Å; C16-R80 HydrophobicContact CB-CG 4.45Å; I76-R80 PolarHBondContact O-N 3.35Å; I76-R80 VanDerWaalsContact O-N 3.16Å; Y77-R80 WeakPolarHBondContact O-CB 3.31Å; Y77-R80 PolarHBondContact O-N 2.87Å; Y77-R80 PolarHBondContact OH-NH1 3.5Å; N78-R80 PolarHBondContact O-N 3.38Å; R80-F82 PolarHBondContact O-N 2.92Å; R80-E83 PolarHBondContact O-N 3.29Å; R80-R84 VanDerWaalsContact NE-NH2 3.15Å; R80-R84 PolarHBondContact O-N 3.23Å
81I82.6Confident85Confident52 Ų5244.8 Ų44.827%0.26721%0.208SC..Hα-helixtrans-53-33.4174.2-165.975.5000112.2F79 R85 I143F79-I81 PolarHBondContact O-N 3Å; I81-R85 WeakPolarHBondContact O-CB 3.48Å; I81-R85 VanDerWaalsContact O-CG 3.27Å; I81-R85 WeakPolarHBondContact O-CG 3.34Å; I81-R85 PolarHBondContact O-N 3.26Å; I81-R85 VanDerWaalsContact O-N 3.12Å; I81-I143 HydrophobicContact CG2-CD1 4.15Å
82F83.8Confident84.8Confident0 Ų045.5 Ų45.50%021%0.214CC..Hα-helixtrans-74.4-40.7178.8-61.8-52000113.2F79 R80 R84 R85 F86 F91 L135 P138 F139 S142 I143F79-F82 HydrophobicContact CB-CD2 3.89Å; F79-F82 HydrophobicContact CB-CE2 4.09Å; F79-F82 HydrophobicContact CD1-CD2 4.15Å; F79-F82 AromaticContact CD1-CE2 3.45Å; F79-F82 HydrophobicContact CD1-CE2 3.45Å; F79-F82 VanDerWaalsContact CD1-CE2 3.45Å; F79-F82 HydrophobicContact CD1-CZ 4.34Å; F79-F82 HydrophobicContact CE1-CE2 4.15Å; F79-F82 HydrophobicContact CG-CD2 4.29Å; F79-F82 HydrophobicContact CG-CE2 4Å; F79-F82 WeakPolarHBondContact O-CB 3.43Å; F79-F82 WeakPolarHBondContact O-CD2 3.35Å; F79-F82 PolarHBondContact O-N 2.99Å; R80-F82 PolarHBondContact O-N 2.92Å; F82-R84 PolarHBondContact O-N 2.9Å; F82-R85 PolarHBondContact O-N 2.77Å; F82-R85 VanDerWaalsContact O-N 3.17Å; F82-F86 HydrophobicContact CB-CD2 3.94Å; F82-F86 HydrophobicContact CB-CE2 4.08Å; F82-F86 HydrophobicContact CD1-CD2 4.38Å; F82-F86 AromaticContact CD1-CE2 3.72Å; F82-F86 HydrophobicContact CD1-CE2 3.72Å; F82-F86 HydrophobicContact CD1-CZ 4.21Å; F82-F86 HydrophobicContact CG-CE2 4.16Å; F82-F86 WeakPolarHBondContact O-CB 3.2Å; F82-F86 PolarHBondContact O-N 2.63Å; F82-F91 HydrophobicContact CB-CD2 3.82Å; F82-F91 HydrophobicContact CB-CE2 3.78Å; F82-L135 HydrophobicContact CD2-CD2 4Å; F82-L135 HydrophobicContact CE2-CB 4.47Å; F82-L135 HydrophobicContact CE2-CD2 4.43Å; F82-P138 HydrophobicContact CE1-CB 4.4Å; F82-F139 HydrophobicContact CE2-CB 4.14Å; F82-F139 HydrophobicContact CE2-CD2 4.31Å; F82-F139 VanDerWaalsContact CZ-CA 3.45Å; F82-F139 HydrophobicContact CZ-CB 3.62Å; F82-F139 AromaticContact CZ-CD2 3.85Å; F82-F139 HydrophobicContact CZ-CD2 3.85Å; F82-F139 HydrophobicContact CZ-CG 4.25Å; F82-S142 WeakPolarHBondContact CE1-OG 3.11Å; F82-I143 HydrophobicContact CE1-CD1 4.41Å; F82-I143 HydrophobicContact CZ-CD1 4.36Å
83E83.6Confident84.6Confident2 Ų245.4 Ų45.41%0.00921%0.214CC..Hα-helixtrans-59-40.4176.2-169.5178.2176.500110.6A13 P14 L15 C16 R80 G87 T88 F91A13-E83 VanDerWaalsContact C-OE2 3.23Å; A13-E83 VanDerWaalsContact CA-CD 3.48Å; A13-E83 VanDerWaalsContact CA-OE2 3.31Å; A13-E83 WeakPolarHBondContact CA-OE2 3.23Å; A13-E83 HydrophobicContact CB-CB 4.49Å; A13-E83 HydrophobicContact CB-CG 4.5Å; A13-E83 WeakPolarHBondContact CB-OE2 3.39Å; P14-E83 WeakPolarHBondContact CD-OE1 3.44Å; P14-E83 WeakPolarHBondContact CG-OE1 3.46Å; L15-E83 WeakPolarHBondContact CB-OE1 3.38Å; L15-E83 PolarHBondContact N-OE1 2.89Å; L15-E83 PolarHBondContact N-OE2 3.43Å; C16-E83 WeakPolarHBondContact CB-OE2 3.09Å; C16-E83 PolarHBondContact N-OE2 2.94Å; C16-E83 PolarHBondContact SG-OE2 2.93Å; R80-E83 PolarHBondContact O-N 3.29Å; E83-G87 CarbonylContact O-C 3.53Å; E83-G87 WeakPolarHBondContact O-CA 3.43Å; E83-G87 PolarHBondContact O-N 3.27Å; E83-T88 WeakPolarHBondContact OE1-CG2 3.4Å; E83-T88 PolarHBondContact OE1-OG1 2.78Å; E83-F91 HydrophobicContact CB-CB 4.5Å; E83-F91 HydrophobicContact CB-CD1 3.91Å; E83-F91 HydrophobicContact CB-CE1 4.32Å; E83-F91 HydrophobicContact CB-CG 4.15Å; E83-F91 HydrophobicContact CG-CB 4.47Å; E83-F91 HydrophobicContact CG-CD1 4.07Å; E83-F91 HydrophobicContact CG-CG 4.46Å
84R82.9Confident84.5Confident73 Ų7345 Ų4528%0.27521%0.209SC..Hα-helixtrans-70.1-33.4177.5-67.5-179.9176.4173.6-2.4113.8S7 G9 Y11 R80 F82S7-R84 PolarHBondContact OG-NH1 2.66Å; S7-R84 PolarHBondContact OG-NH2 3Å; G9-R84 PolarHBondContact O-NH2 2.87Å; Y11-R84 PolarHBondContact O-NE 2.98Å; Y11-R84 PolarHBondContact O-NH2 2.92Å; R80-R84 VanDerWaalsContact NE-NH2 3.15Å; R80-R84 PolarHBondContact O-N 3.23Å; F82-R84 PolarHBondContact O-N 2.9Å
85R80.9Confident84.4Confident140 Ų14043.1 Ų43.153%0.52820%0.199SC..Hα-helixtrans-86-42.5-177.8-74.3-179.8-180-138-0.4113.4I81 F82I81-R85 WeakPolarHBondContact O-CB 3.48Å; I81-R85 VanDerWaalsContact O-CG 3.27Å; I81-R85 WeakPolarHBondContact O-CG 3.34Å; I81-R85 PolarHBondContact O-N 3.26Å; I81-R85 VanDerWaalsContact O-N 3.12Å; F82-R85 PolarHBondContact O-N 2.77Å; F82-R85 VanDerWaalsContact O-N 3.17Å
86F77.3Confident84.3Confident76 Ų7647.2 Ų47.233%0.33322%0.221SC..Hα-helixtrans-89.5-17.8-177.9-61.9-34.4000113.1F82 K90F82-F86 HydrophobicContact CB-CD2 3.94Å; F82-F86 HydrophobicContact CB-CE2 4.08Å; F82-F86 HydrophobicContact CD1-CD2 4.38Å; F82-F86 AromaticContact CD1-CE2 3.72Å; F82-F86 HydrophobicContact CD1-CE2 3.72Å; F82-F86 HydrophobicContact CD1-CZ 4.21Å; F82-F86 HydrophobicContact CG-CE2 4.16Å; F82-F86 WeakPolarHBondContact O-CB 3.2Å; F82-F86 PolarHBondContact O-N 2.63Å; F86-K90 HydrophobicContact CB-CB 4.29Å; F86-K90 HydrophobicContact CB-CD 4.23Å; F86-K90 HydrophobicContact CB-CG 4.39Å; F86-K90 WeakPolarHBondContact O-CB 3.08Å
87G78.7Confident84.1Confident33 Ų3346.9 Ų46.934%0.3422%0.219SC..  trans82.1147.6-168.900000111.8E83 R89 K90 F91E83-G87 CarbonylContact O-C 3.53Å; E83-G87 WeakPolarHBondContact O-CA 3.43Å; E83-G87 PolarHBondContact O-N 3.27Å; G87-R89 VanDerWaalsContact C-N 3.31Å; G87-R89 PolarHBondContact O-N 3.41Å; G87-K90 PolarHBondContact O-N 3.27Å; G87-F91 WeakPolarHBondContact O-CB 3.47Å; G87-F91 PolarHBondContact O-N 3.42Å
88T81Confident84.2Confident51 Ų5142.2 Ų42.231%0.31320%0.201SC..Hα-helixtrans-51.9-42.4-176.7-59.10000113.5P14 L15 E83 F91 A92P14-T88 HydrophobicContact CG-CG2 3.96Å; L15-T88 HydrophobicContact CB-CG2 4.49Å; L15-T88 HydrophobicContact CD1-CG2 3.29Å; L15-T88 WeakPolarHBondContact CD1-O 3.47Å; L15-T88 HydrophobicContact CG-CG2 3.51Å; E83-T88 WeakPolarHBondContact OE1-CG2 3.4Å; E83-T88 PolarHBondContact OE1-OG1 2.78Å; T88-F91 PolarHBondContact O-N 3.5Å; T88-A92 WeakPolarHBondContact O-CB 3.11Å; T88-A92 PolarHBondContact O-N 3.44Å
89R79.7Confident84.3Confident123 Ų12342.3 Ų42.346%0.46420%0.198SC..Hα-helixtrans-64.9-47.2-179.1-71.6-177174-177.7-7.1113.1G87 F91 A92 S93 S209G87-R89 VanDerWaalsContact C-N 3.31Å; G87-R89 PolarHBondContact O-N 3.41Å; R89-F91 VanDerWaalsContact C-N 3.33Å; R89-A92 PolarHBondContact O-N 2.89Å; R89-S93 PolarHBondContact O-N 2.95Å; R89-S93 VanDerWaalsContact O-N 3.08Å; R89-S93 PolarHBondContact O-OG 2.91Å; R89-S209 VanDerWaalsContact CZ-OG 3.32Å; R89-S209 PolarHBondContact NE-OG 3.24Å; R89-S209 PolarHBondContact NH2-OG 2.97Å
90K82.1Confident84.4Confident115 Ų11546.6 Ų46.650%0.522%0.217SC..Hα-helixtrans-70.9-32.8-179.4-171.5175.5-179.4179.30111.5F86 G87 S93 F94F86-K90 HydrophobicContact CB-CB 4.29Å; F86-K90 HydrophobicContact CB-CD 4.23Å; F86-K90 HydrophobicContact CB-CG 4.39Å; F86-K90 WeakPolarHBondContact O-CB 3.08Å; G87-K90 PolarHBondContact O-N 3.27Å; K90-S93 WeakPolarHBondContact CA-OG 3.31Å; K90-S93 PolarHBondContact O-OG 3.39Å; K90-F94 WeakPolarHBondContact O-CB 3.38Å; K90-F94 PolarHBondContact O-N 3.26Å
91F85.9Confident84.6Confident4 Ų446 Ų462%0.01822%0.215CC..Hα-helixtrans-68.7-41.8173.9-175.3-110.5000112.1L15 F82 E83 G87 T88 R89 S93 F94 L95 L135L15-F91 HydrophobicContact CD1-CD1 4.28Å; F82-F91 HydrophobicContact CB-CD2 3.82Å; F82-F91 HydrophobicContact CB-CE2 3.78Å; E83-F91 HydrophobicContact CB-CB 4.5Å; E83-F91 HydrophobicContact CB-CD1 3.91Å; E83-F91 HydrophobicContact CB-CE1 4.32Å; E83-F91 HydrophobicContact CB-CG 4.15Å; E83-F91 HydrophobicContact CG-CB 4.47Å; E83-F91 HydrophobicContact CG-CD1 4.07Å; E83-F91 HydrophobicContact CG-CG 4.46Å; G87-F91 WeakPolarHBondContact O-CB 3.47Å; G87-F91 PolarHBondContact O-N 3.42Å; T88-F91 PolarHBondContact O-N 3.5Å; R89-F91 VanDerWaalsContact C-N 3.33Å; F91-S93 PolarHBondContact O-N 3.08Å; F91-F94 WeakPolarHBondContact O-CB 3.41Å; F91-F94 PolarHBondContact O-N 2.81Å; F91-L95 HydrophobicContact CD1-CD1 4.02Å; F91-L95 HydrophobicContact CE1-CD1 3.44Å; F91-L95 VanDerWaalsContact CE1-CD1 3.44Å; F91-L95 HydrophobicContact CE1-CG 4.12Å; F91-L95 HydrophobicContact CE2-CG 4.41Å; F91-L95 HydrophobicContact CZ-CD1 3.76Å; F91-L95 HydrophobicContact CZ-CD2 4.33Å; F91-L95 HydrophobicContact CZ-CG 4.05Å; F91-L95 PolarHBondContact O-N 3.48Å; F91-L135 HydrophobicContact CE2-CD2 3.67Å; F91-L135 HydrophobicContact CZ-CD1 4.43Å; F91-L135 HydrophobicContact CZ-CD2 4.33Å
92A84.9Confident85Confident21 Ų2143.5 Ų43.517%0.17420%0.202CC..Hα-helixtrans-59.8-45.1172.600000112.2L15 T88 R89 F94 L95 L96L15-A92 HydrophobicContact CD1-CB 3.68Å; T88-A92 WeakPolarHBondContact O-CB 3.11Å; T88-A92 PolarHBondContact O-N 3.44Å; R89-A92 PolarHBondContact O-N 2.89Å; A92-F94 VanDerWaalsContact C-N 3.31Å; A92-F94 PolarHBondContact O-N 3.37Å; A92-L95 PolarHBondContact O-N 2.9Å; A92-L96 WeakPolarHBondContact O-CB 3.04Å; A92-L96 WeakPolarHBondContact O-CG 3.23Å; A92-L96 PolarHBondContact O-N 3.46Å
93S85.3Confident85.2Confident3 Ų344.4 Ų44.42%0.02121%0.208CC..Hα-helixtrans-64.6-37177.763.90000112.5R89 K90 F91 G97 F202 V204R89-S93 PolarHBondContact O-N 2.95Å; R89-S93 VanDerWaalsContact O-N 3.08Å; R89-S93 PolarHBondContact O-OG 2.91Å; K90-S93 WeakPolarHBondContact CA-OG 3.31Å; K90-S93 PolarHBondContact O-OG 3.39Å; F91-S93 PolarHBondContact O-N 3.08Å; S93-G97 PolarHBondContact O-N 3.5Å; S93-F202 WeakPolarHBondContact CB-O 3.38Å; S93-V204 VanDerWaalsContact CA-CG2 3.41Å
94F87.1Confident85.4Confident16 Ų1648.4 Ų48.47%0.0723%0.23CC..Hα-helixtrans-60.2-52172177.5-90.4000111.2K90 F91 A92 L96 G97 T98 L135 P138 Y191K90-F94 WeakPolarHBondContact O-CB 3.38Å; K90-F94 PolarHBondContact O-N 3.26Å; F91-F94 WeakPolarHBondContact O-CB 3.41Å; F91-F94 PolarHBondContact O-N 2.81Å; A92-F94 VanDerWaalsContact C-N 3.31Å; A92-F94 PolarHBondContact O-N 3.37Å; F94-L96 PolarHBondContact O-N 2.9Å; F94-G97 PolarHBondContact O-N 3.26Å; F94-T98 HydrophobicContact CD1-CG2 4.3Å; F94-T98 HydrophobicContact CD2-CG2 4.23Å; F94-T98 HydrophobicContact CE1-CG2 3.88Å; F94-T98 HydrophobicContact CE2-CG2 3.83Å; F94-T98 HydrophobicContact CG-CG2 4.45Å; F94-T98 HydrophobicContact CZ-CG2 3.65Å; F94-T98 WeakPolarHBondContact O-CB 3.26Å; F94-T98 VanDerWaalsContact O-CG2 3.31Å; F94-T98 WeakPolarHBondContact O-CG2 3.4Å; F94-T98 PolarHBondContact O-N 3.43Å; F94-T98 PolarHBondContact O-OG1 3.44Å; F94-L135 HydrophobicContact CD1-CD2 3.77Å; F94-L135 HydrophobicContact CE1-CD2 3.33Å; F94-L135 HydrophobicContact CE1-CG 4Å; F94-L135 HydrophobicContact CZ-CD2 4.3Å; F94-P138 HydrophobicContact CE2-CG 4.46Å; F94-P138 HydrophobicContact CZ-CG 4.01Å; F94-Y191 AromaticContact CD2-CD1 3.45Å; F94-Y191 HydrophobicContact CD2-CD1 3.45Å; F94-Y191 VanDerWaalsContact CD2-CD1 3.45Å; F94-Y191 HydrophobicContact CD2-CD2 4.46Å; F94-Y191 AromaticContact CD2-CE1 3.41Å; F94-Y191 HydrophobicContact CD2-CE1 3.41Å; F94-Y191 VanDerWaalsContact CD2-CE1 3.41Å; F94-Y191 HydrophobicContact CD2-CE2 4.4Å; F94-Y191 HydrophobicContact CD2-CG 4.02Å; F94-Y191 AromaticContact CD2-CZ 3.88Å; F94-Y191 AromaticContact CE2-CD1 3.58Å; F94-Y191 HydrophobicContact CE2-CD1 3.58Å; F94-Y191 HydrophobicContact CE2-CE1 4.04Å; F94-Y191 HydrophobicContact CE2-CG 4.02Å; F94-Y191 HydrophobicContact CG-CE1 4.45Å
95L88.5Confident85.8Confident24 Ų2445.7 Ų45.713%0.12622%0.221CC..Hα-helixtrans-61.9-43.3-178.8-76.9-179.8000112.9L19 F91 A92 T98 W99 L135L19-L95 HydrophobicContact CD1-CD1 4.3Å; F91-L95 HydrophobicContact CD1-CD1 4.02Å; F91-L95 HydrophobicContact CE1-CD1 3.44Å; F91-L95 VanDerWaalsContact CE1-CD1 3.44Å; F91-L95 HydrophobicContact CE1-CG 4.12Å; F91-L95 HydrophobicContact CE2-CG 4.41Å; F91-L95 HydrophobicContact CZ-CD1 3.76Å; F91-L95 HydrophobicContact CZ-CD2 4.33Å; F91-L95 HydrophobicContact CZ-CG 4.05Å; F91-L95 PolarHBondContact O-N 3.48Å; A92-L95 PolarHBondContact O-N 2.9Å; L95-T98 PolarHBondContact O-OG1 3.17Å; L95-W99 WeakPolarHBondContact O-CB 3.31Å; L95-W99 PolarHBondContact O-N 3.28Å; L95-L135 HydrophobicContact CD2-CD1 4.13Å; L95-L135 HydrophobicContact CD2-CD2 4.45Å; L95-L135 HydrophobicContact CD2-CG 4.41Å
96L87.3Confident86.2Confident87 Ų8739.1 Ų39.146%0.45520%0.196SC..Hα-helixtrans-68.2-41.9178.4-71.9174.1000111.7A92 F94 W99 F100 V204A92-L96 WeakPolarHBondContact O-CB 3.04Å; A92-L96 WeakPolarHBondContact O-CG 3.23Å; A92-L96 PolarHBondContact O-N 3.46Å; F94-L96 PolarHBondContact O-N 2.9Å; L96-W99 PolarHBondContact O-N 2.85Å; L96-F100 PolarHBondContact O-N 3.03Å; L96-V204 HydrophobicContact CD1-CG2 3.68Å
97G87.3Confident86.6Confident0 Ų040.3 Ų40.30%020%0.202CC..Hα-helixtrans-61.6-46.8175.800000112.2S93 F94 W99 F100 L101S93-G97 PolarHBondContact O-N 3.5Å; F94-G97 PolarHBondContact O-N 3.26Å; G97-W99 VanDerWaalsContact C-N 3.34Å; G97-F100 PolarHBondContact O-N 2.83Å; G97-L101 WeakPolarHBondContact O-CB 3.45Å; G97-L101 PolarHBondContact O-N 2.8Å
98T89.3Confident87.1Confident0 Ų043.9 Ų43.90%021%0.212CC..Hα-helixtrans-72.3-28.9179.359.10000112.5F94 L95 S102 S134 S187 Y191F94-T98 HydrophobicContact CD1-CG2 4.3Å; F94-T98 HydrophobicContact CD2-CG2 4.23Å; F94-T98 HydrophobicContact CE1-CG2 3.88Å; F94-T98 HydrophobicContact CE2-CG2 3.83Å; F94-T98 HydrophobicContact CG-CG2 4.45Å; F94-T98 HydrophobicContact CZ-CG2 3.65Å; F94-T98 WeakPolarHBondContact O-CB 3.26Å; F94-T98 VanDerWaalsContact O-CG2 3.31Å; F94-T98 WeakPolarHBondContact O-CG2 3.4Å; F94-T98 PolarHBondContact O-N 3.43Å; F94-T98 PolarHBondContact O-OG1 3.44Å; L95-T98 PolarHBondContact O-OG1 3.17Å; T98-S102 WeakPolarHBondContact O-CB 3.45Å; T98-S102 PolarHBondContact O-N 3.24Å; T98-S102 PolarHBondContact O-OG 3.1Å; T98-S134 WeakPolarHBondContact CB-OG 3.14Å; T98-S134 WeakPolarHBondContact CG2-OG 3.27Å; T98-S187 PolarHBondContact O-OG 3.19Å; T98-Y191 HydrophobicContact CG2-CD2 4.42Å; T98-Y191 HydrophobicContact CG2-CG 4.38Å
99W89.5Confident87.5Confident45 Ų4543 Ų4317%0.1721%0.206CC..Hα-helixtrans-65.3-44.9172.2178.390.9000112.3L57 L95 L96 G97 S102 S103 P131L57-W99 HydrophobicContact CD2-CH2 3.32Å; L57-W99 HydrophobicContact CD2-CZ2 3.82Å; L57-W99 HydrophobicContact CD2-CZ3 4.45Å; L95-W99 WeakPolarHBondContact O-CB 3.31Å; L95-W99 PolarHBondContact O-N 3.28Å; L96-W99 PolarHBondContact O-N 2.85Å; G97-W99 VanDerWaalsContact C-N 3.34Å; W99-S102 PolarHBondContact O-OG 3.38Å; W99-S103 PolarHBondContact O-N 3Å; W99-P131 HydrophobicContact CB-CG 3.86Å; W99-P131 HydrophobicContact CG-CG 4.26Å
100F88.7Confident87.7Confident90 Ų9037.8 Ų37.840%0.39519%0.188SC..Hα-helixtrans-68-46.6174.7-177.1-97.6000111.7L96 G97 S102 S103 L104 F202L96-F100 PolarHBondContact O-N 3.03Å; G97-F100 PolarHBondContact O-N 2.83Å; F100-S102 PolarHBondContact O-N 2.75Å; F100-S103 VanDerWaalsContact O-CB 3.31Å; F100-S103 WeakPolarHBondContact O-CB 3.19Å; F100-S103 PolarHBondContact O-N 2.93Å; F100-S103 VanDerWaalsContact O-N 3.11Å; F100-L104 HydrophobicContact CD1-CD1 4.06Å; F100-L104 HydrophobicContact CD1-CG 4.45Å; F100-L104 HydrophobicContact CE1-CD1 3.54Å; F100-L104 HydrophobicContact CE1-CG 4.09Å; F100-L104 HydrophobicContact CZ-CD1 4.22Å; F100-L104 HydrophobicContact CZ-CG 4.45Å; F100-L104 PolarHBondContact O-N 2.97Å; F100-F202 HydrophobicContact CB-CE1 3.61Å; F100-F202 HydrophobicContact CB-CZ 3.84Å; F100-F202 AromaticContact CD1-CE1 3.95Å; F100-F202 HydrophobicContact CD1-CE1 3.95Å; F100-F202 HydrophobicContact CD1-CE2 4.02Å; F100-F202 AromaticContact CD1-CZ 3.22Å; F100-F202 HydrophobicContact CD1-CZ 3.22Å; F100-F202 HydrophobicContact CD2-CZ 4.4Å; F100-F202 HydrophobicContact CE1-CE2 4.42Å; F100-F202 AromaticContact CE1-CZ 3.79Å; F100-F202 HydrophobicContact CE1-CZ 3.79Å; F100-F202 AromaticContact CG-CE1 3.82Å; F100-F202 HydrophobicContact CG-CE1 3.82Å; F100-F202 AromaticContact CG-CZ 3.56Å; F100-F202 HydrophobicContact CG-CZ 3.56Å
