A0A060W402_ONCMY Loading...

Spermatogenesis-associated serine-rich protein 2

AlphaFold DB , UniProt , Accession A0A060W402, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110492121, Length 499 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M33.6Very low36.3Very low252 Ų252166 Ų166100%1.24188%0.881SS**  0147.80-56.2178.9-164.400108.2
2A38.2Very low36.4Very low103 Ų103157 Ų15785%0.85186%0.857SS**  trans-139.2139.8170.600000108.8
3K35.4Very low36.6Very low219 Ų219154.4 Ų154.495%0.95284%0.838SS**  trans-125.7116.7175.5-113.2177.1178.3177.70110.3
4K40.9Very low37.6Very low194 Ų194151.4 Ų151.484%0.84383%0.827SS**  trans-68.1128.5-178.8178.2179.7178.7-179.30110
5N31.5Very low37.6Very low157 Ų157150.2 Ų150.284%0.8481%0.811SS**  trans-77.1144.3167.6-165.111.4000109.4
6S31.4Very low38.1Very low92 Ų92146 Ų14664%0.64379%0.788SS**  trans-136.6127.3-179-123.50000108.9
7Q38.7Very low38.9Very low198 Ų198145.5 Ų145.593%0.92579%0.791SS**  trans-60.8145171.2-68.5167.2-73.500110.3
8K35.9Very low39.5Very low194 Ų194145.3 Ų145.384%0.84379%0.789SS**  trans-149.3124.1162.4-169.7175.7-176.2-179.80108.9
9D38.4Very low39.9Very low151 Ų151144.2 Ų144.281%0.80778%0.782SS**  trans-66.5141.3-176.7-56.1-88.5000112.8
10T34.3Very low40.1Very low136 Ų136147.1 Ų147.183%0.83479%0.787SS**  trans-13364.7169.358.80000110G12T10-G12 PolarHBondContact O-N 3.49Å
11S40.9Very low40.4Very low130 Ų130145.9 Ų145.991%0.90978%0.778SS**  trans-67.798167.4-174.60000109.1
12G37.5Very low40.9Very low58 Ų58137.8 Ų137.860%0.59874%0.742SS**  trans-126.283.3-174.500000111.8T10 V14T10-G12 PolarHBondContact O-N 3.49Å; G12-V14 PolarHBondContact O-N 2.84Å
13M39.4Very low41.2Very low123 Ų123138.9 Ų138.961%0.60673%0.731SS**  trans-81.399.8177.9-169.3-177.8-163.800110.4F15 V22M13-F15 HydrophobicContact CE-CE1 4.49Å; M13-F15 HydrophobicContact CE-CE2 3.96Å; M13-F15 HydrophobicContact CE-CZ 3.63Å; M13-F15 HydrophobicContact CG-CD2 4.42Å; M13-F15 HydrophobicContact CG-CE2 3.86Å; M13-F15 HydrophobicContact CG-CZ 4.47Å; M13-F15 HydrophobicContact SD-CE2 3.72Å; M13-F15 HydrophobicContact SD-CZ 3.97Å; M13-V22 HydrophobicContact CE-CB 4.32Å; M13-V22 HydrophobicContact CE-CG1 3.54Å; M13-V22 HydrophobicContact CE-CG2 3.74Å
14V49.9Very low41.5Very low112 Ų112133.8 Ų133.868%0.67972%0.723SS**  trans-95.6127.8178-174.90000110.2G12G12-V14 PolarHBondContact O-N 2.84Å
15F38.3Very low41.7Very low134 Ų134133.4 Ų133.459%0.58873%0.725SS**BIsolated β-bridgetrans-99.5125.5173.8-75.1-98.5000110.1M13 V22M13-F15 HydrophobicContact CE-CE1 4.49Å; M13-F15 HydrophobicContact CE-CE2 3.96Å; M13-F15 HydrophobicContact CE-CZ 3.63Å; M13-F15 HydrophobicContact CG-CD2 4.42Å; M13-F15 HydrophobicContact CG-CE2 3.86Å; M13-F15 HydrophobicContact CG-CZ 4.47Å; M13-F15 HydrophobicContact SD-CE2 3.72Å; M13-F15 HydrophobicContact SD-CZ 3.97Å; F15-V22 HydrophobicContact CD1-CG2 4.17Å; F15-V22 HydrophobicContact CE1-CG2 3.59Å; F15-V22 HydrophobicContact CZ-CG2 4.04Å
16D45.8Very low42.5Very low83 Ų83129.5 Ų129.544%0.44472%0.722SS.*  trans-94.4114.6169.5-167.7-31.3000110.6N18 L19 K20D16-N18 PolarHBondContact O-N 3.1Å; D16-N18 WeakPolarHBondContact OD1-CB 3.21Å; D16-N18 PolarHBondContact OD1-N 2.71Å; D16-N18 PolarHBondContact OD1-ND2 2.72Å; D16-L19 PolarHBondContact O-N 3.38Å; D16-K20 PolarHBondContact O-N 2.67Å; D16-K20 VanDerWaalsContact O-N 3.12Å
17T50.7Low43.4Very low137 Ų137127.7 Ų127.784%0.8472%0.717SS**THydrogen-bonded Turntrans-64-18.8-178.6-280000113.5
18N50.4Low44.4Very low142 Ų142123.2 Ų123.276%0.75970%0.704SS**THydrogen-bonded Turntrans-84.5-34.1-178.1-60.7-81000113.2D16D16-N18 PolarHBondContact O-N 3.1Å; D16-N18 WeakPolarHBondContact OD1-CB 3.21Å; D16-N18 PolarHBondContact OD1-N 2.71Å; D16-N18 PolarHBondContact OD1-ND2 2.72Å
19L46.6Very low45.4Very low124 Ų124120.8 Ų120.865%0.64969%0.693SS**THydrogen-bonded Turntrans-104.3-13.1-177.9-9571.2000114D16 M21D16-L19 PolarHBondContact O-N 3.38Å; L19-M21 PolarHBondContact O-N 3.1Å; L19-M21 VanDerWaalsContact O-N 3.15Å
20K43.8Very low46.7Very low202 Ų202118.5 Ų118.588%0.87868%0.678SS**  trans57.929.6173.5-148.9179.7-172.8-179.30113.8D16D16-K20 PolarHBondContact O-N 2.67Å; D16-K20 VanDerWaalsContact O-N 3.12Å
21M47.6Very low48.9Very low123 Ų123120.2 Ų120.261%0.60667%0.669SS**  trans-123153.3177.7-87.5171.548.400110.6L19L19-M21 PolarHBondContact O-N 3.1Å; L19-M21 VanDerWaalsContact O-N 3.15Å
22V43.4Very low51.1Low81 Ų81116.6 Ų116.649%0.49164%0.638SS.*BIsolated β-bridgetrans-90.2129.8169174.80000108.3M13 F15M13-V22 HydrophobicContact CE-CB 4.32Å; M13-V22 HydrophobicContact CE-CG1 3.54Å; M13-V22 HydrophobicContact CE-CG2 3.74Å; F15-V22 HydrophobicContact CD1-CG2 4.17Å; F15-V22 HydrophobicContact CE1-CG2 3.59Å; F15-V22 HydrophobicContact CZ-CG2 4.04Å
23M44.3Very low53.6Low126 Ų126118.9 Ų118.962%0.62163%0.632SS**  trans-112.7123172.2-66.9-164.273.700110.9
24S42.1Very low56.2Low112 Ų112119.4 Ų119.478%0.78363%0.633SS**  trans-75.1132.7159.4-173.80000108.7
25Q45.7Very low58.3Low187 Ų187116.5 Ų116.587%0.87461%0.611SS**  trans-88.9133-169.2-167.4179.421.900112.5
26G46.8Very low60.9Low75 Ų75111.2 Ų111.277%0.77359%0.589SS**SBendtrans93.4102.3161.200000116
27G51.3Low63.3Low54 Ų54111.1 Ų111.156%0.55759%0.594SS**SBendtrans131.5-45.4164.200000114.8F29 R31G27-F29 PolarHBondContact O-N 3.26Å; G27-R31 PolarHBondContact O-N 3.23Å
28T58.4Low65.5Low104 Ų104106.6 Ų106.664%0.63857%0.571SS**Hα-helixtrans-65.9-38.7-177.648.70000113.4R31 M32T28-R31 PolarHBondContact O-N 3.07Å; T28-M32 PolarHBondContact O-N 2.93Å
29F57Low67.6Low142 Ų14299.8 Ų99.862%0.62354%0.535SS*.Hα-helixtrans-66.4-45.7-176.8-175.9-101.3000113.2G27 M32 K33G27-F29 PolarHBondContact O-N 3.26Å; F29-M32 PolarHBondContact O-N 2.94Å; F29-K33 HydrophobicContact CE1-CD 4.33Å; F29-K33 WeakPolarHBondContact O-CB 3.02Å; F29-K33 PolarHBondContact O-N 3.28Å
30E67.3Low69.9Low103 Ų103100 Ų10048%0.48153%0.527SS..Hα-helixtrans-66.2-39.9176.8-73.2-62.4147.500111.3M32 K33 E34E30-M32 VanDerWaalsContact C-N 3.25Å; E30-M32 PolarHBondContact O-N 3.34Å; E30-K33 PolarHBondContact O-N 3.04Å; E30-K33 IonicContact OE1-NZ 2.75Å; E30-K33 PolarHBondContact OE1-NZ 3.07Å; E30-K33 IonicContact OE2-NZ 2.65Å; E30-K33 PolarHBondContact OE2-NZ 3.48Å; E30-E34 WeakPolarHBondContact O-CB 3.49Å; E30-E34 PolarHBondContact O-N 3.13Å
31R79.5Confident72.4Confident172 Ų17294.4 Ų94.465%0.64952%0.519SS*.Hα-helixtrans-62.2-30.2173.4-162.3179.5-168.4-166.94.3112.9G27 T28 K35G27-R31 PolarHBondContact O-N 3.23Å; T28-R31 PolarHBondContact O-N 3.07Å; R31-K35 VanDerWaalsContact O-CG 3.27Å; R31-K35 WeakPolarHBondContact O-CG 3.39Å; R31-K35 PolarHBondContact O-N 3.39Å
32M87.2Confident74.6Confident55 Ų5592.4 Ų92.427%0.27151%0.513SS..Hα-helixtrans-78-41.1173.3179.1158.4-83.500112T28 F29 E30 E34 K35 I36 V52 N60T28-M32 PolarHBondContact O-N 2.93Å; F29-M32 PolarHBondContact O-N 2.94Å; E30-M32 VanDerWaalsContact C-N 3.25Å; E30-M32 PolarHBondContact O-N 3.34Å; M32-E34 VanDerWaalsContact C-N 3.34Å; M32-E34 PolarHBondContact O-N 3.31Å; M32-K35 PolarHBondContact O-N 3.19Å; M32-I36 HydrophobicContact CG-CD1 3.93Å; M32-I36 HydrophobicContact CG-CG1 4.4Å; M32-I36 VanDerWaalsContact O-CG1 3.25Å; M32-I36 WeakPolarHBondContact O-CG1 3.29Å; M32-I36 PolarHBondContact O-N 3.17Å; M32-V52 HydrophobicContact SD-CG1 4.39Å; M32-V52 HydrophobicContact SD-CG2 4.28Å; M32-N60 WeakPolarHBondContact CE-OD1 3.45Å
33K90.2Very high76.9Confident106 Ų10689.2 Ų89.246%0.46149%0.494SS..Hα-helixtrans-61-39.9175.4174.8173.6154.7-129.30112.4F29 E30 S37F29-K33 HydrophobicContact CE1-CD 4.33Å; F29-K33 WeakPolarHBondContact O-CB 3.02Å; F29-K33 PolarHBondContact O-N 3.28Å; E30-K33 PolarHBondContact O-N 3.04Å; E30-K33 IonicContact OE1-NZ 2.75Å; E30-K33 PolarHBondContact OE1-NZ 3.07Å; E30-K33 IonicContact OE2-NZ 2.65Å; E30-K33 PolarHBondContact OE2-NZ 3.48Å; K33-S37 WeakPolarHBondContact O-CB 3.44Å; K33-S37 PolarHBondContact O-N 3.43Å
34E93.6Very high79Confident134 Ų13486.9 Ų86.963%0.62649%0.488SS*.Hα-helixtrans-59.8-50.6170.5-178.5178-143.600111.5E30 M32 I36 S37 A38E30-E34 WeakPolarHBondContact O-CB 3.49Å; E30-E34 PolarHBondContact O-N 3.13Å; M32-E34 VanDerWaalsContact C-N 3.34Å; M32-E34 PolarHBondContact O-N 3.31Å; E34-I36 PolarHBondContact O-N 3Å; E34-S37 WeakPolarHBondContact O-CA 3.45Å; E34-S37 WeakPolarHBondContact O-CB 3.2Å; E34-S37 PolarHBondContact O-N 3.39Å; E34-S37 VanDerWaalsContact O-N 3.09Å; E34-A38 PolarHBondContact O-N 3.26Å
35K93.8Very high81.3Confident51 Ų5189 Ų8922%0.22249%0.49CS..Hα-helixtrans-60.9-41.5177.1-71.7179.4174.6-163.50113R31 M32 S37 A38 V39 L55 N60 V62R31-K35 VanDerWaalsContact O-CG 3.27Å; R31-K35 WeakPolarHBondContact O-CG 3.39Å; R31-K35 PolarHBondContact O-N 3.39Å; M32-K35 PolarHBondContact O-N 3.19Å; K35-S37 VanDerWaalsContact C-N 3.31Å; K35-S37 PolarHBondContact O-N 2.99Å; K35-A38 PolarHBondContact O-N 3.46Å; K35-V39 WeakPolarHBondContact O-CG2 3.44Å; K35-V39 PolarHBondContact O-N 3.45Å; K35-L55 HydrophobicContact CB-CD1 3.98Å; K35-L55 HydrophobicContact CB-CD2 4.48Å; K35-N60 HydrophobicContact CD-CB 4.07Å; K35-N60 WeakPolarHBondContact CD-O 3.48Å; K35-N60 WeakPolarHBondContact CE-O 3.34Å; K35-N60 PolarHBondContact NZ-O 3.15Å; K35-V62 HydrophobicContact CB-CG2 3.86Å; K35-V62 HydrophobicContact CD-CG2 4.29Å; K35-V62 HydrophobicContact CG-CG2 3.68Å
36I94.6Very high83.5Confident22 Ų2282.7 Ų82.711%0.11346%0.46CS..Hα-helixtrans-60.2-43.6173.3-65159.6000110.2M32 E34 A38 R40 N48 I51 V52 L55M32-I36 HydrophobicContact CG-CD1 3.93Å; M32-I36 HydrophobicContact CG-CG1 4.4Å; M32-I36 VanDerWaalsContact O-CG1 3.25Å; M32-I36 WeakPolarHBondContact O-CG1 3.29Å; M32-I36 PolarHBondContact O-N 3.17Å; E34-I36 PolarHBondContact O-N 3Å; I36-A38 PolarHBondContact O-N 3.01Å; I36-R40 WeakPolarHBondContact O-CB 3.44Å; I36-R40 PolarHBondContact O-N 2.93Å; I36-N48 HydrophobicContact CG2-CB 4.06Å; I36-I51 HydrophobicContact CB-CG2 4.22Å; I36-I51 HydrophobicContact CG1-CG2 4.12Å; I36-I51 HydrophobicContact CG2-CB 4.46Å; I36-I51 HydrophobicContact CG2-CD1 4.45Å; I36-I51 HydrophobicContact CG2-CG2 4.09Å; I36-V52 HydrophobicContact CD1-CG2 3.44Å; I36-V52 VanDerWaalsContact CD1-CG2 3.44Å; I36-V52 HydrophobicContact CG1-CG2 3.88Å; I36-L55 HydrophobicContact CG1-CD1 4.15Å
37S95.5Very high85.7Confident81 Ų8181.6 Ų81.657%0.56644%0.441SS*.Hα-helixtrans-64.5-38178.1-164.10000112.5K33 E34 K35 R40 A41K33-S37 WeakPolarHBondContact O-CB 3.44Å; K33-S37 PolarHBondContact O-N 3.43Å; E34-S37 WeakPolarHBondContact O-CA 3.45Å; E34-S37 WeakPolarHBondContact O-CB 3.2Å; E34-S37 PolarHBondContact O-N 3.39Å; E34-S37 VanDerWaalsContact O-N 3.09Å; K35-S37 VanDerWaalsContact C-N 3.31Å; K35-S37 PolarHBondContact O-N 2.99Å; S37-R40 PolarHBondContact O-N 3.3Å; S37-A41 PolarHBondContact O-N 2.63Å
38A95.8Very high87.7Confident42 Ų4282.7 Ų82.735%0.34743%0.434SS..Hα-helixtrans-65.9-49.317700000111.9E34 K35 I36 R40 A41 V62E34-A38 PolarHBondContact O-N 3.26Å; K35-A38 PolarHBondContact O-N 3.46Å; I36-A38 PolarHBondContact O-N 3.01Å; A38-R40 VanDerWaalsContact C-N 3.31Å; A38-R40 PolarHBondContact O-N 3.02Å; A38-A41 WeakPolarHBondContact O-CB 3.24Å; A38-A41 PolarHBondContact O-N 2.85Å; A38-V62 HydrophobicContact CB-CG1 3.94Å; A38-V62 HydrophobicContact CB-CG2 4.48Å
39V95.2Very high89.4Confident0 Ų083.6 Ų83.60%044%0.435CS..Hα-helixtrans-59.3-43.9174.6178.10000110.7K35 A41 V42 V43 I51 L55 V62 A65 V66 F69K35-V39 WeakPolarHBondContact O-CG2 3.44Å; K35-V39 PolarHBondContact O-N 3.45Å; V39-A41 VanDerWaalsContact C-N 3.29Å; V39-A41 PolarHBondContact O-N 3.12Å; V39-V42 PolarHBondContact O-N 3.02Å; V39-V43 HydrophobicContact CG1-CG2 4.44Å; V39-V43 PolarHBondContact O-N 3.02Å; V39-I51 HydrophobicContact CB-CG2 3.77Å; V39-I51 HydrophobicContact CG1-CD1 4.32Å; V39-I51 HydrophobicContact CG1-CG1 4.09Å; V39-I51 HydrophobicContact CG1-CG2 3.87Å; V39-I51 HydrophobicContact CG2-CG2 4.12Å; V39-L55 HydrophobicContact CG2-CD1 4.38Å; V39-L55 HydrophobicContact CG2-CD2 4.07Å; V39-L55 HydrophobicContact CG2-CG 4.33Å; V39-V62 HydrophobicContact CG2-CG1 3.94Å; V39-A65 HydrophobicContact CG2-CB 4.18Å; V39-V66 HydrophobicContact CB-CG2 4.23Å; V39-V66 HydrophobicContact CG1-CG2 4.1Å; V39-V66 HydrophobicContact CG2-CG2 4.14Å; V39-F69 HydrophobicContact CG1-CD2 3.81Å; V39-F69 HydrophobicContact CG1-CE2 3.97Å
40R95.4Very high91.1Very high127 Ų12780 Ų8048%0.47942%0.42SS..Hα-helixtrans-70.2-20.4-177.5-165.4169.6179.1-122.8-5.4114I36 S37 A38 V42 V43 P44 I51I36-R40 WeakPolarHBondContact O-CB 3.44Å; I36-R40 PolarHBondContact O-N 2.93Å; S37-R40 PolarHBondContact O-N 3.3Å; A38-R40 VanDerWaalsContact C-N 3.31Å; A38-R40 PolarHBondContact O-N 3.02Å; R40-V42 VanDerWaalsContact C-N 3.32Å; R40-V43 CarbonylContact O-C 3.59Å; R40-P44 VanDerWaalsContact O-CA 3.31Å; R40-P44 WeakPolarHBondContact O-CA 3.47Å; R40-I51 HydrophobicContact CB-CD1 3.87Å; R40-I51 HydrophobicContact CG-CD1 4.23Å
41A95.1Very high92.3Very high86 Ų8675.1 Ų75.171%0.71140%0.397SS*.Hα-helixtrans-68.3-32.6171.900000112.2S37 A38 V39S37-A41 PolarHBondContact O-N 2.63Å; A38-A41 WeakPolarHBondContact O-CB 3.24Å; A38-A41 PolarHBondContact O-N 2.85Å; V39-A41 VanDerWaalsContact C-N 3.29Å; V39-A41 PolarHBondContact O-N 3.12Å
42V93.9Very high93Very high81 Ų8168.8 Ų68.849%0.49138%0.377SS..Hα-helixtrans-88.6-34.8174.8-1710000111.4V39 R40 P44 V66 L70V39-V42 PolarHBondContact O-N 3.02Å; R40-V42 VanDerWaalsContact C-N 3.32Å; V42-P44 WeakPolarHBondContact O-CD 3.05Å; V42-V66 HydrophobicContact CB-CG1 4.05Å; V42-V66 HydrophobicContact CB-CG2 4.33Å; V42-V66 HydrophobicContact CG1-CG1 3.71Å; V42-V66 HydrophobicContact CG2-CG1 4.34Å; V42-V66 HydrophobicContact CG2-CG2 4.35Å; V42-L70 HydrophobicContact CG1-CD1 4.45Å
43V91.9Very high93.3Very high13 Ų1368.4 Ų68.48%0.07938%0.376CS..  trans-123.271.1-174.6-151.40000111.6V39 R40 N45 K46 F69V39-V43 HydrophobicContact CG1-CG2 4.44Å; V39-V43 PolarHBondContact O-N 3.02Å; R40-V43 CarbonylContact O-C 3.59Å; V43-N45 PolarHBondContact O-N 3.39Å; V43-N45 VanDerWaalsContact O-N 3.16Å; V43-K46 HydrophobicContact CB-CG 4.18Å; V43-K46 HydrophobicContact CG1-CD 4.4Å; V43-K46 HydrophobicContact CG1-CG 3.5Å; V43-K46 PolarHBondContact O-N 3.06Å; V43-F69 HydrophobicContact CB-CB 4.41Å; V43-F69 HydrophobicContact CG1-CB 4.01Å; V43-F69 HydrophobicContact CG1-CG 4.42Å; V43-F69 HydrophobicContact CG2-CB 3.84Å; V43-F69 HydrophobicContact CG2-CG 4.48Å
44P89.7Confident93.5Very high78 Ų7863.3 Ų63.351%0.50635%0.354SS..THydrogen-bonded Turntrans-65.5-22.9-170.725.5-35.8000114.4R40 V42 K46R40-P44 VanDerWaalsContact O-CA 3.31Å; R40-P44 WeakPolarHBondContact O-CA 3.47Å; V42-P44 WeakPolarHBondContact O-CD 3.05Å; P44-K46 VanDerWaalsContact C-N 3.29Å; P44-K46 PolarHBondContact O-N 2.86Å
45N90.3Very high93.5Very high155 Ų15557 Ų5783%0.82932%0.324SS*.THydrogen-bonded Turntrans-85.812.5-175-63.9-21.6000114.2V43V43-N45 PolarHBondContact O-N 3.39Å; V43-N45 VanDerWaalsContact O-N 3.16Å
46K92Very high93.4Very high55 Ų5559.6 Ų59.624%0.23934%0.338CS..SBendtrans-110.5146178-55.9-63.4179.3174.80111V43 P44 I51 F69V43-K46 HydrophobicContact CB-CG 4.18Å; V43-K46 HydrophobicContact CG1-CD 4.4Å; V43-K46 HydrophobicContact CG1-CG 3.5Å; V43-K46 PolarHBondContact O-N 3.06Å; P44-K46 VanDerWaalsContact C-N 3.29Å; P44-K46 PolarHBondContact O-N 2.86Å; K46-I51 HydrophobicContact CB-CD1 4.08Å; K46-I51 HydrophobicContact CB-CG1 3.97Å; K46-F69 HydrophobicContact CB-CE1 4.35Å; K46-F69 HydrophobicContact CB-CZ 4.41Å; K46-F69 HydrophobicContact CD-CD1 3.81Å; K46-F69 HydrophobicContact CD-CE1 3.75Å; K46-F69 HydrophobicContact CG-CD1 3.83Å; K46-F69 HydrophobicContact CG-CE1 3.81Å; K46-F69 HydrophobicContact CG-CG 4.29Å; K46-F69 HydrophobicContact CG-CZ 4.27Å
47S93.1Very high93.2Very high52 Ų5262.7 Ų62.736%0.36435%0.351SS..  trans-78.3152.3176.471.90000111.7N49 E50 I51S47-N49 PolarHBondContact O-N 2.68Å; S47-N49 VanDerWaalsContact O-N 3.15Å; S47-E50 WeakPolarHBondContact CB-OE2 3.44Å; S47-E50 PolarHBondContact N-OE2 3.43Å; S47-E50 PolarHBondContact O-N 3.4Å; S47-E50 WeakPolarHBondContact OG-CG 3.21Å; S47-E50 PolarHBondContact OG-N 3.27Å; S47-E50 PolarHBondContact OG-OE2 2.88Å; S47-I51 WeakPolarHBondContact O-CG1 3.46Å; S47-I51 PolarHBondContact O-N 3.13Å
48N93.1Very high93Very high77 Ų7761.2 Ų61.241%0.41234%0.335SS..Hα-helixtrans-56-33.1177.1-64.85.1000112.2I36 I51 V52I36-N48 HydrophobicContact CG2-CB 4.06Å; N48-I51 PolarHBondContact O-N 2.89Å; N48-V52 VanDerWaalsContact O-CG2 3.3Å; N48-V52 WeakPolarHBondContact O-CG2 3.44Å; N48-V52 PolarHBondContact O-N 3.02Å
49N92.5Very high92.7Very high124 Ų12467.4 Ų67.466%0.66336%0.356SS*.Hα-helixtrans-70.6-42.6-179.6-66.15.5000111.8S47 I51 V52 L53S47-N49 PolarHBondContact O-N 2.68Å; S47-N49 VanDerWaalsContact O-N 3.15Å; N49-I51 VanDerWaalsContact C-N 3.33Å; N49-V52 PolarHBondContact O-N 3.31Å; N49-L53 WeakPolarHBondContact O-CG 3.3Å; N49-L53 PolarHBondContact O-N 2.9Å; N49-L53 VanDerWaalsContact O-N 3.09Å
50E92.6Very high92.5Very high67 Ų6769.8 Ų69.831%0.31337%0.369SS..Hα-helixtrans-62.6-43.2173.5-69163.1110.500110.9S47 V52 L53 V54 F69 L78S47-E50 WeakPolarHBondContact CB-OE2 3.44Å; S47-E50 PolarHBondContact N-OE2 3.43Å; S47-E50 PolarHBondContact O-N 3.4Å; S47-E50 WeakPolarHBondContact OG-CG 3.21Å; S47-E50 PolarHBondContact OG-N 3.27Å; S47-E50 PolarHBondContact OG-OE2 2.88Å; E50-V52 VanDerWaalsContact C-N 3.34Å; E50-V52 PolarHBondContact O-N 3.13Å; E50-L53 PolarHBondContact O-N 3.41Å; E50-V54 WeakPolarHBondContact O-CG2 3.38Å; E50-V54 PolarHBondContact O-N 3.36Å; E50-F69 HydrophobicContact CB-CZ 4.31Å; E50-L78 HydrophobicContact CB-CD1 3.88Å; E50-L78 HydrophobicContact CB-CD2 3.92Å; E50-L78 HydrophobicContact CG-CD1 3.91Å; E50-L78 HydrophobicContact CG-CD2 4.04Å
51I94.3Very high92.4Very high0 Ų065.6 Ų65.60%036%0.359CS..Hα-helixtrans-62-40.8177.8-66168.5000111.1I36 V39 R40 K46 S47 N48 N49 L55 F69I36-I51 HydrophobicContact CB-CG2 4.22Å; I36-I51 HydrophobicContact CG1-CG2 4.12Å; I36-I51 HydrophobicContact CG2-CB 4.46Å; I36-I51 HydrophobicContact CG2-CD1 4.45Å; I36-I51 HydrophobicContact CG2-CG2 4.09Å; V39-I51 HydrophobicContact CB-CG2 3.77Å; V39-I51 HydrophobicContact CG1-CD1 4.32Å; V39-I51 HydrophobicContact CG1-CG1 4.09Å; V39-I51 HydrophobicContact CG1-CG2 3.87Å; V39-I51 HydrophobicContact CG2-CG2 4.12Å; R40-I51 HydrophobicContact CB-CD1 3.87Å; R40-I51 HydrophobicContact CG-CD1 4.23Å; K46-I51 HydrophobicContact CB-CD1 4.08Å; K46-I51 HydrophobicContact CB-CG1 3.97Å; S47-I51 WeakPolarHBondContact O-CG1 3.46Å; S47-I51 PolarHBondContact O-N 3.13Å; N48-I51 PolarHBondContact O-N 2.89Å; N49-I51 VanDerWaalsContact C-N 3.33Å; I51-L55 HydrophobicContact CG2-CD1 3.76Å; I51-L55 HydrophobicContact CG2-CG 4.28Å; I51-L55 VanDerWaalsContact O-CB 3.23Å; I51-L55 WeakPolarHBondContact O-CB 3.33Å; I51-L55 VanDerWaalsContact O-CG 3.24Å; I51-L55 WeakPolarHBondContact O-CG 3.4Å; I51-L55 PolarHBondContact O-N 3.11Å; I51-F69 HydrophobicContact CB-CE2 4.4Å; I51-F69 HydrophobicContact CG1-CE2 3.84Å; I51-F69 HydrophobicContact CG1-CZ 4.07Å
52V93.8Very high92.3Very high38 Ų3863 Ų6323%0.2333%0.334CS..Hα-helixtrans-62.4-44.9174.6166.20000112M32 I36 N48 N49 E50 L55 Q56M32-V52 HydrophobicContact SD-CG1 4.39Å; M32-V52 HydrophobicContact SD-CG2 4.28Å; I36-V52 HydrophobicContact CD1-CG2 3.44Å; I36-V52 VanDerWaalsContact CD1-CG2 3.44Å; I36-V52 HydrophobicContact CG1-CG2 3.88Å; N48-V52 VanDerWaalsContact O-CG2 3.3Å; N48-V52 WeakPolarHBondContact O-CG2 3.44Å; N48-V52 PolarHBondContact O-N 3.02Å; N49-V52 PolarHBondContact O-N 3.31Å; E50-V52 VanDerWaalsContact C-N 3.34Å; E50-V52 PolarHBondContact O-N 3.13Å; V52-L55 PolarHBondContact O-N 3.14Å; V52-Q56 VanDerWaalsContact O-CB 3.28Å; V52-Q56 WeakPolarHBondContact O-CB 3.38Å; V52-Q56 PolarHBondContact O-N 3.37Å
53L93.7Very high92.4Very high47 Ų4765 Ų6525%0.24634%0.342CS..Hα-helixtrans-64.4-43.4-179.7-69.2169.8000112.1N49 E50 Q56 H57 L78 W81N49-L53 WeakPolarHBondContact O-CG 3.3Å; N49-L53 PolarHBondContact O-N 2.9Å; N49-L53 VanDerWaalsContact O-N 3.09Å; E50-L53 PolarHBondContact O-N 3.41Å; L53-Q56 PolarHBondContact O-N 2.99Å; L53-H57 PolarHBondContact O-N 2.97Å; L53-L78 HydrophobicContact CB-CD2 3.87Å; L53-L78 HydrophobicContact CD1-CD2 3.88Å; L53-W81 HydrophobicContact CD1-CB 4.42Å; L53-W81 HydrophobicContact CD2-CB 4.47Å; L53-W81 HydrophobicContact CD2-CD2 3.81Å; L53-W81 HydrophobicContact CD2-CE3 3.69Å; L53-W81 HydrophobicContact CD2-CG 4.17Å; L53-W81 HydrophobicContact CD2-CZ3 4.2Å
54V93.5Very high92.5Very high0 Ų070.2 Ų70.20%036%0.364CS..Hα-helixtrans-70-40.7177.7177.20000111.3E50 Q56 H57 F58 A65 A68 F69 A74 I77 L78E50-V54 WeakPolarHBondContact O-CG2 3.38Å; E50-V54 PolarHBondContact O-N 3.36Å; V54-Q56 VanDerWaalsContact C-N 3.34Å; V54-Q56 PolarHBondContact O-N 2.94Å; V54-H57 PolarHBondContact O-N 2.87Å; V54-F58 HydrophobicContact CG1-CD2 3.88Å; V54-F58 HydrophobicContact CG1-CE2 3.87Å; V54-F58 VanDerWaalsContact O-CD2 3.31Å; V54-F58 WeakPolarHBondContact O-CD2 3.47Å; V54-F58 PolarHBondContact O-N 2.97Å; V54-F58 VanDerWaalsContact O-N 3.14Å; V54-A65 HydrophobicContact CG1-CB 3.91Å; V54-A68 HydrophobicContact CG1-CB 4.43Å; V54-F69 HydrophobicContact CB-CE2 3.98Å; V54-F69 HydrophobicContact CB-CZ 3.97Å; V54-F69 HydrophobicContact CG1-CE2 4.11Å; V54-F69 HydrophobicContact CG1-CZ 4.42Å; V54-F69 HydrophobicContact CG2-CE1 4.13Å; V54-F69 HydrophobicContact CG2-CE2 4.16Å; V54-F69 HydrophobicContact CG2-CZ 3.66Å; V54-A74 HydrophobicContact CG1-CB 4.34Å; V54-A74 HydrophobicContact CG2-CB 3.97Å; V54-I77 HydrophobicContact CG2-CG2 4.4Å; V54-L78 HydrophobicContact CG2-CD1 4.21Å; V54-L78 HydrophobicContact CG2-CD2 4.09Å; V54-L78 HydrophobicContact CG2-CG 3.93Å
55L94.6Very high92.7Very high0 Ų066.5 Ų66.50%034%0.34CS..Hα-helixtrans-58.4-46.1170.7-80.2169.7000111K35 I36 V39 I51 V52 H57 F58 E59 N60 C61 V62 A65K35-L55 HydrophobicContact CB-CD1 3.98Å; K35-L55 HydrophobicContact CB-CD2 4.48Å; I36-L55 HydrophobicContact CG1-CD1 4.15Å; V39-L55 HydrophobicContact CG2-CD1 4.38Å; V39-L55 HydrophobicContact CG2-CD2 4.07Å; V39-L55 HydrophobicContact CG2-CG 4.33Å; I51-L55 HydrophobicContact CG2-CD1 3.76Å; I51-L55 HydrophobicContact CG2-CG 4.28Å; I51-L55 VanDerWaalsContact O-CB 3.23Å; I51-L55 WeakPolarHBondContact O-CB 3.33Å; I51-L55 VanDerWaalsContact O-CG 3.24Å; I51-L55 WeakPolarHBondContact O-CG 3.4Å; I51-L55 PolarHBondContact O-N 3.11Å; V52-L55 PolarHBondContact O-N 3.14Å; L55-H57 VanDerWaalsContact C-N 3.33Å; L55-H57 PolarHBondContact O-N 3.35Å; L55-F58 CarbonylContact O-C 3.49Å; L55-F58 PolarHBondContact O-N 3.04Å; L55-F58 VanDerWaalsContact O-N 3.17Å; L55-E59 PolarHBondContact O-N 2.75Å; L55-N60 VanDerWaalsContact O-CA 3.23Å; L55-N60 WeakPolarHBondContact O-CA 3.49Å; L55-N60 PolarHBondContact O-N 2.83Å; L55-C61 WeakPolarHBondContact CD2-O 3.34Å; L55-V62 HydrophobicContact CD2-CG2 4.38Å; L55-A65 HydrophobicContact CD2-CB 3.77Å; L55-A65 HydrophobicContact CG-CB 4.12Å
56Q91.1Very high93Very high107 Ų10760 Ų6050%0.531%0.306SS..Hα-helixtrans-64.8-35.7-178.3-173.8169.56.900112.5V52 L53 V54V52-Q56 VanDerWaalsContact O-CB 3.28Å; V52-Q56 WeakPolarHBondContact O-CB 3.38Å; V52-Q56 PolarHBondContact O-N 3.37Å; L53-Q56 PolarHBondContact O-N 2.99Å; V54-Q56 VanDerWaalsContact C-N 3.34Å; V54-Q56 PolarHBondContact O-N 2.94Å
57H89.7Confident93.1Very high86 Ų8661.9 Ų61.940%0.39832%0.315SS..Hα-helixtrans-63.9-40172.5-178.593.7000112.1L53 V54 L55 E59 I77L53-H57 PolarHBondContact O-N 2.97Å; V54-H57 PolarHBondContact O-N 2.87Å; L55-H57 VanDerWaalsContact C-N 3.33Å; L55-H57 PolarHBondContact O-N 3.35Å; H57-E59 PolarHBondContact O-N 2.97Å; H57-I77 HydrophobicContact CB-CG2 3.77Å
58F91.9Very high93.2Very high50 Ų5059.5 Ų59.522%0.21930%0.299CS..THydrogen-bonded Turntrans-93.834.9177.5-63.8-61.1000114.3V54 L55 N60 C61 K64 A65 A68 I77V54-F58 HydrophobicContact CG1-CD2 3.88Å; V54-F58 HydrophobicContact CG1-CE2 3.87Å; V54-F58 VanDerWaalsContact O-CD2 3.31Å; V54-F58 WeakPolarHBondContact O-CD2 3.47Å; V54-F58 PolarHBondContact O-N 2.97Å; V54-F58 VanDerWaalsContact O-N 3.14Å; L55-F58 CarbonylContact O-C 3.49Å; L55-F58 PolarHBondContact O-N 3.04Å; L55-F58 VanDerWaalsContact O-N 3.17Å; F58-N60 PolarHBondContact O-N 3.37Å; F58-C61 HydrophobicContact CB-CB 4.49Å; F58-C61 VanDerWaalsContact O-CB 3.25Å; F58-C61 WeakPolarHBondContact O-CB 3.39Å; F58-C61 PolarHBondContact O-N 2.73Å; F58-K64 HydrophobicContact CB-CB 3.85Å; F58-K64 HydrophobicContact CB-CD 4.34Å; F58-K64 HydrophobicContact CD1-CB 3.99Å; F58-K64 HydrophobicContact CD1-CD 4.13Å; F58-K64 HydrophobicContact CD2-CB 4.12Å; F58-K64 HydrophobicContact CG-CB 3.73Å; F58-K64 HydrophobicContact CG-CD 4.47Å; F58-A65 HydrophobicContact CD2-CB 4.47Å; F58-A68 HydrophobicContact CE2-CB 3.52Å; F58-A68 HydrophobicContact CZ-CB 3.94Å; F58-I77 HydrophobicContact CD2-CD1 4.44Å; F58-I77 HydrophobicContact CE2-CD1 3.46Å; F58-I77 VanDerWaalsContact CE2-CD1 3.46Å; F58-I77 HydrophobicContact CZ-CD1 3.53Å
59E89.4Confident93.3Very high172 Ų17256.5 Ų56.580%0.80428%0.282SS*.THydrogen-bonded Turntrans55.622.8175.8-56.3-177.6157.800114.8L55 H57L55-E59 PolarHBondContact O-N 2.75Å; H57-E59 PolarHBondContact O-N 2.97Å
60N90.8Very high93.4Very high50 Ų5055.8 Ų55.827%0.26728%0.278SS..THydrogen-bonded Turntrans69.925.4-172.6-43.2-95.5000114.5M32 K35 L55 F58M32-N60 WeakPolarHBondContact CE-OD1 3.45Å; K35-N60 HydrophobicContact CD-CB 4.07Å; K35-N60 WeakPolarHBondContact CD-O 3.48Å; K35-N60 WeakPolarHBondContact CE-O 3.34Å; K35-N60 PolarHBondContact NZ-O 3.15Å; L55-N60 VanDerWaalsContact O-CA 3.23Å; L55-N60 WeakPolarHBondContact O-CA 3.49Å; L55-N60 PolarHBondContact O-N 2.83Å; F58-N60 PolarHBondContact O-N 3.37Å
61C92.7Very high93.3Very high40 Ų4058.7 Ų58.727%0.2729%0.291SS..  trans-72.2121.8167.7178.70000110.2L55 F58 K64 A65L55-C61 WeakPolarHBondContact CD2-O 3.34Å; F58-C61 HydrophobicContact CB-CB 4.49Å; F58-C61 VanDerWaalsContact O-CB 3.25Å; F58-C61 WeakPolarHBondContact O-CB 3.39Å; F58-C61 PolarHBondContact O-N 2.73Å; C61-K64 HydrophobicContact CB-CB 4.13Å; C61-K64 HydrophobicContact CB-CD 4.11Å; C61-K64 HydrophobicContact CB-CG 4.25Å; C61-A65 WeakPolarHBondContact O-CB 3.16Å; C61-A65 PolarHBondContact O-N 3.42Å
62V94.6Very high93.1Very high31 Ų3160.4 Ų60.419%0.18831%0.309CS..Hα-helixtrans-68.1-44-179.6170.70000110.6K35 A38 V39 L55 A65 V66K35-V62 HydrophobicContact CB-CG2 3.86Å; K35-V62 HydrophobicContact CD-CG2 4.29Å; K35-V62 HydrophobicContact CG-CG2 3.68Å; A38-V62 HydrophobicContact CB-CG1 3.94Å; A38-V62 HydrophobicContact CB-CG2 4.48Å; V39-V62 HydrophobicContact CG2-CG1 3.94Å; L55-V62 HydrophobicContact CD2-CG2 4.38Å; V62-A65 PolarHBondContact O-N 3.31Å; V62-V66 HydrophobicContact CG1-CG2 4.27Å; V62-V66 WeakPolarHBondContact O-CG2 3.48Å; V62-V66 PolarHBondContact O-N 2.99Å