101L89.9Confident87.8Confident11 Ų1137.3 Ų37.36%0.05819%0.188CC..Hα-helixtrans-67.3-37-176.5-174.364.5000112.4G97 S103 L104 V105 S187 L190 L198G97-L101 WeakPolarHBondContact O-CB 3.45Å; G97-L101 PolarHBondContact O-N 2.8Å; L101-S103 VanDerWaalsContact C-N 3.3Å; L101-S103 PolarHBondContact O-N 3.19Å; L101-L104 PolarHBondContact O-N 3.49Å; L101-V105 VanDerWaalsContact O-CG2 3.29Å; L101-V105 WeakPolarHBondContact O-CG2 3.42Å; L101-V105 PolarHBondContact O-N 3.38Å; L101-S187 WeakPolarHBondContact CB-OG 3.47Å; L101-S187 WeakPolarHBondContact CD2-O 3.19Å; L101-L190 HydrophobicContact CD1-CD2 3.76Å; L101-L190 HydrophobicContact CD2-CB 3.99Å; L101-L190 HydrophobicContact CD2-CD2 3.79Å; L101-L190 HydrophobicContact CD2-CG 4.27Å; L101-L190 HydrophobicContact CG-CD2 4.22Å; L101-L198 HydrophobicContact CD1-CD1 4.36Å; L101-L198 HydrophobicContact CD2-CD1 4.13Å
102S90.9Very high87.9Confident0 Ų039.9 Ų39.90%021%0.21CC..Hα-helixtrans-63.4-37.2172.354.30000111.4R60 T98 W99 F100 L104 V105 D106 S187R60-S102 PolarHBondContact NH2-OG 3.14Å; T98-S102 WeakPolarHBondContact O-CB 3.45Å; T98-S102 PolarHBondContact O-N 3.24Å; T98-S102 PolarHBondContact O-OG 3.1Å; W99-S102 PolarHBondContact O-OG 3.38Å; F100-S102 PolarHBondContact O-N 2.75Å; S102-L104 VanDerWaalsContact C-N 3.32Å; S102-L104 PolarHBondContact O-N 3.25Å; S102-V105 PolarHBondContact O-N 3.08Å; S102-D106 VanDerWaalsContact O-CB 3.31Å; S102-D106 WeakPolarHBondContact O-CB 3.47Å; S102-D106 PolarHBondContact O-N 3.11Å; S102-S187 PolarHBondContact N-OG 3.31Å
103S87.6Confident87.9Confident18 Ų1840.6 Ų40.613%0.12621%0.209CC..Hα-helixtrans-61.2-39.6175-170.90000112.7W99 F100 L101 F107W99-S103 PolarHBondContact O-N 3Å; F100-S103 VanDerWaalsContact O-CB 3.31Å; F100-S103 WeakPolarHBondContact O-CB 3.19Å; F100-S103 PolarHBondContact O-N 2.93Å; F100-S103 VanDerWaalsContact O-N 3.11Å; L101-S103 VanDerWaalsContact C-N 3.3Å; L101-S103 PolarHBondContact O-N 3.19Å; S103-F107 PolarHBondContact O-N 2.97Å
104L89.5Confident87.8Confident87 Ų8743.8 Ų43.846%0.45522%0.224SC..Hα-helixtrans-67.2-44.8175.5-67.9179.2000111.4F100 L101 S102 D106 F107 L108F100-L104 HydrophobicContact CD1-CD1 4.06Å; F100-L104 HydrophobicContact CD1-CG 4.45Å; F100-L104 HydrophobicContact CE1-CD1 3.54Å; F100-L104 HydrophobicContact CE1-CG 4.09Å; F100-L104 HydrophobicContact CZ-CD1 4.22Å; F100-L104 HydrophobicContact CZ-CG 4.45Å; F100-L104 PolarHBondContact O-N 2.97Å; L101-L104 PolarHBondContact O-N 3.49Å; S102-L104 VanDerWaalsContact C-N 3.32Å; S102-L104 PolarHBondContact O-N 3.25Å; L104-D106 VanDerWaalsContact C-N 3.35Å; L104-F107 PolarHBondContact O-N 3.35Å; L104-L108 WeakPolarHBondContact O-CG 3.49Å; L104-L108 PolarHBondContact O-N 3Å; L104-L108 VanDerWaalsContact O-N 3.08Å
105V90.7Very high87.7Confident16 Ų1651.8 Ų51.810%0.09726%0.259CS..Hα-helixtrans-67.1-36.8-179.7175.30000111.3L101 S102 L108 L109 I186L101-V105 VanDerWaalsContact O-CG2 3.29Å; L101-V105 WeakPolarHBondContact O-CG2 3.42Å; L101-V105 PolarHBondContact O-N 3.38Å; S102-V105 PolarHBondContact O-N 3.08Å; V105-L108 PolarHBondContact O-N 3.02Å; V105-L109 HydrophobicContact CG1-CD1 3.62Å; V105-L109 WeakPolarHBondContact O-CB 3.45Å; V105-L109 PolarHBondContact O-N 2.99Å; V105-I186 HydrophobicContact CG1-CB 4.22Å; V105-I186 HydrophobicContact CG1-CG2 4.1Å; V105-I186 HydrophobicContact CG2-CG2 4.27Å
106D89.3Confident87.5Confident2 Ų256.7 Ų56.71%0.01128%0.284CS..Hα-helixtrans-60.4-44.4174.2-75.4-38.6000111.8R60 S102 L104 L109 A110 S183R60-D106 IonicContact CZ-OD2 3.79Å; R60-D106 IonicContact NH1-OD2 3.98Å; R60-D106 PolarHBondContact NH1-OD2 3.47Å; R60-D106 IonicContact NH2-OD2 2.63Å; R60-D106 PolarHBondContact NH2-OD2 2.94Å; S102-D106 VanDerWaalsContact O-CB 3.31Å; S102-D106 WeakPolarHBondContact O-CB 3.47Å; S102-D106 PolarHBondContact O-N 3.11Å; L104-D106 VanDerWaalsContact C-N 3.35Å; D106-L109 PolarHBondContact O-N 3.48Å; D106-A110 WeakPolarHBondContact O-CB 3.31Å; D106-A110 PolarHBondContact O-N 3.28Å; D106-S183 WeakPolarHBondContact OD1-CB 3.33Å; D106-S183 PolarHBondContact OD1-OG 3.39Å
107F86.1Confident87.2Confident101 Ų10157.9 Ų57.944%0.44329%0.286SS..Hα-helixtrans-62.9-44.9175.7-175.7-94.9000111.7L44 A48 S103 L104 L109 A110 Q111L44-F107 HydrophobicContact CD2-CB 4.34Å; L44-F107 HydrophobicContact CD2-CD2 4.23Å; A48-F107 HydrophobicContact CB-CE2 4.48Å; S103-F107 PolarHBondContact O-N 2.97Å; L104-F107 PolarHBondContact O-N 3.35Å; F107-L109 PolarHBondContact O-N 3.12Å; F107-A110 PolarHBondContact O-N 3.17Å; F107-Q111 WeakPolarHBondContact O-CB 3.29Å; F107-Q111 PolarHBondContact O-N 3.28Å
108L89.1Confident86.7Confident108 Ų10866.5 Ų66.557%0.56533%0.327SS*.Hα-helixtrans-63.8-40.5177-69.6173.8000112.5L104 V105 Q111 A112L104-L108 WeakPolarHBondContact O-CG 3.49Å; L104-L108 PolarHBondContact O-N 3Å; L104-L108 VanDerWaalsContact O-N 3.08Å; V105-L108 PolarHBondContact O-N 3.02Å; L108-Q111 PolarHBondContact O-N 3.47Å; L108-A112 VanDerWaalsContact O-CB 3.27Å; L108-A112 WeakPolarHBondContact O-CB 3.13Å; L108-A112 PolarHBondContact O-N 3.26Å
109L88.9Confident85.8Confident33 Ų3372.8 Ų72.817%0.17336%0.355CS..Hα-helixtrans-68.1-42.1177-100.2139.2000112.1V105 D106 F107 Q111 A112 F113 L179 L182 I186V105-L109 HydrophobicContact CG1-CD1 3.62Å; V105-L109 WeakPolarHBondContact O-CB 3.45Å; V105-L109 PolarHBondContact O-N 2.99Å; D106-L109 PolarHBondContact O-N 3.48Å; F107-L109 PolarHBondContact O-N 3.12Å; L109-Q111 VanDerWaalsContact C-N 3.35Å; L109-A112 PolarHBondContact O-N 3.46Å; L109-F113 VanDerWaalsContact O-CB 3.26Å; L109-F113 WeakPolarHBondContact O-CB 3.23Å; L109-F113 PolarHBondContact O-N 3.47Å; L109-L179 HydrophobicContact CD2-CD2 3.87Å; L109-L182 HydrophobicContact CD1-CD2 3.52Å; L109-L182 HydrophobicContact CD2-CD2 3.67Å; L109-L182 HydrophobicContact CG-CD2 4.18Å; L109-I186 HydrophobicContact CD1-CD1 4.47Å
110A84.4Confident84.6Confident12 Ų1275.9 Ų75.910%0.09937%0.372CS..Hα-helixtrans-61.8-44.6174.800000111.1L44 D106 F107 F113 Q114L44-A110 HydrophobicContact CD2-CB 3.77Å; D106-A110 WeakPolarHBondContact O-CB 3.31Å; D106-A110 PolarHBondContact O-N 3.28Å; F107-A110 PolarHBondContact O-N 3.17Å; A110-F113 PolarHBondContact O-N 2.88Å; A110-Q114 WeakPolarHBondContact O-CG 3.18Å; A110-Q114 PolarHBondContact O-N 3.4Å
111Q84.1Confident83.4Confident106 Ų10671.9 Ų71.950%0.49536%0.355SS..Hα-helixtrans-63.6-42.9176.2-173.5177.3-1.200112.1F107 L108 L109 F113 Q114 F115F107-Q111 WeakPolarHBondContact O-CB 3.29Å; F107-Q111 PolarHBondContact O-N 3.28Å; L108-Q111 PolarHBondContact O-N 3.47Å; L109-Q111 VanDerWaalsContact C-N 3.35Å; Q111-F113 VanDerWaalsContact C-N 3.31Å; Q111-F113 PolarHBondContact O-N 3.3Å; Q111-Q114 PolarHBondContact O-N 3.38Å; Q111-F115 WeakPolarHBondContact O-CB 3.41Å; Q111-F115 PolarHBondContact O-N 2.96Å
112A86.9Confident82.1Confident57 Ų5777.3 Ų77.347%0.47138%0.38SS..Hα-helixtrans-64.6-36.817600000112L108 L109 F115 L116L108-A112 VanDerWaalsContact O-CB 3.27Å; L108-A112 WeakPolarHBondContact O-CB 3.13Å; L108-A112 PolarHBondContact O-N 3.26Å; L109-A112 PolarHBondContact O-N 3.46Å; A112-F115 PolarHBondContact O-N 2.88Å; A112-L116 VanDerWaalsContact O-CB 3.29Å; A112-L116 WeakPolarHBondContact O-CB 2.95Å; A112-L116 PolarHBondContact O-N 2.87Å
113F84.8Confident81.1Confident36 Ų3683.3 Ų83.316%0.15841%0.408CS..Hα-helixtrans-69.4-44.2178-166.9-94.4000111.8L109 A110 Q111 F115 L116 F117 H119 V121 W178L109-F113 VanDerWaalsContact O-CB 3.26Å; L109-F113 WeakPolarHBondContact O-CB 3.23Å; L109-F113 PolarHBondContact O-N 3.47Å; A110-F113 PolarHBondContact O-N 2.88Å; Q111-F113 VanDerWaalsContact C-N 3.31Å; Q111-F113 PolarHBondContact O-N 3.3Å; F113-F115 VanDerWaalsContact C-N 3.31Å; F113-F115 PolarHBondContact O-N 3.45Å; F113-L116 PolarHBondContact O-N 3.28Å; F113-F117 HydrophobicContact CD1-CD2 4.44Å; F113-F117 AromaticContact CD2-CD2 3.41Å; F113-F117 HydrophobicContact CD2-CD2 3.41Å; F113-F117 VanDerWaalsContact CD2-CD2 3.41Å; F113-F117 AromaticContact CD2-CE2 3.74Å; F113-F117 HydrophobicContact CD2-CE2 3.74Å; F113-F117 HydrophobicContact CD2-CG 4.39Å; F113-F117 HydrophobicContact CE1-CB 4.25Å; F113-F117 HydrophobicContact CE1-CD2 4.41Å; F113-F117 AromaticContact CE2-CD2 3.34Å; F113-F117 HydrophobicContact CE2-CD2 3.34Å; F113-F117 AromaticContact CE2-CE2 3.61Å; F113-F117 HydrophobicContact CE2-CE2 3.61Å; F113-F117 HydrophobicContact CE2-CG 4.02Å; F113-F117 HydrophobicContact CE2-CZ 4.48Å; F113-F117 AromaticContact CG-CD2 3.99Å; F113-F117 HydrophobicContact CG-CD2 3.99Å; F113-F117 HydrophobicContact CZ-CB 4.25Å; F113-F117 AromaticContact CZ-CD2 3.89Å; F113-F117 HydrophobicContact CZ-CD2 3.89Å; F113-F117 HydrophobicContact CZ-CE2 4.48Å; F113-F117 HydrophobicContact CZ-CG 4.12Å; F113-F117 WeakPolarHBondContact O-CB 3.23Å; F113-F117 PolarHBondContact O-N 3.32Å; F113-H119 HydrophobicContact CE1-CB 4.13Å; F113-V121 HydrophobicContact CD1-CG2 3.46Å; F113-V121 VanDerWaalsContact CD1-CG2 3.46Å; F113-V121 HydrophobicContact CE1-CG2 3.88Å; F113-V121 HydrophobicContact CG-CG2 4.26Å; F113-W178 HydrophobicContact CE2-CH2 4.37Å; F113-W178 HydrophobicContact CE2-CZ2 4.12Å
114Q83.1Confident80.5Confident71 Ų7183 Ų8333%0.33241%0.405SS..Hα-helixtrans-57.9-44.3172.3-77179.8-22.700111.3A110 Q111 L116 E118A110-Q114 WeakPolarHBondContact O-CG 3.18Å; A110-Q114 PolarHBondContact O-N 3.4Å; Q111-Q114 PolarHBondContact O-N 3.38Å; Q114-L116 PolarHBondContact O-N 3.07Å; Q114-E118 WeakPolarHBondContact O-CA 3.46Å; Q114-E118 PolarHBondContact O-N 2.51Å; Q114-E118 VanDerWaalsContact O-N 3.08Å
115F85.6Confident80Confident183 Ų18379.5 Ų79.580%0.80339%0.387SS*.Hα-helixtrans-66.1-36.7178.9-177.4-99.5000113.3Q111 A112 F113Q111-F115 WeakPolarHBondContact O-CB 3.41Å; Q111-F115 PolarHBondContact O-N 2.96Å; A112-F115 PolarHBondContact O-N 2.88Å; F113-F115 VanDerWaalsContact C-N 3.31Å; F113-F115 PolarHBondContact O-N 3.45Å
116L85.4Confident79.5Confident127 Ų12779.1 Ų79.167%0.66539%0.386SS*.Hα-helixtrans-88.3-34.3-173.5-170.962.9000113.6A112 F113 Q114A112-L116 VanDerWaalsContact O-CB 3.29Å; A112-L116 WeakPolarHBondContact O-CB 2.95Å; A112-L116 PolarHBondContact O-N 2.87Å; F113-L116 PolarHBondContact O-N 3.28Å; Q114-L116 PolarHBondContact O-N 3.07Å
117F80.5Confident79.2Confident112 Ų11279.2 Ų79.249%0.49139%0.387SS..Hα-helixtrans-115.1-3.4-171.4-66.5-79.3000114.1F113 H119F113-F117 HydrophobicContact CD1-CD2 4.44Å; F113-F117 AromaticContact CD2-CD2 3.41Å; F113-F117 HydrophobicContact CD2-CD2 3.41Å; F113-F117 VanDerWaalsContact CD2-CD2 3.41Å; F113-F117 AromaticContact CD2-CE2 3.74Å; F113-F117 HydrophobicContact CD2-CE2 3.74Å; F113-F117 HydrophobicContact CD2-CG 4.39Å; F113-F117 HydrophobicContact CE1-CB 4.25Å; F113-F117 HydrophobicContact CE1-CD2 4.41Å; F113-F117 AromaticContact CE2-CD2 3.34Å; F113-F117 HydrophobicContact CE2-CD2 3.34Å; F113-F117 AromaticContact CE2-CE2 3.61Å; F113-F117 HydrophobicContact CE2-CE2 3.61Å; F113-F117 HydrophobicContact CE2-CG 4.02Å; F113-F117 HydrophobicContact CE2-CZ 4.48Å; F113-F117 AromaticContact CG-CD2 3.99Å; F113-F117 HydrophobicContact CG-CD2 3.99Å; F113-F117 HydrophobicContact CZ-CB 4.25Å; F113-F117 AromaticContact CZ-CD2 3.89Å; F113-F117 HydrophobicContact CZ-CD2 3.89Å; F113-F117 HydrophobicContact CZ-CE2 4.48Å; F113-F117 HydrophobicContact CZ-CG 4.12Å; F113-F117 WeakPolarHBondContact O-CB 3.23Å; F113-F117 PolarHBondContact O-N 3.32Å; F117-H119 PolarHBondContact O-N 3.45Å; F117-H119 PolarHBondContact O-ND1 2.83Å
118E77.3Confident79.3Confident182 Ų18275.2 Ų75.285%0.8537%0.37SS*.  trans52.218-175-59.4-172.5171.100114Q114Q114-E118 WeakPolarHBondContact O-CA 3.46Å; Q114-E118 PolarHBondContact O-N 2.51Å; Q114-E118 VanDerWaalsContact O-N 3.08Å
119H69Low79.3Confident131 Ų13170 Ų7061%0.60634%0.343SS*.  trans-105.5129.2177.8-80.472.3000109.8F113 F117F113-H119 HydrophobicContact CE1-CB 4.13Å; F117-H119 PolarHBondContact O-N 3.45Å; F117-H119 PolarHBondContact O-ND1 2.83Å
120E64Low79.3Confident111 Ų11168.5 Ų68.552%0.51934%0.336SS..  trans-81.4124.2175.1-59.9-164.4150.100110.2Q45 E122Q45-E120 VanDerWaalsContact NE2-CD 3.27Å; Q45-E120 PolarHBondContact NE2-OE1 3.15Å; Q45-E120 PolarHBondContact NE2-OE2 2.85Å; E120-E122 HydrophobicContact CB-CG 4.45Å; E120-E122 PolarHBondContact O-N 3.29Å
121V64.4Low79.6Confident5 Ų568 Ų683%0.0333%0.331CS..  trans-8689.7171.5-166.70000107.3F113 L124 F176 L179F113-V121 HydrophobicContact CD1-CG2 3.46Å; F113-V121 VanDerWaalsContact CD1-CG2 3.46Å; F113-V121 HydrophobicContact CE1-CG2 3.88Å; F113-V121 HydrophobicContact CG-CG2 4.26Å; V121-L124 HydrophobicContact CB-CD1 4.19Å; V121-L124 HydrophobicContact CG1-CD1 3.44Å; V121-L124 VanDerWaalsContact CG1-CD1 3.44Å; V121-L124 HydrophobicContact CG1-CG 4.16Å; V121-F176 HydrophobicContact CG1-CD1 3.86Å; V121-F176 HydrophobicContact CG1-CD2 4.39Å; V121-F176 HydrophobicContact CG1-CE1 4.11Å; V121-F176 HydrophobicContact CG1-CG 4.01Å; V121-F176 HydrophobicContact CG1-CZ 4.49Å; V121-L179 HydrophobicContact CG2-CD1 4.35Å
122E62.8Low80Confident125 Ų12563 Ų6358%0.58431%0.308SS*.  trans-69.4-34.6-173.3-71.8-176.214300113S43 E120S43-E122 WeakPolarHBondContact CA-O 3.38Å; S43-E122 WeakPolarHBondContact CB-O 3.48Å; S43-E122 PolarHBondContact OG-O 2.98Å; E120-E122 HydrophobicContact CB-CG 4.45Å; E120-E122 PolarHBondContact O-N 3.29Å
123E69.4Low80.3Confident126 Ų12660.7 Ų60.759%0.58929%0.287SS*.  trans-139.4123.5-174.7-59.2-170.5161.500111.7V41V41-E123 HydrophobicContact CG1-CG 4.2Å
124L75.9Confident80.7Confident12 Ų1259 Ų596%0.06328%0.28CS..PPolyproline II helixtrans-102.9150170.9-79.475.9000109.5Y42 L44 V121 A126 L180Y42-L124 HydrophobicContact CD1-CB 3.58Å; Y42-L124 HydrophobicContact CE1-CB 3.83Å; Y42-L124 HydrophobicContact CE1-CD2 4.34Å; Y42-L124 PolarHBondContact O-N 3.5Å; L44-L124 HydrophobicContact CD1-CB 4.46Å; L44-L124 HydrophobicContact CD1-CD1 3.46Å; L44-L124 VanDerWaalsContact CD1-CD1 3.46Å; L44-L124 HydrophobicContact CD1-CD2 3.96Å; L44-L124 HydrophobicContact CD1-CG 4.17Å; V121-L124 HydrophobicContact CB-CD1 4.19Å; V121-L124 HydrophobicContact CG1-CD1 3.44Å; V121-L124 VanDerWaalsContact CG1-CD1 3.44Å; V121-L124 HydrophobicContact CG1-CG 4.16Å; L124-A126 PolarHBondContact O-N 2.9Å; L124-L180 HydrophobicContact CB-CD1 4.42Å; L124-L180 HydrophobicContact CD2-CD1 3.71Å
125P78Confident81.1Confident14 Ų1455.8 Ų55.89%0.09127%0.265CS..PPolyproline II helixtrans-55.1124.4176-25.334.8000111.6L129 S174 M177 L180P125-L129 HydrophobicContact CB-CD1 3.9Å; P125-S174 WeakPolarHBondContact CG-OG 3.38Å; P125-M177 HydrophobicContact CB-CE 3.98Å; P125-M177 HydrophobicContact CG-CB 4.29Å; P125-M177 HydrophobicContact CG-CE 4.1Å; P125-L180 WeakPolarHBondContact O-CD2 2.97Å
126A80.8Confident81.4Confident8 Ų848 Ų487%0.06623%0.231CC..PPolyproline II helixtrans-74.7147.3178.200000111.5G59 I62 L64 L124G59-A126 CarbonylContact O-C 3.49Å; G59-A126 VanDerWaalsContact O-CA 3.28Å; G59-A126 WeakPolarHBondContact O-CA 3.26Å; G59-A126 VanDerWaalsContact O-CB 3.26Å; G59-A126 WeakPolarHBondContact O-CB 3.28Å; I62-A126 CarbonylContact O-C 3.45Å; L64-A126 HydrophobicContact CB-CB 4.48Å; L64-A126 HydrophobicContact CD1-CB 3.73Å; L64-A126 HydrophobicContact CG-CB 3.75Å; L124-A126 PolarHBondContact O-N 2.9Å
127G83.8Confident81.6Confident4 Ų443 Ų434%0.04121%0.206CC..SBendtrans125176.1172.200000115.5G59 R60 I62 L129G59-G127 PolarHBondContact O-N 3.22Å; R60-G127 CarbonylContact O-C 2.95Å; I62-G127 WeakPolarHBondContact O-CA 3.42Å; I62-G127 PolarHBondContact O-N 3.31Å; G127-L129 PolarHBondContact O-N 3.49Å
128L86.3Confident81.9Confident16 Ų1638.3 Ų38.38%0.08419%0.186CC..THydrogen-bonded Turntrans-74.733.6-177.8-154.6128.3000112.3L19 L23 R60 L61 P131 V132L19-L128 HydrophobicContact CD1-CD1 4.22Å; L19-L128 HydrophobicContact CD1-CD2 4.25Å; L19-L128 HydrophobicContact CD2-CD2 4.46Å; L23-L128 HydrophobicContact CD1-CB 4.32Å; R60-L128 WeakPolarHBondContact O-CA 3.47Å; R60-L128 PolarHBondContact O-N 3.27Å; R60-L128 VanDerWaalsContact O-N 3.17Å; L61-L128 HydrophobicContact CD2-CD1 4.22Å; L128-P131 HydrophobicContact CD2-CB 3.99Å; L128-P131 HydrophobicContact CD2-CG 4.33Å; L128-P131 HydrophobicContact CG-CB 4.3Å; L128-P131 HydrophobicContact CG-CG 4.08Å; L128-V132 HydrophobicContact CD2-CG2 4.05Å; L128-V132 WeakPolarHBondContact O-CG2 3.46Å; L128-V132 PolarHBondContact O-N 3.3Å