63D94.6Very high92.9Very high122 Ų12260.6 Ų60.665%0.65231%0.312SS*.Hα-helixtrans-68-45.4-171.4-42.2-81.9000111.1A65 V66 Q67D63-A65 VanDerWaalsContact C-N 3.32Å; D63-A65 PolarHBondContact O-N 2.87Å; D63-V66 PolarHBondContact O-N 3.36Å; D63-Q67 WeakPolarHBondContact O-CB 3.27Å; D63-Q67 PolarHBondContact O-N 3.34Å
64K95.2Very high92.8Very high123 Ų12358.4 Ų58.454%0.53530%0.3SS..Hα-helixtrans-60.3-39.5171.9-70.1179.2-178.9-178.40112.3F58 C61 Q67 A68F58-K64 HydrophobicContact CB-CB 3.85Å; F58-K64 HydrophobicContact CB-CD 4.34Å; F58-K64 HydrophobicContact CD1-CB 3.99Å; F58-K64 HydrophobicContact CD1-CD 4.13Å; F58-K64 HydrophobicContact CD2-CB 4.12Å; F58-K64 HydrophobicContact CG-CB 3.73Å; F58-K64 HydrophobicContact CG-CD 4.47Å; C61-K64 HydrophobicContact CB-CB 4.13Å; C61-K64 HydrophobicContact CB-CD 4.11Å; C61-K64 HydrophobicContact CB-CG 4.25Å; K64-Q67 PolarHBondContact O-N 3.4Å; K64-A68 WeakPolarHBondContact O-CB 3.44Å; K64-A68 PolarHBondContact O-N 3.1Å
65A94Very high92.5Very high0 Ų062.6 Ų62.60%033%0.326CS..Hα-helixtrans-69.4-40.2177.800000112.6V39 V54 L55 F58 C61 V62 D63 F69V39-A65 HydrophobicContact CG2-CB 4.18Å; V54-A65 HydrophobicContact CG1-CB 3.91Å; L55-A65 HydrophobicContact CD2-CB 3.77Å; L55-A65 HydrophobicContact CG-CB 4.12Å; F58-A65 HydrophobicContact CD2-CB 4.47Å; C61-A65 WeakPolarHBondContact O-CB 3.16Å; C61-A65 PolarHBondContact O-N 3.42Å; V62-A65 PolarHBondContact O-N 3.31Å; D63-A65 VanDerWaalsContact C-N 3.32Å; D63-A65 PolarHBondContact O-N 2.87Å; A65-F69 WeakPolarHBondContact O-CD2 3.43Å; A65-F69 PolarHBondContact O-N 2.99Å
66V95.4Very high92.3Very high19 Ų1969.4 Ų69.412%0.11536%0.358CS..Hα-helixtrans-61.8-49.3171.9168.10000110.3V39 V42 V62 D63 A68 F69 L70V39-V66 HydrophobicContact CB-CG2 4.23Å; V39-V66 HydrophobicContact CG1-CG2 4.1Å; V39-V66 HydrophobicContact CG2-CG2 4.14Å; V42-V66 HydrophobicContact CB-CG1 4.05Å; V42-V66 HydrophobicContact CB-CG2 4.33Å; V42-V66 HydrophobicContact CG1-CG1 3.71Å; V42-V66 HydrophobicContact CG2-CG1 4.34Å; V42-V66 HydrophobicContact CG2-CG2 4.35Å; V62-V66 HydrophobicContact CG1-CG2 4.27Å; V62-V66 WeakPolarHBondContact O-CG2 3.48Å; V62-V66 PolarHBondContact O-N 2.99Å; D63-V66 PolarHBondContact O-N 3.36Å; V66-A68 PolarHBondContact O-N 2.84Å; V66-F69 PolarHBondContact O-N 3.48Å; V66-L70 HydrophobicContact CG1-CD1 3.79Å; V66-L70 HydrophobicContact CG1-CG 4.3Å; V66-L70 WeakPolarHBondContact O-CG 3.31Å; V66-L70 PolarHBondContact O-N 3.35Å
67Q95.6Very high92.1Very high94 Ų9464.9 Ų64.944%0.43934%0.337SS..Hα-helixtrans-56.5-49.7-179.7-167.366.414.600111.3D63 K64 F69 L70 E71D63-Q67 WeakPolarHBondContact O-CB 3.27Å; D63-Q67 PolarHBondContact O-N 3.34Å; K64-Q67 PolarHBondContact O-N 3.4Å; Q67-F69 VanDerWaalsContact C-N 3.25Å; Q67-F69 PolarHBondContact O-N 2.78Å; Q67-L70 PolarHBondContact O-N 2.71Å; Q67-E71 HydrophobicContact CG-CG 4.31Å; Q67-E71 WeakPolarHBondContact CG-OE1 3.18Å; Q67-E71 PolarHBondContact NE2-OE1 3.2Å; Q67-E71 WeakPolarHBondContact O-CB 3.17Å; Q67-E71 WeakPolarHBondContact O-CG 3.15Å; Q67-E71 PolarHBondContact O-N 2.71Å
68A94.9Very high92.1Very high3 Ų361.5 Ų61.53%0.02532%0.321CS..Hα-helixtrans-62.7-29.2178.100000113.8V54 F58 K64 V66 G72 S73 A74V54-A68 HydrophobicContact CG1-CB 4.43Å; F58-A68 HydrophobicContact CE2-CB 3.52Å; F58-A68 HydrophobicContact CZ-CB 3.94Å; K64-A68 WeakPolarHBondContact O-CB 3.44Å; K64-A68 PolarHBondContact O-N 3.1Å; V66-A68 PolarHBondContact O-N 2.84Å; A68-G72 CarbonylContact O-C 3.43Å; A68-G72 PolarHBondContact O-N 2.83Å; A68-G72 VanDerWaalsContact O-N 3.1Å; A68-S73 VanDerWaalsContact CA-OG 3.31Å; A68-S73 WeakPolarHBondContact CA-OG 3Å; A68-S73 WeakPolarHBondContact CB-OG 3.33Å; A68-S73 PolarHBondContact O-N 2.89Å; A68-A74 HydrophobicContact CB-CB 4.07Å; A68-A74 VanDerWaalsContact O-CB 3.22Å; A68-A74 WeakPolarHBondContact O-CB 3.42Å; A68-A74 PolarHBondContact O-N 3.42Å
69F95.1Very high91.9Very high14 Ų1466.5 Ų66.56%0.06134%0.343CS..Hα-helixtrans-77.1-26.5173.6-83.6-53.5000113.9V39 V43 K46 E50 I51 V54 A65 V66 Q67 A74 L78V39-F69 HydrophobicContact CG1-CD2 3.81Å; V39-F69 HydrophobicContact CG1-CE2 3.97Å; V43-F69 HydrophobicContact CB-CB 4.41Å; V43-F69 HydrophobicContact CG1-CB 4.01Å; V43-F69 HydrophobicContact CG1-CG 4.42Å; V43-F69 HydrophobicContact CG2-CB 3.84Å; V43-F69 HydrophobicContact CG2-CG 4.48Å; K46-F69 HydrophobicContact CB-CE1 4.35Å; K46-F69 HydrophobicContact CB-CZ 4.41Å; K46-F69 HydrophobicContact CD-CD1 3.81Å; K46-F69 HydrophobicContact CD-CE1 3.75Å; K46-F69 HydrophobicContact CG-CD1 3.83Å; K46-F69 HydrophobicContact CG-CE1 3.81Å; K46-F69 HydrophobicContact CG-CG 4.29Å; K46-F69 HydrophobicContact CG-CZ 4.27Å; E50-F69 HydrophobicContact CB-CZ 4.31Å; I51-F69 HydrophobicContact CB-CE2 4.4Å; I51-F69 HydrophobicContact CG1-CE2 3.84Å; I51-F69 HydrophobicContact CG1-CZ 4.07Å; V54-F69 HydrophobicContact CB-CE2 3.98Å; V54-F69 HydrophobicContact CB-CZ 3.97Å; V54-F69 HydrophobicContact CG1-CE2 4.11Å; V54-F69 HydrophobicContact CG1-CZ 4.42Å; V54-F69 HydrophobicContact CG2-CE1 4.13Å; V54-F69 HydrophobicContact CG2-CE2 4.16Å; V54-F69 HydrophobicContact CG2-CZ 3.66Å; A65-F69 WeakPolarHBondContact O-CD2 3.43Å; A65-F69 PolarHBondContact O-N 2.99Å; V66-F69 PolarHBondContact O-N 3.48Å; Q67-F69 VanDerWaalsContact C-N 3.25Å; Q67-F69 PolarHBondContact O-N 2.78Å; F69-A74 HydrophobicContact CD1-CB 3.42Å; F69-A74 VanDerWaalsContact CD1-CB 3.42Å; F69-A74 HydrophobicContact CE1-CB 3.71Å; F69-A74 HydrophobicContact CG-CB 3.97Å; F69-A74 HydrophobicContact CZ-CB 4.45Å; F69-L78 HydrophobicContact CE1-CD1 4.11Å
70L93.4Very high91.4Very high108 Ų10864.3 Ų64.357%0.56533%0.333SS*.Hα-helixtrans-81.5-41.5175.4-66.9173.6000111.8V42 V66 Q67 G72V42-L70 HydrophobicContact CG1-CD1 4.45Å; V66-L70 HydrophobicContact CG1-CD1 3.79Å; V66-L70 HydrophobicContact CG1-CG 4.3Å; V66-L70 WeakPolarHBondContact O-CG 3.31Å; V66-L70 PolarHBondContact O-N 3.35Å; Q67-L70 PolarHBondContact O-N 2.71Å; L70-G72 VanDerWaalsContact C-N 3.3Å
71E92.1Very high90.6Very high129 Ų12967.2 Ų67.260%0.60334%0.34SS*.Hα-helixtrans-76.3-16.7176.6-66.7174.6165.800113.2Q67 S73Q67-E71 HydrophobicContact CG-CG 4.31Å; Q67-E71 WeakPolarHBondContact CG-OE1 3.18Å; Q67-E71 PolarHBondContact NE2-OE1 3.2Å; Q67-E71 WeakPolarHBondContact O-CB 3.17Å; Q67-E71 WeakPolarHBondContact O-CG 3.15Å; Q67-E71 PolarHBondContact O-N 2.71Å; E71-S73 VanDerWaalsContact C-N 3.32Å; E71-S73 PolarHBondContact O-N 2.91Å
72G88.6Confident89.2Confident35 Ų3571.2 Ų71.236%0.36136%0.359SS..SBendtrans86.3-10.8-179.400000115.2A68 L70 A74 V75A68-G72 CarbonylContact O-C 3.43Å; A68-G72 PolarHBondContact O-N 2.83Å; A68-G72 VanDerWaalsContact O-N 3.1Å; L70-G72 VanDerWaalsContact C-N 3.3Å; G72-A74 PolarHBondContact O-N 3.03Å; G72-A74 VanDerWaalsContact O-N 3.12Å; G72-V75 VanDerWaalsContact O-CB 3.31Å; G72-V75 WeakPolarHBondContact O-CB 3.49Å; G72-V75 WeakPolarHBondContact O-CG2 3.14Å; G72-V75 PolarHBondContact O-N 3.14Å
73S89.6Confident87Confident42 Ų4275.2 Ų75.229%0.29438%0.383SS..THydrogen-bonded Turntrans-58.1-24176.654.40000113.6A68 E71 V75 E76 I77A68-S73 VanDerWaalsContact CA-OG 3.31Å; A68-S73 WeakPolarHBondContact CA-OG 3Å; A68-S73 WeakPolarHBondContact CB-OG 3.33Å; A68-S73 PolarHBondContact O-N 2.89Å; E71-S73 VanDerWaalsContact C-N 3.32Å; E71-S73 PolarHBondContact O-N 2.91Å; S73-V75 PolarHBondContact O-N 3.16Å; S73-V75 VanDerWaalsContact O-N 3.13Å; S73-E76 WeakPolarHBondContact O-CB 3.46Å; S73-E76 PolarHBondContact O-N 3.31Å; S73-I77 PolarHBondContact O-N 2.78Å
74A91.2Very high84.8Confident1 Ų176.1 Ų76.11%0.00839%0.393CS..Hα-helixtrans-55-2716900000113.8V54 A68 F69 G72 E76 L78V54-A74 HydrophobicContact CG1-CB 4.34Å; V54-A74 HydrophobicContact CG2-CB 3.97Å; A68-A74 HydrophobicContact CB-CB 4.07Å; A68-A74 VanDerWaalsContact O-CB 3.22Å; A68-A74 WeakPolarHBondContact O-CB 3.42Å; A68-A74 PolarHBondContact O-N 3.42Å; F69-A74 HydrophobicContact CD1-CB 3.42Å; F69-A74 VanDerWaalsContact CD1-CB 3.42Å; F69-A74 HydrophobicContact CE1-CB 3.71Å; F69-A74 HydrophobicContact CG-CB 3.97Å; F69-A74 HydrophobicContact CZ-CB 4.45Å; G72-A74 PolarHBondContact O-N 3.03Å; G72-A74 VanDerWaalsContact O-N 3.12Å; A74-E76 VanDerWaalsContact C-N 3.27Å; A74-E76 PolarHBondContact O-N 2.83Å; A74-L78 WeakPolarHBondContact O-CB 3.36Å; A74-L78 WeakPolarHBondContact O-CD1 3.43Å; A74-L78 WeakPolarHBondContact O-CG 3.37Å; A74-L78 PolarHBondContact O-N 3.17Å
75V88.6Confident82.2Confident89 Ų8972.6 Ų72.654%0.53939%0.392SS..Hα-helixtrans-65.9-32.1175.71790000111.3G72 S73 K79G72-V75 VanDerWaalsContact O-CB 3.31Å; G72-V75 WeakPolarHBondContact O-CB 3.49Å; G72-V75 WeakPolarHBondContact O-CG2 3.14Å; G72-V75 PolarHBondContact O-N 3.14Å; S73-V75 PolarHBondContact O-N 3.16Å; S73-V75 VanDerWaalsContact O-N 3.13Å; V75-K79 WeakPolarHBondContact O-CB 3.41Å; V75-K79 PolarHBondContact O-N 2.98Å
76E89.3Confident79.4Confident142 Ų14283 Ų8366%0.66444%0.438SS*.Hα-helixtrans-74.1-45.5179.2-52.8-162.8131.400111.1S73 A74 L78 K79 E80S73-E76 WeakPolarHBondContact O-CB 3.46Å; S73-E76 PolarHBondContact O-N 3.31Å; A74-E76 VanDerWaalsContact C-N 3.27Å; A74-E76 PolarHBondContact O-N 2.83Å; E76-L78 VanDerWaalsContact C-N 3.33Å; E76-L78 PolarHBondContact O-N 2.98Å; E76-K79 WeakPolarHBondContact O-CB 3.49Å; E76-K79 PolarHBondContact O-N 3.33Å; E76-K79 VanDerWaalsContact O-N 3.12Å; E76-E80 PolarHBondContact O-N 3.43Å
77I88.1Confident77.4Confident12 Ų1291.7 Ų91.76%0.06247%0.474CS..Hα-helixtrans-55.4-49.7172.1-59.8168.4000110.1V54 H57 F58 S73 K79 E80 W81V54-I77 HydrophobicContact CG2-CG2 4.4Å; H57-I77 HydrophobicContact CB-CG2 3.77Å; F58-I77 HydrophobicContact CD2-CD1 4.44Å; F58-I77 HydrophobicContact CE2-CD1 3.46Å; F58-I77 VanDerWaalsContact CE2-CD1 3.46Å; F58-I77 HydrophobicContact CZ-CD1 3.53Å; S73-I77 PolarHBondContact O-N 2.78Å; I77-K79 VanDerWaalsContact C-N 3.31Å; I77-K79 PolarHBondContact O-N 3.44Å; I77-E80 PolarHBondContact O-N 3.02Å; I77-W81 VanDerWaalsContact O-CD1 3.3Å; I77-W81 PolarHBondContact O-N 3.3Å
78L89.1Confident74.7Confident15 Ų1596.8 Ų96.88%0.07949%0.494CS..Hα-helixtrans-65.9-32.9179.1-69167.3000112.3E50 L53 V54 F69 A74 E76 N82E50-L78 HydrophobicContact CB-CD1 3.88Å; E50-L78 HydrophobicContact CB-CD2 3.92Å; E50-L78 HydrophobicContact CG-CD1 3.91Å; E50-L78 HydrophobicContact CG-CD2 4.04Å; L53-L78 HydrophobicContact CB-CD2 3.87Å; L53-L78 HydrophobicContact CD1-CD2 3.88Å; V54-L78 HydrophobicContact CG2-CD1 4.21Å; V54-L78 HydrophobicContact CG2-CD2 4.09Å; V54-L78 HydrophobicContact CG2-CG 3.93Å; F69-L78 HydrophobicContact CE1-CD1 4.11Å; A74-L78 WeakPolarHBondContact O-CB 3.36Å; A74-L78 WeakPolarHBondContact O-CD1 3.43Å; A74-L78 WeakPolarHBondContact O-CG 3.37Å; A74-L78 PolarHBondContact O-N 3.17Å; E76-L78 VanDerWaalsContact C-N 3.33Å; E76-L78 PolarHBondContact O-N 2.98Å; L78-N82 WeakPolarHBondContact O-CB 3.42Å; L78-N82 PolarHBondContact O-N 3.09Å; L78-N82 VanDerWaalsContact O-N 3.11Å; L78-N82 PolarHBondContact O-ND2 2.92Å
79K87Confident72.3Confident155 Ų155102.6 Ų102.667%0.67453%0.532SS*.Hα-helixtrans-67.7-40.4174.9179.9-174.8176.3-169.50111.7V75 E76 I77 N82V75-K79 WeakPolarHBondContact O-CB 3.41Å; V75-K79 PolarHBondContact O-N 2.98Å; E76-K79 WeakPolarHBondContact O-CB 3.49Å; E76-K79 PolarHBondContact O-N 3.33Å; E76-K79 VanDerWaalsContact O-N 3.12Å; I77-K79 VanDerWaalsContact C-N 3.31Å; I77-K79 PolarHBondContact O-N 3.44Å; K79-N82 PolarHBondContact O-N 3.47Å
80E79.1Confident70Confident127 Ų127111 Ų11159%0.59357%0.568SS**Hα-helixtrans-63.1-51.3174.8-175.3179.9-157.400111.5E76 I77 N82 V83E76-E80 PolarHBondContact O-N 3.43Å; I77-E80 PolarHBondContact O-N 3.02Å; E80-N82 PolarHBondContact O-N 3.02Å; E80-V83 WeakPolarHBondContact O-CB 3.48Å; E80-V83 WeakPolarHBondContact O-CG2 3.28Å; E80-V83 PolarHBondContact O-N 3.41Å
81W74Confident67.2Low110 Ų110116 Ų11642%0.41759%0.585SS.*Hα-helixtrans-59.9-30.4177.1-83.790.2000113.2L53 I77 V83L53-W81 HydrophobicContact CD1-CB 4.42Å; L53-W81 HydrophobicContact CD2-CB 4.47Å; L53-W81 HydrophobicContact CD2-CD2 3.81Å; L53-W81 HydrophobicContact CD2-CE3 3.69Å; L53-W81 HydrophobicContact CD2-CG 4.17Å; L53-W81 HydrophobicContact CD2-CZ3 4.2Å; I77-W81 VanDerWaalsContact O-CD1 3.3Å; I77-W81 PolarHBondContact O-N 3.3Å; W81-V83 PolarHBondContact O-N 3.41Å
82N64.2Low64.7Low125 Ų125119 Ų11967%0.66860%0.597SS**THydrogen-bonded Turntrans-70.6-6.5174.6-88.7-69.2000114.8L78 K79 E80L78-N82 WeakPolarHBondContact O-CB 3.42Å; L78-N82 PolarHBondContact O-N 3.09Å; L78-N82 VanDerWaalsContact O-N 3.11Å; L78-N82 PolarHBondContact O-ND2 2.92Å; K79-N82 PolarHBondContact O-N 3.47Å; E80-N82 PolarHBondContact O-N 3.02Å
83V48.4Very low62.2Low115 Ų115127.8 Ų127.870%0.69763%0.625SS**THydrogen-bonded Turntrans-77.3-29.3177.3-176.60000112.2E80 W81 G85E80-V83 WeakPolarHBondContact O-CB 3.48Å; E80-V83 WeakPolarHBondContact O-CG2 3.28Å; E80-V83 PolarHBondContact O-N 3.41Å; W81-V83 PolarHBondContact O-N 3.41Å; V83-G85 PolarHBondContact O-N 3.11Å
84T48.2Very low59.7Low140 Ų140134.4 Ų134.486%0.85965%0.648SS**SBendtrans-80.554.5179.8-73.10000111.9
85G40.6Very low57.4Low50 Ų50140.4 Ų140.452%0.51569%0.687SS.*  trans-148.889.9-176.100000114.4V83 K87V83-G85 PolarHBondContact O-N 3.11Å; G85-K87 PolarHBondContact O-N 2.75Å