129L89.6Confident82.4Confident0 Ų030.2 Ų30.20%015%0.148CC..Hα-helixtrans-72-48.2-173-64.7170.2000111.2D68 P125 G127 V132 F133 L170 M177 L180D68-L129 HydrophobicContact CB-CD2 4.4Å; P125-L129 HydrophobicContact CB-CD1 3.9Å; G127-L129 PolarHBondContact O-N 3.49Å; L129-V132 WeakPolarHBondContact O-CB 3.49Å; L129-V132 PolarHBondContact O-N 2.87Å; L129-V132 VanDerWaalsContact O-N 3.12Å; L129-F133 HydrophobicContact CB-CD2 4.47Å; L129-F133 HydrophobicContact CB-CE2 4.33Å; L129-F133 WeakPolarHBondContact O-CD2 3.26Å; L129-F133 PolarHBondContact O-N 3.15Å; L129-L170 HydrophobicContact CD2-CD1 3.83Å; L129-L170 HydrophobicContact CD2-CD2 3.79Å; L129-L170 HydrophobicContact CD2-CG 4.12Å; L129-M177 HydrophobicContact CD1-CE 4.14Å; L129-L180 HydrophobicContact CB-CD2 3.66Å; L129-L180 HydrophobicContact CD1-CD2 3.97Å; L129-L180 HydrophobicContact CG-CD2 4.44Å
130A90.3Very high83.2Confident1 Ų130.9 Ų30.91%0.00815%0.146CC..Hα-helixtrans-60.7-44.8-178.500000113.2V132 F133 S134 L180 G184A130-V132 VanDerWaalsContact C-N 3.34Å; A130-V132 PolarHBondContact O-N 3.31Å; A130-F133 PolarHBondContact O-N 3.25Å; A130-S134 PolarHBondContact O-N 3.43Å; A130-L180 HydrophobicContact CB-CG 4.15Å; A130-G184 VanDerWaalsContact O-CA 3.23Å; A130-G184 WeakPolarHBondContact O-CA 3.34Å
131P90.3Very high84.1Confident2 Ų230.2 Ų30.21%0.01314%0.144CC..Hα-helixtrans-65.4-33.6173.4-22.335.1000113.5W99 L128 S134 L135W99-P131 HydrophobicContact CB-CG 3.86Å; W99-P131 HydrophobicContact CG-CG 4.26Å; L128-P131 HydrophobicContact CD2-CB 3.99Å; L128-P131 HydrophobicContact CD2-CG 4.33Å; L128-P131 HydrophobicContact CG-CB 4.3Å; L128-P131 HydrophobicContact CG-CG 4.08Å; P131-S134 VanDerWaalsContact O-CB 3.29Å; P131-S134 WeakPolarHBondContact O-CB 3.29Å; P131-S134 PolarHBondContact O-N 2.9Å; P131-L135 PolarHBondContact O-N 3.12Å
132V92.4Very high84.7Confident0 Ų032.1 Ų32.10%016%0.157CC..Hα-helixtrans-64.5-42.4173168.90000110.8L75 I76 F79 L128 L129 A130 S134 L135L75-V132 HydrophobicContact CB-CG1 3.69Å; L75-V132 HydrophobicContact CD1-CG1 3.59Å; L75-V132 HydrophobicContact CG-CG1 4.26Å; I76-V132 HydrophobicContact CD1-CG2 4.18Å; I76-V132 HydrophobicContact CG1-CG2 3.88Å; F79-V132 HydrophobicContact CE2-CG1 4.2Å; L128-V132 HydrophobicContact CD2-CG2 4.05Å; L128-V132 WeakPolarHBondContact O-CG2 3.46Å; L128-V132 PolarHBondContact O-N 3.3Å; L129-V132 WeakPolarHBondContact O-CB 3.49Å; L129-V132 PolarHBondContact O-N 2.87Å; L129-V132 VanDerWaalsContact O-N 3.12Å; A130-V132 VanDerWaalsContact C-N 3.34Å; A130-V132 PolarHBondContact O-N 3.31Å; V132-S134 VanDerWaalsContact C-N 3.29Å; V132-S134 PolarHBondContact O-N 3.24Å; V132-L135 WeakPolarHBondContact O-CB 3.47Å; V132-L135 PolarHBondContact O-N 3.08Å
133F92.7Very high85.2Confident8 Ų827.7 Ų27.74%0.03514%0.137CC..Hα-helixtrans-63.4-35.8174.2-75.4-62.5000112.2L129 A130 L135 F136 L170 L171 M177 A181L129-F133 HydrophobicContact CB-CD2 4.47Å; L129-F133 HydrophobicContact CB-CE2 4.33Å; L129-F133 WeakPolarHBondContact O-CD2 3.26Å; L129-F133 PolarHBondContact O-N 3.15Å; A130-F133 PolarHBondContact O-N 3.25Å; F133-L135 VanDerWaalsContact C-N 3.26Å; F133-L135 PolarHBondContact O-N 3.13Å; F133-F136 HydrophobicContact CD1-CD2 4.28Å; F133-F136 HydrophobicContact CD1-CE2 4.12Å; F133-F136 WeakPolarHBondContact O-CB 3.33Å; F133-F136 PolarHBondContact O-N 3.45Å; F133-F136 VanDerWaalsContact O-N 3.1Å; F133-L170 HydrophobicContact CE1-CD2 4.2Å; F133-L170 HydrophobicContact CE2-CD2 3.97Å; F133-L170 HydrophobicContact CE2-CG 4.27Å; F133-L170 HydrophobicContact CZ-CB 4Å; F133-L170 HydrophobicContact CZ-CD2 3.58Å; F133-L170 HydrophobicContact CZ-CG 3.72Å; F133-L171 HydrophobicContact CE1-CD2 4.27Å; F133-L171 HydrophobicContact CE1-CG 4.32Å; F133-L171 HydrophobicContact CZ-CD2 4.06Å; F133-L171 HydrophobicContact CZ-CG 4.33Å; F133-M177 HydrophobicContact CE2-CG 4.3Å; F133-A181 HydrophobicContact CD1-CB 3.9Å; F133-A181 HydrophobicContact CD2-CB 3.8Å; F133-A181 HydrophobicContact CE1-CB 3.96Å; F133-A181 HydrophobicContact CE2-CB 3.86Å; F133-A181 HydrophobicContact CG-CB 3.83Å; F133-A181 HydrophobicContact CZ-CB 3.93Å
134S92.9Very high85.1Confident0 Ų025.5 Ų25.50%013%0.133CC..Hα-helixtrans-59.5-33.1174.6-169.40000113.7T98 A130 P131 V132 F136 V137 P138 G184 G188T98-S134 WeakPolarHBondContact CB-OG 3.14Å; T98-S134 WeakPolarHBondContact CG2-OG 3.27Å; A130-S134 PolarHBondContact O-N 3.43Å; P131-S134 VanDerWaalsContact O-CB 3.29Å; P131-S134 WeakPolarHBondContact O-CB 3.29Å; P131-S134 PolarHBondContact O-N 2.9Å; V132-S134 VanDerWaalsContact C-N 3.29Å; V132-S134 PolarHBondContact O-N 3.24Å; S134-F136 PolarHBondContact O-N 3.11Å; S134-V137 PolarHBondContact O-N 2.82Å; S134-P138 WeakPolarHBondContact O-CD 3.45Å; S134-G184 WeakPolarHBondContact CA-O 3.45Å; S134-G184 VanDerWaalsContact CB-O 3.23Å; S134-G184 WeakPolarHBondContact CB-O 3.31Å; S134-G184 PolarHBondContact OG-O 2.94Å; S134-G188 WeakPolarHBondContact OG-CA 3.4Å; S134-G188 PolarHBondContact OG-N 3.49Å; S134-G188 VanDerWaalsContact OG-N 3.11Å
135L91.2Very high84.2Confident5 Ų534.1 Ų34.13%0.02617%0.165CC..THydrogen-bonded Turntrans-66.7-18.2176.9-70.6168000113.9F79 F82 F91 F94 L95 P131 V132 F133 V137 P138 F139F79-L135 HydrophobicContact CB-CD1 3.99Å; F79-L135 HydrophobicContact CD1-CB 4.44Å; F79-L135 HydrophobicContact CD2-CB 3.71Å; F79-L135 HydrophobicContact CD2-CD1 3.61Å; F79-L135 HydrophobicContact CD2-CG 4.31Å; F79-L135 HydrophobicContact CE1-CB 4.5Å; F79-L135 HydrophobicContact CE2-CB 3.77Å; F79-L135 HydrophobicContact CE2-CD1 4.36Å; F79-L135 HydrophobicContact CG-CB 4.06Å; F79-L135 HydrophobicContact CG-CD1 4.04Å; F79-L135 HydrophobicContact CZ-CB 4.18Å; F82-L135 HydrophobicContact CD2-CD2 4Å; F82-L135 HydrophobicContact CE2-CB 4.47Å; F82-L135 HydrophobicContact CE2-CD2 4.43Å; F91-L135 HydrophobicContact CE2-CD2 3.67Å; F91-L135 HydrophobicContact CZ-CD1 4.43Å; F91-L135 HydrophobicContact CZ-CD2 4.33Å; F94-L135 HydrophobicContact CD1-CD2 3.77Å; F94-L135 HydrophobicContact CE1-CD2 3.33Å; F94-L135 HydrophobicContact CE1-CG 4Å; F94-L135 HydrophobicContact CZ-CD2 4.3Å; L95-L135 HydrophobicContact CD2-CD1 4.13Å; L95-L135 HydrophobicContact CD2-CD2 4.45Å; L95-L135 HydrophobicContact CD2-CG 4.41Å; P131-L135 PolarHBondContact O-N 3.12Å; V132-L135 WeakPolarHBondContact O-CB 3.47Å; V132-L135 PolarHBondContact O-N 3.08Å; F133-L135 VanDerWaalsContact C-N 3.26Å; F133-L135 PolarHBondContact O-N 3.13Å; L135-V137 PolarHBondContact O-N 3.13Å; L135-P138 VanDerWaalsContact O-CD 3.26Å; L135-P138 WeakPolarHBondContact O-CD 3.47Å; L135-P138 VanDerWaalsContact O-CG 3.31Å; L135-P138 WeakPolarHBondContact O-CG 3.11Å; L135-F139 VanDerWaalsContact O-CB 3.28Å; L135-F139 WeakPolarHBondContact O-CB 3.2Å; L135-F139 PolarHBondContact O-N 2.83Å; L135-F139 VanDerWaalsContact O-N 3.15Å
136F91.9Very high83.1Confident18 Ų1839.8 Ų39.88%0.07919%0.192CC..Hα-helixtrans-67.1-26.7175.1-77.1-91.5000112.8L75 F79 F133 S134 F139 Y140 V163 Y164 L185L75-F136 HydrophobicContact CD1-CE2 4.17Å; L75-F136 HydrophobicContact CD1-CZ 4.18Å; L75-F136 HydrophobicContact CD2-CE1 4.41Å; L75-F136 HydrophobicContact CD2-CE2 4.16Å; L75-F136 HydrophobicContact CD2-CZ 3.54Å; F79-F136 HydrophobicContact CE2-CD2 4.16Å; F79-F136 AromaticContact CE2-CE2 3.94Å; F79-F136 HydrophobicContact CE2-CE2 3.94Å; F79-F136 HydrophobicContact CE2-CZ 4.33Å; F79-F136 HydrophobicContact CZ-CD1 4.04Å; F79-F136 AromaticContact CZ-CD2 3.78Å; F79-F136 HydrophobicContact CZ-CD2 3.78Å; F79-F136 AromaticContact CZ-CE1 3.98Å; F79-F136 HydrophobicContact CZ-CE1 3.98Å; F79-F136 AromaticContact CZ-CE2 3.74Å; F79-F136 HydrophobicContact CZ-CE2 3.74Å; F79-F136 AromaticContact CZ-CG 3.98Å; F79-F136 HydrophobicContact CZ-CG 3.98Å; F79-F136 AromaticContact CZ-CZ 3.84Å; F79-F136 HydrophobicContact CZ-CZ 3.84Å; F133-F136 HydrophobicContact CD1-CD2 4.28Å; F133-F136 HydrophobicContact CD1-CE2 4.12Å; F133-F136 WeakPolarHBondContact O-CB 3.33Å; F133-F136 PolarHBondContact O-N 3.45Å; F133-F136 VanDerWaalsContact O-N 3.1Å; S134-F136 PolarHBondContact O-N 3.11Å; F136-F139 WeakPolarHBondContact O-CB 3.44Å; F136-F139 PolarHBondContact O-N 3.46Å; F136-Y140 WeakPolarHBondContact O-CB 3.47Å; F136-Y140 PolarHBondContact O-N 3.34Å; F136-V163 HydrophobicContact CE1-CG1 3.92Å; F136-V163 HydrophobicContact CZ-CG1 4.38Å; F136-Y164 AromaticContact CD1-CD1 3.89Å; F136-Y164 HydrophobicContact CD1-CD1 3.89Å; F136-Y164 AromaticContact CD1-CE1 3.77Å; F136-Y164 HydrophobicContact CD1-CE1 3.77Å; F136-Y164 AromaticContact CE1-CD1 3.95Å; F136-Y164 HydrophobicContact CE1-CD1 3.95Å; F136-Y164 HydrophobicContact CE1-CE1 4.29Å; F136-L185 HydrophobicContact CB-CD2 4.14Å
137V90.8Very high81.8Confident23 Ų2344.6 Ų44.614%0.13922%0.222CC..Hα-helixtrans-63.6-58.4177.61800000111.4S134 L135 F139 Y140 Q141 L185 H192S134-V137 PolarHBondContact O-N 2.82Å; L135-V137 PolarHBondContact O-N 3.13Å; V137-F139 PolarHBondContact O-N 3.26Å; V137-Y140 PolarHBondContact O-N 3.19Å; V137-Q141 PolarHBondContact O-N 2.92Å; V137-L185 HydrophobicContact CG2-CD2 3.95Å; V137-H192 HydrophobicContact CG1-CB 4.49Å
138P86Confident80.4Confident14 Ų1448 Ų489%0.09124%0.242CC..Hα-helixtrans-64.2-27.2174.625.6-33.3000112.1F82 F94 S134 L135 Q141 S142F82-P138 HydrophobicContact CE1-CB 4.4Å; F94-P138 HydrophobicContact CE2-CG 4.46Å; F94-P138 HydrophobicContact CZ-CG 4.01Å; S134-P138 WeakPolarHBondContact O-CD 3.45Å; L135-P138 VanDerWaalsContact O-CD 3.26Å; L135-P138 WeakPolarHBondContact O-CD 3.47Å; L135-P138 VanDerWaalsContact O-CG 3.31Å; L135-P138 WeakPolarHBondContact O-CG 3.11Å; P138-Q141 PolarHBondContact O-N 2.99Å; P138-S142 VanDerWaalsContact O-CB 3.24Å; P138-S142 WeakPolarHBondContact O-CB 3.43Å; P138-S142 PolarHBondContact O-N 2.67Å; P138-S142 PolarHBondContact O-OG 2.86Å
139F87.9Confident78.7Confident11 Ų1151.5 Ų51.55%0.04826%0.264CS..Hα-helixtrans-65.2-37.7174.6-173.8-101.7000114.2F79 F82 L135 F136 V137 I143 K160 V163 Y164F79-F139 AromaticContact CD1-CD2 3.91Å; F79-F139 HydrophobicContact CD1-CD2 3.91Å; F79-F139 HydrophobicContact CD1-CE2 4.49Å; F79-F139 HydrophobicContact CD1-CG 4.44Å; F79-F139 HydrophobicContact CE1-CB 3.92Å; F79-F139 HydrophobicContact CE1-CD1 4.4Å; F79-F139 AromaticContact CE1-CD2 3.6Å; F79-F139 HydrophobicContact CE1-CD2 3.6Å; F79-F139 HydrophobicContact CE1-CE2 4.2Å; F79-F139 AromaticContact CE1-CG 3.74Å; F79-F139 HydrophobicContact CE1-CG 3.74Å; F82-F139 HydrophobicContact CE2-CB 4.14Å; F82-F139 HydrophobicContact CE2-CD2 4.31Å; F82-F139 VanDerWaalsContact CZ-CA 3.45Å; F82-F139 HydrophobicContact CZ-CB 3.62Å; F82-F139 AromaticContact CZ-CD2 3.85Å; F82-F139 HydrophobicContact CZ-CD2 3.85Å; F82-F139 HydrophobicContact CZ-CG 4.25Å; L135-F139 VanDerWaalsContact O-CB 3.28Å; L135-F139 WeakPolarHBondContact O-CB 3.2Å; L135-F139 PolarHBondContact O-N 2.83Å; L135-F139 VanDerWaalsContact O-N 3.15Å; F136-F139 WeakPolarHBondContact O-CB 3.44Å; F136-F139 PolarHBondContact O-N 3.46Å; V137-F139 PolarHBondContact O-N 3.26Å; F139-I143 HydrophobicContact CD2-CD1 3.27Å; F139-I143 HydrophobicContact CE2-CD1 3.37Å; F139-I143 HydrophobicContact CG-CD1 4.17Å; F139-I143 HydrophobicContact CZ-CD1 4.35Å; F139-K160 HydrophobicContact CE1-CD 4.25Å; F139-K160 HydrophobicContact CE1-CG 3.8Å; F139-K160 HydrophobicContact CZ-CB 4.39Å; F139-K160 HydrophobicContact CZ-CG 4.04Å; F139-K160 PolarHBondContact O-NZ 3Å; F139-V163 HydrophobicContact CD1-CG1 4.46Å; F139-V163 HydrophobicContact CE1-CB 4.07Å; F139-V163 HydrophobicContact CE1-CG1 3.88Å; F139-V163 HydrophobicContact CE2-CG1 4.23Å; F139-V163 HydrophobicContact CE2-CG2 4.4Å; F139-V163 HydrophobicContact CZ-CB 3.77Å; F139-V163 HydrophobicContact CZ-CG1 3.78Å; F139-V163 HydrophobicContact CZ-CG2 3.96Å; F139-Y164 HydrophobicContact CD1-CE1 4.27Å; F139-Y164 HydrophobicContact CD1-CE2 4.34Å; F139-Y164 AromaticContact CD1-CZ 3.82Å; F139-Y164 HydrophobicContact CE1-CD2 4.47Å; F139-Y164 HydrophobicContact CE1-CE1 4.43Å; F139-Y164 AromaticContact CE1-CE2 3.89Å; F139-Y164 HydrophobicContact CE1-CE2 3.89Å; F139-Y164 AromaticContact CE1-CZ 3.85Å
140Y86.6Confident77Confident145 Ų14557.7 Ų57.757%0.56929%0.294SS*.Hα-helixtrans-66.5-47.4174.9-177.6-96.9000110.9F136 V137 K160F136-Y140 WeakPolarHBondContact O-CB 3.47Å; F136-Y140 PolarHBondContact O-N 3.34Å; V137-Y140 PolarHBondContact O-N 3.19Å; Y140-K160 PolarHBondContact O-NZ 3.02Å
141Q82Confident75.3Confident98 Ų9862.5 Ų62.546%0.45832%0.323SS..Hα-helixtrans-79.1-40.6-171.8-65.9171.2-22.300114.6V137 P138 H192V137-Q141 PolarHBondContact O-N 2.92Å; P138-Q141 PolarHBondContact O-N 2.99Å; Q141-H192 PolarHBondContact NE2-CD2 3.26Å; Q141-H192 VanDerWaalsContact NE2-CD2 3.33Å; Q141-H192 PolarHBondContact NE2-NE2 3.1Å; Q141-H192 PolarHBondContact OE1-CD2 3.01Å; Q141-H192 PolarHBondContact OE1-CE1 2.89Å; Q141-H192 VanDerWaalsContact OE1-CG 3.31Å; Q141-H192 PolarHBondContact OE1-ND1 2.76Å; Q141-H192 PolarHBondContact OE1-NE2 2.69Å
142S76.6Confident73.7Confident44 Ų4468.7 Ų68.731%0.30836%0.355SS..Hα-helixtrans-91.3-17.9-168.267.50000114.9F82 P138 P144F82-S142 WeakPolarHBondContact CE1-OG 3.11Å; P138-S142 VanDerWaalsContact O-CB 3.24Å; P138-S142 WeakPolarHBondContact O-CB 3.43Å; P138-S142 PolarHBondContact O-N 2.67Å; P138-S142 PolarHBondContact O-OG 2.86Å; S142-P144 WeakPolarHBondContact O-CD 3.29Å
143I74.6Confident72Confident33 Ų3371.2 Ų71.217%0.16938%0.381CS..SBendtrans-103.3108.2-176.5-63.7171.7000109.4I81 F82 F139 K160I81-I143 HydrophobicContact CG2-CD1 4.15Å; F82-I143 HydrophobicContact CE1-CD1 4.41Å; F82-I143 HydrophobicContact CZ-CD1 4.36Å; F139-I143 HydrophobicContact CD2-CD1 3.27Å; F139-I143 HydrophobicContact CE2-CD1 3.37Å; F139-I143 HydrophobicContact CG-CD1 4.17Å; F139-I143 HydrophobicContact CZ-CD1 4.35Å; I143-K160 PolarHBondContact O-NZ 3.21Å
144P65.9Low70.4Confident79 Ų7979.4 Ų79.451%0.51342%0.419SS..  trans-64.9145.8175.928-33.8000110.3S142 M146S142-P144 WeakPolarHBondContact O-CD 3.29Å; P144-M146 HydrophobicContact CG-CE 4.04Å; P144-M146 PolarHBondContact O-N 2.87Å; P144-M146 VanDerWaalsContact O-N 3.1Å
145R56.9Low68.9Low193 Ų19384.5 Ų84.573%0.72845%0.445SS*.  trans-74.7100.8177.9-62.8179.4-174.8-176.60.8108.2P147R145-P147 WeakPolarHBondContact O-CD 3.25Å
146M56.2Low67.4Low134 Ų13488.2 Ų88.266%0.6646%0.462SS*.  trans-92114.4170.4-62-179.7-172.100108.2P144 V148P144-M146 HydrophobicContact CG-CE 4.04Å; P144-M146 PolarHBondContact O-N 2.87Å; P144-M146 VanDerWaalsContact O-N 3.1Å; M146-V148 PolarHBondContact O-N 3.46Å
147P52.7Low66.1Low108 Ų10891.6 Ų91.670%0.70148%0.48SS*.  trans-72.2113.7175.428.8-30.9000108.5R145R145-P147 WeakPolarHBondContact O-CD 3.25Å
148V54.9Low65.3Low75 Ų7592 Ų9246%0.45548%0.483SS..  trans-123.4123.1171-169.20000108.5M146M146-V148 PolarHBondContact O-N 3.46Å
149T51.1Low64.8Low90 Ų9096.5 Ų96.555%0.55251%0.506SS*.  trans49.3113170.555.80000117.5V151T149-V151 PolarHBondContact O-N 3.39Å
150Q53Low64.5Low131 Ų13197.3 Ų97.361%0.61251%0.509SS*.  trans-72.6110.2164.9-69.1174-41.400109H156Q150-H156 WeakPolarHBondContact CG-CE1 3.48Å
151V55.3Low64.4Low102 Ų10292.6 Ų92.662%0.61850%0.496SS*.SBendtrans-92.8-12.6175179.20000111.6T149T149-V151 PolarHBondContact O-N 3.39Å
152L56.3Low64.6Low131 Ų13192.1 Ų92.169%0.68650%0.496SS*.BIsolated β-bridgetrans-155.544.9-176.6-138.677.3000114.5H154L152-H154 PolarHBondContact O-N 2.94Å
153G55.6Low65.1Low54 Ų5490.1 Ų90.156%0.55748%0.482SS*.THydrogen-bonded Turntrans64.9-39.4168.900000118.5
154H59.3Low65.9Low180 Ų18092.4 Ų92.483%0.83349%0.489SS*.THydrogen-bonded Turntrans-123.3-26.6-176-73.9-86000113.7L152L152-H154 PolarHBondContact O-N 2.94Å
155I63.1Low67.1Low106 Ų10693.2 Ų93.254%0.54449%0.488SS..BIsolated β-bridgetrans-109.8109.8-176.3-49.1174.3000109.9I157I155-I157 HydrophobicContact CG2-CG1 3.92Å; I155-I157 PolarHBondContact O-N 3.41Å; I155-I157 VanDerWaalsContact O-N 3.08Å
156H59.2Low68.7Low83 Ų8385.1 Ų85.138%0.38446%0.46SS..  trans-78.285.7170.4-65.9-93.1000109.2Q150 T158Q150-H156 WeakPolarHBondContact CG-CE1 3.48Å; H156-T158 VanDerWaalsContact C-N 3.34Å; H156-T158 HydrophobicContact CB-CG2 4.37Å; H156-T158 PolarHBondContact O-N 3.22Å
157I63.9Low70.4Confident89 Ų8979 Ų7946%0.45643%0.431SS..  trans-7195171.7-57.7173.6000107.3I155 L162I155-I157 HydrophobicContact CG2-CG1 3.92Å; I155-I157 PolarHBondContact O-N 3.41Å; I155-I157 VanDerWaalsContact O-N 3.08Å; I157-L162 HydrophobicContact CG2-CD2 4.15Å; I157-L162 HydrophobicContact CG2-CG 4.42Å
158T73.5Confident72.2Confident31 Ų3179 Ų7919%0.1943%0.425CS..  trans-102.9164.4176.258.10000109.7H156 K160 T161 L162H156-T158 VanDerWaalsContact C-N 3.34Å; H156-T158 HydrophobicContact CB-CG2 4.37Å; H156-T158 PolarHBondContact O-N 3.22Å; T158-K160 PolarHBondContact O-N 3.11Å; T158-K160 VanDerWaalsContact O-N 3.12Å; T158-T161 PolarHBondContact N-OG1 2.99Å; T158-T161 PolarHBondContact O-N 3.25Å; T158-T161 PolarHBondContact O-OG1 3.5Å; T158-T161 PolarHBondContact OG1-N 2.87Å; T158-L162 PolarHBondContact O-N 2.82Å
159N75.8Confident74Confident109 Ų10981.3 Ų81.358%0.58343%0.431SS*.Hα-helixtrans-54.8-33.2172-168.525.5000111.7L162 V163N159-L162 PolarHBondContact O-N 2.52Å; N159-V163 WeakPolarHBondContact O-CG2 3.34Å; N159-V163 PolarHBondContact O-N 3.42Å
160K82.5Confident75.9Confident28 Ų2877.1 Ų77.112%0.12241%0.405CS..Hα-helixtrans-65.2-40176.3-174.5150.8-178.5153.50112.4F139 Y140 I143 T158 V163 Y164F139-K160 HydrophobicContact CE1-CD 4.25Å; F139-K160 HydrophobicContact CE1-CG 3.8Å; F139-K160 HydrophobicContact CZ-CB 4.39Å; F139-K160 HydrophobicContact CZ-CG 4.04Å; F139-K160 PolarHBondContact O-NZ 3Å; Y140-K160 PolarHBondContact O-NZ 3.02Å; I143-K160 PolarHBondContact O-NZ 3.21Å; T158-K160 PolarHBondContact O-N 3.11Å; T158-K160 VanDerWaalsContact O-N 3.12Å; K160-V163 PolarHBondContact O-N 3.45Å; K160-Y164 HydrophobicContact CD-CE2 4.27Å; K160-Y164 HydrophobicContact CG-CD2 4.07Å; K160-Y164 HydrophobicContact CG-CE2 3.54Å; K160-Y164 WeakPolarHBondContact O-CD2 3.22Å; K160-Y164 PolarHBondContact O-N 3.38Å
161T84.1Confident77.7Confident47 Ų4773.7 Ų73.729%0.28839%0.391SS..Hα-helixtrans-68.4-36.8176.456.10000112T158 V163 Y164 I165T158-T161 PolarHBondContact N-OG1 2.99Å; T158-T161 PolarHBondContact O-N 3.25Å; T158-T161 PolarHBondContact O-OG1 3.5Å; T158-T161 PolarHBondContact OG1-N 2.87Å; T161-V163 PolarHBondContact O-N 2.87Å; T161-Y164 PolarHBondContact O-N 3.33Å; T161-I165 VanDerWaalsContact O-CG1 3.26Å; T161-I165 WeakPolarHBondContact O-CG1 3.29Å; T161-I165 PolarHBondContact O-N 3.39Å
162L85.1Confident79.3Confident87 Ų8774.5 Ų74.546%0.45540%0.396SS..Hα-helixtrans-60.4-44.8176.2-66.8177.8000111.8I157 T158 N159 Y164 I165 V166I157-L162 HydrophobicContact CG2-CD2 4.15Å; I157-L162 HydrophobicContact CG2-CG 4.42Å; T158-L162 PolarHBondContact O-N 2.82Å; N159-L162 PolarHBondContact O-N 2.52Å; L162-Y164 VanDerWaalsContact C-N 3.31Å; L162-Y164 PolarHBondContact O-N 2.88Å; L162-I165 PolarHBondContact O-N 2.81Å; L162-V166 WeakPolarHBondContact O-CG2 3.17Å; L162-V166 PolarHBondContact O-N 3.11Å
163V88.9Confident80.8Confident2 Ų269.5 Ų69.51%0.01237%0.372CS..Hα-helixtrans-61.3-40177.7176.90000111.6L75 N78 F79 F136 F139 N159 K160 T161 G167L75-V163 HydrophobicContact CD2-CG1 3.97Å; N78-V163 HydrophobicContact CB-CG2 3.72Å; F79-V163 HydrophobicContact CE1-CG1 3.79Å; F79-V163 HydrophobicContact CZ-CG1 3.93Å; F136-V163 HydrophobicContact CE1-CG1 3.92Å; F136-V163 HydrophobicContact CZ-CG1 4.38Å; F139-V163 HydrophobicContact CD1-CG1 4.46Å; F139-V163 HydrophobicContact CE1-CB 4.07Å; F139-V163 HydrophobicContact CE1-CG1 3.88Å; F139-V163 HydrophobicContact CE2-CG1 4.23Å; F139-V163 HydrophobicContact CE2-CG2 4.4Å; F139-V163 HydrophobicContact CZ-CB 3.77Å; F139-V163 HydrophobicContact CZ-CG1 3.78Å; F139-V163 HydrophobicContact CZ-CG2 3.96Å; N159-V163 WeakPolarHBondContact O-CG2 3.34Å; N159-V163 PolarHBondContact O-N 3.42Å; K160-V163 PolarHBondContact O-N 3.45Å; T161-V163 PolarHBondContact O-N 2.87Å; V163-G167 PolarHBondContact O-N 3.23Å
164Y90.1Very high82.2Confident81 Ų8168.3 Ų68.332%0.31836%0.355SS..Hα-helixtrans-70-37.6175.6-71.9-60.9000113.2F136 F139 K160 T161 L162 V166 G167 L168F136-Y164 AromaticContact CD1-CD1 3.89Å; F136-Y164 HydrophobicContact CD1-CD1 3.89Å; F136-Y164 AromaticContact CD1-CE1 3.77Å; F136-Y164 HydrophobicContact CD1-CE1 3.77Å; F136-Y164 AromaticContact CE1-CD1 3.95Å; F136-Y164 HydrophobicContact CE1-CD1 3.95Å; F136-Y164 HydrophobicContact CE1-CE1 4.29Å; F139-Y164 HydrophobicContact CD1-CE1 4.27Å; F139-Y164 HydrophobicContact CD1-CE2 4.34Å; F139-Y164 AromaticContact CD1-CZ 3.82Å; F139-Y164 HydrophobicContact CE1-CD2 4.47Å; F139-Y164 HydrophobicContact CE1-CE1 4.43Å; F139-Y164 AromaticContact CE1-CE2 3.89Å; F139-Y164 HydrophobicContact CE1-CE2 3.89Å; F139-Y164 AromaticContact CE1-CZ 3.85Å; K160-Y164 HydrophobicContact CD-CE2 4.27Å; K160-Y164 HydrophobicContact CG-CD2 4.07Å; K160-Y164 HydrophobicContact CG-CE2 3.54Å; K160-Y164 WeakPolarHBondContact O-CD2 3.22Å; K160-Y164 PolarHBondContact O-N 3.38Å; T161-Y164 PolarHBondContact O-N 3.33Å; L162-Y164 VanDerWaalsContact C-N 3.31Å; L162-Y164 PolarHBondContact O-N 2.88Å; Y164-V166 VanDerWaalsContact C-N 3.34Å; Y164-G167 PolarHBondContact O-N 2.88Å; Y164-L168 WeakPolarHBondContact O-CB 3.45Å; Y164-L168 PolarHBondContact O-N 3.17Å
165I90.9Very high83.4Confident97 Ų9764.5 Ų64.550%0.49735%0.346SS..Hα-helixtrans-62.5-44175.7-70163.2000110.1T161 L162 L168 Q169T161-I165 VanDerWaalsContact O-CG1 3.26Å; T161-I165 WeakPolarHBondContact O-CG1 3.29Å; T161-I165 PolarHBondContact O-N 3.39Å; L162-I165 PolarHBondContact O-N 2.81Å; I165-L168 PolarHBondContact O-N 3.12Å; I165-Q169 WeakPolarHBondContact O-CB 3.09Å; I165-Q169 PolarHBondContact O-N 2.88Å
166V91.6Very high84.5Confident22 Ų2262.8 Ų62.813%0.13334%0.335CS..Hα-helixtrans-63.5-43.2176.1175.90000110.7C71 L74 L75 L162 Y164 L168 Q169 L170C71-V166 WeakPolarHBondContact SG-CG1 3.45Å; C71-V166 PolarHBondContact SG-O 3.43Å; L74-V166 HydrophobicContact CB-CG1 4.23Å; L75-V166 HydrophobicContact CD1-CG1 4.29Å; L75-V166 HydrophobicContact CD2-CB 4.19Å; L75-V166 HydrophobicContact CD2-CG1 3.91Å; L75-V166 HydrophobicContact CG-CG1 3.74Å; L162-V166 WeakPolarHBondContact O-CG2 3.17Å; L162-V166 PolarHBondContact O-N 3.11Å; Y164-V166 VanDerWaalsContact C-N 3.34Å; V166-L168 VanDerWaalsContact C-N 3.32Å; V166-L168 PolarHBondContact O-N 3.25Å; V166-Q169 WeakPolarHBondContact O-CB 3.41Å; V166-Q169 PolarHBondContact O-N 2.9Å; V166-L170 PolarHBondContact O-N 3.49Å
167G91.5Very high85.9Confident6 Ų658.9 Ų58.96%0.06232%0.317CS..Hα-helixtrans-60.9-38.8174.100000113.6V163 Y164 L170 L171V163-G167 PolarHBondContact O-N 3.23Å; Y164-G167 PolarHBondContact O-N 2.88Å; G167-L170 WeakPolarHBondContact O-CB 3.33Å; G167-L170 PolarHBondContact O-N 3.3Å; G167-L171 PolarHBondContact O-N 3.1Å
168L91.3Very high87.1Confident109 Ų10960.4 Ų60.457%0.57132%0.317SS*.Hα-helixtrans-69.7-40175.6-174.967.4000111.7Y164 I165 V166 L170 L171 T172Y164-L168 WeakPolarHBondContact O-CB 3.45Å; Y164-L168 PolarHBondContact O-N 3.17Å; I165-L168 PolarHBondContact O-N 3.12Å; V166-L168 VanDerWaalsContact C-N 3.32Å; V166-L168 PolarHBondContact O-N 3.25Å; L168-L170 PolarHBondContact O-N 3.32Å; L168-L171 HydrophobicContact CD1-CD1 4.22Å; L168-L171 WeakPolarHBondContact O-CB 3.4Å; L168-L171 PolarHBondContact O-N 3.15Å; L168-T172 PolarHBondContact O-N 3.21Å; L168-T172 PolarHBondContact O-OG1 3.19Å
169Q92.6Very high87.9Confident122 Ų12259.2 Ų59.257%0.5731%0.309SS*.Hα-helixtrans-60.4-37.6174.8-179.3-179.9-5.400111.3I165 V166 T172I165-Q169 WeakPolarHBondContact O-CB 3.09Å; I165-Q169 PolarHBondContact O-N 2.88Å; V166-Q169 WeakPolarHBondContact O-CB 3.41Å; V166-Q169 PolarHBondContact O-N 2.9Å; Q169-T172 PolarHBondContact O-N 3.21Å
170L90.9Very high88.6Confident2 Ų254.1 Ų54.11%0.0128%0.282CS..Hα-helixtrans-58.5-49.6174.5-164.249.5000110.3D68 C71 L75 L129 F133 V166 G167 L168 T172 S173 M177D68-L170 HydrophobicContact CB-CD1 4.29Å; C71-L170 HydrophobicContact CB-CD1 3.9Å; L75-L170 HydrophobicContact CD1-CD2 3.8Å; L129-L170 HydrophobicContact CD2-CD1 3.83Å; L129-L170 HydrophobicContact CD2-CD2 3.79Å; L129-L170 HydrophobicContact CD2-CG 4.12Å; F133-L170 HydrophobicContact CE1-CD2 4.2Å; F133-L170 HydrophobicContact CE2-CD2 3.97Å; F133-L170 HydrophobicContact CE2-CG 4.27Å; F133-L170 HydrophobicContact CZ-CB 4Å; F133-L170 HydrophobicContact CZ-CD2 3.58Å; F133-L170 HydrophobicContact CZ-CG 3.72Å; V166-L170 PolarHBondContact O-N 3.49Å; G167-L170 WeakPolarHBondContact O-CB 3.33Å; G167-L170 PolarHBondContact O-N 3.3Å; L168-L170 PolarHBondContact O-N 3.32Å; L170-T172 PolarHBondContact O-N 3.26Å; L170-T172 VanDerWaalsContact O-N 3.1Å; L170-S173 WeakPolarHBondContact O-CB 3.32Å; L170-S173 PolarHBondContact O-N 3.29Å; L170-M177 HydrophobicContact CB-SD 4.4Å; L170-M177 HydrophobicContact CD1-CE 4.47Å; L170-M177 HydrophobicContact CD1-SD 3.86Å; L170-M177 HydrophobicContact CG-SD 3.66Å
171L90.6Very high89.1Confident60 Ų6053 Ų5331%0.31428%0.279SS..Hα-helixtrans-54.1-34.2179.2-71.1172.9000114.3F133 G167 L168 S173 A181F133-L171 HydrophobicContact CE1-CD2 4.27Å; F133-L171 HydrophobicContact CE1-CG 4.32Å; F133-L171 HydrophobicContact CZ-CD2 4.06Å; F133-L171 HydrophobicContact CZ-CG 4.33Å; G167-L171 PolarHBondContact O-N 3.1Å; L168-L171 HydrophobicContact CD1-CD1 4.22Å; L168-L171 WeakPolarHBondContact O-CB 3.4Å; L168-L171 PolarHBondContact O-N 3.15Å; L171-S173 PolarHBondContact O-N 3.38Å; L171-A181 HydrophobicContact CD2-CB 3.31Å
172T89.1Confident89.5Confident119 Ų11954 Ų5473%0.7328%0.282SS*.THydrogen-bonded Turntrans-74.7-7.6179.6-49.10000113.1L168 Q169 L170L168-T172 PolarHBondContact O-N 3.21Å; L168-T172 PolarHBondContact O-OG1 3.19Å; Q169-T172 PolarHBondContact O-N 3.21Å; L170-T172 PolarHBondContact O-N 3.26Å; L170-T172 VanDerWaalsContact O-N 3.1Å
173S86.9Confident89.8Confident25 Ų2549.9 Ų49.918%0.17526%0.26CS..THydrogen-bonded Turntrans-70.4-37.2-174.7-176.20000113.5K67 D68 L170 L171K67-S173 WeakPolarHBondContact CD-OG 3.19Å; K67-S173 WeakPolarHBondContact CE-OG 3.39Å; K67-S173 PolarHBondContact NZ-O 3.24Å; K67-S173 PolarHBondContact NZ-OG 3.43Å; D68-S173 WeakPolarHBondContact OD1-CB 3.36Å; D68-S173 PolarHBondContact OD1-OG 3.08Å; D68-S173 PolarHBondContact OD2-OG 2.89Å; L170-S173 WeakPolarHBondContact O-CB 3.32Å; L170-S173 PolarHBondContact O-N 3.29Å; L171-S173 PolarHBondContact O-N 3.38Å
174S85.8Confident90Very high29 Ų2949.8 Ų49.820%0.20326%0.259CS..  trans-144145.8-178.5165.70000111.5P125 F176 M177P125-S174 WeakPolarHBondContact CG-OG 3.38Å; S174-F176 PolarHBondContact O-N 3.38Å; S174-M177 WeakPolarHBondContact O-CB 3.48Å; S174-M177 PolarHBondContact O-N 2.88Å; S174-M177 VanDerWaalsContact O-N 3.11Å
175P84.5Confident90.2Very high101 Ų10149.8 Ų49.866%0.65626%0.264SS*.THydrogen-bonded Turntrans-61.1-25-17925.4-36.6000114.2W178P175-W178 PolarHBondContact O-NE1 3.27Å; P175-W178 VanDerWaalsContact O-NE1 3.13Å
176F86.1Confident90.3Very high70 Ų7049 Ų4931%0.30726%0.261SS..THydrogen-bonded Turntrans-100.42.1179.1-60.4-66.8000113.4V121 S174 W178 L179V121-F176 HydrophobicContact CG1-CD1 3.86Å; V121-F176 HydrophobicContact CG1-CD2 4.39Å; V121-F176 HydrophobicContact CG1-CE1 4.11Å; V121-F176 HydrophobicContact CG1-CG 4.01Å; V121-F176 HydrophobicContact CG1-CZ 4.49Å; S174-F176 PolarHBondContact O-N 3.38Å; F176-W178 PolarHBondContact O-N 2.88Å; F176-L179 HydrophobicContact CD1-CD1 4.21Å; F176-L179 WeakPolarHBondContact O-CB 3.39Å; F176-L179 PolarHBondContact O-N 2.74Å
177M88.9Confident90.3Very high0 Ų048 Ų480%025%0.254CS..Hα-helixtrans-67-25.8-177-163.2166.4-60.700113.1D68 P125 L129 F133 L170 S174 L179 L180 A181D68-M177 WeakPolarHBondContact OD2-CE 3.46Å; P125-M177 HydrophobicContact CB-CE 3.98Å; P125-M177 HydrophobicContact CG-CB 4.29Å; P125-M177 HydrophobicContact CG-CE 4.1Å; L129-M177 HydrophobicContact CD1-CE 4.14Å; F133-M177 HydrophobicContact CE2-CG 4.3Å; L170-M177 HydrophobicContact CB-SD 4.4Å; L170-M177 HydrophobicContact CD1-CE 4.47Å; L170-M177 HydrophobicContact CD1-SD 3.86Å; L170-M177 HydrophobicContact CG-SD 3.66Å; S174-M177 WeakPolarHBondContact O-CB 3.48Å; S174-M177 PolarHBondContact O-N 2.88Å; S174-M177 VanDerWaalsContact O-N 3.11Å; M177-L179 VanDerWaalsContact C-N 3.29Å; M177-L179 PolarHBondContact O-N 2.8Å; M177-L180 PolarHBondContact O-N 3.26Å; M177-A181 WeakPolarHBondContact O-CB 3.27Å; M177-A181 PolarHBondContact O-N 3.16Å
178W88.9Confident90.2Very high121 Ų12147.7 Ų47.746%0.45825%0.251SS..Hα-helixtrans-63.4-33.2175.471-88.3000112.7F113 P175 F176 A181 L182F113-W178 HydrophobicContact CE2-CH2 4.37Å; F113-W178 HydrophobicContact CE2-CZ2 4.12Å; P175-W178 PolarHBondContact O-NE1 3.27Å; P175-W178 VanDerWaalsContact O-NE1 3.13Å; F176-W178 PolarHBondContact O-N 2.88Å; W178-A181 PolarHBondContact O-N 3.36Å; W178-L182 VanDerWaalsContact O-CB 3.26Å; W178-L182 WeakPolarHBondContact O-CB 3.45Å; W178-L182 PolarHBondContact O-N 2.82Å
179L89.7Confident90.1Very high6 Ų643.9 Ų43.93%0.03124%0.238CC..Hα-helixtrans-63.2-46174.7-72.6170.5000110.3L109 V121 F176 M177 A181 L182 S183L109-L179 HydrophobicContact CD2-CD2 3.87Å; V121-L179 HydrophobicContact CG2-CD1 4.35Å; F176-L179 HydrophobicContact CD1-CD1 4.21Å; F176-L179 WeakPolarHBondContact O-CB 3.39Å; F176-L179 PolarHBondContact O-N 2.74Å; M177-L179 VanDerWaalsContact C-N 3.29Å; M177-L179 PolarHBondContact O-N 2.8Å; L179-A181 VanDerWaalsContact C-N 3.31Å; L179-A181 PolarHBondContact O-N 2.98Å; L179-L182 PolarHBondContact O-N 3.48Å; L179-S183 WeakPolarHBondContact O-CB 3.43Å; L179-S183 PolarHBondContact O-N 2.91Å; L179-S183 PolarHBondContact O-OG 3.4Å
180L90.1Very high89.9Confident2 Ų240.5 Ų40.51%0.0122%0.224CC..Hα-helixtrans-67.1-32.7179.4-143.176.4000112.4L124 P125 L129 A130 M177 S183 G184L124-L180 HydrophobicContact CB-CD1 4.42Å; L124-L180 HydrophobicContact CD2-CD1 3.71Å; P125-L180 WeakPolarHBondContact O-CD2 2.97Å; L129-L180 HydrophobicContact CB-CD2 3.66Å; L129-L180 HydrophobicContact CD1-CD2 3.97Å; L129-L180 HydrophobicContact CG-CD2 4.44Å; A130-L180 HydrophobicContact CB-CG 4.15Å; M177-L180 PolarHBondContact O-N 3.26Å; L180-S183 WeakPolarHBondContact CA-OG 3.27Å; L180-S183 PolarHBondContact O-OG 3.18Å; L180-G184 PolarHBondContact O-N 3.13Å; L180-G184 VanDerWaalsContact O-N 3.07Å
181A92.8Very high89.6Confident6 Ų641.4 Ų41.45%0.0523%0.227CC..Hα-helixtrans-72.6-42.2173.600000111.9F133 L171 M177 W178 L179 S183 G184 L185F133-A181 HydrophobicContact CD1-CB 3.9Å; F133-A181 HydrophobicContact CD2-CB 3.8Å; F133-A181 HydrophobicContact CE1-CB 3.96Å; F133-A181 HydrophobicContact CE2-CB 3.86Å; F133-A181 HydrophobicContact CG-CB 3.83Å; F133-A181 HydrophobicContact CZ-CB 3.93Å; L171-A181 HydrophobicContact CD2-CB 3.31Å; M177-A181 WeakPolarHBondContact O-CB 3.27Å; M177-A181 PolarHBondContact O-N 3.16Å; W178-A181 PolarHBondContact O-N 3.36Å; L179-A181 VanDerWaalsContact C-N 3.31Å; L179-A181 PolarHBondContact O-N 2.98Å; A181-S183 VanDerWaalsContact C-N 3.35Å; A181-G184 PolarHBondContact O-N 3.2Å; A181-L185 WeakPolarHBondContact O-CB 3.26Å; A181-L185 VanDerWaalsContact O-CG 3.26Å; A181-L185 WeakPolarHBondContact O-CG 3.22Å; A181-L185 PolarHBondContact O-N 2.89Å
182L92.8Very high89.2Confident67 Ų6743.6 Ų43.635%0.35124%0.236SC..Hα-helixtrans-64.7-41.4177.3-172.6145.9000110.7L109 W178 L179 L185 I186L109-L182 HydrophobicContact CD1-CD2 3.52Å; L109-L182 HydrophobicContact CD2-CD2 3.67Å; L109-L182 HydrophobicContact CG-CD2 4.18Å; W178-L182 VanDerWaalsContact O-CB 3.26Å; W178-L182 WeakPolarHBondContact O-CB 3.45Å; W178-L182 PolarHBondContact O-N 2.82Å; L179-L182 PolarHBondContact O-N 3.48Å; L182-L185 PolarHBondContact O-N 2.98Å; L182-I186 HydrophobicContact CD2-CD1 3.4Å; L182-I186 VanDerWaalsContact CD2-CD1 3.4Å; L182-I186 HydrophobicContact CD2-CG1 4.28Å; L182-I186 HydrophobicContact CG-CD1 4.26Å; L182-I186 WeakPolarHBondContact O-CB 3.31Å; L182-I186 VanDerWaalsContact O-CG1 3.27Å; L182-I186 WeakPolarHBondContact O-CG1 3.28Å; L182-I186 PolarHBondContact O-N 3.23Å
183S92.3Very high88.6Confident0 Ų041.6 Ų41.60%023%0.227CC..Hα-helixtrans-63.8-42174.1720000112.6D106 L179 L180 A181 I186 S187D106-S183 WeakPolarHBondContact OD1-CB 3.33Å; D106-S183 PolarHBondContact OD1-OG 3.39Å; L179-S183 WeakPolarHBondContact O-CB 3.43Å; L179-S183 PolarHBondContact O-N 2.91Å; L179-S183 PolarHBondContact O-OG 3.4Å; L180-S183 WeakPolarHBondContact CA-OG 3.27Å; L180-S183 PolarHBondContact O-OG 3.18Å; A181-S183 VanDerWaalsContact C-N 3.35Å; S183-I186 PolarHBondContact O-N 2.86Å; S183-S187 WeakPolarHBondContact O-CB 3.42Å; S183-S187 PolarHBondContact O-N 3.3Å
184G92.9Very high88Confident0 Ų043.8 Ų43.80%024%0.236CC..Hα-helixtrans-60.3-46.5174.400000112.4A130 S134 L180 A181 S187 G188A130-G184 VanDerWaalsContact O-CA 3.23Å; A130-G184 WeakPolarHBondContact O-CA 3.34Å; S134-G184 WeakPolarHBondContact CA-O 3.45Å; S134-G184 VanDerWaalsContact CB-O 3.23Å; S134-G184 WeakPolarHBondContact CB-O 3.31Å; S134-G184 PolarHBondContact OG-O 2.94Å; L180-G184 PolarHBondContact O-N 3.13Å; L180-G184 VanDerWaalsContact O-N 3.07Å; A181-G184 PolarHBondContact O-N 3.2Å; G184-S187 PolarHBondContact O-N 2.88Å; G184-G188 PolarHBondContact O-N 3.11Å