86K35.1Very low54.8Low219 Ų219142.4 Ų142.495%0.95269%0.688SS**  trans-70.296.8-178.2-71.8178.1178.2171.90113.1
87K53.7Low52.2Low201 Ų201141.8 Ų141.887%0.87470%0.697SS**  trans-66.9133.8173.4-69.9178177.2171.90113.8G85G85-K87 PolarHBondContact O-N 2.75Å
88K38.5Very low49.6Very low200 Ų200146.8 Ų146.887%0.8772%0.72SS**  trans-150.4168.6161.4-79.8-150.8176.2-177.90109.5
89P44.2Very low47.4Very low125 Ų125151.6 Ų151.681%0.81275%0.752SS**  -131.8-176.8-9128.9-3.7000117.1
90K46.7Very low44.7Very low191 Ų191151.3 Ų151.383%0.8375%0.753SS**  trans-57.9149.2-169.3-58.7168.2176.5173.50118.7
91K35.3Very low42.5Very low212 Ų212152.6 Ų152.692%0.92276%0.759SS**  trans-135.9109.2134.7-70.1-178.4179.1176.60107.2
92K40.3Very low40.7Very low193 Ų193154.2 Ų154.284%0.83978%0.775SS**  66.6104.364.5-84.3-164173.4-176.10116.1
93K34.3Very low39.2Very low219 Ų219152.6 Ų152.695%0.95278%0.779SS**  -154.8173.8118.9-109.3179.6180-174.70111
94K37.2Very low38.3Very low182 Ų182156.5 Ų156.579%0.79179%0.789SS**  trans-126.6179.7-167.3-123.3-164.4177.6-173.30108.4
95P44.1Very low37.4Very low126 Ų126157.6 Ų157.682%0.81879%0.785SS**  cis-130.6-149.530.139.9-18.9000115.4
96K33.9Very low37.1Very low131 Ų131162.5 Ų162.557%0.5780%0.799SS**  trans-143.5162.3-159-175.2-179.8-173.4-171.60109.4Q98K96-Q98 VanDerWaalsContact NZ-CD 3.29Å
97P34.7Very low37.2Very low130 Ų130156.4 Ų156.484%0.84479%0.789SS**  -130.3170.6125.535.6-26.5000113.9
98Q33.5Very low37.1Very low116 Ų116152.9 Ų152.954%0.54279%0.787SS.*  trans-143.3157-179.5-146.8-174.5-30.200108.8K96K96-Q98 VanDerWaalsContact NZ-CD 3.29Å
99P41.9Very low36.7Very low116 Ų116148.1 Ų148.175%0.75378%0.784SS**  -123.3156.4111.9-4.826.5000112.3
100E31.9Very low36.1Very low149 Ų149150.9 Ų150.970%0.69679%0.787SS**  cis73139.734.8-66.3172-154.400113.2
101H32.7Very low35.1Very low155 Ų155148.6 Ų148.672%0.71879%0.789SS**  cis-132.2156.80.4-139.1-110.4000107.6
102L36.3Very low35.2Very low144 Ų144146.2 Ų146.275%0.75478%0.783SS**  cis92.896.223.1-134.7-175.6000115.8
103A31Very low34.7Very low91 Ų91145.2 Ų145.275%0.75278%0.781SS**  trans-170148.5170.900000108.7
104E29.8Very low34.9Very low196 Ų196140.9 Ų140.992%0.91678%0.775SS**  cis-151.5178.1-14.3-166.7156.1179.900110.2
105E30.2Very low34.5Very low164 Ų164137.3 Ų137.377%0.76677%0.773SS**  trans-103161.2-156.9-173.8-177.5130.400113.9
106L32.8Very low34Very low153 Ų153139.4 Ų139.480%0.80177%0.772SS**  162.5138.2125.5-85.3168.6000117.4
107A37.2Very low33.8Very low91 Ų91139.7 Ų139.775%0.75279%0.785SS**  trans71.5154.4147.800000122.6
108P51.6Low33.5Very low127 Ų127141.6 Ų141.683%0.82578%0.783SS**  trans-140-163.6-158.944-23000116.6
109A31.2Very low33.3Very low99 Ų99140.7 Ų140.782%0.81879%0.789SS**  trans108.5162.1153.900000119
110E31.3Very low32.8Very low184 Ų184143.3 Ų143.386%0.8679%0.789SS**  trans-103.4169.1-161.1-57.1162.396.400113.3
111T26.4Very low32.6Very low142 Ų142143.7 Ų143.787%0.87179%0.791SS**  163.9158.9116.7-61.80000111.4
112M36.3Very low32.4Very low162 Ų162140.3 Ų140.380%0.79879%0.789SS**  trans-89.7-172.9177.4-69.3172.25700113.7
113Q31.1Very low32.3Very low173 Ų173139.5 Ų139.581%0.80879%0.79SS**  trans-40.5158.3176.2-59.5172.8-80.100117.5
114P36.8Very low32.4Very low127 Ų127142.9 Ų142.983%0.82580%0.796SS**  trans-126.7176.2138.436.4-24000113.6
115S30.5Very low32.3Very low107 Ų107137.2 Ų137.275%0.74879%0.79SS**  trans-151.3167.6-17752.70000113.1
116E32.1Very low32.3Very low170 Ų170139.1 Ų139.179%0.79480%0.796SS**  trans98.2131.7159.1-52.2-154.5112.500121.8
117T29.8Very low32.2Very low138 Ų138139.5 Ų139.585%0.84779%0.793SS**  trans65.7150.2155.251.90000120
118E29.2Very low32Very low169 Ų169140 Ų14079%0.7980%0.797SS**  cis-158.2160.533-161.9-158127.400114.2
119S28.1Very low31.2Very low97 Ų97141.7 Ų141.768%0.67880%0.799SS**  trans70.2153.3160790000118.7
120K31.4Very low31.2Very low172 Ų172140.3 Ų140.375%0.74879%0.794SS**  cis-165.2134.3-8.3-115.5178.7165-130.80107
121E27.8Very low31.3Very low157 Ų157136.8 Ų136.873%0.73479%0.79SS**  123.415678.7-174.5160.7-165.800111.1
122A30Very low31.6Very low83 Ų83135.7 Ų135.769%0.68678%0.783SS**  trans91.695.8162.800000124.7
123V34.4Very low31.8Very low127 Ų127135.9 Ų135.977%0.7779%0.786SS**  65.5131.7130-50.80000127.4
124N31.3Very low32.2Very low163 Ų163134.7 Ų134.787%0.87279%0.785SS**  trans55.2143137.9-63.5-1.4000124.2
125G29.4Very low32Very low77 Ų77132.3 Ų132.379%0.79478%0.784SS**  trans-171.91.7172.500000125.6
126F29.6Very low32.2Very low204 Ų204135 Ų13590%0.89579%0.79SS**  trans66.5166.5164.4-112.9-101.9000122.7
127H30.6Very low32.4Very low161 Ų161131.8 Ų131.875%0.74579%0.787SS**  trans-98.4160.2-168.5-49.6-112.8000114.4
128A32Very low32.8Very low100 Ų100132.6 Ų132.683%0.82679%0.785SS**  157.8166.1128.200000113.4
129N34.8Very low33Very low164 Ų164130.9 Ų130.988%0.87778%0.781SS**  cis-172.6142.3-49.7-148.62.9000109.2
130G33Very low33.8Very low69 Ų69130.5 Ų130.571%0.71178%0.778SS**  trans69.7178.4164.300000118.6
131S32.8Very low33.9Very low111 Ų111130.3 Ų130.378%0.77679%0.785SS**  cis-162.9140.9-11.3-145.90000113.8
132V32.8Very low34.5Very low118 Ų118127.6 Ų127.672%0.71578%0.783SS**  trans34.2122.9135.6177.60000120.2
133L40.6Very low34.8Very low167 Ų167131.5 Ų131.587%0.87479%0.787SS**  -165.1143.1109.6-121.7128.1000113.8
134D40.1Very low35Very low147 Ų147133 Ų13379%0.78679%0.786SS**  trans-86173172.4-75.3-69.7000112.6
135G31.5Very low35.2Very low78 Ų78133 Ų13380%0.80479%0.785SS**  trans-174.978.2175.200000114.6
136D34.1Very low35.7Very low163 Ų163136.5 Ų136.587%0.87279%0.785SS**  trans-64.9149.9173-62.8-78.8000113.9
137S37.4Very low35.8Very low103 Ų103131.2 Ų131.272%0.7277%0.774SS**  trans-169.6123.6142.5178.70000112.9
138L38.7Very low35.9Very low155 Ų155128 Ų12881%0.81278%0.776SS**  trans18.2148.5131.1-40.5175.6000119.3
139D33Very low35.9Very low132 Ų132128 Ų12871%0.70677%0.769SS**  cis-157.7144.622.5-162.228.5000115.3
140S43.9Very low36.1Very low89 Ų89127.8 Ų127.862%0.62277%0.767SS**  trans21.7161.5145.6-54.50000126.6
141L34.7Very low36.5Very low168 Ų168131.3 Ų131.388%0.8877%0.77SS**  trans80135.3162.2-50.2-174.1000117.1
142S38.9Very low36.7Very low101 Ų101130 Ų13071%0.70677%0.765SS**  cis-150.6148.7-0.254.20000113.5
143E37.8Very low36.9Very low165 Ų165129.2 Ų129.277%0.77177%0.771SS**  trans6.4127.5155.3-66.8167.9112.400119.6
144Q38.3Very low37Very low159 Ų159130.1 Ų130.174%0.74377%0.771SS**  74.7110.656.1-175.4-167.6-76.800113.8
145L35.4Very low37Very low163 Ų163131.4 Ų131.485%0.85378%0.777SS**  trans-152.7102.5135-98.9-173.1000109.5
146D39.5Very low37.1Very low149 Ų149134 Ų13480%0.79777%0.772SS**  trans-127.4146.8158.9-163-13.1000107
147S31.8Very low37.2Very low94 Ų94131.6 Ų131.666%0.65777%0.768SS**  trans-164.1106.9-176.4-73.50000108.3
148A33.1Very low37.3Very low94 Ų94134.8 Ų134.878%0.77777%0.772SS**  73.7144.478.100000113.2
149S32.7Very low37.3Very low99 Ų99133.2 Ų133.269%0.69277%0.771SS**  cis-172.7173.6-17.1-171.80000108.2
150L38.7Very low37.4Very low159 Ų159131.1 Ų131.183%0.83277%0.772SS**  trans66.2166.5166.3-59134.6000117.6
151D39.9Very low36.8Very low143 Ų143132.4 Ų132.477%0.76578%0.776SS**  cis-166.2165.4-45.3-168.725000109.7
152A37.5Very low36.7Very low83 Ų83130.5 Ų130.569%0.68678%0.777SS**  trans35.5119153.600000121.8
153A37Very low36.4Very low102 Ų102132.6 Ų132.684%0.84378%0.78SS**  trans-154.2143.5135.300000110.9
154E42.5Very low36.4Very low187 Ų187132.5 Ų132.587%0.87478%0.783SS**  trans-69.8158160.7-64168.390.400110.4
155L39.9Very low36Very low174 Ų174131.4 Ų131.491%0.91179%0.788SS**  -164.4137.8123-106.4176.8000111.7
156D34.5Very low35.6Very low131 Ų131127.4 Ų127.470%0.70179%0.786SS**  trans-87.8158.2172.417932.5000111.2
157S36.8Very low35.6Very low113 Ų113124.5 Ų124.579%0.7978%0.782SS**  trans-166.295.8172.7-77.80000112.8
158E38Very low35.9Very low171 Ų171128.5 Ų128.580%0.79979%0.791SS**PPolyproline II helixtrans-71.5154167.3-72.1-147.5119.300113.9
159P38.3Very low36.1Very low121 Ų121128.1 Ų128.179%0.78679%0.787SS**PPolyproline II helixtrans-88.6126.5158.834.2-29000111.5
160A35.7Very low36.2Very low88 Ų88131 Ų13173%0.72780%0.795SS**PPolyproline II helixtrans-79.2133.4-166.100000116.6
161T31.9Very low35.9Very low116 Ų116128.3 Ų128.371%0.71279%0.79SS**  trans41.8129.3136.963.60000121.9
162S32.8Very low35.6Very low129 Ų129129 Ų12990%0.90279%0.793SS**  trans-159.8114.9132-78.60000110.6
163D32.3Very low35.2Very low144 Ų144130.5 Ų130.577%0.7780%0.797SS**  trans-77.5157-179-63.6-87.8000114.3
164I37.5Very low34.9Very low163 Ų163131.3 Ų131.384%0.83680%0.796SS**  -159.8110.8125.5-104.7158.8000112.3
165T29.3Very low34.3Very low137 Ų137126 Ų12684%0.8479%0.791SS**  trans21.1124.9142.6-38.80000121.5
166G28.6Very low34.6Very low78 Ų78123.9 Ų123.980%0.80479%0.788SS**  trans179.6125.3156.800000111.7
167A38.6Very low34.6Very low88 Ų88122.6 Ų122.673%0.72779%0.79SS**  trans-119.5-161.6-168.800000113.7
168E37.9Very low35.1Very low179 Ų179123 Ų12384%0.83679%0.789SS**  trans73.2143.4-174.7-43.5-55.4107.700116.5
169A37.5Very low35.2Very low85 Ų85120.8 Ų120.870%0.70279%0.788SS**  cis-173.5159.7-35.500000107.8
170D34.8Very low35.4Very low160 Ų160120.6 Ų120.686%0.85679%0.786SS**  trans-42.4155.4-177.7-58.3-67.7000116.6
171S32.9Very low35.3Very low103 Ų103125.3 Ų125.372%0.7279%0.793SS**  175.5163.660.4-147.60000115.4
172L33Very low35.6Very low158 Ų158127.5 Ų127.583%0.82780%0.795SS**  trans62.388.3151.2-71.7160.9000123.1
173C30Very low35.7Very low114 Ų114125.3 Ų125.377%0.7778%0.784SS**  43.3124.6117.5-165.30000122.9
174S29.9Very low35.9Very low118 Ų118127 Ų12783%0.82579%0.788SS**  174.1132.8121.3-80.30000116.4
175G30.6Very low35.6Very low75 Ų75123.1 Ų123.177%0.77379%0.789SS**  trans90.7130.2142.800000120.6
176P45.3Very low35.6Very low131 Ų131120.8 Ų120.885%0.85179%0.791SS**  trans-108.3173.7178.340.6-34.5000116.1
177S35.1Very low35.8Very low104 Ų104128.3 Ų128.373%0.72780%0.795SS**  trans-74.2163.7173.1-173.70000113.3
178P48.2Very low35.5Very low120 Ų120130.6 Ų130.678%0.77980%0.796SS**  -149.6170.6114.139.4-23.7000117.9
179T39.1Very low35.3Very low125 Ų125131.4 Ų131.477%0.76780%0.799SS**  trans-82.3164.7169.9520000114.4
180P43.5Very low35.4Very low117 Ų117135.7 Ų135.776%0.7680%0.804SS**  trans-120.3136.7166.837.5-26.6000116.2
181H33.1Very low36.2Very low188 Ų188132.7 Ų132.787%0.8779%0.794SS**  trans-146.8164169.5-80.3-4.6000109.2
182H38.6Very low37Very low161 Ų161133.8 Ų133.875%0.74580%0.799SS**  cis-117.8-98.73.8-174.911.6000112.6
183A33.2Very low37.2Very low83 Ų83138.2 Ų138.269%0.68680%0.804SS**  cis-152.1123.7-13.400000112.5
184Q37.6Very low37.2Very low179 Ų179136.6 Ų136.684%0.83681%0.806SS**  trans39.7138.3140.4-56.7-172.2-2.100124.3
185G29.9Very low37.4Very low83 Ų83138.2 Ų138.286%0.85681%0.806SS**  trans132.6132.9136.800000119.6
186G29.7Very low37.7Very low87 Ų87142.6 Ų142.690%0.89780%0.804SS**  trans104.7119.4145.300000119.8
187R33.4Very low37.1Very low236 Ų236144.8 Ų144.889%0.89180%0.8SS**  trans-81.7154176.7-83.6173161.9171.6-6.1114.7
188N32.5Very low37.1Very low137 Ų137151.1 Ų151.173%0.73381%0.808SS**  trans43.2127.3143.3-63.9-8.7000121.7
189H33.5Very low36.4Very low195 Ų195150.9 Ų150.990%0.90381%0.809SS**  -168.6165.5116.8-98.9-69.9000111.2
190Q39.4Very low36.3Very low175 Ų175156 Ų15682%0.81882%0.815SS**  trans-158.4165.6-177.7-130.3-152.452.200109.1
191P51.3Low35.8Very low98 Ų98156.6 Ų156.664%0.63682%0.816SS**  cis-112-158-44.432.4-13.8000110
192P49.8Very low36Very low126 Ų126154.8 Ų154.882%0.81881%0.813SS**  -148.7171.393.938.9-21.2000117.4
193R38Very low35.9Very low251 Ų251152.4 Ų152.495%0.94781%0.814SS**  trans-56.2141.8-175-60.1159.8173.4164.7-3.1116
194G29.7Very low36.4Very low79 Ų79156.7 Ų156.781%0.81482%0.82SS**  trans-138.2154.4156.500000110
195N34.4Very low36.8Very low152 Ų152154.1 Ų154.181%0.81382%0.819SS**  trans-145.1159-164.5-166.410.4000113.8
196K36.4Very low37.3Very low168 Ų168154.8 Ų154.873%0.7381%0.811SS**  trans101.7110.1164.5-59.8178.8-179.7175.60119.9
197F32Very low37.6Very low177 Ų177156.8 Ų156.878%0.77681%0.805SS**  49.1126.2129.1-62.4-69.1000124.6
198R35.1Very low38Very low236 Ų236150.2 Ų150.289%0.89180%0.796SS**  trans66.6158.2143.7-67.3-178.1175.2-171.3-1.5116.5
199S33.7Very low38.3Very low116 Ų116148.6 Ų148.681%0.81180%0.795SS**  cis-142.9-172.311.3-148.70000113.4
200R38Very low38.4Very low233 Ų233146.3 Ų146.388%0.87979%0.794SS**  trans-123.5113.3-172.4171.6-169.7167.5-169.5-2.9113.3
201T33.4Very low38.5Very low129 Ų129145.3 Ų145.379%0.79179%0.794SS**  trans-161.1134.5162.45.40000106.2
202N36Very low37.9Very low150 Ų150147.2 Ų147.280%0.80280%0.804SS**  cis75.980.625.9-162.193.1000115.9
203S37.6Very low37.4Very low110 Ų110146.8 Ų146.877%0.76980%0.799SS**  trans-155.3139.9153.445.10000110.2
204Q43.7Very low37.3Very low174 Ų174141.4 Ų141.481%0.81379%0.789SS**  trans-85.7164.1161.5-62172.2-86.800109.2
205P45.3Very low38Very low124 Ų124145 Ų14581%0.80579%0.785SS**  trans-118.3139.5143.734.6-26.6000111.6
206S40.5Very low38.1Very low98 Ų98141.8 Ų141.869%0.68577%0.768SS**  trans-142.1105174.9-66.20000111
207T36.8Very low38.4Very low128 Ų128142.7 Ų142.779%0.78577%0.774SS**  trans-161.2123163.633.60000105.9
208S40.5Very low38.7Very low98 Ų98142.2 Ų142.269%0.68578%0.775SS**  62.4132.665.377.40000113.7