185L93.9Very high86.3Confident81 Ų8144 Ų4442%0.42424%0.239SC..Hα-helixtrans-65.7-43.8178.2-71.8173.9000112.3F136 V137 A181 L182 G188 G189F136-L185 HydrophobicContact CB-CD2 4.14Å; V137-L185 HydrophobicContact CG2-CD2 3.95Å; A181-L185 WeakPolarHBondContact O-CB 3.26Å; A181-L185 VanDerWaalsContact O-CG 3.26Å; A181-L185 WeakPolarHBondContact O-CG 3.22Å; A181-L185 PolarHBondContact O-N 2.89Å; L182-L185 PolarHBondContact O-N 2.98Å; L185-G188 PolarHBondContact O-N 3.06Å; L185-G189 PolarHBondContact O-N 3.46Å
186I93.2Very high84.7Confident82 Ų8245.8 Ų45.842%0.42124%0.243SC..Hα-helixtrans-61.2-46.4174.6-70.7174.9000110.1V105 L109 L182 S183 G188 G189 L190V105-I186 HydrophobicContact CG1-CB 4.22Å; V105-I186 HydrophobicContact CG1-CG2 4.1Å; V105-I186 HydrophobicContact CG2-CG2 4.27Å; L109-I186 HydrophobicContact CD1-CD1 4.47Å; L182-I186 HydrophobicContact CD2-CD1 3.4Å; L182-I186 VanDerWaalsContact CD2-CD1 3.4Å; L182-I186 HydrophobicContact CD2-CG1 4.28Å; L182-I186 HydrophobicContact CG-CD1 4.26Å; L182-I186 WeakPolarHBondContact O-CB 3.31Å; L182-I186 VanDerWaalsContact O-CG1 3.27Å; L182-I186 WeakPolarHBondContact O-CG1 3.28Å; L182-I186 PolarHBondContact O-N 3.23Å; S183-I186 PolarHBondContact O-N 2.86Å; I186-G188 VanDerWaalsContact C-N 3.34Å; I186-G188 PolarHBondContact O-N 3.35Å; I186-G189 PolarHBondContact O-N 2.94Å; I186-L190 VanDerWaalsContact O-CB 3.31Å; I186-L190 WeakPolarHBondContact O-CB 3.26Å; I186-L190 PolarHBondContact O-N 3.43Å
187S91.4Very high83.4Confident0 Ų050.9 Ų50.90%026%0.26CS..Hα-helixtrans-58.8-43.8176.9172.30000111.9T98 L101 S102 S183 G184 L190 Y191T98-S187 PolarHBondContact O-OG 3.19Å; L101-S187 WeakPolarHBondContact CB-OG 3.47Å; L101-S187 WeakPolarHBondContact CD2-O 3.19Å; S102-S187 PolarHBondContact N-OG 3.31Å; S183-S187 WeakPolarHBondContact O-CB 3.42Å; S183-S187 PolarHBondContact O-N 3.3Å; G184-S187 PolarHBondContact O-N 2.88Å; S187-L190 PolarHBondContact O-N 2.79Å; S187-Y191 WeakPolarHBondContact O-CB 3.43Å; S187-Y191 PolarHBondContact O-N 3.43Å
188G89.7Confident81.8Confident0 Ų051.5 Ų51.50%026%0.263CS..Hα-helixtrans-65.7-40.9175.900000113.2S134 G184 L185 I186 Y191 H192S134-G188 WeakPolarHBondContact OG-CA 3.4Å; S134-G188 PolarHBondContact OG-N 3.49Å; S134-G188 VanDerWaalsContact OG-N 3.11Å; G184-G188 PolarHBondContact O-N 3.11Å; L185-G188 PolarHBondContact O-N 3.06Å; I186-G188 VanDerWaalsContact C-N 3.34Å; I186-G188 PolarHBondContact O-N 3.35Å; G188-Y191 PolarHBondContact O-N 3.17Å; G188-H192 WeakPolarHBondContact O-CB 3.26Å; G188-H192 PolarHBondContact O-N 3.34Å
189G88.8Confident80.5Confident28 Ų2849.3 Ų49.329%0.28926%0.258SS..Hα-helixtrans-62.4-43.6174.400000112.1L185 I186 H192 S193L185-G189 PolarHBondContact O-N 3.46Å; I186-G189 PolarHBondContact O-N 2.94Å; G189-H192 PolarHBondContact O-N 3.31Å; G189-S193 PolarHBondContact O-N 3.43Å; G189-S193 PolarHBondContact O-OG 3.21Å
190L87.8Confident78.9Confident52 Ų5255.9 Ų55.927%0.27229%0.287SS..Hα-helixtrans-68.9-36.9179.6-164.374.2000112.1L101 I186 S187 H192 S193 N194 A195 L198L101-L190 HydrophobicContact CD1-CD2 3.76Å; L101-L190 HydrophobicContact CD2-CB 3.99Å; L101-L190 HydrophobicContact CD2-CD2 3.79Å; L101-L190 HydrophobicContact CD2-CG 4.27Å; L101-L190 HydrophobicContact CG-CD2 4.22Å; I186-L190 VanDerWaalsContact O-CB 3.31Å; I186-L190 WeakPolarHBondContact O-CB 3.26Å; I186-L190 PolarHBondContact O-N 3.43Å; S187-L190 PolarHBondContact O-N 2.79Å; L190-H192 VanDerWaalsContact C-N 3.33Å; L190-S193 WeakPolarHBondContact CA-OG 3.13Å; L190-S193 PolarHBondContact O-OG 3.02Å; L190-S193 VanDerWaalsContact O-OG 3.12Å; L190-N194 PolarHBondContact O-N 2.93Å; L190-A195 HydrophobicContact CD1-CB 3.38Å; L190-A195 HydrophobicContact CG-CB 3.9Å; L190-A195 PolarHBondContact O-N 2.87Å; L190-L198 HydrophobicContact CD2-CD1 4.33Å
191Y85.1Confident77.3Confident21 Ų2161 Ų618%0.08232%0.317CS..Hα-helixtrans-64.8-38.2171.5-172.2-80.2000111.7F94 T98 S187 G188 N194 Q199F94-Y191 AromaticContact CD2-CD1 3.45Å; F94-Y191 HydrophobicContact CD2-CD1 3.45Å; F94-Y191 VanDerWaalsContact CD2-CD1 3.45Å; F94-Y191 HydrophobicContact CD2-CD2 4.46Å; F94-Y191 AromaticContact CD2-CE1 3.41Å; F94-Y191 HydrophobicContact CD2-CE1 3.41Å; F94-Y191 VanDerWaalsContact CD2-CE1 3.41Å; F94-Y191 HydrophobicContact CD2-CE2 4.4Å; F94-Y191 HydrophobicContact CD2-CG 4.02Å; F94-Y191 AromaticContact CD2-CZ 3.88Å; F94-Y191 AromaticContact CE2-CD1 3.58Å; F94-Y191 HydrophobicContact CE2-CD1 3.58Å; F94-Y191 HydrophobicContact CE2-CE1 4.04Å; F94-Y191 HydrophobicContact CE2-CG 4.02Å; F94-Y191 HydrophobicContact CG-CE1 4.45Å; T98-Y191 HydrophobicContact CG2-CD2 4.42Å; T98-Y191 HydrophobicContact CG2-CG 4.38Å; S187-Y191 WeakPolarHBondContact O-CB 3.43Å; S187-Y191 PolarHBondContact O-N 3.43Å; G188-Y191 PolarHBondContact O-N 3.17Å; Y191-N194 PolarHBondContact O-N 3.33Å; Y191-Q199 HydrophobicContact CE1-CG 4Å; Y191-Q199 HydrophobicContact CE2-CG 4.42Å; Y191-Q199 PolarHBondContact O-NE2 3.46Å
192H81.9Confident75.7Confident106 Ų10663.3 Ų63.349%0.49133%0.327SS..Hα-helixtrans-71.9-41.8179.1-173.879000112.9V137 Q141 G188 G189 L190 N194V137-H192 HydrophobicContact CG1-CB 4.49Å; Q141-H192 PolarHBondContact NE2-CD2 3.26Å; Q141-H192 VanDerWaalsContact NE2-CD2 3.33Å; Q141-H192 PolarHBondContact NE2-NE2 3.1Å; Q141-H192 PolarHBondContact OE1-CD2 3.01Å; Q141-H192 PolarHBondContact OE1-CE1 2.89Å; Q141-H192 VanDerWaalsContact OE1-CG 3.31Å; Q141-H192 PolarHBondContact OE1-ND1 2.76Å; Q141-H192 PolarHBondContact OE1-NE2 2.69Å; G188-H192 WeakPolarHBondContact O-CB 3.26Å; G188-H192 PolarHBondContact O-N 3.34Å; G189-H192 PolarHBondContact O-N 3.31Å; L190-H192 VanDerWaalsContact C-N 3.33Å; H192-N194 PolarHBondContact O-N 3.45Å; H192-N194 VanDerWaalsContact O-N 3.11Å
193S77.9Confident74.2Confident77 Ų7766 Ų6654%0.53834%0.336SS..THydrogen-bonded Turntrans-68.5-5.9176.764.60000113.2G189 L190 A195G189-S193 PolarHBondContact O-N 3.43Å; G189-S193 PolarHBondContact O-OG 3.21Å; L190-S193 WeakPolarHBondContact CA-OG 3.13Å; L190-S193 PolarHBondContact O-OG 3.02Å; L190-S193 VanDerWaalsContact O-OG 3.12Å; S193-A195 PolarHBondContact O-N 3.27Å; S193-A195 VanDerWaalsContact O-N 3.08Å
194N72.8Confident72.7Confident70 Ų7066.8 Ų66.837%0.37434%0.341SS..THydrogen-bonded Turntrans54.925.2-178-142.48.8000112.4L190 Y191 H192 L196 W197 Q199L190-N194 PolarHBondContact O-N 2.93Å; Y191-N194 PolarHBondContact O-N 3.33Å; H192-N194 PolarHBondContact O-N 3.45Å; H192-N194 VanDerWaalsContact O-N 3.11Å; N194-L196 PolarHBondContact O-N 2.6Å; N194-W197 PolarHBondContact O-N 3.21Å; N194-Q199 PolarHBondContact ND2-OE1 2.85Å; N194-Q199 WeakPolarHBondContact OD1-CB 3.3Å; N194-Q199 WeakPolarHBondContact OD1-CG 3.41Å
195A50Low71.2Confident33 Ų3370.7 Ų70.727%0.27337%0.366SS..G310 helixtrans-54.6136.7172.500000107.7L190 S193 W197 L198L190-A195 HydrophobicContact CD1-CB 3.38Å; L190-A195 HydrophobicContact CG-CB 3.9Å; L190-A195 PolarHBondContact O-N 2.87Å; S193-A195 PolarHBondContact O-N 3.27Å; S193-A195 VanDerWaalsContact O-N 3.08Å; A195-W197 PolarHBondContact O-N 3.28Å; A195-L198 VanDerWaalsContact O-CD1 3.27Å; A195-L198 WeakPolarHBondContact O-CD1 3.16Å
196L52.6Low69.5Low139 Ų13971.4 Ų71.473%0.72837%0.373SS*.G310 helixtrans67.716.3-179.9-50.2168.2000117.5N194 L198N194-L196 PolarHBondContact O-N 2.6Å; L196-L198 HydrophobicContact CB-CD1 4.05Å; L196-L198 HydrophobicContact CB-CG 4.14Å; L196-L198 HydrophobicContact CD1-CD1 4.12Å; L196-L198 PolarHBondContact O-N 2.85Å
197W57.5Low67.7Low178 Ų17876.7 Ų76.767%0.67439%0.388SS*.G310 helixtrans55.226.6-177.9-72.737.2000112.5N194 A195 Q199 K200 V201N194-W197 PolarHBondContact O-N 3.21Å; A195-W197 PolarHBondContact O-N 3.28Å; W197-Q199 PolarHBondContact O-N 2.93Å; W197-Q199 VanDerWaalsContact O-N 3.08Å; W197-K200 HydrophobicContact CD2-CD 4.42Å; W197-K200 HydrophobicContact CE3-CD 3.53Å; W197-K200 HydrophobicContact CZ3-CD 3.84Å; W197-K200 PolarHBondContact O-N 2.99Å; W197-V201 PolarHBondContact O-N 3.36Å
198L56.5Low66.4Low12 Ų1279.6 Ų79.66%0.06341%0.406CS..Hα-helixtrans-54.6-32.7-174.3-95.6153.6000112.3L101 L190 A195 L196 K200 V201 F202L101-L198 HydrophobicContact CD1-CD1 4.36Å; L101-L198 HydrophobicContact CD2-CD1 4.13Å; L190-L198 HydrophobicContact CD2-CD1 4.33Å; A195-L198 VanDerWaalsContact O-CD1 3.27Å; A195-L198 WeakPolarHBondContact O-CD1 3.16Å; L196-L198 HydrophobicContact CB-CD1 4.05Å; L196-L198 HydrophobicContact CB-CG 4.14Å; L196-L198 HydrophobicContact CD1-CD1 4.12Å; L196-L198 PolarHBondContact O-N 2.85Å; L198-K200 VanDerWaalsContact C-N 3.26Å; L198-K200 PolarHBondContact O-N 2.89Å; L198-V201 PolarHBondContact O-N 2.71Å; L198-F202 HydrophobicContact CD2-CD2 3.56Å; L198-F202 HydrophobicContact CD2-CE2 3.83Å; L198-F202 HydrophobicContact CD2-CG 4.48Å; L198-F202 WeakPolarHBondContact O-CB 3.49Å; L198-F202 PolarHBondContact O-N 3.28Å
199Q60.2Low64.9Low75 Ų7580.4 Ų80.435%0.3541%0.412SS..Hα-helixtrans-64.3-27176.1-66.7177.310.500113.8Y191 N194 W197Y191-Q199 HydrophobicContact CE1-CG 4Å; Y191-Q199 HydrophobicContact CE2-CG 4.42Å; Y191-Q199 PolarHBondContact O-NE2 3.46Å; N194-Q199 PolarHBondContact ND2-OE1 2.85Å; N194-Q199 WeakPolarHBondContact OD1-CB 3.3Å; N194-Q199 WeakPolarHBondContact OD1-CG 3.41Å; W197-Q199 PolarHBondContact O-N 2.93Å; W197-Q199 VanDerWaalsContact O-N 3.08Å
200K56.5Low63.4Low145 Ų14581 Ų8163%0.6341%0.411SS*.Hα-helixtrans-86.9-36.7174.6-81179.3177.4177.40112.2W197 L198W197-K200 HydrophobicContact CD2-CD 4.42Å; W197-K200 HydrophobicContact CE3-CD 3.53Å; W197-K200 HydrophobicContact CZ3-CD 3.84Å; W197-K200 PolarHBondContact O-N 2.99Å; L198-K200 VanDerWaalsContact C-N 3.26Å; L198-K200 PolarHBondContact O-N 2.89Å
201V56.8Low61.8Low108 Ų10880.7 Ų80.766%0.65541%0.411SS*.Hα-helixtrans-75.7-40.3-178177.90000112W197 L198 F203W197-V201 PolarHBondContact O-N 3.36Å; L198-V201 PolarHBondContact O-N 2.71Å; V201-F203 VanDerWaalsContact C-N 3.34Å
202F59.2Low60.6Low56 Ų5680.9 Ų80.925%0.24642%0.419CS..SBendtrans-94.716.1179.7-85.1-95.6000113.6S93 F100 L198 V204S93-F202 WeakPolarHBondContact CB-O 3.38Å; F100-F202 HydrophobicContact CB-CE1 3.61Å; F100-F202 HydrophobicContact CB-CZ 3.84Å; F100-F202 AromaticContact CD1-CE1 3.95Å; F100-F202 HydrophobicContact CD1-CE1 3.95Å; F100-F202 HydrophobicContact CD1-CE2 4.02Å; F100-F202 AromaticContact CD1-CZ 3.22Å; F100-F202 HydrophobicContact CD1-CZ 3.22Å; F100-F202 HydrophobicContact CD2-CZ 4.4Å; F100-F202 HydrophobicContact CE1-CE2 4.42Å; F100-F202 AromaticContact CE1-CZ 3.79Å; F100-F202 HydrophobicContact CE1-CZ 3.79Å; F100-F202 AromaticContact CG-CE1 3.82Å; F100-F202 HydrophobicContact CG-CE1 3.82Å; F100-F202 AromaticContact CG-CZ 3.56Å; F100-F202 HydrophobicContact CG-CZ 3.56Å; L198-F202 HydrophobicContact CD2-CD2 3.56Å; L198-F202 HydrophobicContact CD2-CE2 3.83Å; L198-F202 HydrophobicContact CD2-CG 4.48Å; L198-F202 WeakPolarHBondContact O-CB 3.49Å; L198-F202 PolarHBondContact O-N 3.28Å; F202-V204 PolarHBondContact O-N 3Å; F202-V204 VanDerWaalsContact O-N 3.08Å
203F61.6Low59.6Low124 Ų12480.9 Ų80.954%0.54442%0.418SS..  trans-64.7115.5172.7-163.2-95000108.8V201 P205V201-F203 VanDerWaalsContact C-N 3.34Å; F203-P205 WeakPolarHBondContact O-CD 3.49Å; F203-P205 VanDerWaalsContact O-N 3.14Å
204V60.5Low58.6Low16 Ų1686.4 Ų86.410%0.09743%0.428CS..  trans-56.6121-176.5170.60000109S93 L96 F202 V208S93-V204 VanDerWaalsContact CA-CG2 3.41Å; L96-V204 HydrophobicContact CD1-CG2 3.68Å; F202-V204 PolarHBondContact O-N 3Å; F202-V204 VanDerWaalsContact O-N 3.08Å; V204-V208 HydrophobicContact CG1-CB 3.51Å; V204-V208 HydrophobicContact CG1-CG1 3.57Å; V204-V208 HydrophobicContact CG1-CG2 4.42Å
205P60.4Low57.9Low82 Ų8288.1 Ų88.153%0.53244%0.436SS..  trans-55.2144.5179.8-24.332000110.4F203 W207 V208 S209F203-P205 WeakPolarHBondContact O-CD 3.49Å; F203-P205 VanDerWaalsContact O-N 3.14Å; P205-W207 PolarHBondContact O-N 3.26Å; P205-V208 PolarHBondContact O-N 2.98Å; P205-S209 PolarHBondContact O-N 3.27Å
206V59.8Low58.2Low96 Ų9688.1 Ų88.158%0.58243%0.432SS*.Hα-helixtrans-53.9-29.7-178.6-177.30000111.5S209 S210V206-S209 WeakPolarHBondContact O-CB 3.38Å; V206-S209 PolarHBondContact O-N 3.42Å; V206-S209 PolarHBondContact O-OG 2.83Å; V206-S210 PolarHBondContact O-N 3.37Å; V206-S210 PolarHBondContact O-OG 2.86Å
207W54.9Low58.7Low192 Ų19286.9 Ų86.973%0.72742%0.422SS*.Hα-helixtrans-60.8-46.2174.8-172.479.5000113.4P205 S209 S210 V211P205-W207 PolarHBondContact O-N 3.26Å; W207-S209 VanDerWaalsContact C-N 3.27Å; W207-S209 PolarHBondContact O-N 3.42Å; W207-S210 CarbonylContact O-C 3.55Å; W207-S210 WeakPolarHBondContact O-CA 3.38Å; W207-S210 VanDerWaalsContact O-CB 3.31Å; W207-S210 WeakPolarHBondContact O-CB 3.36Å; W207-S210 PolarHBondContact O-N 3.39Å; W207-V211 HydrophobicContact CD2-CG2 3.93Å; W207-V211 HydrophobicContact CE3-CG2 4.06Å; W207-V211 HydrophobicContact CH2-CG2 3.89Å; W207-V211 HydrophobicContact CZ2-CG2 3.75Å; W207-V211 HydrophobicContact CZ3-CG2 4.04Å; W207-V211 WeakPolarHBondContact O-CG2 3.5Å; W207-V211 PolarHBondContact O-N 3.3Å
208V63.7Low58.7Low61 Ų6183.3 Ų83.337%0.3742%0.422SS..Hα-helixtrans-65.9-33.6176.8176.70000110.9V204 P205 S210 G212V204-V208 HydrophobicContact CG1-CB 3.51Å; V204-V208 HydrophobicContact CG1-CG1 3.57Å; V204-V208 HydrophobicContact CG1-CG2 4.42Å; P205-V208 PolarHBondContact O-N 2.98Å; V208-S210 PolarHBondContact O-N 3.37Å; V208-G212 PolarHBondContact O-N 3.32Å
209S58.2Low58.7Low18 Ų1888.4 Ų88.413%0.12645%0.449CS..Hα-helixtrans-66.7-26.9171.489.80000112.9R89 P205 V206 W207 K213R89-S209 VanDerWaalsContact CZ-OG 3.32Å; R89-S209 PolarHBondContact NE-OG 3.24Å; R89-S209 PolarHBondContact NH2-OG 2.97Å; P205-S209 PolarHBondContact O-N 3.27Å; V206-S209 WeakPolarHBondContact O-CB 3.38Å; V206-S209 PolarHBondContact O-N 3.42Å; V206-S209 PolarHBondContact O-OG 2.83Å; W207-S209 VanDerWaalsContact C-N 3.27Å; W207-S209 PolarHBondContact O-N 3.42Å; S209-K213 WeakPolarHBondContact O-CG 3.48Å; S209-K213 PolarHBondContact O-N 3.14Å; S209-K213 VanDerWaalsContact O-N 3.14Å
210S57.1Low58.7Low39 Ų3985.6 Ų85.627%0.27344%0.435SS..Hα-helixtrans-80.9-44.5178.6-53.40000110V206 W207 V208 G212 K213 Y214V206-S210 PolarHBondContact O-N 3.37Å; V206-S210 PolarHBondContact O-OG 2.86Å; W207-S210 CarbonylContact O-C 3.55Å; W207-S210 WeakPolarHBondContact O-CA 3.38Å; W207-S210 VanDerWaalsContact O-CB 3.31Å; W207-S210 WeakPolarHBondContact O-CB 3.36Å; W207-S210 PolarHBondContact O-N 3.39Å; V208-S210 PolarHBondContact O-N 3.37Å; S210-G212 VanDerWaalsContact C-N 3.3Å; S210-G212 PolarHBondContact O-N 2.81Å; S210-K213 WeakPolarHBondContact O-CA 2.98Å; S210-K213 WeakPolarHBondContact O-CB 3.2Å; S210-K213 PolarHBondContact O-N 3.33Å; S210-K213 VanDerWaalsContact O-N 3.08Å; S210-Y214 WeakPolarHBondContact O-CD2 3.49Å; S210-Y214 PolarHBondContact O-N 3.43Å
211V55.8Low58.4Low47 Ų4782.8 Ų82.829%0.28543%0.434SS..Hα-helixtrans-59.2-42.9171.2175.50000110.8W207 K213 Y214 I215W207-V211 HydrophobicContact CD2-CG2 3.93Å; W207-V211 HydrophobicContact CE3-CG2 4.06Å; W207-V211 HydrophobicContact CH2-CG2 3.89Å; W207-V211 HydrophobicContact CZ2-CG2 3.75Å; W207-V211 HydrophobicContact CZ3-CG2 4.04Å; W207-V211 WeakPolarHBondContact O-CG2 3.5Å; W207-V211 PolarHBondContact O-N 3.3Å; V211-K213 VanDerWaalsContact C-N 3.32Å; V211-K213 PolarHBondContact O-N 2.97Å; V211-Y214 PolarHBondContact O-N 3.37Å; V211-I215 HydrophobicContact CG1-CD1 3.53Å; V211-I215 HydrophobicContact CG1-CG1 4.23Å; V211-I215 WeakPolarHBondContact O-CB 3.02Å; V211-I215 WeakPolarHBondContact O-CG1 3.47Å; V211-I215 PolarHBondContact O-N 2.82Å
212G59.3Low58.2Low24 Ų2480 Ų8025%0.24742%0.419CS..Hα-helixtrans-60.8-37.9173.500000112.8V208 S210 L216V208-G212 PolarHBondContact O-N 3.32Å; S210-G212 VanDerWaalsContact C-N 3.3Å; S210-G212 PolarHBondContact O-N 2.81Å; G212-L216 WeakPolarHBondContact O-CA 3.39Å; G212-L216 WeakPolarHBondContact O-CB 3.39Å; G212-L216 WeakPolarHBondContact O-CD1 3.24Å; G212-L216 PolarHBondContact O-N 3.3Å
213K61.4Low57.8Low106 Ų10682.5 Ų82.546%0.46144%0.444SS..Hα-helixtrans-64.2-54.2170.6-76.9178.2178.1-164.50110.9S209 S210 V211 I215 L216 E217S209-K213 WeakPolarHBondContact O-CG 3.48Å; S209-K213 PolarHBondContact O-N 3.14Å; S209-K213 VanDerWaalsContact O-N 3.14Å; S210-K213 WeakPolarHBondContact O-CA 2.98Å; S210-K213 WeakPolarHBondContact O-CB 3.2Å; S210-K213 PolarHBondContact O-N 3.33Å; S210-K213 VanDerWaalsContact O-N 3.08Å; V211-K213 VanDerWaalsContact C-N 3.32Å; V211-K213 PolarHBondContact O-N 2.97Å; K213-I215 VanDerWaalsContact C-N 3.28Å; K213-I215 PolarHBondContact O-N 2.86Å; K213-L216 PolarHBondContact O-N 3.07Å; K213-E217 WeakPolarHBondContact O-CA 3.37Å; K213-E217 WeakPolarHBondContact O-CB 3.43Å; K213-E217 PolarHBondContact O-N 3.37Å
214Y56.6Low57.4Low193 Ų19381.6 Ų81.676%0.75744%0.441SS*.Hα-helixtrans-60.5-32.8-178.3-75.5-71.4000114.4S210 V211 P218S210-Y214 WeakPolarHBondContact O-CD2 3.49Å; S210-Y214 PolarHBondContact O-N 3.43Å; V211-Y214 PolarHBondContact O-N 3.37Å; Y214-P218 WeakPolarHBondContact O-CD 3.14Å; Y214-P218 WeakPolarHBondContact O-CG 3.43Å
215I56.5Low56.9Low106 Ų10683.1 Ų83.154%0.54445%0.451SS..Hα-helixtrans-87.3-44.1179.1-63.5176.3000111.8V211 K213V211-I215 HydrophobicContact CG1-CD1 3.53Å; V211-I215 HydrophobicContact CG1-CG1 4.23Å; V211-I215 WeakPolarHBondContact O-CB 3.02Å; V211-I215 WeakPolarHBondContact O-CG1 3.47Å; V211-I215 PolarHBondContact O-N 2.82Å; K213-I215 VanDerWaalsContact C-N 3.28Å; K213-I215 PolarHBondContact O-N 2.86Å
216L56.9Low56.4Low33 Ų3387.1 Ų87.117%0.17347%0.468CS..Hα-helixtrans-87.4-27.9-175.4-71.9101.1000114.3P14 L15 G212 K213 L219 F220P14-L216 WeakPolarHBondContact O-CD2 3.4Å; L15-L216 HydrophobicContact CD2-CD1 4.5Å; L15-L216 HydrophobicContact CD2-CD2 4.2Å; G212-L216 WeakPolarHBondContact O-CA 3.39Å; G212-L216 WeakPolarHBondContact O-CB 3.39Å; G212-L216 WeakPolarHBondContact O-CD1 3.24Å; G212-L216 PolarHBondContact O-N 3.3Å; K213-L216 PolarHBondContact O-N 3.07Å; L216-L219 PolarHBondContact O-N 2.94Å; L216-F220 HydrophobicContact CB-CD2 3.8Å; L216-F220 HydrophobicContact CD2-CD2 3.75Å; L216-F220 HydrophobicContact CD2-CE2 4.09Å; L216-F220 HydrophobicContact CG-CD2 3.78Å; L216-F220 HydrophobicContact CG-CE2 4.1Å; L216-F220 WeakPolarHBondContact O-CA 3.29Å; L216-F220 VanDerWaalsContact O-CB 3.25Å; L216-F220 WeakPolarHBondContact O-CB 3.2Å; L216-F220 PolarHBondContact O-N 2.89Å
217E63.2Low56Low114 Ų11489.7 Ų89.753%0.53348%0.479SS..Hα-helixtrans-64.4-42.9-178.8-163.9161.7-161.900112.9K213 S221K213-E217 WeakPolarHBondContact O-CA 3.37Å; K213-E217 WeakPolarHBondContact O-CB 3.43Å; K213-E217 PolarHBondContact O-N 3.37Å; E217-S221 WeakPolarHBondContact O-CB 3.33Å; E217-S221 PolarHBondContact O-N 3.5Å; E217-S221 PolarHBondContact O-OG 3.22Å
218P58Low55.7Low102 Ų10283.3 Ų83.366%0.66246%0.457SS*.Hα-helixtrans-75.1-32.9175.827.3-33.1000113.3Y214Y214-P218 WeakPolarHBondContact O-CD 3.14Å; Y214-P218 WeakPolarHBondContact O-CG 3.43Å
219L56.2Low54.8Low120 Ų12085.6 Ų85.663%0.62847%0.471SS*.Hα-helixtrans-89.1-24.1-173.2-133.5123000113.4L216L216-L219 PolarHBondContact O-N 2.94Å
220F59.3Low54.5Low16 Ų1690.1 Ų90.17%0.0750%0.5CS..Hα-helixtrans-123.3-4.4-172.3-60.6-72.4000115.4K17 G18 L21 L216 S222K17-F220 HydrophobicContact CB-CD1 4.3Å; K17-F220 HydrophobicContact CD-CB 4.17Å; K17-F220 HydrophobicContact CD-CD1 3.81Å; K17-F220 HydrophobicContact CD-CG 4.45Å; K17-F220 HydrophobicContact CG-CD1 3.68Å; K17-F220 HydrophobicContact CG-CE1 4.27Å; K17-F220 PolarHBondContact NZ-O 3.12Å; G18-F220 VanDerWaalsContact CA-CZ 3.42Å; L21-F220 HydrophobicContact CB-CE1 4.06Å; L21-F220 HydrophobicContact CB-CZ 4.49Å; L21-F220 HydrophobicContact CD1-CE1 3.81Å; L21-F220 HydrophobicContact CD1-CZ 4.49Å; L216-F220 HydrophobicContact CB-CD2 3.8Å; L216-F220 HydrophobicContact CD2-CD2 3.75Å; L216-F220 HydrophobicContact CD2-CE2 4.09Å; L216-F220 HydrophobicContact CG-CD2 3.78Å; L216-F220 HydrophobicContact CG-CE2 4.1Å; L216-F220 WeakPolarHBondContact O-CA 3.29Å; L216-F220 VanDerWaalsContact O-CB 3.25Å; L216-F220 WeakPolarHBondContact O-CB 3.2Å; L216-F220 PolarHBondContact O-N 2.89Å; F220-S222 PolarHBondContact O-N 3.37Å
221S51.6Low53.8Low85 Ų8594.6 Ų94.659%0.59452%0.52SS*.  trans-60.596.4168-72.90000110E217E217-S221 WeakPolarHBondContact O-CB 3.33Å; E217-S221 PolarHBondContact O-N 3.5Å; E217-S221 PolarHBondContact O-OG 3.22Å
222S52.9Low53.3Low50 Ų5094.8 Ų94.835%0.3553%0.532SS..  trans-68.3135.5163.848.20000108.3F220 Q224F220-S222 PolarHBondContact O-N 3.37Å; S222-Q224 PolarHBondContact O-N 3.39Å
223S49.3Very low52.8Low109 Ų109101.6 Ų101.676%0.76256%0.559SS**  trans-44.8128.1166.851.80000110
224Q52.9Low52.6Low105 Ų10598 Ų9849%0.49155%0.553SS.*  trans-51126.4170.3-173.6163.8200107.8S222 N226S222-Q224 PolarHBondContact O-N 3.39Å; Q224-N226 PolarHBondContact O-N 3.26Å; Q224-N226 VanDerWaalsContact O-N 3.08Å
225P50.8Low52.4Low48 Ų4891.9 Ų91.931%0.31254%0.542SS..  trans-58.8120.5173.722.1-28.7000107.5Y11 D227 E228Y11-P225 HydrophobicContact CE1-CG 4.34Å; P225-D227 PolarHBondContact O-N 3.47Å; P225-E228 PolarHBondContact O-N 3.23Å
226N49.1Very low52.5Low166 Ų16690.3 Ų90.389%0.88854%0.537SS*.THydrogen-bonded Turntrans-57.3-10.3-173.7-80.7-15.5000114.5Q224Q224-N226 PolarHBondContact O-N 3.26Å; Q224-N226 VanDerWaalsContact O-N 3.08Å
227D52.6Low52.5Low150 Ų15091.5 Ų91.580%0.80254%0.543SS*.THydrogen-bonded Turntrans-94.8-3.7-177.6-71.1-31.7000115P225P225-D227 PolarHBondContact O-N 3.47Å
228E48.7Very low52.3Low57 Ų5789.2 Ų89.227%0.26654%0.535SS..SBendtrans-109.6103.9-179.3-63.4-163.5153.100111.9P225 R241P225-E228 PolarHBondContact O-N 3.23Å; E228-R241 IonicContact OE1-NH1 3.15Å; E228-R241 IonicContact OE1-NH2 2.77Å
229T43.4Very low52.6Low109 Ų10988.9 Ų88.967%0.66953%0.527SS*.  trans-53.6141.4174.941.20000111.8L231T229-L231 VanDerWaalsContact C-N 3.26Å; T229-L231 PolarHBondContact O-N 3.17Å
230P52.7Low53.2Low114 Ų11488.4 Ų88.474%0.7452%0.521SS*.SBendtrans-81.470.1-173.834.7-34.7000110.2
231L42Very low53.8Low133 Ų13393.5 Ų93.570%0.69654%0.54SS*.  trans-139.3122.3176-78.4166000110.5T229 L237T229-L231 VanDerWaalsContact C-N 3.26Å; T229-L231 PolarHBondContact O-N 3.17Å; L231-L237 WeakPolarHBondContact O-CD1 3.07Å
232G46.2Very low55.2Low51 Ų5194.6 Ų94.653%0.52654%0.536SS..SBendtrans75.611716000000116.4G234G232-G234 PolarHBondContact O-N 2.9Å
233M47.7Very low56.6Low166 Ų16697.9 Ų97.982%0.81855%0.545SS*.  trans-22.2117.9162.6-158.9163.7-77.800113.7A235 T236M233-A235 PolarHBondContact O-N 3.39Å; M233-T236 PolarHBondContact O-N 2.83Å; M233-T236 PolarHBondContact O-OG1 3.49Å
234G58.3Low58.2Low32 Ų32101.6 Ų101.633%0.3354%0.543SS..Hα-helixtrans-55.1-18.8-166.100000116.8G232 T236 D238G232-G234 PolarHBondContact O-N 2.9Å; G234-T236 VanDerWaalsContact C-N 3.32Å; G234-T236 PolarHBondContact O-N 3.31Å; G234-D238 WeakPolarHBondContact O-CB 3.35Å; G234-D238 PolarHBondContact O-N 3.02Å
235A52.1Low59.3Low64 Ų64101.8 Ų101.853%0.52955%0.545SS..Hα-helixtrans-62.5-35.8170.600000112.7M233 I239M233-A235 PolarHBondContact O-N 3.39Å; A235-I239 WeakPolarHBondContact O-CB 3.3Å; A235-I239 WeakPolarHBondContact O-CD1 3.26Å; A235-I239 WeakPolarHBondContact O-CG1 3.34Å; A235-I239 PolarHBondContact O-N 2.94Å; A235-I239 VanDerWaalsContact O-N 3.14Å
236T58Low61.1Low72 Ų72103.9 Ų103.944%0.44255%0.553SS.*Hα-helixtrans-75.9-37.6179.458.70000112M233 G234 Q240M233-T236 PolarHBondContact O-N 2.83Å; M233-T236 PolarHBondContact O-OG1 3.49Å; G234-T236 VanDerWaalsContact C-N 3.32Å; G234-T236 PolarHBondContact O-N 3.31Å; T236-Q240 VanDerWaalsContact O-CB 3.29Å; T236-Q240 WeakPolarHBondContact O-CB 3.35Å; T236-Q240 WeakPolarHBondContact O-CG 3.26Å; T236-Q240 PolarHBondContact O-N 2.86Å
237L57.8Low63.1Low58 Ų58100.3 Ų100.330%0.30453%0.534SS..Hα-helixtrans-70.8-40.6177.4-76.1176.1000112.3L231 I239 Q240 R241L231-L237 WeakPolarHBondContact O-CD1 3.07Å; L237-I239 VanDerWaalsContact C-N 3.35Å; L237-Q240 PolarHBondContact O-N 3.13Å; L237-R241 WeakPolarHBondContact O-CB 3.38Å; L237-R241 WeakPolarHBondContact O-CG 3.48Å; L237-R241 PolarHBondContact O-N 3.24Å
238D58.3Low65.1Low66 Ų6696.8 Ų96.835%0.35352%0.515SS..Hα-helixtrans-64.9-41.9175.6-74.2-31.8000110.4G234 R241 Q242G234-D238 WeakPolarHBondContact O-CB 3.35Å; G234-D238 PolarHBondContact O-N 3.02Å; D238-R241 PolarHBondContact O-N 3.3Å; D238-Q242 VanDerWaalsContact O-CB 3.3Å; D238-Q242 WeakPolarHBondContact O-CB 3.42Å; D238-Q242 PolarHBondContact O-N 3.1Å
239I64.2Low67.1Low96 Ų9699.1 Ų99.149%0.49253%0.529SS..Hα-helixtrans-62.9-43.3173.5-69.2166.5000111A235 L237 R241 Q242 Q243A235-I239 WeakPolarHBondContact O-CB 3.3Å; A235-I239 WeakPolarHBondContact O-CD1 3.26Å; A235-I239 WeakPolarHBondContact O-CG1 3.34Å; A235-I239 PolarHBondContact O-N 2.94Å; A235-I239 VanDerWaalsContact O-N 3.14Å; L237-I239 VanDerWaalsContact C-N 3.35Å; I239-R241 PolarHBondContact O-N 3.34Å; I239-Q242 WeakPolarHBondContact O-CB 3.03Å; I239-Q242 PolarHBondContact O-N 3.36Å; I239-Q243 HydrophobicContact CG2-CG 4.29Å; I239-Q243 WeakPolarHBondContact O-CB 3.32Å; I239-Q243 VanDerWaalsContact O-CG 3.26Å; I239-Q243 WeakPolarHBondContact O-CG 3.36Å; I239-Q243 PolarHBondContact O-N 2.97Å
240Q70.1Confident69.5Low109 Ų10999.9 Ų99.951%0.50953%0.525SS..Hα-helixtrans-65.2-38.5177.6-77.8171.3-11.600112.5T236 L237 R244T236-Q240 VanDerWaalsContact O-CB 3.29Å; T236-Q240 WeakPolarHBondContact O-CB 3.35Å; T236-Q240 WeakPolarHBondContact O-CG 3.26Å; T236-Q240 PolarHBondContact O-N 2.86Å; L237-Q240 PolarHBondContact O-N 3.13Å; Q240-R244 WeakPolarHBondContact O-CB 3.33Å; Q240-R244 PolarHBondContact O-N 2.98Å
241R71.4Confident71.5Confident123 Ų12399.8 Ų99.846%0.46452%0.515SS..Hα-helixtrans-67-42.3174.2-75.8178.7-173.7168.92110.9E228 L237 D238 I239 R244 M245E228-R241 IonicContact OE1-NH1 3.15Å; E228-R241 IonicContact OE1-NH2 2.77Å; L237-R241 WeakPolarHBondContact O-CB 3.38Å; L237-R241 WeakPolarHBondContact O-CG 3.48Å; L237-R241 PolarHBondContact O-N 3.24Å; D238-R241 PolarHBondContact O-N 3.3Å; I239-R241 PolarHBondContact O-N 3.34Å; R241-R244 PolarHBondContact O-N 3.21Å; R241-M245 WeakPolarHBondContact O-CG 3.48Å; R241-M245 PolarHBondContact O-N 2.78Å
242Q80.3Confident74Confident108 Ų10898.5 Ų98.551%0.50551%0.508SS..Hα-helixtrans-59.7-50.8175.2-163.790.318.500110.5D238 I239 R244 M245 D246D238-Q242 VanDerWaalsContact O-CB 3.3Å; D238-Q242 WeakPolarHBondContact O-CB 3.42Å; D238-Q242 PolarHBondContact O-N 3.1Å; I239-Q242 WeakPolarHBondContact O-CB 3.03Å; I239-Q242 PolarHBondContact O-N 3.36Å; Q242-R244 VanDerWaalsContact C-N 3.31Å; Q242-R244 PolarHBondContact O-N 3.39Å; Q242-M245 PolarHBondContact O-N 2.95Å; Q242-M245 VanDerWaalsContact O-N 3.13Å; Q242-D246 VanDerWaalsContact O-CG 3.26Å; Q242-D246 PolarHBondContact O-N 2.93Å
243Q82.2Confident76.2Confident119 Ų119101.2 Ų101.256%0.55651%0.51SS*.Hα-helixtrans-60.3-39.1177.9-75.3177.9-28.100112.6I239 D246 L247I239-Q243 HydrophobicContact CG2-CG 4.29Å; I239-Q243 WeakPolarHBondContact O-CB 3.32Å; I239-Q243 VanDerWaalsContact O-CG 3.26Å; I239-Q243 WeakPolarHBondContact O-CG 3.36Å; I239-Q243 PolarHBondContact O-N 2.97Å; Q243-D246 PolarHBondContact O-N 3.45Å; Q243-L247 WeakPolarHBondContact O-CB 3.34Å; Q243-L247 PolarHBondContact O-N 3.04Å
244R83.1Confident78.4Confident188 Ų18897.7 Ų97.771%0.70949%0.494SS*.Hα-helixtrans-67-38.6177-171.3173.5-176.6170.91.1111.8Q240 R241 Q242 L248Q240-R244 WeakPolarHBondContact O-CB 3.33Å; Q240-R244 PolarHBondContact O-N 2.98Å; R241-R244 PolarHBondContact O-N 3.21Å; Q242-R244 VanDerWaalsContact C-N 3.31Å; Q242-R244 PolarHBondContact O-N 3.39Å; R244-L248 WeakPolarHBondContact O-CG 3.37Å; R244-L248 PolarHBondContact O-N 3.41Å
245M75.9Confident79.9Confident108 Ų10898.2 Ų98.253%0.53250%0.495SS..Hα-helixtrans-68.3-42.8175.1-71.3-55.7-55.300111.6R241 Q242 L247 L248 D249R241-M245 WeakPolarHBondContact O-CG 3.48Å; R241-M245 PolarHBondContact O-N 2.78Å; Q242-M245 PolarHBondContact O-N 2.95Å; Q242-M245 VanDerWaalsContact O-N 3.13Å; M245-L247 VanDerWaalsContact C-N 3.28Å; M245-L247 PolarHBondContact O-N 3.35Å; M245-L248 PolarHBondContact O-N 3.49Å; M245-L248 HydrophobicContact SD-CD1 4.34Å; M245-D249 WeakPolarHBondContact O-CB 3.43Å; M245-D249 PolarHBondContact O-N 2.83Å
246D88.1Confident81.7Confident92 Ų92101.4 Ų101.449%0.49250%0.499SS..Hα-helixtrans-61.3-39.1176.8-66.3-17.8000111.2Q242 Q243 D249 Q250Q242-D246 VanDerWaalsContact O-CG 3.26Å; Q242-D246 PolarHBondContact O-N 2.93Å; Q243-D246 PolarHBondContact O-N 3.45Å; D246-D249 PolarHBondContact O-N 3.08Å; D246-Q250 WeakPolarHBondContact O-CB 3.33Å; D246-Q250 PolarHBondContact O-N 2.92Å
247L92.3Very high83.1Confident92 Ų92104.7 Ų104.748%0.48250%0.504SS..Hα-helixtrans-66.2-44.8175.7-163.6163.2000111.5Q243 M245 D249 Q250 Q251Q243-L247 WeakPolarHBondContact O-CB 3.34Å; Q243-L247 PolarHBondContact O-N 3.04Å; M245-L247 VanDerWaalsContact C-N 3.28Å; M245-L247 PolarHBondContact O-N 3.35Å; L247-D249 VanDerWaalsContact C-N 3.32Å; L247-D249 PolarHBondContact O-N 2.96Å; L247-Q250 PolarHBondContact O-N 3.26Å; L247-Q251 HydrophobicContact CD2-CG 4.09Å; L247-Q251 VanDerWaalsContact CD2-NE2 3.33Å; L247-Q251 WeakPolarHBondContact O-CG 3.39Å; L247-Q251 PolarHBondContact O-N 2.9Å
248L93.9Very high84.4Confident76 Ų76106 Ų10640%0.39851%0.512SS..Hα-helixtrans-63.8-38.7176-74173.9000112R244 M245 Q251 L252R244-L248 WeakPolarHBondContact O-CG 3.37Å; R244-L248 PolarHBondContact O-N 3.41Å; M245-L248 PolarHBondContact O-N 3.49Å; M245-L248 HydrophobicContact SD-CD1 4.34Å; L248-Q251 PolarHBondContact O-N 3.26Å; L248-L252 PolarHBondContact O-N 2.66Å
249D90.7Very high85.5Confident106 Ų106108.5 Ų108.557%0.56752%0.521SS*.Hα-helixtrans-66.1-41.3177.4-157.336.6000110.5M245 D246 L247 Q251 L252 L253M245-D249 WeakPolarHBondContact O-CB 3.43Å; M245-D249 PolarHBondContact O-N 2.83Å; D246-D249 PolarHBondContact O-N 3.08Å; L247-D249 VanDerWaalsContact C-N 3.32Å; L247-D249 PolarHBondContact O-N 2.96Å; D249-Q251 VanDerWaalsContact C-N 3.32Å; D249-Q251 PolarHBondContact O-N 2.86Å; D249-L252 PolarHBondContact O-N 2.98Å; D249-L253 WeakPolarHBondContact O-CB 3.39Å; D249-L253 PolarHBondContact O-N 3.34Å
250Q94.3Very high86.3Confident124 Ų124106.5 Ų106.558%0.57952%0.519SS*.Hα-helixtrans-61.1-40.8172.9-169.1179.13.100111.9D246 L247 L253 L254D246-Q250 WeakPolarHBondContact O-CB 3.33Å; D246-Q250 PolarHBondContact O-N 2.92Å; L247-Q250 PolarHBondContact O-N 3.26Å; Q250-L253 PolarHBondContact O-N 3.43Å; Q250-L254 HydrophobicContact CG-CD1 4.5Å; Q250-L254 WeakPolarHBondContact O-CB 3.5Å; Q250-L254 VanDerWaalsContact O-CG 3.29Å; Q250-L254 WeakPolarHBondContact O-CG 3.38Å; Q250-L254 PolarHBondContact O-N 3.44Å
251Q93.8Very high86.5Confident112 Ų112108.4 Ų108.452%0.52352%0.521SS..Hα-helixtrans-65.2-43.3175.7-74.8-179.3-7.200112.2L247 L248 D249 L253 L254 A255L247-Q251 HydrophobicContact CD2-CG 4.09Å; L247-Q251 VanDerWaalsContact CD2-NE2 3.33Å; L247-Q251 WeakPolarHBondContact O-CG 3.39Å; L247-Q251 PolarHBondContact O-N 2.9Å; L248-Q251 PolarHBondContact O-N 3.26Å; D249-Q251 VanDerWaalsContact C-N 3.32Å; D249-Q251 PolarHBondContact O-N 2.86Å; Q251-L253 VanDerWaalsContact C-N 3.34Å; Q251-L254 PolarHBondContact O-N 3.26Å; Q251-A255 WeakPolarHBondContact O-CB 3.49Å; Q251-A255 PolarHBondContact O-N 2.87Å
252L94.6Very high86.2Confident106 Ų106111.2 Ų111.256%0.55553%0.532SS*.Hα-helixtrans-63.4-40.6176.1-83.9169.8000111.8L248 D249 A255 Q256L248-L252 PolarHBondContact O-N 2.66Å; D249-L252 PolarHBondContact O-N 2.98Å; L252-A255 WeakPolarHBondContact O-CB 3.38Å; L252-A255 PolarHBondContact O-N 2.86Å; L252-Q256 WeakPolarHBondContact O-CB 3.29Å; L252-Q256 WeakPolarHBondContact O-CG 3.49Å; L252-Q256 PolarHBondContact O-N 3.38Å
253L93.9Very high85.4Confident108 Ų108111.4 Ų111.457%0.56554%0.537SS*.Hα-helixtrans-64.5-43.5177.8-153.3166.9000110.8D249 Q250 Q251 Q256 Y257D249-L253 WeakPolarHBondContact O-CB 3.39Å; D249-L253 PolarHBondContact O-N 3.34Å; Q250-L253 PolarHBondContact O-N 3.43Å; Q251-L253 VanDerWaalsContact C-N 3.34Å; L253-Q256 PolarHBondContact O-N 3.34Å; L253-Y257 WeakPolarHBondContact O-CB 3.47Å; L253-Y257 PolarHBondContact O-N 3.5Å
254L93.8Very high84.3Confident93 Ų93111.5 Ų111.549%0.48755%0.545SS..Hα-helixtrans-64.6-38.4173.8-71174.1000112.4Q250 Q251 Y257 N258Q250-L254 HydrophobicContact CG-CD1 4.5Å; Q250-L254 WeakPolarHBondContact O-CB 3.5Å; Q250-L254 VanDerWaalsContact O-CG 3.29Å; Q250-L254 WeakPolarHBondContact O-CG 3.38Å; Q250-L254 PolarHBondContact O-N 3.44Å; Q251-L254 PolarHBondContact O-N 3.26Å; L254-Y257 PolarHBondContact O-N 3.18Å; L254-N258 WeakPolarHBondContact O-CB 3.25Å; L254-N258 VanDerWaalsContact O-CG 3.22Å; L254-N258 PolarHBondContact O-N 3.33Å; L254-N258 PolarHBondContact O-ND2 3.04Å