209S38.3Very low38.7Very low103 Ų103134.5 Ų134.572%0.7277%0.769SS**  cis179.4144.6-6.842.90000109.8
210V35.9Very low39Very low147 Ų147134.3 Ų134.389%0.89177%0.767SS**  trans-139.2146.9159-175.90000108.9
211L42.3Very low39.5Very low155 Ų155129.6 Ų129.681%0.81277%0.77SS**  trans-117.2-176.8-175.5-71.7166.8000111.6
212T38.9Very low40.1Very low137 Ų137126.6 Ų126.684%0.8477%0.765SS**  trans103.5138179.263.50000113.7
213T38.8Very low40.6Very low118 Ų118123.7 Ų123.772%0.72476%0.761SS**  cis-160.1113.1-16.3-890000104.6
214D36.7Very low41.7Very low137 Ų137127.7 Ų127.773%0.73377%0.765SS**  88.712087.2-149.830.1000113.8
215E43Very low42.3Very low155 Ų155128.8 Ų128.872%0.72477%0.767SS**  trans62.8156.8145.6-95.7-152.2167.800122.8
216N36.8Very low42.8Very low84 Ų84129.4 Ų129.445%0.44976%0.762SS.*  cis-151.3141.2-7.8-161.4-19.9000111.2
217Q42.3Very low43.7Very low187 Ų187127.5 Ų127.587%0.87475%0.753SS**  173.7112.2129.4-94.7165.2108.200109.6
218Q39.9Very low45Very low168 Ų168125.9 Ų125.979%0.78574%0.744SS**  96.910662.5-170.178.5-13.100111.4
219G34Very low46.3Very low74 Ų74126.2 Ų126.276%0.76374%0.738SS**  trans106.783.8154.400000119.5
220S40Very low48.7Very low112 Ų112125.1 Ų125.178%0.78372%0.723SS**  trans-161.753.5139-159.50000113.2G222S220-G222 PolarHBondContact O-N 2.69Å
221S49.1Very low51.2Low133 Ų133122.6 Ų122.693%0.9371%0.705SS**THydrogen-bonded Turntrans-79.733176.342.70000113.7
222G45.4Very low53.5Low67 Ų67123.7 Ų123.769%0.69170%0.698SS**THydrogen-bonded Turntrans-105.2-23.4-173.900000116.7S220 K224S220-G222 PolarHBondContact O-N 2.69Å; G222-K224 PolarHBondContact O-N 3.25Å; G222-K224 VanDerWaalsContact O-N 3.12Å
223A47.7Very low56.1Low88 Ų88119.9 Ų119.973%0.72768%0.677SS**  trans-91.153-167.100000114.8
224K59.5Low58.8Low195 Ų195117.2 Ų117.285%0.84866%0.661SS**  trans-118.8127.1174.1-72.3-179179.1174.90111.2G222G222-K224 PolarHBondContact O-N 3.25Å; G222-K224 VanDerWaalsContact O-N 3.12Å
225K57Low61.6Low197 Ų197117.7 Ų117.786%0.85766%0.656SS**  trans78.835.6-174.5-49.2-178.6-172.51770117A227K225-A227 PolarHBondContact O-N 3.01Å
226I55.5Low64.1Low136 Ų136114 Ų11470%0.69764%0.642SS**SBendtrans-56.5126.6134.7-80.6174.4000106.1I230I226-I230 HydrophobicContact CG2-CG2 3.63Å
227A58.5Low66.9Low59 Ų59115.4 Ų115.449%0.48865%0.648SS.*  trans-67.4135.6-153.800000112.9K225 N229 I230K225-A227 PolarHBondContact O-N 3.01Å; A227-N229 PolarHBondContact O-N 3.29Å; A227-I230 WeakPolarHBondContact O-CG2 3.46Å; A227-I230 PolarHBondContact O-N 3.24Å
228P64.8Low69.6Low94 Ų94112 Ų11261%0.6163%0.632SS**THydrogen-bonded Turntrans-67.211.2-175.529.2-37.6000115.2
229N68.7Low72.3Confident105 Ų105111.6 Ų111.656%0.56162%0.624SS**THydrogen-bonded Turntrans-78.7-39.9163.6-165.4-74.3000110.8A227 D231 R232 S233A227-N229 PolarHBondContact O-N 3.29Å; N229-D231 PolarHBondContact O-N 3.44Å; N229-R232 WeakPolarHBondContact O-CB 3.29Å; N229-R232 PolarHBondContact O-N 3.47Å; N229-S233 PolarHBondContact O-N 2.94Å; N229-S233 PolarHBondContact O-OG 3.49Å
230I87.4Confident75.3Confident79 Ų79110.6 Ų110.641%0.40561%0.605SS.*Hα-helixtrans-64.6-36.9-173.4-161.862.8000112.5I226 A227 R232 S233 V234I226-I230 HydrophobicContact CG2-CG2 3.63Å; A227-I230 WeakPolarHBondContact O-CG2 3.46Å; A227-I230 PolarHBondContact O-N 3.24Å; I230-R232 PolarHBondContact O-N 2.66Å; I230-R232 VanDerWaalsContact O-N 3.17Å; I230-S233 CarbonylContact O-C 3.54Å; I230-S233 WeakPolarHBondContact O-CB 3.45Å; I230-S233 PolarHBondContact O-N 2.98Å; I230-V234 HydrophobicContact CG1-CG2 4.28Å; I230-V234 WeakPolarHBondContact O-CG2 3.33Å; I230-V234 PolarHBondContact O-N 3.39Å
231D89.1Confident78.1Confident94 Ų94109 Ų10950%0.50359%0.59SS.*Hα-helixtrans-61.6-26.4176.9-59.3-59.3000112.5N229 K235N229-D231 PolarHBondContact O-N 3.44Å; D231-K235 VanDerWaalsContact O-CG 3.29Å; D231-K235 WeakPolarHBondContact O-CG 3.24Å; D231-K235 PolarHBondContact O-N 2.99Å
232R90.9Very high80.4Confident178 Ų178107.7 Ų107.767%0.67258%0.577SS**Hα-helixtrans-77.8-44.3174.5-54.7177.7-176.7165.60.2110N229 I230 V234 K235 D236N229-R232 WeakPolarHBondContact O-CB 3.29Å; N229-R232 PolarHBondContact O-N 3.47Å; I230-R232 PolarHBondContact O-N 2.66Å; I230-R232 VanDerWaalsContact O-N 3.17Å; R232-V234 VanDerWaalsContact C-N 3.33Å; R232-V234 PolarHBondContact O-N 3.07Å; R232-K235 PolarHBondContact O-N 2.73Å; R232-D236 PolarHBondContact O-N 3.44Å
233S93.5Very high82.9Confident57 Ų57106.4 Ų106.440%0.39956%0.557SS.*Hα-helixtrans-62.3-36.9174-520000112.9N229 I230 D236 L237N229-S233 PolarHBondContact O-N 2.94Å; N229-S233 PolarHBondContact O-OG 3.49Å; I230-S233 CarbonylContact O-C 3.54Å; I230-S233 WeakPolarHBondContact O-CB 3.45Å; I230-S233 PolarHBondContact O-N 2.98Å; S233-D236 PolarHBondContact O-N 3.3Å; S233-L237 VanDerWaalsContact O-CB 3.29Å; S233-L237 WeakPolarHBondContact O-CB 3.32Å; S233-L237 PolarHBondContact O-N 2.94Å
234V94.8Very high85.3Confident63 Ų63106.6 Ų106.638%0.38255%0.545SS..Hα-helixtrans-67.9-40.7175.5169.40000110.9I230 R232 L237 Q238I230-V234 HydrophobicContact CG1-CG2 4.28Å; I230-V234 WeakPolarHBondContact O-CG2 3.33Å; I230-V234 PolarHBondContact O-N 3.39Å; R232-V234 VanDerWaalsContact C-N 3.33Å; R232-V234 PolarHBondContact O-N 3.07Å; V234-L237 PolarHBondContact O-N 2.84Å; V234-Q238 VanDerWaalsContact O-CG 3.31Å; V234-Q238 WeakPolarHBondContact O-CG 3.39Å; V234-Q238 PolarHBondContact O-N 3.33Å
235K95.3Very high87.2Confident146 Ų146100.9 Ų100.964%0.63553%0.527SS*.Hα-helixtrans-67.1-38.4174.5-75.9174-179.3-179.90112.7D231 R232 Q238 R239D231-K235 VanDerWaalsContact O-CG 3.29Å; D231-K235 WeakPolarHBondContact O-CG 3.24Å; D231-K235 PolarHBondContact O-N 2.99Å; R232-K235 PolarHBondContact O-N 2.73Å; K235-Q238 PolarHBondContact O-N 2.94Å; K235-R239 WeakPolarHBondContact O-CB 3.48Å; K235-R239 PolarHBondContact O-N 3.43Å
236D95.8Very high89.1Confident78 Ų7899.7 Ų99.742%0.41752%0.517SS..Hα-helixtrans-71.6-34.6174.3-160.146.7000111.6R232 S233 R239 C240R232-D236 PolarHBondContact O-N 3.44Å; S233-D236 PolarHBondContact O-N 3.3Å; D236-R239 CarbonylContact O-C 3.55Å; D236-R239 WeakPolarHBondContact O-CB 3.38Å; D236-R239 PolarHBondContact O-N 3.5Å; D236-R239 IonicContact OD1-NH1 2.98Å; D236-R239 PolarHBondContact OD1-NH1 2.95Å; D236-C240 WeakPolarHBondContact O-CB 3.34Å; D236-C240 PolarHBondContact O-N 3.4Å; D236-C240 PolarHBondContact O-SG 2.91Å; D236-C240 VanDerWaalsContact O-SG 3.33Å
237L96.8Very high91.2Very high113 Ų11399.7 Ų99.759%0.59251%0.509SS*.Hα-helixtrans-60.7-45.5169.7179.461.7000111.9S233 V234 R239 C240 T241S233-L237 VanDerWaalsContact O-CB 3.29Å; S233-L237 WeakPolarHBondContact O-CB 3.32Å; S233-L237 PolarHBondContact O-N 2.94Å; V234-L237 PolarHBondContact O-N 2.84Å; L237-R239 VanDerWaalsContact C-N 3.31Å; L237-R239 PolarHBondContact O-N 3.17Å; L237-C240 CarbonylContact O-C 3.57Å; L237-C240 WeakPolarHBondContact O-CB 3.35Å; L237-C240 PolarHBondContact O-N 2.97Å; L237-C240 VanDerWaalsContact O-N 3.17Å; L237-T241 PolarHBondContact O-N 3.38Å; L237-T241 PolarHBondContact O-OG1 2.94Å; L237-T241 VanDerWaalsContact O-OG1 3.11Å
238Q97.3Very high93.1Very high115 Ų115105.7 Ų105.754%0.53752%0.519SS..Hα-helixtrans-59.1-42.7173.7-74.3169.7-13.400111.5V234 K235 T241 V242V234-Q238 VanDerWaalsContact O-CG 3.31Å; V234-Q238 WeakPolarHBondContact O-CG 3.39Å; V234-Q238 PolarHBondContact O-N 3.33Å; K235-Q238 PolarHBondContact O-N 2.94Å; Q238-T241 WeakPolarHBondContact O-CB 3.2Å; Q238-T241 PolarHBondContact O-N 3.48Å; Q238-V242 WeakPolarHBondContact O-CG2 3.41Å; Q238-V242 PolarHBondContact O-N 3.25Å
239R97.6Very high94.7Very high161 Ų161105 Ų10561%0.60851%0.513SS*.Hα-helixtrans-63.6-39.4174.4178.5175.3168.1-92.9-6.7112K235 D236 L237 V242 S243K235-R239 WeakPolarHBondContact O-CB 3.48Å; K235-R239 PolarHBondContact O-N 3.43Å; D236-R239 CarbonylContact O-C 3.55Å; D236-R239 WeakPolarHBondContact O-CB 3.38Å; D236-R239 PolarHBondContact O-N 3.5Å; D236-R239 IonicContact OD1-NH1 2.98Å; D236-R239 PolarHBondContact OD1-NH1 2.95Å; L237-R239 VanDerWaalsContact C-N 3.31Å; L237-R239 PolarHBondContact O-N 3.17Å; R239-V242 PolarHBondContact O-N 3.4Å; R239-S243 WeakPolarHBondContact O-CB 3.5Å; R239-S243 PolarHBondContact O-N 3.37Å; R239-S243 PolarHBondContact O-OG 3.04Å
240C97.6Very high96.1Very high53 Ų53102.5 Ų102.536%0.35850%0.501SS..Hα-helixtrans-62.6-43.7171-73.70000111.7D236 L237 V242 S243 L244D236-C240 WeakPolarHBondContact O-CB 3.34Å; D236-C240 PolarHBondContact O-N 3.4Å; D236-C240 PolarHBondContact O-SG 2.91Å; D236-C240 VanDerWaalsContact O-SG 3.33Å; L237-C240 CarbonylContact O-C 3.57Å; L237-C240 WeakPolarHBondContact O-CB 3.35Å; L237-C240 PolarHBondContact O-N 2.97Å; L237-C240 VanDerWaalsContact O-N 3.17Å; C240-V242 PolarHBondContact O-N 3.48Å; C240-S243 CarbonylContact O-C 3.6Å; C240-S243 PolarHBondContact O-N 3.19Å; C240-S243 VanDerWaalsContact O-N 3.14Å; C240-L244 WeakPolarHBondContact O-CB 3.37Å; C240-L244 VanDerWaalsContact O-CG 3.27Å; C240-L244 WeakPolarHBondContact O-CG 3.43Å; C240-L244 PolarHBondContact O-N 2.86Å
241T97.9Very high96.5Very high79 Ų79103.1 Ų103.149%0.48551%0.509SS..Hα-helixtrans-58-47.2175.6-58.30000111.8L237 Q238 S243 L244 T245L237-T241 PolarHBondContact O-N 3.38Å; L237-T241 PolarHBondContact O-OG1 2.94Å; L237-T241 VanDerWaalsContact O-OG1 3.11Å; Q238-T241 WeakPolarHBondContact O-CB 3.2Å; Q238-T241 PolarHBondContact O-N 3.48Å; T241-S243 VanDerWaalsContact C-N 3.32Å; T241-S243 PolarHBondContact O-N 2.89Å; T241-L244 PolarHBondContact O-N 3.09Å; T241-T245 PolarHBondContact O-N 3.48Å; T241-T245 VanDerWaalsContact O-N 3.07Å; T241-T245 PolarHBondContact O-OG1 3.46Å
242V98.1Very high97Very high105 Ų105105.1 Ų105.164%0.63651%0.513SS*.Hα-helixtrans-62.3-40.8174.9175.30000111.3Q238 R239 C240 T245 R246Q238-V242 WeakPolarHBondContact O-CG2 3.41Å; Q238-V242 PolarHBondContact O-N 3.25Å; R239-V242 PolarHBondContact O-N 3.4Å; C240-V242 PolarHBondContact O-N 3.48Å; V242-T245 PolarHBondContact O-N 2.91Å; V242-R246 PolarHBondContact O-N 2.94Å
243S98.1Very high97.3Very high39 Ų39101 Ų10127%0.27350%0.504SS..Hα-helixtrans-66.6-41179.8-56.70000111.9R239 C240 T241 R246 Y247R239-S243 WeakPolarHBondContact O-CB 3.5Å; R239-S243 PolarHBondContact O-N 3.37Å; R239-S243 PolarHBondContact O-OG 3.04Å; C240-S243 CarbonylContact O-C 3.6Å; C240-S243 PolarHBondContact O-N 3.19Å; C240-S243 VanDerWaalsContact O-N 3.14Å; T241-S243 VanDerWaalsContact C-N 3.32Å; T241-S243 PolarHBondContact O-N 2.89Å; S243-R246 WeakPolarHBondContact O-CB 3.43Å; S243-R246 PolarHBondContact O-N 3.19Å; S243-Y247 WeakPolarHBondContact O-CD2 3.38Å; S243-Y247 VanDerWaalsContact O-CG 3.32Å; S243-Y247 PolarHBondContact O-N 2.99Å
244L97.7Very high97.5Very high92 Ų92103.6 Ų103.648%0.48251%0.51SS..Hα-helixtrans-62.6-41.9174.6-73.3167.5000111.7C240 T241 R246 Y247 R248C240-L244 WeakPolarHBondContact O-CB 3.37Å; C240-L244 VanDerWaalsContact O-CG 3.27Å; C240-L244 WeakPolarHBondContact O-CG 3.43Å; C240-L244 PolarHBondContact O-N 2.86Å; T241-L244 PolarHBondContact O-N 3.09Å; L244-R246 VanDerWaalsContact C-N 3.32Å; L244-R246 PolarHBondContact O-N 3.28Å; L244-Y247 PolarHBondContact O-N 3.33Å; L244-R248 WeakPolarHBondContact O-CG 3.41Å; L244-R248 PolarHBondContact O-N 3.46Å
245T98.4Very high97.6Very high76 Ų76105.3 Ų105.347%0.46652%0.515SS..Hα-helixtrans-60.2-41.9172.8-62.50000111.5T241 V242 R248T241-T245 PolarHBondContact O-N 3.48Å; T241-T245 VanDerWaalsContact O-N 3.07Å; T241-T245 PolarHBondContact O-OG1 3.46Å; V242-T245 PolarHBondContact O-N 2.91Å; T245-R248 PolarHBondContact O-N 2.94Å
246R98.4Very high97.8Very high171 Ų171101.4 Ų101.465%0.64550%0.501SS*.Hα-helixtrans-64.6-42.8173.1-178.5176.7175.8-111.2-5.4112.5V242 S243 L244 R248 V249 V250V242-R246 PolarHBondContact O-N 2.94Å; S243-R246 WeakPolarHBondContact O-CB 3.43Å; S243-R246 PolarHBondContact O-N 3.19Å; L244-R246 VanDerWaalsContact C-N 3.32Å; L244-R246 PolarHBondContact O-N 3.28Å; R246-R248 VanDerWaalsContact C-N 3.31Å; R246-R248 PolarHBondContact O-N 2.97Å; R246-V249 PolarHBondContact O-N 2.92Å; R246-V249 VanDerWaalsContact O-N 3.16Å; R246-V250 HydrophobicContact CG-CG2 4.47Å; R246-V250 PolarHBondContact O-N 3.45Å
247Y98.2Very high97.9Very high136 Ų136100.3 Ų100.353%0.53350%0.499SS..Hα-helixtrans-65.3-32.4179.8-67.8-50.7000112.8S243 L244 V249 V250 V251S243-Y247 WeakPolarHBondContact O-CD2 3.38Å; S243-Y247 VanDerWaalsContact O-CG 3.32Å; S243-Y247 PolarHBondContact O-N 2.99Å; L244-Y247 PolarHBondContact O-N 3.33Å; Y247-V249 VanDerWaalsContact C-N 3.31Å; Y247-V249 PolarHBondContact O-N 3.39Å; Y247-V250 PolarHBondContact O-N 3.19Å; Y247-V251 WeakPolarHBondContact O-CB 3.31Å; Y247-V251 WeakPolarHBondContact O-CG2 3.43Å; Y247-V251 PolarHBondContact O-N 3.2Å
248R98.2Very high98Very high185 Ų18597.6 Ų97.670%0.69849%0.49SS*.Hα-helixtrans-59.1-40.7171.4-71.7170.1-178.8171.4-1.9112.4L244 T245 R246 K252L244-R248 WeakPolarHBondContact O-CG 3.41Å; L244-R248 PolarHBondContact O-N 3.46Å; T245-R248 PolarHBondContact O-N 2.94Å; R246-R248 VanDerWaalsContact C-N 3.31Å; R246-R248 PolarHBondContact O-N 2.97Å; R248-K252 PolarHBondContact O-N 3.2Å
249V98.4Very high98Very high79 Ų7996.1 Ų96.148%0.47949%0.485SS..Hα-helixtrans-67.3-51.3176.4-179.70000110R246 Y247 V251 K252 D253R246-V249 PolarHBondContact O-N 2.92Å; R246-V249 VanDerWaalsContact O-N 3.16Å; Y247-V249 VanDerWaalsContact C-N 3.31Å; Y247-V249 PolarHBondContact O-N 3.39Å; V249-V251 VanDerWaalsContact C-N 3.33Å; V249-V251 PolarHBondContact O-N 2.87Å; V249-K252 WeakPolarHBondContact O-CA 3.42Å; V249-K252 WeakPolarHBondContact O-CB 3.5Å; V249-K252 PolarHBondContact O-N 3.31Å; V249-D253 WeakPolarHBondContact CG1-OD2 3.37Å; V249-D253 VanDerWaalsContact O-CG 3.28Å; V249-D253 PolarHBondContact O-N 3.28Å
250V97.9Very high98.1Very high54 Ų5495.3 Ų95.333%0.32749%0.486SS..Hα-helixtrans-56-44.9178.61750000112R246 Y247 K252 D253 E254R246-V250 HydrophobicContact CG-CG2 4.47Å; R246-V250 PolarHBondContact O-N 3.45Å; Y247-V250 PolarHBondContact O-N 3.19Å; V250-K252 VanDerWaalsContact C-N 3.31Å; V250-K252 PolarHBondContact O-N 3.02Å; V250-D253 PolarHBondContact O-N 2.94Å; V250-E254 HydrophobicContact CG1-CG 4.27Å; V250-E254 WeakPolarHBondContact O-CB 3.37Å; V250-E254 VanDerWaalsContact O-CG 3.29Å; V250-E254 WeakPolarHBondContact O-CG 3.33Å; V250-E254 PolarHBondContact O-N 3.11Å
251V97.4Very high98.1Very high92 Ų9296.7 Ų96.756%0.55849%0.493SS*.Hα-helixtrans-61.7-39.7176.7169.60000111.3Y247 V249 M255Y247-V251 WeakPolarHBondContact O-CB 3.31Å; Y247-V251 WeakPolarHBondContact O-CG2 3.43Å; Y247-V251 PolarHBondContact O-N 3.2Å; V249-V251 VanDerWaalsContact C-N 3.33Å; V249-V251 PolarHBondContact O-N 2.87Å; V251-M255 VanDerWaalsContact O-CG 3.25Å; V251-M255 WeakPolarHBondContact O-CG 3.39Å; V251-M255 PolarHBondContact O-N 3.21Å
252K98Very high98.2Very high136 Ų13697.2 Ų97.259%0.59149%0.491SS*.Hα-helixtrans-65.5-47.4176.6-168.1-174.9176.2-172.10111.6R248 V249 V250 E254 M255 D256R248-K252 PolarHBondContact O-N 3.2Å; V249-K252 WeakPolarHBondContact O-CA 3.42Å; V249-K252 WeakPolarHBondContact O-CB 3.5Å; V249-K252 PolarHBondContact O-N 3.31Å; V250-K252 VanDerWaalsContact C-N 3.31Å; V250-K252 PolarHBondContact O-N 3.02Å; K252-E254 VanDerWaalsContact C-N 3.32Å; K252-E254 PolarHBondContact O-N 2.74Å; K252-M255 PolarHBondContact O-N 3.02Å; K252-D256 PolarHBondContact O-N 3.28Å
253D98.3Very high98.2Very high90 Ų9099.4 Ų99.448%0.48149%0.492SS..Hα-helixtrans-60.1-42-179.9-61.6-22.2000111.5V249 V250 D256 S257V249-D253 WeakPolarHBondContact CG1-OD2 3.37Å; V249-D253 VanDerWaalsContact O-CG 3.28Å; V249-D253 PolarHBondContact O-N 3.28Å; V250-D253 PolarHBondContact O-N 2.94Å; D253-D256 PolarHBondContact O-N 3.47Å; D253-S257 VanDerWaalsContact O-CB 3.23Å; D253-S257 WeakPolarHBondContact O-CB 3.4Å; D253-S257 PolarHBondContact O-N 2.72Å
254E97.4Very high98.2Very high112 Ų112102.6 Ų102.652%0.52350%0.502SS..Hα-helixtrans-68.5-34.3176.4-68.8-64.1162.900112.8V250 K252 S258V250-E254 HydrophobicContact CG1-CG 4.27Å; V250-E254 WeakPolarHBondContact O-CB 3.37Å; V250-E254 VanDerWaalsContact O-CG 3.29Å; V250-E254 WeakPolarHBondContact O-CG 3.33Å; V250-E254 PolarHBondContact O-N 3.11Å; K252-E254 VanDerWaalsContact C-N 3.32Å; K252-E254 PolarHBondContact O-N 2.74Å; E254-S258 VanDerWaalsContact O-CB 3.3Å; E254-S258 WeakPolarHBondContact O-CB 3.5Å; E254-S258 PolarHBondContact O-N 3.49Å; E254-S258 PolarHBondContact O-OG 3.26Å
255M97.8Very high98.2Very high99 Ų99100.4 Ų100.449%0.48849%0.493SS..Hα-helixtrans-69.8-45.4172.6-68.5-59.695.500111.6V251 K252 S257 S258 I259V251-M255 VanDerWaalsContact O-CG 3.25Å; V251-M255 WeakPolarHBondContact O-CG 3.39Å; V251-M255 PolarHBondContact O-N 3.21Å; K252-M255 PolarHBondContact O-N 3.02Å; M255-S257 VanDerWaalsContact C-N 3.25Å; M255-S257 PolarHBondContact O-N 3.25Å; M255-S258 PolarHBondContact O-N 3.03Å; M255-I259 VanDerWaalsContact O-CG1 3.3Å; M255-I259 WeakPolarHBondContact O-CG1 3.49Å; M255-I259 PolarHBondContact O-N 3.26Å
256D98.4Very high98.2Very high65 Ų65100.9 Ų100.935%0.34849%0.488SS..Hα-helixtrans-62.8-33.3175.6-75.6-23.7000111.5K252 D253 K260K252-D256 PolarHBondContact O-N 3.28Å; D253-D256 PolarHBondContact O-N 3.47Å; D256-K260 VanDerWaalsContact O-CD 3.24Å; D256-K260 WeakPolarHBondContact O-CD 3.38Å; D256-K260 WeakPolarHBondContact O-CE 3.48Å; D256-K260 WeakPolarHBondContact O-CG 3.37Å; D256-K260 PolarHBondContact O-N 3.16Å
257S98.4Very high98.3Very high54 Ų5494.9 Ų94.938%0.37848%0.476SS..Hα-helixtrans-66.6-49.8170.7-172.30000111.7D253 M255 I259 K260 T261D253-S257 VanDerWaalsContact O-CB 3.23Å; D253-S257 WeakPolarHBondContact O-CB 3.4Å; D253-S257 PolarHBondContact O-N 2.72Å; M255-S257 VanDerWaalsContact C-N 3.25Å; M255-S257 PolarHBondContact O-N 3.25Å; S257-I259 VanDerWaalsContact C-N 3.32Å; S257-I259 PolarHBondContact O-N 3.04Å; S257-K260 PolarHBondContact O-N 3.47Å; S257-K260 VanDerWaalsContact O-N 3.15Å; S257-T261 PolarHBondContact O-N 3.12Å; S257-T261 PolarHBondContact O-OG1 3.34Å; S257-T261 VanDerWaalsContact O-OG1 3.07Å
258S98.3Very high98.3Very high56 Ų5693.4 Ų93.439%0.39247%0.473SS..Hα-helixtrans-59.4-40.4178.9-60.90000112.5E254 M255 T261 M262E254-S258 VanDerWaalsContact O-CB 3.3Å; E254-S258 WeakPolarHBondContact O-CB 3.5Å; E254-S258 PolarHBondContact O-N 3.49Å; E254-S258 PolarHBondContact O-OG 3.26Å; M255-S258 PolarHBondContact O-N 3.03Å; S258-T261 PolarHBondContact O-N 3.13Å; S258-M262 VanDerWaalsContact O-CB 3.32Å; S258-M262 WeakPolarHBondContact O-CB 3.43Å; S258-M262 PolarHBondContact O-N 2.95Å
259I98.3Very high98.3Very high85 Ų8587.9 Ų87.944%0.43646%0.458SS..Hα-helixtrans-66.4-39.4177-68.9164.1000111.4M255 S257 K263M255-I259 VanDerWaalsContact O-CG1 3.3Å; M255-I259 WeakPolarHBondContact O-CG1 3.49Å; M255-I259 PolarHBondContact O-N 3.26Å; S257-I259 VanDerWaalsContact C-N 3.32Å; S257-I259 PolarHBondContact O-N 3.04Å; I259-K263 HydrophobicContact CG2-CD 4.42Å; I259-K263 WeakPolarHBondContact O-CG 3.46Å; I259-K263 PolarHBondContact O-N 3.5Å; I259-K263 VanDerWaalsContact O-N 3.07Å
260K98.7Very high98.2Very high143 Ų14390 Ų9062%0.62246%0.462SS*.Hα-helixtrans-64.8-48.1175.2-70.6160.9-165.8163.60110.9D256 S257 M262 K263 Q264D256-K260 VanDerWaalsContact O-CD 3.24Å; D256-K260 WeakPolarHBondContact O-CD 3.38Å; D256-K260 WeakPolarHBondContact O-CE 3.48Å; D256-K260 WeakPolarHBondContact O-CG 3.37Å; D256-K260 PolarHBondContact O-N 3.16Å; S257-K260 PolarHBondContact O-N 3.47Å; S257-K260 VanDerWaalsContact O-N 3.15Å; K260-M262 PolarHBondContact O-N 2.99Å; K260-K263 PolarHBondContact O-N 3.37Å; K260-Q264 WeakPolarHBondContact O-CB 3.33Å; K260-Q264 PolarHBondContact O-N 3.04Å
261T98.3Very high98.3Very high82 Ų8290 Ų9050%0.50346%0.464SS..Hα-helixtrans-58.4-47.4177.1-55.20000111.3S257 S258 K263 Q264 T265S257-T261 PolarHBondContact O-N 3.12Å; S257-T261 PolarHBondContact O-OG1 3.34Å; S257-T261 VanDerWaalsContact O-OG1 3.07Å; S258-T261 PolarHBondContact O-N 3.13Å; T261-K263 PolarHBondContact O-N 3.14Å; T261-Q264 PolarHBondContact O-N 2.91Å; T261-T265 PolarHBondContact O-N 2.9Å; T261-T265 PolarHBondContact O-OG1 3.35Å; T261-T265 VanDerWaalsContact O-OG1 3.13Å
262M98.6Very high98.3Very high91 Ų9189.5 Ų89.545%0.44846%0.464SS..Hα-helixtrans-57.2-48.6176.8-177-173.7-67.300112S258 K260 Q264 T265 F266 V363S258-M262 VanDerWaalsContact O-CB 3.32Å; S258-M262 WeakPolarHBondContact O-CB 3.43Å; S258-M262 PolarHBondContact O-N 2.95Å; K260-M262 PolarHBondContact O-N 2.99Å; M262-Q264 VanDerWaalsContact C-N 3.34Å; M262-Q264 PolarHBondContact O-N 3.45Å; M262-T265 PolarHBondContact O-N 2.79Å; M262-F266 HydrophobicContact CG-CD2 4.05Å; M262-F266 HydrophobicContact CG-CE2 4.09Å; M262-F266 WeakPolarHBondContact O-CD2 3.45Å; M262-F266 PolarHBondContact O-N 3.1Å; M262-F266 VanDerWaalsContact O-N 3.1Å; M262-V363 HydrophobicContact CE-CG2 3.98Å
263K98.6Very high98.3Very high150 Ų15087.7 Ų87.765%0.65246%0.46SS*.Hα-helixtrans-61.4-42177.4-74.4-179.5177.8-171.80112.3I259 K260 T261 F266 A267I259-K263 HydrophobicContact CG2-CD 4.42Å; I259-K263 WeakPolarHBondContact O-CG 3.46Å; I259-K263 PolarHBondContact O-N 3.5Å; I259-K263 VanDerWaalsContact O-N 3.07Å; K260-K263 PolarHBondContact O-N 3.37Å; T261-K263 PolarHBondContact O-N 3.14Å; K263-F266 PolarHBondContact O-N 2.7Å; K263-A267 PolarHBondContact O-N 3.44Å
264Q98.6Very high98.3Very high107 Ų10788.6 Ų88.650%0.546%0.463SS..Hα-helixtrans-62-48.6177.5-179.260.128.600111.5K260 T261 M262 F266 A267 E268K260-Q264 WeakPolarHBondContact O-CB 3.33Å; K260-Q264 PolarHBondContact O-N 3.04Å; T261-Q264 PolarHBondContact O-N 2.91Å; M262-Q264 VanDerWaalsContact C-N 3.34Å; M262-Q264 PolarHBondContact O-N 3.45Å; Q264-F266 VanDerWaalsContact C-N 3.34Å; Q264-F266 PolarHBondContact O-N 2.94Å; Q264-A267 PolarHBondContact O-N 3.41Å; Q264-A267 VanDerWaalsContact O-N 3.13Å; Q264-E268 WeakPolarHBondContact CG-OE1 3.43Å; Q264-E268 PolarHBondContact NE2-OE1 3.13Å; Q264-E268 WeakPolarHBondContact O-CG 3.46Å; Q264-E268 PolarHBondContact O-N 3.35Å
265T98.5Very high98.4Very high45 Ų4587.7 Ų87.728%0.27646%0.462SS..Hα-helixtrans-61.5-38.4178.4-57.70000112.6T261 M262 E268 L269 F360T261-T265 PolarHBondContact O-N 2.9Å; T261-T265 PolarHBondContact O-OG1 3.35Å; T261-T265 VanDerWaalsContact O-OG1 3.13Å; M262-T265 PolarHBondContact O-N 2.79Å; T265-E268 PolarHBondContact O-N 3.46Å; T265-L269 WeakPolarHBondContact O-CG 3.3Å; T265-L269 PolarHBondContact O-N 3.02Å; T265-F360 HydrophobicContact CG2-CE1 3.96Å; T265-F360 HydrophobicContact CG2-CZ 3.82Å
266F98.4Very high98.4Very high86 Ų8688.5 Ų88.538%0.37746%0.46SS..Hα-helixtrans-70.2-32.9174.8-84-72.3000113.2M262 K263 Q264 L269 Q270 F360M262-F266 HydrophobicContact CG-CD2 4.05Å; M262-F266 HydrophobicContact CG-CE2 4.09Å; M262-F266 WeakPolarHBondContact O-CD2 3.45Å; M262-F266 PolarHBondContact O-N 3.1Å; M262-F266 VanDerWaalsContact O-N 3.1Å; K263-F266 PolarHBondContact O-N 2.7Å; Q264-F266 VanDerWaalsContact C-N 3.34Å; Q264-F266 PolarHBondContact O-N 2.94Å; F266-L269 HydrophobicContact CD1-CD1 4.28Å; F266-L269 HydrophobicContact CE1-CD1 4.49Å; F266-Q270 VanDerWaalsContact O-CG 3.3Å; F266-Q270 WeakPolarHBondContact O-CG 3.43Å; F266-Q270 PolarHBondContact O-N 3.07Å; F266-F360 HydrophobicContact CE1-CD1 4.07Å; F266-F360 AromaticContact CZ-CD1 3.86Å; F266-F360 HydrophobicContact CZ-CD1 3.86Å; F266-F360 HydrophobicContact CZ-CE1 4.33Å
267A98.6Very high98.4Very high46 Ų4691.1 Ų91.138%0.3847%0.47SS..Hα-helixtrans-68.1-39172.400000112.2K263 Q264 Q270 S271K263-A267 PolarHBondContact O-N 3.44Å; Q264-A267 PolarHBondContact O-N 3.41Å; Q264-A267 VanDerWaalsContact O-N 3.13Å; A267-Q270 PolarHBondContact O-N 2.94Å; A267-S271 PolarHBondContact O-N 3.01Å
268E98.4Very high98.4Very high104 Ų10492.8 Ų92.849%0.48648%0.478SS..Hα-helixtrans-63.5-41.6173.9-72.8165.6-177.700112Q264 T265 Q270 S271 C272Q264-E268 WeakPolarHBondContact CG-OE1 3.43Å; Q264-E268 PolarHBondContact NE2-OE1 3.13Å; Q264-E268 WeakPolarHBondContact O-CG 3.46Å; Q264-E268 PolarHBondContact O-N 3.35Å; T265-E268 PolarHBondContact O-N 3.46Å; E268-Q270 VanDerWaalsContact C-N 3.34Å; E268-Q270 PolarHBondContact O-N 3.23Å; E268-S271 PolarHBondContact O-N 3.46Å; E268-C272 WeakPolarHBondContact O-CB 3.35Å; E268-C272 PolarHBondContact O-N 3.47Å
269L98Very high98.4Very high70 Ų7093.3 Ų93.337%0.36648%0.478SS..Hα-helixtrans-63.1-38.4173-74.2172.7000112.4T265 F266 C272 L273 F360T265-L269 WeakPolarHBondContact O-CG 3.3Å; T265-L269 PolarHBondContact O-N 3.02Å; F266-L269 HydrophobicContact CD1-CD1 4.28Å; F266-L269 HydrophobicContact CE1-CD1 4.49Å; L269-C272 PolarHBondContact O-N 3.29Å; L269-L273 WeakPolarHBondContact O-CG 3.4Å; L269-L273 PolarHBondContact O-N 3.15Å; L269-L273 VanDerWaalsContact O-N 3.16Å; L269-F360 HydrophobicContact CD1-CD1 3.9Å; L269-F360 HydrophobicContact CD1-CE1 3.54Å; L269-F360 HydrophobicContact CD1-CE2 4.43Å; L269-F360 HydrophobicContact CD1-CG 4.49Å; L269-F360 HydrophobicContact CD1-CZ 3.84Å
270Q98.1Very high98.4Very high123 Ų12391.8 Ų91.858%0.57547%0.471SS*.Hα-helixtrans-65-44.6174.7-74.5169.2-4.900111.6F266 A267 E268 L273 M274F266-Q270 VanDerWaalsContact O-CG 3.3Å; F266-Q270 WeakPolarHBondContact O-CG 3.43Å; F266-Q270 PolarHBondContact O-N 3.07Å; A267-Q270 PolarHBondContact O-N 2.94Å; E268-Q270 VanDerWaalsContact C-N 3.34Å; E268-Q270 PolarHBondContact O-N 3.23Å; Q270-L273 PolarHBondContact O-N 2.77Å; Q270-M274 WeakPolarHBondContact O-CG 3.35Å; Q270-M274 PolarHBondContact O-N 2.9Å; Q270-M274 VanDerWaalsContact O-N 3.12Å
271S98.6Very high98.3Very high53 Ų5389.9 Ų89.937%0.37147%0.467SS..Hα-helixtrans-56.5-52.4173.1-165.60000110.7A267 E268 L273 M274 D275A267-S271 PolarHBondContact O-N 3.01Å; E268-S271 PolarHBondContact O-N 3.46Å; S271-L273 PolarHBondContact O-N 3.37Å; S271-L273 VanDerWaalsContact O-N 3.13Å; S271-M274 CarbonylContact O-C 3.58Å; S271-M274 PolarHBondContact O-N 3.47Å; S271-D275 WeakPolarHBondContact O-CB 3.42Å; S271-D275 PolarHBondContact O-N 3.29Å; S271-D275 PolarHBondContact OG-OD2 3.44Å
272C98.3Very high98.3Very high83 Ų8390.4 Ų90.456%0.56147%0.47SS*.Hα-helixtrans-55.6-35.6-178-174.80000113.5E268 L269 R276E268-C272 WeakPolarHBondContact O-CB 3.35Å; E268-C272 PolarHBondContact O-N 3.47Å; L269-C272 PolarHBondContact O-N 3.29Å; C272-R276 WeakPolarHBondContact O-CB 3.45Å; C272-R276 PolarHBondContact O-N 3.35Å; C272-R276 VanDerWaalsContact O-N 3.14Å
273L97.8Very high98.2Very high97 Ų9790.6 Ų90.651%0.50847%0.47SS..Hα-helixtrans-71.3-44.8174.6-70.3171.4000112.3L269 Q270 S271 R276 E277L269-L273 WeakPolarHBondContact O-CG 3.4Å; L269-L273 PolarHBondContact O-N 3.15Å; L269-L273 VanDerWaalsContact O-N 3.16Å; Q270-L273 PolarHBondContact O-N 2.77Å; S271-L273 PolarHBondContact O-N 3.37Å; S271-L273 VanDerWaalsContact O-N 3.13Å; L273-R276 PolarHBondContact O-N 2.71Å; L273-E277 PolarHBondContact O-N 3.22Å