255A89.5Confident82.9Confident42 Ų42112.3 Ų112.335%0.34755%0.548SS..Hα-helixtrans-62.8-47.7174.900000111.1Q251 L252 Y257 N258 E259Q251-A255 WeakPolarHBondContact O-CB 3.49Å; Q251-A255 PolarHBondContact O-N 2.87Å; L252-A255 WeakPolarHBondContact O-CB 3.38Å; L252-A255 PolarHBondContact O-N 2.86Å; A255-Y257 PolarHBondContact O-N 3.24Å; A255-N258 PolarHBondContact O-N 3.28Å; A255-E259 WeakPolarHBondContact O-CG 3.47Å; A255-E259 PolarHBondContact O-N 3.46Å
256Q89.5Confident81.7Confident131 Ų131117.5 Ų117.561%0.61256%0.562SS**Hα-helixtrans-60.9-42.4175.2-74.8-178.13.600112.2L252 L253 N258 E259 A260L252-Q256 WeakPolarHBondContact O-CB 3.29Å; L252-Q256 WeakPolarHBondContact O-CG 3.49Å; L252-Q256 PolarHBondContact O-N 3.38Å; L253-Q256 PolarHBondContact O-N 3.34Å; Q256-N258 PolarHBondContact O-N 3.43Å; Q256-E259 PolarHBondContact O-N 3.24Å; Q256-A260 WeakPolarHBondContact O-CB 3.35Å; Q256-A260 PolarHBondContact O-N 2.58Å
257Y87.3Confident79.8Confident141 Ų141121.2 Ų121.255%0.55358%0.576SS**Hα-helixtrans-62.5-43.3177-178.4-95.8000111.8L253 L254 A255 A260 R261L253-Y257 WeakPolarHBondContact O-CB 3.47Å; L253-Y257 PolarHBondContact O-N 3.5Å; L254-Y257 PolarHBondContact O-N 3.18Å; A255-Y257 PolarHBondContact O-N 3.24Å; Y257-A260 PolarHBondContact O-N 3.46Å; Y257-R261 WeakPolarHBondContact O-CB 3.34Å; Y257-R261 PolarHBondContact O-N 2.92Å
258N84.7Confident77.7Confident86 Ų86122 Ų12246%0.4659%0.586SS.*Hα-helixtrans-66.8-38.2177.8-75.1-25.6000112.3L254 A255 Q256 R261 R262L254-N258 WeakPolarHBondContact O-CB 3.25Å; L254-N258 VanDerWaalsContact O-CG 3.22Å; L254-N258 PolarHBondContact O-N 3.33Å; L254-N258 PolarHBondContact O-ND2 3.04Å; A255-N258 PolarHBondContact O-N 3.28Å; Q256-N258 PolarHBondContact O-N 3.43Å; N258-R261 PolarHBondContact O-N 3.5Å; N258-R262 WeakPolarHBondContact O-CB 3.48Å; N258-R262 WeakPolarHBondContact O-CG 3.38Å; N258-R262 PolarHBondContact O-N 3.45Å
259E81.9Confident75.3Confident119 Ų119127 Ų12756%0.55661%0.608SS**Hα-helixtrans-66.8-44.4174.1-75.5-179.8178.300112.2A255 Q256 R261 R262 N263A255-E259 WeakPolarHBondContact O-CG 3.47Å; A255-E259 PolarHBondContact O-N 3.46Å; Q256-E259 PolarHBondContact O-N 3.24Å; E259-R261 VanDerWaalsContact C-N 3.28Å; E259-R261 PolarHBondContact O-N 3.27Å; E259-R262 PolarHBondContact O-N 3.42Å; E259-R262 VanDerWaalsContact O-N 3.14Å; E259-N263 PolarHBondContact O-N 2.88Å
260A81.9Confident72.9Confident54 Ų54129.2 Ų129.245%0.44663%0.625SS.*Hα-helixtrans-57.9-42.8173.800000111.1Q256 Y257 N263 V264Q256-A260 WeakPolarHBondContact O-CB 3.35Å; Q256-A260 PolarHBondContact O-N 2.58Å; Y257-A260 PolarHBondContact O-N 3.46Å; A260-N263 PolarHBondContact O-N 3.39Å; A260-V264 VanDerWaalsContact O-CG2 3.29Å; A260-V264 WeakPolarHBondContact O-CG2 3.3Å; A260-V264 PolarHBondContact O-N 3.37Å
261R74.3Confident70.5Confident148 Ų148126.8 Ų126.856%0.55863%0.633SS**Hα-helixtrans-67.3-36.5176.4-164.6176.7-177.2-173.22.3112.7Y257 N258 E259 R265Y257-R261 WeakPolarHBondContact O-CB 3.34Å; Y257-R261 PolarHBondContact O-N 2.92Å; N258-R261 PolarHBondContact O-N 3.5Å; E259-R261 VanDerWaalsContact C-N 3.28Å; E259-R261 PolarHBondContact O-N 3.27Å; R261-R265 PolarHBondContact O-N 2.93Å
262R64.9Low68.5Low182 Ų182125 Ų12569%0.68764%0.644SS**Hα-helixtrans-66.7-40.4173.9-80.9179.8177.1179.40.2111.9N258 E259 R265 R266N258-R262 WeakPolarHBondContact O-CB 3.48Å; N258-R262 WeakPolarHBondContact O-CG 3.38Å; N258-R262 PolarHBondContact O-N 3.45Å; E259-R262 PolarHBondContact O-N 3.42Å; E259-R262 VanDerWaalsContact O-N 3.14Å; R262-R265 PolarHBondContact O-N 2.87Å; R262-R266 PolarHBondContact O-N 2.94Å
263N62.3Low66.1Low113 Ų113127.5 Ų127.560%0.60466%0.658SS**Hα-helixtrans-66.9-36.9176.7-73.8-13.1000111.8E259 A260 R265 R266E259-N263 PolarHBondContact O-N 2.88Å; A260-N263 PolarHBondContact O-N 3.39Å; N263-R265 VanDerWaalsContact C-N 3.32Å; N263-R265 PolarHBondContact O-N 2.86Å; N263-R266 PolarHBondContact O-N 3.23Å
264V59.9Low64.1Low120 Ų120128.7 Ų128.773%0.72766%0.664SS**Hα-helixtrans-66.8-32172.3171.90000112.1A260A260-V264 VanDerWaalsContact O-CG2 3.29Å; A260-V264 WeakPolarHBondContact O-CG2 3.3Å; A260-V264 PolarHBondContact O-N 3.37Å
265R54.4Low61.8Low206 Ų206129.3 Ų129.378%0.77766%0.664SS**Hα-helixtrans-81.2-17.2177-116.5176.4178.7-179.9-2.3114.2R261 R262 N263 Q267R261-R265 PolarHBondContact O-N 2.93Å; R262-R265 PolarHBondContact O-N 2.87Å; N263-R265 VanDerWaalsContact C-N 3.32Å; N263-R265 PolarHBondContact O-N 2.86Å; R265-Q267 VanDerWaalsContact C-N 3.3Å; R265-Q267 PolarHBondContact O-N 3.34Å
266R50.3Low59.7Low216 Ų216136.1 Ų136.182%0.81568%0.681SS**THydrogen-bonded Turntrans-87.113.6178.7-84.7-167.4174.7-172.4-0.7114.5R262 N263R262-R266 PolarHBondContact O-N 2.94Å; N263-R266 PolarHBondContact O-N 3.23Å
267Q47.5Very low58Low171 Ų171136 Ų13680%0.79969%0.69SS**  trans-118.298.1168-112.4162-7.200111.7R265R265-Q267 VanDerWaalsContact C-N 3.3Å; R265-Q267 PolarHBondContact O-N 3.34Å
268P48.3Very low56.4Low107 Ų107138.1 Ų138.170%0.69570%0.697SS**SBend-118.6119.6127.729.1-16.7000109.4
269Q44.5Very low54.9Low182 Ų182139.4 Ų139.485%0.8570%0.703SS**SBendtrans54.9110.4154.8-65.3176.6-31.500118.8
270V38.6Very low53.4Low152 Ų152140.4 Ų140.492%0.92171%0.706SS**  153.2130.1115.2169.20000109.2
271G45.5Very low51.8Low74 Ų74143.2 Ų143.276%0.76372%0.72SS**  trans109.173.5150.400000117.5
272G49.8Very low50.5Low73 Ų73140.9 Ų140.975%0.75373%0.726SS**  trans4993.6139.200000119.9
273L44.9Very low49.7Very low160 Ų160139.4 Ų139.484%0.83873%0.731SS**  -163.3120.3125.2-136.277.2000110.3
274L52.1Low49.1Very low133 Ų133144.9 Ų144.970%0.69674%0.743SS**  trans6988.3155-66.2153.7000117.9W276L274-W276 VanDerWaalsContact C-N 3.3Å; L274-W276 PolarHBondContact O-N 3.46Å
275Q46.2Very low48.3Very low106 Ų106147.4 Ų147.450%0.49575%0.746SS.*  trans-61.669.2168.1-172.8150.631.300114T277 R278Q275-T277 PolarHBondContact O-N 3.29Å; Q275-R278 VanDerWaalsContact CD-CD 3.46Å; Q275-R278 VanDerWaalsContact CD-NE 3.32Å; Q275-R278 HydrophobicContact CG-CB 3.97Å; Q275-R278 HydrophobicContact CG-CG 3.65Å; Q275-R278 VanDerWaalsContact NE2-CZ 3.28Å; Q275-R278 PolarHBondContact O-N 3.08Å
276W43.8Very low47.6Very low184 Ų184149.6 Ų149.670%0.69776%0.755SS**G310 helixtrans-62.1-18.3170-78.795000113.6L274 R278 L279L274-W276 VanDerWaalsContact C-N 3.3Å; L274-W276 PolarHBondContact O-N 3.46Å; W276-R278 VanDerWaalsContact C-N 3.31Å; W276-R278 PolarHBondContact O-N 3.14Å; W276-L279 HydrophobicContact CE3-CD1 4.04Å; W276-L279 HydrophobicContact CZ3-CD1 4.31Å; W276-L279 PolarHBondContact O-N 2.94Å
277T55.3Low47Very low130 Ų130143.3 Ų143.380%0.79876%0.757SS**G310 helixtrans-77.9-5.6-179.6460000115Q275Q275-T277 PolarHBondContact O-N 3.29Å
278R52.5Low46.4Very low184 Ų184143.3 Ų143.369%0.69476%0.757SS**G310 helixtrans-93-12.6170.7-81.6-173.7-175.8163.57.6114.1Q275 W276Q275-R278 VanDerWaalsContact CD-CD 3.46Å; Q275-R278 VanDerWaalsContact CD-NE 3.32Å; Q275-R278 HydrophobicContact CG-CB 3.97Å; Q275-R278 HydrophobicContact CG-CG 3.65Å; Q275-R278 VanDerWaalsContact NE2-CZ 3.28Å; Q275-R278 PolarHBondContact O-N 3.08Å; W276-R278 VanDerWaalsContact C-N 3.31Å; W276-R278 PolarHBondContact O-N 3.14Å
279L54.4Low45.5Very low113 Ų113145.8 Ų145.859%0.59276%0.764SS**SBendtrans-85.5-13.4-171.7-76.5161.7000114.2W276W276-L279 HydrophobicContact CE3-CD1 4.04Å; W276-L279 HydrophobicContact CZ3-CD1 4.31Å; W276-L279 PolarHBondContact O-N 2.94Å
280F50.9Low45Very low141 Ų141148 Ų14862%0.61877%0.765SS**  trans-136.978178.8-60-76.5000112.7S282F280-S282 VanDerWaalsContact C-N 3.3Å
281P47Very low44.8Very low113 Ų113146.6 Ų146.673%0.73476%0.759SS**  trans-77.3-13.2174.214.9-5.1000113.5
282S47.3Very low44.4Very low99 Ų99148.7 Ų148.769%0.69276%0.759SS**THydrogen-bonded Turntrans-97.5-0.9-165.449.20000116.5F280F280-S282 VanDerWaalsContact C-N 3.3Å
283L49Very low43.6Very low151 Ų151152 Ų15279%0.79176%0.764SS**THydrogen-bonded Turntrans-99.26.3-179.7-69.8173000114.6
284R49.2Very low43.3Very low228 Ų228152.2 Ų152.286%0.8676%0.761SS**SBendtrans-91.8-0.6179.1-167.5169.2-84.2-168.8-4114.4
285H42.8Very low42.5Very low172 Ų172151.8 Ų151.880%0.79677%0.766SS**  trans-122.478.3179.9-77.8-43.6000113.3
286R38.6Very low41.8Very low253 Ų253154.7 Ų154.796%0.95578%0.779SS**SBendtrans-158.897.9144-155.9167.7-170.3168.31.4110.9
287G37.7Very low41.5Very low83 Ų83151 Ų15186%0.85678%0.779SS**  trans154.747.5175.200000113.4
288Q35Very low40.1Very low171 Ų171153.6 Ų153.680%0.79978%0.782SS**  trans-100.3115.3173.7-165.8161.82700108.5
289N30.1Very low39Very low159 Ų159149.1 Ų149.185%0.8578%0.784SS**  trans-145.593152.6-100.6-10.3000109.8
290R33.3Very low37.6Very low230 Ų230152.7 Ų152.787%0.86880%0.798SS**  trans32.8133.2151.3-61.2179.8177.1170.2-1.5121.8
291P35.1Very low36.5Very low121 Ų121151.8 Ų151.879%0.78680%0.804SS**  trans-113.9151.7135.934.7-25.8000111.9
292P37.4Very low35.5Very low119 Ų119155.6 Ų155.677%0.77381%0.812SS**  trans-96.7124.8167.432.5-22.8000112.4
293V32.9Very low34.4Very low142 Ų142159.2 Ų159.286%0.86182%0.818SS**  41.1129.1129.8-170.90000120.7
294Q38.1Very low33.4Very low165 Ų165157 Ų15777%0.77182%0.815SS**  trans-65.9176.7174.7-60.9164.2-31.400113.8
295P35.3Very low32.2Very low123 Ų123152.5 Ų152.580%0.79981%0.813SS**  -140139.591.624.2-3.8000114.7
296H32.3Very low31.6Very low168 Ų168153 Ų15378%0.77882%0.815SS**  trans-89.4149.6149.1-105.159.8000108.2
297P37Very low31.7Very low106 Ų106146.5 Ų146.569%0.68881%0.806SS**  -136.8162.611022.1-1.9000109.6
298E25.5Very low32Very low185 Ų185147.7 Ų147.786%0.86480%0.799SS**  cis-166.51607.1-116.7165.9-163.900106.6
299A29.9Very low32Very low89 Ų89147 Ų14774%0.73680%0.8SS**  trans-72.8144.3-177.900000113.5
300Q25.6Very low32.2Very low189 Ų189146.6 Ų146.688%0.88380%0.797SS**  trans-138.5102.3143.2-72.9-168.9-11.200110.7
301T26.4Very low32.2Very low122 Ų122143.2 Ų143.275%0.74879%0.791SS**  trans-59.6131.615426.10000110.9
302H27.8Very low32.8Very low192 Ų192145.2 Ų145.289%0.88980%0.795SS**  trans-143131.3138.9-90.1-65.2000111.1
303Q23.3Very low33.4Very low176 Ų176142.4 Ų142.482%0.82278%0.778SS**  trans-81.4156.9-180-78.5167.5-36.400112.2
304S27.6Very low34.3Very low104 Ų104140.4 Ų140.473%0.72777%0.768SS**  trans64.8131.8152.6-47.40000115.6
305T24.8Very low35.2Very low134 Ų134136.4 Ų136.482%0.82276%0.755SS**  177.513567.4-31.50000106.1
306Q30.3Very low36.5Very low182 Ų182131.8 Ų131.885%0.8573%0.727SS**  trans-73.9161.5152.3-81.8179.3-30.300108.2
307P41Very low38.2Very low117 Ų117130.1 Ų130.176%0.7672%0.72SS**  cis-136.9-151.98.737.8-14.8000110.9
308P44Very low39.9Very low108 Ų108132 Ų13270%0.70172%0.719SS**  cis-121.9171-30.328.6-7.2000113.7
309L34.7Very low42.2Very low157 Ų157124.6 Ų124.682%0.82268%0.684SS**  trans44.3139.5147.4-61.9171.6000122.7
310L33.2Very low44.4Very low150 Ų150120.8 Ų120.879%0.78565%0.652SS**  trans76.8133.7174.4-59132.6000112.5
311E34.7Very low46.9Very low158 Ų158114.1 Ų114.174%0.73863%0.629SS**  cis-168141.825.8-127152.6156.600106.8S313E311-S313 PolarHBondContact O-N 3.26Å
312N46.3Very low49.4Very low163 Ų163115.8 Ų115.887%0.87262%0.622SS**  trans9.493.7163.7-61.7-28.5000117.6
313S50.1Low51.7Low60 Ų60106.7 Ų106.742%0.4258%0.58SS.*  trans-87134167.33.70000109.8E311 V315 A316E311-S313 PolarHBondContact O-N 3.26Å; S313-V315 PolarHBondContact O-N 3.24Å; S313-A316 PolarHBondContact O-N 3.27Å
314P53.5Low54.5Low100 Ų100101.3 Ų101.365%0.64956%0.559SS**Hα-helixtrans-59.3-22.6177.925-34.3000112.5A316 E317 E318P314-A316 VanDerWaalsContact C-N 3.28Å; P314-A316 PolarHBondContact O-N 2.94Å; P314-E317 PolarHBondContact O-N 2.84Å; P314-E318 PolarHBondContact O-N 3.36Å
315V55.4Low56.9Low82 Ų82104.1 Ų104.150%0.49756%0.561SS.*Hα-helixtrans-61.2-34.5175.1-174.70000111.9S313 Q319S313-V315 PolarHBondContact O-N 3.24Å; V315-Q319 WeakPolarHBondContact O-CG 3.41Å; V315-Q319 PolarHBondContact O-N 3.26Å
316A63.3Low59.2Low26 Ų26102.4 Ų102.422%0.21554%0.544CS..Hα-helixtrans-71.7-33.8179.200000111.9S313 P314 Q319 V320S313-A316 PolarHBondContact O-N 3.27Å; P314-A316 VanDerWaalsContact C-N 3.28Å; P314-A316 PolarHBondContact O-N 2.94Å; A316-Q319 PolarHBondContact O-N 2.93Å; A316-V320 WeakPolarHBondContact O-CG2 3.37Å; A316-V320 PolarHBondContact O-N 3.47Å
317E68.3Low61.2Low133 Ų13396.9 Ų96.962%0.62154%0.537SS*.Hα-helixtrans-70.5-37.5178.2-68.5-153142.900112.5P314 Q319 V320 A321P314-E317 PolarHBondContact O-N 2.84Å; E317-Q319 VanDerWaalsContact C-N 3.3Å; E317-Q319 PolarHBondContact O-N 3.43Å; E317-V320 PolarHBondContact O-N 3Å; E317-A321 WeakPolarHBondContact O-CB 3.47Å; E317-A321 PolarHBondContact O-N 2.94Å
318E71.8Confident63.1Low145 Ų14593.8 Ų93.868%0.67851%0.511SS*.Hα-helixtrans-62.8-38.5173-69.3-177.6176.600111.8P314 A321 R322P314-E318 PolarHBondContact O-N 3.36Å; E318-A321 PolarHBondContact O-N 2.81Å; E318-R322 WeakPolarHBondContact O-CB 3.35Å; E318-R322 PolarHBondContact O-N 2.9Å
319Q73.9Confident64.8Low29 Ų2991.1 Ų91.114%0.13650%0.495CS..Hα-helixtrans-68.6-39177.1-67.6177.6-5.100112.2V315 A316 E317 R322 L323 L337 N342 I344V315-Q319 WeakPolarHBondContact O-CG 3.41Å; V315-Q319 PolarHBondContact O-N 3.26Å; A316-Q319 PolarHBondContact O-N 2.93Å; E317-Q319 VanDerWaalsContact C-N 3.3Å; E317-Q319 PolarHBondContact O-N 3.43Å; Q319-R322 PolarHBondContact O-N 3.14Å; Q319-L323 WeakPolarHBondContact O-CG 3.36Å; Q319-L323 PolarHBondContact O-N 2.96Å; Q319-L323 VanDerWaalsContact O-N 3.14Å; Q319-L337 HydrophobicContact CB-CD1 3.96Å; Q319-L337 HydrophobicContact CB-CD2 4.31Å; Q319-N342 PolarHBondContact NE2-O 3.45Å; Q319-N342 PolarHBondContact OE1-O 3.33Å; Q319-I344 HydrophobicContact CB-CD1 4.27Å; Q319-I344 HydrophobicContact CB-CG1 4.03Å; Q319-I344 HydrophobicContact CG-CD1 3.67Å; Q319-I344 HydrophobicContact CG-CG1 3.67Å
320V76.8Confident66.9Low10 Ų1091 Ų916%0.06148%0.484CS..Hα-helixtrans-65.8-45.3173.7173.80000110.6A316 E317 R322 L323 V324 R330 L334 L337A316-V320 WeakPolarHBondContact O-CG2 3.37Å; A316-V320 PolarHBondContact O-N 3.47Å; E317-V320 PolarHBondContact O-N 3Å; V320-R322 VanDerWaalsContact C-N 3.26Å; V320-R322 PolarHBondContact O-N 3.43Å; V320-L323 PolarHBondContact O-N 3.36Å; V320-L323 VanDerWaalsContact O-N 3.14Å; V320-V324 HydrophobicContact CG1-CG2 4.34Å; V320-V324 WeakPolarHBondContact O-CG2 3.47Å; V320-V324 PolarHBondContact O-N 3.44Å; V320-R330 HydrophobicContact CG1-CG 3.87Å; V320-L334 HydrophobicContact CG1-CG 4.31Å; V320-L334 HydrophobicContact CG2-CD2 3.49Å; V320-L334 VanDerWaalsContact CG2-CD2 3.49Å; V320-L334 HydrophobicContact CG2-CG 4.01Å; V320-L337 HydrophobicContact CB-CD1 4.39Å; V320-L337 HydrophobicContact CG2-CD1 3.49Å; V320-L337 VanDerWaalsContact CG2-CD1 3.49Å
321A78Confident69Low49 Ų4990 Ų9041%0.40548%0.478SS..Hα-helixtrans-57.5-42.3177.400000111.1E317 E318 L323 V324 E325E317-A321 WeakPolarHBondContact O-CB 3.47Å; E317-A321 PolarHBondContact O-N 2.94Å; E318-A321 PolarHBondContact O-N 2.81Å; A321-L323 PolarHBondContact O-N 3.18Å; A321-V324 PolarHBondContact O-N 3.06Å; A321-E325 WeakPolarHBondContact O-CG 3.38Å; A321-E325 PolarHBondContact O-N 3Å
322R78.6Confident71.1Confident157 Ų15785.9 Ų85.959%0.59246%0.461SS*.Hα-helixtrans-65.1-36.2177.1-162.6169-169.7163.52.8113.5E318 Q319 V320 M326E318-R322 WeakPolarHBondContact O-CB 3.35Å; E318-R322 PolarHBondContact O-N 2.9Å; Q319-R322 PolarHBondContact O-N 3.14Å; V320-R322 VanDerWaalsContact C-N 3.26Å; V320-R322 PolarHBondContact O-N 3.43Å; R322-M326 WeakPolarHBondContact O-CE 3.3Å; R322-M326 WeakPolarHBondContact O-CG 3.39Å; R322-M326 PolarHBondContact O-N 3.34Å
323L75.9Confident72.7Confident0 Ų078.1 Ų78.10%042%0.419CS..Hα-helixtrans-70.9-36.3174.4-72.7164.4000112Q319 V320 A321 M326 G327 F328 A333 L337 A347 T348 L351Q319-L323 WeakPolarHBondContact O-CG 3.36Å; Q319-L323 PolarHBondContact O-N 2.96Å; Q319-L323 VanDerWaalsContact O-N 3.14Å; V320-L323 PolarHBondContact O-N 3.36Å; V320-L323 VanDerWaalsContact O-N 3.14Å; A321-L323 PolarHBondContact O-N 3.18Å; L323-M326 HydrophobicContact CD2-CE 3.61Å; L323-M326 HydrophobicContact CG-CE 4.21Å; L323-M326 PolarHBondContact O-N 3.46Å; L323-G327 PolarHBondContact O-N 3.46Å; L323-F328 WeakPolarHBondContact O-CD2 3.49Å; L323-F328 PolarHBondContact O-N 3.25Å; L323-A333 HydrophobicContact CB-CB 3.68Å; L323-A333 HydrophobicContact CD1-CB 3.88Å; L323-A333 HydrophobicContact CG-CB 4.41Å; L323-L337 HydrophobicContact CD1-CD1 3.56Å; L323-L337 HydrophobicContact CD1-CD2 4.05Å; L323-L337 HydrophobicContact CD1-CG 3.6Å; L323-A347 HydrophobicContact CD1-CB 4.31Å; L323-T348 HydrophobicContact CD2-CG2 3.47Å; L323-T348 VanDerWaalsContact CD2-CG2 3.47Å; L323-L351 HydrophobicContact CD2-CD1 4.1Å
324V81.6Confident74Confident63 Ų6378.4 Ų78.438%0.38242%0.416SS..Hα-helixtrans-68.8-38.7175.21740000111.4V320 A321 M326 G327 F328 R330V320-V324 HydrophobicContact CG1-CG2 4.34Å; V320-V324 WeakPolarHBondContact O-CG2 3.47Å; V320-V324 PolarHBondContact O-N 3.44Å; A321-V324 PolarHBondContact O-N 3.06Å; V324-M326 PolarHBondContact O-N 3.37Å; V324-G327 WeakPolarHBondContact O-CA 3.35Å; V324-G327 PolarHBondContact O-N 2.86Å; V324-F328 WeakPolarHBondContact CA-O 3.42Å; V324-R330 HydrophobicContact CG2-CB 3.91Å; V324-R330 HydrophobicContact CG2-CG 4.28Å
325E78Confident75.2Confident164 Ų16479.7 Ų79.777%0.76641%0.413SS*.Hα-helixtrans-61-31.5171.8-77.5178.7175.600112.7A321 G327A321-E325 WeakPolarHBondContact O-CG 3.38Å; A321-E325 PolarHBondContact O-N 3Å; E325-G327 PolarHBondContact O-N 3.03Å
326M74.7Confident76.3Confident97 Ų9775.9 Ų75.948%0.47839%0.39SS..THydrogen-bonded Turntrans-76.3-1.4173.4-69.7-174-64.800113.4R322 L323 V324 F328 T348R322-M326 WeakPolarHBondContact O-CE 3.3Å; R322-M326 WeakPolarHBondContact O-CG 3.39Å; R322-M326 PolarHBondContact O-N 3.34Å; L323-M326 HydrophobicContact CD2-CE 3.61Å; L323-M326 HydrophobicContact CG-CE 4.21Å; L323-M326 PolarHBondContact O-N 3.46Å; V324-M326 PolarHBondContact O-N 3.37Å; M326-F328 HydrophobicContact CB-CD2 4.01Å; M326-F328 HydrophobicContact CB-CE2 4.05Å; M326-T348 HydrophobicContact CE-CG2 3.61Å; M326-T348 HydrophobicContact SD-CG2 4.5Å
327G72.5Confident77Confident67 Ų6774.8 Ų74.869%0.69138%0.381SS*.THydrogen-bonded Turntrans97.56.317300000115.2L323 V324 E325L323-G327 PolarHBondContact O-N 3.46Å; V324-G327 WeakPolarHBondContact O-CA 3.35Å; V324-G327 PolarHBondContact O-N 2.86Å; E325-G327 PolarHBondContact O-N 3.03Å
328F79.2Confident77.4Confident51 Ų5178.1 Ų78.122%0.22439%0.387CS..  trans-84.3149.2176.9-60.7-76.8000111.6L323 V324 M326 L351 L352L323-F328 WeakPolarHBondContact O-CD2 3.49Å; L323-F328 PolarHBondContact O-N 3.25Å; V324-F328 WeakPolarHBondContact CA-O 3.42Å; M326-F328 HydrophobicContact CB-CD2 4.01Å; M326-F328 HydrophobicContact CB-CE2 4.05Å; F328-L351 HydrophobicContact CB-CD1 4.06Å; F328-L351 HydrophobicContact CD1-CB 3.89Å; F328-L351 HydrophobicContact CD1-CD1 4.09Å; F328-L351 HydrophobicContact CD1-CG 4.43Å; F328-L351 HydrophobicContact CD2-CD1 4.24Å; F328-L351 HydrophobicContact CE1-CB 3.81Å; F328-L351 HydrophobicContact CG-CB 4.46Å; F328-L351 HydrophobicContact CG-CD1 3.86Å; F328-L351 HydrophobicContact CZ-CB 4.31Å; F328-L352 HydrophobicContact CE1-CD2 4.49Å; F328-L352 HydrophobicContact CZ-CD2 4Å; F328-L352 HydrophobicContact CZ-CG 4.3Å
329S81.5Confident77.6Confident52 Ų5274.4 Ų74.436%0.36438%0.382SS..  trans-66.4143.8178.394.70000110.2I331 D332 A333S329-I331 PolarHBondContact O-N 3.47Å; S329-I331 VanDerWaalsContact O-N 3.14Å; S329-D332 WeakPolarHBondContact CB-OD2 3.4Å; S329-D332 PolarHBondContact O-N 3.14Å; S329-D332 PolarHBondContact OG-N 2.85Å; S329-D332 PolarHBondContact OG-OD1 2.99Å; S329-D332 PolarHBondContact OG-OD2 2.88Å; S329-A333 WeakPolarHBondContact O-CB 3.42Å; S329-A333 PolarHBondContact O-N 3.48Å
330R77.1Confident77.7Confident155 Ų15574 Ų7459%0.58538%0.382SS*.Hα-helixtrans-57.9-30.4179.9-171.4-180-177.7-139.52112.1V320 V324 L334V320-R330 HydrophobicContact CG1-CG 3.87Å; V324-R330 HydrophobicContact CG2-CB 3.91Å; V324-R330 HydrophobicContact CG2-CG 4.28Å; R330-L334 HydrophobicContact CG-CD1 4.35Å; R330-L334 WeakPolarHBondContact O-CB 3.48Å; R330-L334 WeakPolarHBondContact O-CD1 3.3Å; R330-L334 VanDerWaalsContact O-CG 3.3Å; R330-L334 WeakPolarHBondContact O-CG 3.47Å; R330-L334 PolarHBondContact O-N 3Å
331I77.3Confident77.5Confident128 Ų12880.2 Ų80.266%0.65642%0.415SS*.Hα-helixtrans-72.1-49.4-178.7-62.1166.3000109.6S329 A333 L334 E335S329-I331 PolarHBondContact O-N 3.47Å; S329-I331 VanDerWaalsContact O-N 3.14Å; I331-A333 VanDerWaalsContact C-N 3.34Å; I331-A333 PolarHBondContact O-N 3.19Å; I331-L334 PolarHBondContact O-N 3.45Å; I331-E335 PolarHBondContact O-N 3.14Å; I331-E335 VanDerWaalsContact O-N 3.08Å
332D79.3Confident77.3Confident73 Ų7381.2 Ų81.239%0.3941%0.413SS..Hα-helixtrans-67.3-37.7179.7-50.5-33.2000110.9S329 L334 E335 A336 L351S329-D332 WeakPolarHBondContact CB-OD2 3.4Å; S329-D332 PolarHBondContact O-N 3.14Å; S329-D332 PolarHBondContact OG-N 2.85Å; S329-D332 PolarHBondContact OG-OD1 2.99Å; S329-D332 PolarHBondContact OG-OD2 2.88Å; D332-L334 PolarHBondContact O-N 3.36Å; D332-E335 PolarHBondContact O-N 2.98Å; D332-A336 VanDerWaalsContact O-CB 3.3Å; D332-A336 WeakPolarHBondContact O-CB 3.46Å; D332-A336 PolarHBondContact O-N 3.29Å; D332-L351 HydrophobicContact CB-CD2 3.53Å
333A79.1Confident77.3Confident0 Ų078.6 Ų78.60%041%0.411CS..Hα-helixtrans-60.9-41.4175.600000112.8L323 S329 I331 L337L323-A333 HydrophobicContact CB-CB 3.68Å; L323-A333 HydrophobicContact CD1-CB 3.88Å; L323-A333 HydrophobicContact CG-CB 4.41Å; S329-A333 WeakPolarHBondContact O-CB 3.42Å; S329-A333 PolarHBondContact O-N 3.48Å; I331-A333 VanDerWaalsContact C-N 3.34Å; I331-A333 PolarHBondContact O-N 3.19Å; A333-L337 WeakPolarHBondContact O-CB 3.19Å; A333-L337 VanDerWaalsContact O-CG 3.31Å; A333-L337 WeakPolarHBondContact O-CG 3.47Å; A333-L337 PolarHBondContact O-N 3.44Å
334L79.3Confident77.4Confident66 Ų6680.6 Ų80.635%0.34642%0.422SS..Hα-helixtrans-67.7-39.7176-80.1168.2000111.9V320 R330 I331 D332 R338V320-L334 HydrophobicContact CG1-CG 4.31Å; V320-L334 HydrophobicContact CG2-CD2 3.49Å; V320-L334 VanDerWaalsContact CG2-CD2 3.49Å; V320-L334 HydrophobicContact CG2-CG 4.01Å; R330-L334 HydrophobicContact CG-CD1 4.35Å; R330-L334 WeakPolarHBondContact O-CB 3.48Å; R330-L334 WeakPolarHBondContact O-CD1 3.3Å; R330-L334 VanDerWaalsContact O-CG 3.3Å; R330-L334 WeakPolarHBondContact O-CG 3.47Å; R330-L334 PolarHBondContact O-N 3Å; I331-L334 PolarHBondContact O-N 3.45Å; D332-L334 PolarHBondContact O-N 3.36Å; L334-R338 WeakPolarHBondContact O-CB 3.29Å; L334-R338 VanDerWaalsContact O-CG 3.28Å; L334-R338 WeakPolarHBondContact O-CG 3.39Å; L334-R338 PolarHBondContact O-N 3.44Å
335E78.1Confident77.3Confident127 Ų12783.6 Ų83.659%0.59344%0.435SS*.Hα-helixtrans-66.7-45177.3-172.3167-171.600111.5I331 D332 L337 R338 A339I331-E335 PolarHBondContact O-N 3.14Å; I331-E335 VanDerWaalsContact O-N 3.08Å; D332-E335 PolarHBondContact O-N 2.98Å; E335-L337 PolarHBondContact O-N 3.42Å; E335-R338 PolarHBondContact O-N 2.99Å; E335-A339 WeakPolarHBondContact O-CB 3.48Å; E335-A339 PolarHBondContact O-N 2.94Å
336A78.2Confident77.4Confident1 Ų181 Ų811%0.00843%0.425CS..Hα-helixtrans-65.2-38.4177.600000112.7D332 A339 S340 A347 F350 L351D332-A336 VanDerWaalsContact O-CB 3.3Å; D332-A336 WeakPolarHBondContact O-CB 3.46Å; D332-A336 PolarHBondContact O-N 3.29Å; A336-A339 PolarHBondContact O-N 3.28Å; A336-S340 WeakPolarHBondContact O-CB 3.43Å; A336-S340 PolarHBondContact O-N 3.36Å; A336-S340 PolarHBondContact O-OG 3.37Å; A336-A347 HydrophobicContact CB-CB 3.93Å; A336-F350 HydrophobicContact CB-CD1 4.37Å; A336-L351 HydrophobicContact CB-CD1 3.96Å; A336-L351 HydrophobicContact CB-CD2 3.92Å; A336-L351 HydrophobicContact CB-CG 3.64Å
337L78.3Confident77.5Confident4 Ų476.4 Ų76.42%0.02140%0.402CS..Hα-helixtrans-70.5-35.3175.1-77.1170.1000112.6Q319 V320 L323 A333 E335 S340 N341 N342 A347Q319-L337 HydrophobicContact CB-CD1 3.96Å; Q319-L337 HydrophobicContact CB-CD2 4.31Å; V320-L337 HydrophobicContact CB-CD1 4.39Å; V320-L337 HydrophobicContact CG2-CD1 3.49Å; V320-L337 VanDerWaalsContact CG2-CD1 3.49Å; L323-L337 HydrophobicContact CD1-CD1 3.56Å; L323-L337 HydrophobicContact CD1-CD2 4.05Å; L323-L337 HydrophobicContact CD1-CG 3.6Å; A333-L337 WeakPolarHBondContact O-CB 3.19Å; A333-L337 VanDerWaalsContact O-CG 3.31Å; A333-L337 WeakPolarHBondContact O-CG 3.47Å; A333-L337 PolarHBondContact O-N 3.44Å; E335-L337 PolarHBondContact O-N 3.42Å; L337-S340 CarbonylContact O-C 3.38Å; L337-S340 PolarHBondContact O-N 2.76Å; L337-N341 PolarHBondContact O-N 3.21Å; L337-N342 PolarHBondContact O-N 2.9Å; L337-A347 HydrophobicContact CD2-CB 3.8Å; L337-A347 HydrophobicContact CG-CB 4.06Å
338R76.7Confident77.7Confident202 Ų20274.3 Ų74.376%0.76238%0.376SS*.Hα-helixtrans-64.3-43.9171-79.4177-179.6168.61.6111.5L334 E335 S340L334-R338 WeakPolarHBondContact O-CB 3.29Å; L334-R338 VanDerWaalsContact O-CG 3.28Å; L334-R338 WeakPolarHBondContact O-CG 3.39Å; L334-R338 PolarHBondContact O-N 3.44Å; E335-R338 PolarHBondContact O-N 2.99Å; R338-S340 VanDerWaalsContact C-N 3.27Å; R338-S340 PolarHBondContact O-N 3.07Å
339A75Confident77.8Confident68 Ų6875.6 Ų75.656%0.56239%0.385SS*.Hα-helixtrans-67.1-30177.100000112.5E335 A336E335-A339 WeakPolarHBondContact O-CB 3.48Å; E335-A339 PolarHBondContact O-N 2.94Å; A336-A339 PolarHBondContact O-N 3.28Å
340S76.4Confident77.7Confident19 Ų1977.9 Ų77.913%0.13339%0.389CS..THydrogen-bonded Turntrans-100.312.2-176.3-53.10000114A336 L337 R338 N342 D343 A347A336-S340 WeakPolarHBondContact O-CB 3.43Å; A336-S340 PolarHBondContact O-N 3.36Å; A336-S340 PolarHBondContact O-OG 3.37Å; L337-S340 CarbonylContact O-C 3.38Å; L337-S340 PolarHBondContact O-N 2.76Å; R338-S340 VanDerWaalsContact C-N 3.27Å; R338-S340 PolarHBondContact O-N 3.07Å; S340-N342 VanDerWaalsContact C-N 3.33Å; S340-N342 PolarHBondContact O-N 3.34Å; S340-D343 WeakPolarHBondContact O-CB 3.42Å; S340-D343 PolarHBondContact O-N 3.01Å; S340-A347 WeakPolarHBondContact OG-CA 3.28Å; S340-A347 PolarHBondContact OG-N 3.19Å
341N73.1Confident77.6Confident141 Ų14171.4 Ų71.475%0.75437%0.366SS*.THydrogen-bonded Turntrans51.245.9177.8-157.425.8000114L337 D343L337-N341 PolarHBondContact O-N 3.21Å; N341-D343 VanDerWaalsContact C-N 3.32Å; N341-D343 PolarHBondContact O-N 3.47Å
342N72.6Confident77.6Confident70 Ų7071 Ų7137%0.37436%0.364SS..THydrogen-bonded Turntrans64.719.6-177.1-62.2-27.9000116.3Q319 L337 S340Q319-N342 PolarHBondContact NE2-O 3.45Å; Q319-N342 PolarHBondContact OE1-O 3.33Å; L337-N342 PolarHBondContact O-N 2.9Å; S340-N342 VanDerWaalsContact C-N 3.33Å; S340-N342 PolarHBondContact O-N 3.34Å
343D78.5Confident77.2Confident103 Ų10375.2 Ų75.255%0.55138%0.382SS*.  trans-90.2111.1169.5-83.8-37000112.4S340 N341 N345 M346 A347S340-D343 WeakPolarHBondContact O-CB 3.42Å; S340-D343 PolarHBondContact O-N 3.01Å; N341-D343 VanDerWaalsContact C-N 3.32Å; N341-D343 PolarHBondContact O-N 3.47Å; D343-N345 PolarHBondContact O-N 3.06Å; D343-M346 HydrophobicContact CB-CB 4.2Å; D343-M346 HydrophobicContact CB-CG 4.46Å; D343-M346 PolarHBondContact O-N 3.38Å; D343-A347 WeakPolarHBondContact O-CB 3.39Å; D343-A347 PolarHBondContact O-N 3.01Å
344I78.9Confident76Confident42 Ų4285.5 Ų85.522%0.21543%0.429CS..Hα-helixtrans-60.3-41.2-177.8-51.7172.9000112.4Q319 M346 A347 T348Q319-I344 HydrophobicContact CB-CD1 4.27Å; Q319-I344 HydrophobicContact CB-CG1 4.03Å; Q319-I344 HydrophobicContact CG-CD1 3.67Å; Q319-I344 HydrophobicContact CG-CG1 3.67Å; I344-M346 VanDerWaalsContact C-N 3.3Å; I344-M346 PolarHBondContact O-N 3.37Å; I344-A347 PolarHBondContact O-N 3.28Å; I344-T348 HydrophobicContact CG2-CG2 4.42Å; I344-T348 WeakPolarHBondContact O-CG2 3.47Å; I344-T348 PolarHBondContact O-N 3.19Å; I344-T348 PolarHBondContact O-OG1 2.97Å
345N79.9Confident75.8Confident125 Ų12586.5 Ų86.567%0.66843%0.433SS*.Hα-helixtrans-70-28.7-176.4-66-30000112.4D343 T348 N349D343-N345 PolarHBondContact O-N 3.06Å; N345-T348 WeakPolarHBondContact CA-OG1 3.31Å; N345-T348 PolarHBondContact O-OG1 3.4Å; N345-T348 VanDerWaalsContact O-OG1 3.06Å; N345-N349 PolarHBondContact O-ND2 3.47Å
346M79Confident75.7Confident110 Ų11084.3 Ų84.354%0.54243%0.425SS..Hα-helixtrans-80.7-40.8173.9-76.4-67.7110.800110.5D343 I344 T348 N349 F350D343-M346 HydrophobicContact CB-CB 4.2Å; D343-M346 HydrophobicContact CB-CG 4.46Å; D343-M346 PolarHBondContact O-N 3.38Å; I344-M346 VanDerWaalsContact C-N 3.3Å; I344-M346 PolarHBondContact O-N 3.37Å; M346-T348 PolarHBondContact O-N 3.27Å; M346-N349 PolarHBondContact O-N 3.06Å; M346-F350 PolarHBondContact O-N 2.92Å
347A77Confident75.6Confident0 Ų088.9 Ų88.90%045%0.448CS..Hα-helixtrans-61-42.2177.300000112.7L323 A336 L337 S340 D343 I344 F350 L351L323-A347 HydrophobicContact CD1-CB 4.31Å; A336-A347 HydrophobicContact CB-CB 3.93Å; L337-A347 HydrophobicContact CD2-CB 3.8Å; L337-A347 HydrophobicContact CG-CB 4.06Å; S340-A347 WeakPolarHBondContact OG-CA 3.28Å; S340-A347 PolarHBondContact OG-N 3.19Å; D343-A347 WeakPolarHBondContact O-CB 3.39Å; D343-A347 PolarHBondContact O-N 3.01Å; I344-A347 PolarHBondContact O-N 3.28Å; A347-F350 WeakPolarHBondContact O-CB 3.39Å; A347-F350 PolarHBondContact O-N 3.41Å; A347-L351 WeakPolarHBondContact O-CG 3.14Å; A347-L351 PolarHBondContact O-N 3.37Å
348T78Confident75.4Confident24 Ų2493.9 Ų93.915%0.14747%0.473CS..Hα-helixtrans-62-42173.944.60000112.6L323 M326 I344 N345 M346 F350 L351 L352L323-T348 HydrophobicContact CD2-CG2 3.47Å; L323-T348 VanDerWaalsContact CD2-CG2 3.47Å; M326-T348 HydrophobicContact CE-CG2 3.61Å; M326-T348 HydrophobicContact SD-CG2 4.5Å; I344-T348 HydrophobicContact CG2-CG2 4.42Å; I344-T348 WeakPolarHBondContact O-CG2 3.47Å; I344-T348 PolarHBondContact O-N 3.19Å; I344-T348 PolarHBondContact O-OG1 2.97Å; N345-T348 WeakPolarHBondContact CA-OG1 3.31Å; N345-T348 PolarHBondContact O-OG1 3.4Å; N345-T348 VanDerWaalsContact O-OG1 3.06Å; M346-T348 PolarHBondContact O-N 3.27Å; T348-F350 VanDerWaalsContact C-N 3.31Å; T348-F350 PolarHBondContact O-N 3.39Å; T348-L351 PolarHBondContact O-N 3.26Å; T348-L352 WeakPolarHBondContact O-CB 3.18Å; T348-L352 VanDerWaalsContact O-CG 3.25Å; T348-L352 WeakPolarHBondContact O-CG 3.44Å; T348-L352 PolarHBondContact O-N 2.98Å
349N81.5Confident75.3Confident78 Ų7887.2 Ų87.242%0.41746%0.455SS..Hα-helixtrans-65.6-35.5176.1-82.1-54.9000112.1N345 M346 L352 Q353N345-N349 PolarHBondContact O-ND2 3.47Å; M346-N349 PolarHBondContact O-N 3.06Å; N349-L352 PolarHBondContact O-N 3.06Å; N349-Q353 VanDerWaalsContact O-CG 3.3Å; N349-Q353 WeakPolarHBondContact O-CG 3.35Å; N349-Q353 PolarHBondContact O-N 3.39Å
350F78.4Confident75.4Confident99 Ų9988.5 Ų88.543%0.43445%0.448SS..Hα-helixtrans-65.8-42.9175.6-160.4-93.3000111.6A336 M346 A347 T348 L352 Q353A336-F350 HydrophobicContact CB-CD1 4.37Å; M346-F350 PolarHBondContact O-N 2.92Å; A347-F350 WeakPolarHBondContact O-CB 3.39Å; A347-F350 PolarHBondContact O-N 3.41Å; T348-F350 VanDerWaalsContact C-N 3.31Å; T348-F350 PolarHBondContact O-N 3.39Å; F350-L352 VanDerWaalsContact C-N 3.31Å; F350-L352 PolarHBondContact O-N 3.27Å; F350-Q353 PolarHBondContact O-N 3.2Å
351L75.7Confident75.3Confident20 Ų2093.4 Ų93.411%0.10547%0.47CS..Hα-helixtrans-71.3-21177.8-70.1170.1000114.6L323 F328 D332 A336 A347 T348L323-L351 HydrophobicContact CD2-CD1 4.1Å; F328-L351 HydrophobicContact CB-CD1 4.06Å; F328-L351 HydrophobicContact CD1-CB 3.89Å; F328-L351 HydrophobicContact CD1-CD1 4.09Å; F328-L351 HydrophobicContact CD1-CG 4.43Å; F328-L351 HydrophobicContact CD2-CD1 4.24Å; F328-L351 HydrophobicContact CE1-CB 3.81Å; F328-L351 HydrophobicContact CG-CB 4.46Å; F328-L351 HydrophobicContact CG-CD1 3.86Å; F328-L351 HydrophobicContact CZ-CB 4.31Å; D332-L351 HydrophobicContact CB-CD2 3.53Å; A336-L351 HydrophobicContact CB-CD1 3.96Å; A336-L351 HydrophobicContact CB-CD2 3.92Å; A336-L351 HydrophobicContact CB-CG 3.64Å; A347-L351 WeakPolarHBondContact O-CG 3.14Å; A347-L351 PolarHBondContact O-N 3.37Å; T348-L351 PolarHBondContact O-N 3.26Å
352L77.8Confident75.5Confident120 Ų12089.8 Ų89.863%0.62845%0.448SS*.Hα-helixtrans-87.7-16.8175.9-72.7170000112.9F328 T348 N349 F350F328-L352 HydrophobicContact CE1-CD2 4.49Å; F328-L352 HydrophobicContact CZ-CD2 4Å; F328-L352 HydrophobicContact CZ-CG 4.3Å; T348-L352 WeakPolarHBondContact O-CB 3.18Å; T348-L352 VanDerWaalsContact O-CG 3.25Å; T348-L352 WeakPolarHBondContact O-CG 3.44Å; T348-L352 PolarHBondContact O-N 2.98Å; N349-L352 PolarHBondContact O-N 3.06Å; F350-L352 VanDerWaalsContact C-N 3.31Å; F350-L352 PolarHBondContact O-N 3.27Å
353Q69.3Low75.7Confident161 Ų16191.4 Ų91.475%0.75246%0.455SS*.Hα-helixtrans-89.1-14.7179.1-77179.18.300113.3N349 F350N349-Q353 VanDerWaalsContact O-CG 3.3Å; N349-Q353 WeakPolarHBondContact O-CG 3.35Å; N349-Q353 PolarHBondContact O-N 3.39Å; F350-Q353 PolarHBondContact O-N 3.2Å
354H54.6Low75.5Confident215 Ų21590.4 Ų90.4100%0.99545%0.446SS*.  trans-112.90178.4-120.7-68.7000110.3

Retrieved 354 of 354 residues in 506.6 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).