274M98.5Very high98Very high109 Ų10986.5 Ų86.554%0.53745%0.454SS..Hα-helixtrans-64.1-42.6176.1-66.7-176.8-66.600111.8Q270 S271 R276 E277 V278Q270-M274 WeakPolarHBondContact O-CG 3.35Å; Q270-M274 PolarHBondContact O-N 2.9Å; Q270-M274 VanDerWaalsContact O-N 3.12Å; S271-M274 CarbonylContact O-C 3.58Å; S271-M274 PolarHBondContact O-N 3.47Å; M274-R276 VanDerWaalsContact C-N 3.28Å; M274-R276 PolarHBondContact O-N 2.9Å; M274-E277 WeakPolarHBondContact O-CB 3.43Å; M274-E277 PolarHBondContact O-N 2.88Å; M274-V278 WeakPolarHBondContact O-CG2 3.3Å; M274-V278 PolarHBondContact O-N 3.13Å
275D98.6Very high97.9Very high93 Ų9386 Ų8650%0.49746%0.455SS..Hα-helixtrans-59.9-39.1175.4-66.6-46.8000111S271 T279S271-D275 WeakPolarHBondContact O-CB 3.42Å; S271-D275 PolarHBondContact O-N 3.29Å; S271-D275 PolarHBondContact OG-OD2 3.44Å; D275-T279 WeakPolarHBondContact O-CB 3.32Å; D275-T279 PolarHBondContact O-N 2.88Å; D275-T279 PolarHBondContact O-OG1 2.95Å
276R98.1Very high97.8Very high116 Ų11690.4 Ų90.444%0.43847%0.47SS..Hα-helixtrans-71.9-36.2175.8-175.956.9-175.2137.8-4.4112.8C272 L273 M274 T279 L280 E283C272-R276 WeakPolarHBondContact O-CB 3.45Å; C272-R276 PolarHBondContact O-N 3.35Å; C272-R276 VanDerWaalsContact O-N 3.14Å; L273-R276 PolarHBondContact O-N 2.71Å; M274-R276 VanDerWaalsContact C-N 3.28Å; M274-R276 PolarHBondContact O-N 2.9Å; R276-T279 VanDerWaalsContact NH1-CG2 3.31Å; R276-T279 WeakPolarHBondContact O-CB 3.3Å; R276-T279 PolarHBondContact O-N 3.13Å; R276-L280 HydrophobicContact CG-CD1 4.21Å; R276-L280 WeakPolarHBondContact O-CG 3.38Å; R276-L280 PolarHBondContact O-N 2.92Å; R276-E283 IonicContact CZ-OE2 3.57Å; R276-E283 IonicContact NH1-OE2 2.72Å; R276-E283 PolarHBondContact NH1-OE2 2.97Å; R276-E283 IonicContact NH2-OE2 3.47Å; R276-E283 PolarHBondContact NH2-OE2 3.45Å
277E97.9Very high97.7Very high120 Ų12089.7 Ų89.756%0.56147%0.473SS*.Hα-helixtrans-62.2-51173.8179.6172-151.400111.3L273 M274 T279 L280 L281L273-E277 PolarHBondContact O-N 3.22Å; M274-E277 WeakPolarHBondContact O-CB 3.43Å; M274-E277 PolarHBondContact O-N 2.88Å; E277-T279 VanDerWaalsContact C-N 3.26Å; E277-T279 PolarHBondContact O-N 3.47Å; E277-L280 PolarHBondContact O-N 3.07Å; E277-L280 VanDerWaalsContact O-N 3.11Å; E277-L281 HydrophobicContact CG-CD1 4.09Å; E277-L281 WeakPolarHBondContact O-CG 3.21Å; E277-L281 PolarHBondContact O-N 3.19Å
278V98.7Very high97.5Very high90 Ų9093.3 Ų93.355%0.54548%0.48SS..Hα-helixtrans-58.3-39.6175.3173.60000111.2M274 T282M274-V278 WeakPolarHBondContact O-CG2 3.3Å; M274-V278 PolarHBondContact O-N 3.13Å; V278-T282 WeakPolarHBondContact O-CB 3.41Å; V278-T282 PolarHBondContact O-N 2.87Å; V278-T282 PolarHBondContact O-OG1 3.35Å
279T98.5Very high97.4Very high66 Ų6691.3 Ų91.341%0.40548%0.481SS..Hα-helixtrans-61.3-49.2174.3-56.10000111.3D275 R276 E277 L281 T282 E283D275-T279 WeakPolarHBondContact O-CB 3.32Å; D275-T279 PolarHBondContact O-N 2.88Å; D275-T279 PolarHBondContact O-OG1 2.95Å; R276-T279 VanDerWaalsContact NH1-CG2 3.31Å; R276-T279 WeakPolarHBondContact O-CB 3.3Å; R276-T279 PolarHBondContact O-N 3.13Å; E277-T279 VanDerWaalsContact C-N 3.26Å; E277-T279 PolarHBondContact O-N 3.47Å; T279-L281 PolarHBondContact O-N 2.86Å; T279-T282 WeakPolarHBondContact O-CB 3.34Å; T279-T282 PolarHBondContact O-N 3.41Å; T279-E283 HydrophobicContact CG2-CG 4.45Å; T279-E283 WeakPolarHBondContact O-CG 3.4Å; T279-E283 PolarHBondContact O-N 3.17Å
280L97.7Very high97.3Very high53 Ų5393.1 Ų93.128%0.27749%0.488SS..Hα-helixtrans-62.3-40.4-179.7-79165.7000112.8R276 E277 E283 M284 F346R276-L280 HydrophobicContact CG-CD1 4.21Å; R276-L280 WeakPolarHBondContact O-CG 3.38Å; R276-L280 PolarHBondContact O-N 2.92Å; E277-L280 PolarHBondContact O-N 3.07Å; E277-L280 VanDerWaalsContact O-N 3.11Å; L280-E283 PolarHBondContact O-N 3.36Å; L280-M284 WeakPolarHBondContact O-CB 3.24Å; L280-M284 PolarHBondContact O-N 2.85Å; L280-F346 HydrophobicContact CD1-CE2 3.98Å; L280-F346 HydrophobicContact CD1-CZ 4.45Å; L280-F346 HydrophobicContact CD2-CE2 4.22Å
281L97.3Very high97.1Very high104 Ų10488 Ų8855%0.54547%0.466SS..Hα-helixtrans-63-43.9174.6-69168.5000111E277 T279 E283 M284 D285E277-L281 HydrophobicContact CG-CD1 4.09Å; E277-L281 WeakPolarHBondContact O-CG 3.21Å; E277-L281 PolarHBondContact O-N 3.19Å; T279-L281 PolarHBondContact O-N 2.86Å; L281-E283 PolarHBondContact O-N 3.07Å; L281-M284 WeakPolarHBondContact O-CB 3.23Å; L281-M284 PolarHBondContact O-N 3.09Å; L281-M284 VanDerWaalsContact O-N 3.17Å; L281-D285 PolarHBondContact O-N 3.19Å
282T97.8Very high97Very high92 Ų9290.2 Ų90.256%0.56447%0.472SS*.Hα-helixtrans-63.4-40.8175.9-52.20000112.2V278 T279 M284 K286V278-T282 WeakPolarHBondContact O-CB 3.41Å; V278-T282 PolarHBondContact O-N 2.87Å; V278-T282 PolarHBondContact O-OG1 3.35Å; T279-T282 WeakPolarHBondContact O-CB 3.34Å; T279-T282 PolarHBondContact O-N 3.41Å; T282-M284 VanDerWaalsContact C-N 3.32Å; T282-M284 PolarHBondContact O-N 2.72Å; T282-K286 WeakPolarHBondContact O-CB 3.25Å; T282-K286 PolarHBondContact O-N 3.32Å; T282-K286 VanDerWaalsContact O-N 3.09Å
283E96.4Very high97Very high96 Ų9689.1 Ų89.145%0.44947%0.469SS..Hα-helixtrans-61.7-39.9173.3-71.6-179.8113.700111.3R276 T279 L280 L281 K286 V287R276-E283 IonicContact CZ-OE2 3.57Å; R276-E283 IonicContact NH1-OE2 2.72Å; R276-E283 PolarHBondContact NH1-OE2 2.97Å; R276-E283 IonicContact NH2-OE2 3.47Å; R276-E283 PolarHBondContact NH2-OE2 3.45Å; T279-E283 HydrophobicContact CG2-CG 4.45Å; T279-E283 WeakPolarHBondContact O-CG 3.4Å; T279-E283 PolarHBondContact O-N 3.17Å; L280-E283 PolarHBondContact O-N 3.36Å; L281-E283 PolarHBondContact O-N 3.07Å; E283-K286 PolarHBondContact O-N 2.74Å; E283-V287 WeakPolarHBondContact O-CG2 3.49Å; E283-V287 PolarHBondContact O-N 2.84Å
284M96Very high97Very high63 Ų6388.6 Ų88.631%0.3147%0.466SS..Hα-helixtrans-67.6-47179.2-16564.161.600112.9L280 L281 T282 K286 V287 K288 V344 F346L280-M284 WeakPolarHBondContact O-CB 3.24Å; L280-M284 PolarHBondContact O-N 2.85Å; L281-M284 WeakPolarHBondContact O-CB 3.23Å; L281-M284 PolarHBondContact O-N 3.09Å; L281-M284 VanDerWaalsContact O-N 3.17Å; T282-M284 VanDerWaalsContact C-N 3.32Å; T282-M284 PolarHBondContact O-N 2.72Å; M284-K286 VanDerWaalsContact C-N 3.29Å; M284-K286 PolarHBondContact O-N 3.33Å; M284-V287 PolarHBondContact O-N 2.73Å; M284-K288 WeakPolarHBondContact O-CB 3.33Å; M284-K288 PolarHBondContact O-N 3.42Å; M284-V344 HydrophobicContact SD-CG1 3.54Å; M284-V344 VanDerWaalsContact SD-CG1 3.54Å; M284-F346 HydrophobicContact CE-CB 3.96Å
285D96Very high96.9Very high97 Ų9786.5 Ų86.552%0.51946%0.456SS..Hα-helixtrans-65.2-33.6176.7-89.5-36.5000111.9L281 K288 A289L281-D285 PolarHBondContact O-N 3.19Å; D285-K288 PolarHBondContact O-N 3.3Å; D285-K288 IonicContact OD1-NZ 3.75Å; D285-A289 WeakPolarHBondContact O-CB 3.46Å; D285-A289 PolarHBondContact O-N 3.17Å
286K96.4Very high96.8Very high138 Ų13885.5 Ų85.560%0.645%0.451SS*.Hα-helixtrans-62.1-50.4170.8-175-167.7168.7-165.70111.5T282 E283 M284 K288 A289 E290T282-K286 WeakPolarHBondContact O-CB 3.25Å; T282-K286 PolarHBondContact O-N 3.32Å; T282-K286 VanDerWaalsContact O-N 3.09Å; E283-K286 PolarHBondContact O-N 2.74Å; M284-K286 VanDerWaalsContact C-N 3.29Å; M284-K286 PolarHBondContact O-N 3.33Å; K286-K288 VanDerWaalsContact C-N 3.28Å; K286-K288 PolarHBondContact O-N 3.04Å; K286-A289 PolarHBondContact O-N 2.98Å; K286-E290 WeakPolarHBondContact O-CB 3.25Å; K286-E290 PolarHBondContact O-N 2.85Å
287V95Very high96.8Very high71 Ų7181.8 Ų81.843%0.4345%0.449SS..Hα-helixtrans-59.8-40179167.90000111.2E283 M284 E290 A291E283-V287 WeakPolarHBondContact O-CG2 3.49Å; E283-V287 PolarHBondContact O-N 2.84Å; M284-V287 PolarHBondContact O-N 2.73Å; V287-E290 PolarHBondContact O-N 2.84Å; V287-A291 WeakPolarHBondContact O-CB 3.42Å; V287-A291 PolarHBondContact O-N 3.47Å
288K94.8Very high96.8Very high122 Ų12277.4 Ų77.453%0.5343%0.427SS..Hα-helixtrans-62-47.2173.8176.7-175170.2-167.60112.2M284 D285 K286 A291 M292M284-K288 WeakPolarHBondContact O-CB 3.33Å; M284-K288 PolarHBondContact O-N 3.42Å; D285-K288 PolarHBondContact O-N 3.3Å; D285-K288 IonicContact OD1-NZ 3.75Å; K286-K288 VanDerWaalsContact C-N 3.28Å; K286-K288 PolarHBondContact O-N 3.04Å; K288-A291 PolarHBondContact O-N 3.4Å; K288-M292 WeakPolarHBondContact O-CG 3.4Å; K288-M292 PolarHBondContact O-N 3.27Å
289A96.2Very high96.8Very high62 Ų6278.6 Ų78.651%0.51243%0.427SS..Hα-helixtrans-64.1-39.4177.800000112.3D285 K286 M292 A293D285-A289 WeakPolarHBondContact O-CB 3.46Å; D285-A289 PolarHBondContact O-N 3.17Å; K286-A289 PolarHBondContact O-N 2.98Å; A289-M292 PolarHBondContact O-N 3.36Å; A289-A293 WeakPolarHBondContact O-CB 3.23Å; A289-A293 PolarHBondContact O-N 3.3Å
290E95.7Very high96.8Very high108 Ų10881.6 Ų81.651%0.50543%0.434SS..Hα-helixtrans-65.6-45176.4-167171.6147.800111.5K286 V287 A293 I294K286-E290 WeakPolarHBondContact O-CB 3.25Å; K286-E290 PolarHBondContact O-N 2.85Å; V287-E290 PolarHBondContact O-N 2.84Å; E290-A293 PolarHBondContact O-N 3.2Å; E290-I294 WeakPolarHBondContact O-CG1 3.5Å; E290-I294 PolarHBondContact O-N 3.45Å
291A95.7Very high96.8Very high14 Ų1485.1 Ų85.112%0.11644%0.444CS..Hα-helixtrans-62-43.317500000112.6V287 K288 I294 L295 L340V287-A291 WeakPolarHBondContact O-CB 3.42Å; V287-A291 PolarHBondContact O-N 3.47Å; K288-A291 PolarHBondContact O-N 3.4Å; A291-I294 PolarHBondContact O-N 3.48Å; A291-L295 WeakPolarHBondContact O-CG 3.39Å; A291-L295 PolarHBondContact O-N 3.43Å; A291-L295 VanDerWaalsContact O-N 3.16Å; A291-L340 HydrophobicContact CB-CD1 3.83Å; A291-L340 HydrophobicContact CB-CD2 4.4Å; A291-L340 HydrophobicContact CB-CG 4.11Å
292M96.1Very high96.9Very high100 Ų10081.9 Ų81.949%0.49343%0.432SS..Hα-helixtrans-62.2-44.3174.2-72.3-57.9-5400111.9K288 A289 I294 L295 D296K288-M292 WeakPolarHBondContact O-CG 3.4Å; K288-M292 PolarHBondContact O-N 3.27Å; A289-M292 PolarHBondContact O-N 3.36Å; M292-I294 VanDerWaalsContact C-N 3.29Å; M292-I294 PolarHBondContact O-N 3.19Å; M292-L295 PolarHBondContact O-N 3.09Å; M292-L295 VanDerWaalsContact O-N 3.14Å; M292-D296 WeakPolarHBondContact O-CB 3.42Å; M292-D296 PolarHBondContact O-N 3.5Å
293A97.7Very high96.9Very high61 Ų6182.3 Ų82.350%0.50443%0.428SS..Hα-helixtrans-62.4-34.2178.900000113.1A289 E290 G297A289-A293 WeakPolarHBondContact O-CB 3.23Å; A289-A293 PolarHBondContact O-N 3.3Å; E290-A293 PolarHBondContact O-N 3.2Å; A293-G297 PolarHBondContact O-N 3.38Å
294I96.9Very high97Very high86 Ų8681.5 Ų81.544%0.44142%0.424SS..Hα-helixtrans-65.3-47.1173-67.8163000110.5E290 A291 M292 G297 R298 L340E290-I294 WeakPolarHBondContact O-CG1 3.5Å; E290-I294 PolarHBondContact O-N 3.45Å; A291-I294 PolarHBondContact O-N 3.48Å; M292-I294 VanDerWaalsContact C-N 3.29Å; M292-I294 PolarHBondContact O-N 3.19Å; I294-G297 PolarHBondContact O-N 2.86Å; I294-R298 VanDerWaalsContact O-CB 3.24Å; I294-R298 WeakPolarHBondContact O-CB 3.27Å; I294-R298 PolarHBondContact O-N 3.21Å; I294-L340 HydrophobicContact CB-CD2 3.97Å; I294-L340 HydrophobicContact CD1-CD2 4.36Å; I294-L340 HydrophobicContact CG2-CD2 3.72Å
295L96.6Very high97.1Very high65 Ų6579.4 Ų79.434%0.3441%0.414SS..Hα-helixtrans-64.9-43.6178.7-66.7173.5000112A291 M292 R298 Q299 D337 L340A291-L295 WeakPolarHBondContact O-CG 3.39Å; A291-L295 PolarHBondContact O-N 3.43Å; A291-L295 VanDerWaalsContact O-N 3.16Å; M292-L295 PolarHBondContact O-N 3.09Å; M292-L295 VanDerWaalsContact O-N 3.14Å; L295-R298 CarbonylContact O-C 3.49Å; L295-R298 WeakPolarHBondContact O-CB 3.42Å; L295-R298 PolarHBondContact O-N 2.89Å; L295-R298 VanDerWaalsContact O-N 3.17Å; L295-Q299 PolarHBondContact O-N 3.47Å; L295-D337 HydrophobicContact CD2-CB 4.45Å; L295-L340 HydrophobicContact CD2-CD2 4.25Å; L295-L340 HydrophobicContact CG-CD2 4.14Å
296D98.1Very high97.3Very high71 Ų7182.8 Ų82.838%0.3842%0.419SS..Hα-helixtrans-60.7-45.2175.2-76.5-0.8000112.1M292 R298 Q299 K300M292-D296 WeakPolarHBondContact O-CB 3.42Å; M292-D296 PolarHBondContact O-N 3.5Å; D296-R298 PolarHBondContact O-N 3.01Å; D296-Q299 PolarHBondContact O-N 3.16Å; D296-K300 WeakPolarHBondContact O-CD 3.41Å; D296-K300 VanDerWaalsContact O-CG 3.32Å; D296-K300 WeakPolarHBondContact O-CG 3.49Å; D296-K300 PolarHBondContact O-N 2.98Å; D296-K300 VanDerWaalsContact O-N 3.09Å
297G98.1Very high97.4Very high39 Ų3981.6 Ų81.640%0.40241%0.411SS..Hα-helixtrans-63.1-33.6176.200000112.1A293 I294 R301A293-G297 PolarHBondContact O-N 3.38Å; I294-G297 PolarHBondContact O-N 2.86Å; G297-R301 PolarHBondContact O-N 2.9Å; G297-R301 VanDerWaalsContact O-N 3.11Å
298R97.6Very high97.5Very high28 Ų2880.5 Ų80.511%0.10640%0.402CS..Hα-helixtrans-76.9-36.6178-171.2167.1171.375.8-3.4113.2I294 L295 D296 R301 A302 F330 E333 D337I294-R298 VanDerWaalsContact O-CB 3.24Å; I294-R298 WeakPolarHBondContact O-CB 3.27Å; I294-R298 PolarHBondContact O-N 3.21Å; L295-R298 CarbonylContact O-C 3.49Å; L295-R298 WeakPolarHBondContact O-CB 3.42Å; L295-R298 PolarHBondContact O-N 2.89Å; L295-R298 VanDerWaalsContact O-N 3.17Å; D296-R298 PolarHBondContact O-N 3.01Å; R298-R301 PolarHBondContact O-N 3.02Å; R298-A302 PolarHBondContact O-N 2.65Å; R298-F330 HydrophobicContact CG-CE2 3.66Å; R298-F330 HydrophobicContact CG-CZ 4.21Å; R298-F330 PolarHBondContact NH2-O 3.44Å; R298-F330 WeakPolarHBondContact O-CE2 3.22Å; R298-E333 IonicContact CZ-OE2 3.32Å; R298-E333 IonicContact NH1-OE2 2.99Å; R298-E333 PolarHBondContact NH1-OE2 2.75Å; R298-E333 VanDerWaalsContact NH2-CB 3.34Å; R298-D337 WeakPolarHBondContact CD-OD1 3.36Å; R298-D337 IonicContact CZ-OD1 3.71Å; R298-D337 IonicContact CZ-OD2 3.98Å; R298-D337 IonicContact NE-OD1 3.39Å; R298-D337 PolarHBondContact NE-OD1 3.43Å; R298-D337 IonicContact NE-OD2 3.66Å; R298-D337 PolarHBondContact NE-OD2 3.22Å; R298-D337 IonicContact NH2-OD1 2.75Å; R298-D337 IonicContact NH2-OD2 3.6Å; R298-D337 PolarHBondContact NH2-OD2 2.98Å
299Q98.1Very high97.7Very high115 Ų11577.4 Ų77.454%0.53739%0.394SS..Hα-helixtrans-60.3-46.2169.5-177.2-179.1-37.500110.5L295 D296 R301 A302 E303L295-Q299 PolarHBondContact O-N 3.47Å; D296-Q299 PolarHBondContact O-N 3.16Å; Q299-R301 VanDerWaalsContact C-N 3.29Å; Q299-R301 PolarHBondContact O-N 3.2Å; Q299-A302 WeakPolarHBondContact O-CA 3.49Å; Q299-A302 VanDerWaalsContact O-CB 3.27Å; Q299-A302 WeakPolarHBondContact O-CB 3.46Å; Q299-A302 PolarHBondContact O-N 3.42Å; Q299-E303 WeakPolarHBondContact CG-OE1 3.39Å; Q299-E303 PolarHBondContact NE2-OE1 2.96Å; Q299-E303 WeakPolarHBondContact O-CG 3.43Å; Q299-E303 PolarHBondContact O-N 3.49Å
300K98.7Very high97.8Very high129 Ų12979.6 Ų79.656%0.56140%0.397SS*.Hα-helixtrans-59.8-37.4176.3-69.6160.1-170.9160.80112.5D296 E303 E304D296-K300 WeakPolarHBondContact O-CD 3.41Å; D296-K300 VanDerWaalsContact O-CG 3.32Å; D296-K300 WeakPolarHBondContact O-CG 3.49Å; D296-K300 PolarHBondContact O-N 2.98Å; D296-K300 VanDerWaalsContact O-N 3.09Å; K300-E303 PolarHBondContact O-N 2.99Å; K300-E304 PolarHBondContact O-N 3.34Å
301R98.3Very high97.9Very high127 Ų12777.9 Ų77.948%0.47939%0.389SS..Hα-helixtrans-63.5-40.6171.4-175.7-174.3-77.4171.6-2.9111.8G297 R298 Q299 E304 L305 F330 E333G297-R301 PolarHBondContact O-N 2.9Å; G297-R301 VanDerWaalsContact O-N 3.11Å; R298-R301 PolarHBondContact O-N 3.02Å; Q299-R301 VanDerWaalsContact C-N 3.29Å; Q299-R301 PolarHBondContact O-N 3.2Å; R301-E304 PolarHBondContact O-N 3.06Å; R301-L305 HydrophobicContact CG-CD1 4.09Å; R301-L305 HydrophobicContact CG-CG 4.47Å; R301-L305 WeakPolarHBondContact O-CB 3.34Å; R301-L305 VanDerWaalsContact O-CG 3.29Å; R301-L305 WeakPolarHBondContact O-CG 3.39Å; R301-L305 PolarHBondContact O-N 3.42Å; R301-F330 HydrophobicContact CB-CE2 4.38Å; R301-F330 HydrophobicContact CG-CD2 4.06Å; R301-F330 HydrophobicContact CG-CE2 4.38Å; R301-E333 IonicContact NH1-OE1 3.87Å; R301-E333 IonicContact NH1-OE2 2.71Å; R301-E333 PolarHBondContact NH1-OE2 3.38Å
302A98.6Very high97.9Very high35 Ų3579.4 Ų79.429%0.28940%0.399SS..Hα-helixtrans-63.6-41.417600000112.2R298 Q299 R306 F330R298-A302 PolarHBondContact O-N 2.65Å; Q299-A302 WeakPolarHBondContact O-CA 3.49Å; Q299-A302 VanDerWaalsContact O-CB 3.27Å; Q299-A302 WeakPolarHBondContact O-CB 3.46Å; Q299-A302 PolarHBondContact O-N 3.42Å; A302-R306 WeakPolarHBondContact O-CB 3.48Å; A302-R306 PolarHBondContact O-N 3.41Å; A302-F330 HydrophobicContact CB-CE1 4.06Å; A302-F330 HydrophobicContact CB-CE2 4.11Å; A302-F330 HydrophobicContact CB-CZ 3.53Å
303E98.6Very high98Very high102 Ų10279.9 Ų79.948%0.47742%0.419SS..Hα-helixtrans-65-41.6177.7-71.1167.5-176.900111.9Q299 K300 R306 R307Q299-E303 WeakPolarHBondContact CG-OE1 3.39Å; Q299-E303 PolarHBondContact NE2-OE1 2.96Å; Q299-E303 WeakPolarHBondContact O-CG 3.43Å; Q299-E303 PolarHBondContact O-N 3.49Å; K300-E303 PolarHBondContact O-N 2.99Å; E303-R306 PolarHBondContact O-N 3.3Å; E303-R307 WeakPolarHBondContact O-CB 3.31Å; E303-R307 PolarHBondContact O-N 3.5Å
304E98.5Very high97.9Very high79 Ų7981.7 Ų81.737%0.36943%0.427SS..Hα-helixtrans-70.1-42.2175.5-18057-162.400112.6K300 R301 R306 R307 L308K300-E304 PolarHBondContact O-N 3.34Å; R301-E304 PolarHBondContact O-N 3.06Å; E304-R306 VanDerWaalsContact C-N 3.25Å; E304-R306 PolarHBondContact O-N 3.04Å; E304-R307 WeakPolarHBondContact O-CB 3.47Å; E304-R307 PolarHBondContact O-N 3Å; E304-R307 VanDerWaalsContact O-N 3.13Å; E304-R307 IonicContact OE1-CZ 3.29Å; E304-R307 IonicContact OE1-NE 2.66Å; E304-R307 PolarHBondContact OE1-NE 2.89Å; E304-R307 IonicContact OE1-NH2 3.24Å; E304-R307 PolarHBondContact OE1-NH2 3.41Å; E304-R307 WeakPolarHBondContact OE2-CD 3.31Å; E304-R307 IonicContact OE2-CZ 2.69Å; E304-R307 IonicContact OE2-NE 3.76Å; E304-R307 PolarHBondContact OE2-NE 3.3Å; E304-R307 IonicContact OE2-NH2 3.25Å; E304-L308 HydrophobicContact CG-CD1 4.33Å; E304-L308 WeakPolarHBondContact O-CG 3.45Å; E304-L308 PolarHBondContact O-N 3.41Å
305L98.6Very high97.9Very high18 Ų1879.5 Ų79.59%0.09442%0.416CS..Hα-helixtrans-61.1-36173.6-71.9172.2000111.8R301 T309 L323 D326 I327 F330R301-L305 HydrophobicContact CG-CD1 4.09Å; R301-L305 HydrophobicContact CG-CG 4.47Å; R301-L305 WeakPolarHBondContact O-CB 3.34Å; R301-L305 VanDerWaalsContact O-CG 3.29Å; R301-L305 WeakPolarHBondContact O-CG 3.39Å; R301-L305 PolarHBondContact O-N 3.42Å; L305-T309 WeakPolarHBondContact O-CB 3.48Å; L305-T309 PolarHBondContact O-N 3.03Å; L305-T309 PolarHBondContact O-OG1 3.37Å; L305-L323 HydrophobicContact CD2-CD1 4.02Å; L305-D326 HydrophobicContact CD2-CB 3.82Å; L305-I327 HydrophobicContact CB-CG1 4.39Å; L305-I327 HydrophobicContact CD2-CG1 4.35Å; L305-F330 HydrophobicContact CD1-CB 3.71Å; L305-F330 HydrophobicContact CD1-CD1 4.47Å; L305-F330 HydrophobicContact CD1-CD2 4.12Å; L305-F330 HydrophobicContact CD1-CG 3.84Å
306R98.6Very high98Very high169 Ų16979 Ų7964%0.63842%0.417SS*.Hα-helixtrans-64.9-48.7170.8179.7173.7176.4-94.7-19.9111.3A302 E303 E304 L308 T309 D310A302-R306 WeakPolarHBondContact O-CB 3.48Å; A302-R306 PolarHBondContact O-N 3.41Å; E303-R306 PolarHBondContact O-N 3.3Å; E304-R306 VanDerWaalsContact C-N 3.25Å; E304-R306 PolarHBondContact O-N 3.04Å; R306-L308 VanDerWaalsContact C-N 3.28Å; R306-L308 PolarHBondContact O-N 3.39Å; R306-T309 WeakPolarHBondContact O-CA 3.29Å; R306-T309 WeakPolarHBondContact O-CB 3.45Å; R306-T309 PolarHBondContact O-N 3.14Å; R306-D310 IonicContact CZ-OD2 3.93Å; R306-D310 IonicContact NH2-OD2 3.8Å; R306-D310 PolarHBondContact O-N 3.17Å
307R98.4Very high98Very high113 Ų11381 Ų8143%0.42642%0.424SS..Hα-helixtrans-54.8-44.7176.9-164.4-166.368.780.96111.2E303 E304 D310 Q311E303-R307 WeakPolarHBondContact O-CB 3.31Å; E303-R307 PolarHBondContact O-N 3.5Å; E304-R307 WeakPolarHBondContact O-CB 3.47Å; E304-R307 PolarHBondContact O-N 3Å; E304-R307 VanDerWaalsContact O-N 3.13Å; E304-R307 IonicContact OE1-CZ 3.29Å; E304-R307 IonicContact OE1-NE 2.66Å; E304-R307 PolarHBondContact OE1-NE 2.89Å; E304-R307 IonicContact OE1-NH2 3.24Å; E304-R307 PolarHBondContact OE1-NH2 3.41Å; E304-R307 WeakPolarHBondContact OE2-CD 3.31Å; E304-R307 IonicContact OE2-CZ 2.69Å; E304-R307 IonicContact OE2-NE 3.76Å; E304-R307 PolarHBondContact OE2-NE 3.3Å; E304-R307 IonicContact OE2-NH2 3.25Å; R307-D310 PolarHBondContact O-N 2.83Å; R307-Q311 VanDerWaalsContact NH1-OE1 3.12Å; R307-Q311 PolarHBondContact O-N 3.45Å; R307-Q311 PolarHBondContact O-NE2 2.86Å
308L98.3Very high98Very high47 Ų4785.1 Ų85.125%0.24644%0.437CS..Hα-helixtrans-64.3-41.2175.3-69.8170.8000112.1E304 R306 D310 Q311 S312 M315 L323E304-L308 HydrophobicContact CG-CD1 4.33Å; E304-L308 WeakPolarHBondContact O-CG 3.45Å; E304-L308 PolarHBondContact O-N 3.41Å; R306-L308 VanDerWaalsContact C-N 3.28Å; R306-L308 PolarHBondContact O-N 3.39Å; L308-D310 VanDerWaalsContact C-N 3.31Å; L308-D310 PolarHBondContact O-N 3.48Å; L308-Q311 PolarHBondContact O-N 2.88Å; L308-S312 PolarHBondContact O-N 3.2Å; L308-M315 HydrophobicContact CB-CE 4.07Å; L308-M315 HydrophobicContact CD2-CE 3.87Å; L308-M315 WeakPolarHBondContact O-CE 3.42Å; L308-L323 HydrophobicContact CB-CD1 3.77Å; L308-L323 HydrophobicContact CB-CD2 4.17Å; L308-L323 HydrophobicContact CD1-CD1 4.3Å
309T98.2Very high98Very high57 Ų5788.4 Ų88.435%0.3545%0.454SS..Hα-helixtrans-59.8-40.8174.5-55.60000111.9L305 R306 Q311 S312 I327L305-T309 WeakPolarHBondContact O-CB 3.48Å; L305-T309 PolarHBondContact O-N 3.03Å; L305-T309 PolarHBondContact O-OG1 3.37Å; R306-T309 WeakPolarHBondContact O-CA 3.29Å; R306-T309 WeakPolarHBondContact O-CB 3.45Å; R306-T309 PolarHBondContact O-N 3.14Å; T309-Q311 PolarHBondContact O-N 3.23Å; T309-S312 WeakPolarHBondContact O-CB 3.23Å; T309-S312 PolarHBondContact O-N 3Å; T309-S312 VanDerWaalsContact O-N 3.1Å; T309-S312 PolarHBondContact O-OG 2.94Å; T309-I327 WeakPolarHBondContact OG1-CD1 3.04Å
310D98.1Very high98Very high108 Ų10884.4 Ų84.458%0.57844%0.436SS*.Hα-helixtrans-65.1-19.6176.5-63-28.7000112.6R306 R307 L308R306-D310 IonicContact CZ-OD2 3.93Å; R306-D310 IonicContact NH2-OD2 3.8Å; R306-D310 PolarHBondContact O-N 3.17Å; R307-D310 PolarHBondContact O-N 2.83Å; L308-D310 VanDerWaalsContact C-N 3.31Å; L308-D310 PolarHBondContact O-N 3.48Å
311Q97.6Very high98Very high73 Ų7381.3 Ų81.334%0.34143%0.43SS..THydrogen-bonded Turntrans-96.4-1.9174.9-79.5153.8105.400114.1R307 L308 T309 A313 S314 M315R307-Q311 VanDerWaalsContact NH1-OE1 3.12Å; R307-Q311 PolarHBondContact O-N 3.45Å; R307-Q311 PolarHBondContact O-NE2 2.86Å; L308-Q311 PolarHBondContact O-N 2.88Å; T309-Q311 PolarHBondContact O-N 3.23Å; Q311-A313 PolarHBondContact O-N 3.48Å; Q311-S314 PolarHBondContact O-N 3.42Å; Q311-S314 PolarHBondContact O-OG 2.88Å; Q311-M315 HydrophobicContact CB-CE 3.93Å
312S97Very high98Very high46 Ų4681.3 Ų81.332%0.32244%0.436SS..G310 helixtrans-51.5-34.8-170.553.50000115.1L308 T309 S314 M315L308-S312 PolarHBondContact O-N 3.2Å; T309-S312 WeakPolarHBondContact O-CB 3.23Å; T309-S312 PolarHBondContact O-N 3Å; T309-S312 VanDerWaalsContact O-N 3.1Å; T309-S312 PolarHBondContact O-OG 2.94Å; S312-S314 PolarHBondContact O-N 3.16Å; S312-M315 PolarHBondContact O-N 3.07Å; S312-M315 VanDerWaalsContact O-N 3.13Å
313A96.8Very high98Very high110 Ų11080.4 Ų80.491%0.90943%0.426SS*.G310 helixtrans-64.1-10.2177.600000115.1Q311Q311-A313 PolarHBondContact O-N 3.48Å
314S96.8Very high98Very high98 Ų9881.6 Ų81.669%0.68543%0.426SS*.G310 helixtrans-109.50.8176.463.90000114.5Q311 S312Q311-S314 PolarHBondContact O-N 3.42Å; Q311-S314 PolarHBondContact O-OG 2.88Å; S312-S314 PolarHBondContact O-N 3.16Å
315M97.2Very high98Very high41 Ų4180.5 Ų80.520%0.20243%0.431CS..SBendtrans-90.8156.5-176.7-66.7-178.7178.600112.3L308 Q311 S312 Q319 L320 L323L308-M315 HydrophobicContact CB-CE 4.07Å; L308-M315 HydrophobicContact CD2-CE 3.87Å; L308-M315 WeakPolarHBondContact O-CE 3.42Å; Q311-M315 HydrophobicContact CB-CE 3.93Å; S312-M315 PolarHBondContact O-N 3.07Å; S312-M315 VanDerWaalsContact O-N 3.13Å; M315-Q319 HydrophobicContact CB-CB 4.04Å; M315-L320 HydrophobicContact CB-CD2 3.91Å; M315-L320 HydrophobicContact CB-CG 3.93Å; M315-L320 HydrophobicContact SD-CD2 4.12Å; M315-L323 HydrophobicContact CE-CD2 4.46Å; M315-L323 HydrophobicContact SD-CD2 3.99Å
316S98.1Very high98Very high53 Ų5383.4 Ų83.437%0.37145%0.446SS..  trans-73.1158.7167.573.30000111.3D318 Q319 L320S316-D318 PolarHBondContact O-N 2.88Å; S316-Q319 WeakPolarHBondContact O-CB 3.11Å; S316-Q319 PolarHBondContact O-N 3.34Å; S316-Q319 VanDerWaalsContact O-N 3.13Å; S316-Q319 WeakPolarHBondContact OG-CG 3.42Å; S316-Q319 PolarHBondContact OG-N 2.98Å; S316-L320 WeakPolarHBondContact O-CG 3.24Å; S316-L320 PolarHBondContact O-N 3.27Å
317E97.9Very high98Very high113 Ų11378.1 Ų78.153%0.52843%0.43SS..Hα-helixtrans-62.9-29.3178.1-178.656.3-162.100112.5L320 S321 R324E317-L320 PolarHBondContact O-N 3.23Å; E317-S321 WeakPolarHBondContact O-CB 3.37Å; E317-S321 PolarHBondContact O-N 3.37Å; E317-R324 IonicContact OE1-CZ 3.36Å; E317-R324 IonicContact OE1-NH1 2.67Å; E317-R324 PolarHBondContact OE1-NH1 2.78Å; E317-R324 IonicContact OE1-NH2 3.1Å; E317-R324 PolarHBondContact OE1-NH2 3.14Å; E317-R324 VanDerWaalsContact OE1-NH2 3.1Å; E317-R324 IonicContact OE2-CZ 3.76Å; E317-R324 IonicContact OE2-NH1 3.77Å; E317-R324 IonicContact OE2-NH2 2.84Å; E317-R324 PolarHBondContact OE2-NH2 3.46Å
318D97.9Very high98Very high126 Ų12680.5 Ų80.567%0.67444%0.444SS*.Hα-helixtrans-63.2-48.8171.8-58.1-50.6000111.3S316 L320 S321 E322S316-D318 PolarHBondContact O-N 2.88Å; D318-L320 VanDerWaalsContact C-N 3.31Å; D318-L320 PolarHBondContact O-N 3.07Å; D318-S321 WeakPolarHBondContact O-CA 3.33Å; D318-S321 WeakPolarHBondContact O-CB 3.25Å; D318-S321 PolarHBondContact O-N 3.46Å; D318-S321 PolarHBondContact O-OG 2.86Å; D318-E322 PolarHBondContact O-N 3.41Å
319Q98.2Very high98Very high98 Ų9883 Ų8346%0.45845%0.454SS..Hα-helixtrans-62.6-37.2175.7-72.1172.5-28.400111.9M315 S316 S321 E322 L323M315-Q319 HydrophobicContact CB-CB 4.04Å; S316-Q319 WeakPolarHBondContact O-CB 3.11Å; S316-Q319 PolarHBondContact O-N 3.34Å; S316-Q319 VanDerWaalsContact O-N 3.13Å; S316-Q319 WeakPolarHBondContact OG-CG 3.42Å; S316-Q319 PolarHBondContact OG-N 2.98Å; Q319-S321 VanDerWaalsContact C-N 3.33Å; Q319-E322 PolarHBondContact O-N 3.46Å; Q319-L323 WeakPolarHBondContact O-CB 3.17Å; Q319-L323 PolarHBondContact O-N 3.05Å
320L98.5Very high98Very high31 Ų3182.3 Ų82.316%0.16245%0.446CS..Hα-helixtrans-67-34.6173-67174.2000111.7M315 S316 E317 D318 R324M315-L320 HydrophobicContact CB-CD2 3.91Å; M315-L320 HydrophobicContact CB-CG 3.93Å; M315-L320 HydrophobicContact SD-CD2 4.12Å; S316-L320 WeakPolarHBondContact O-CG 3.24Å; S316-L320 PolarHBondContact O-N 3.27Å; E317-L320 PolarHBondContact O-N 3.23Å; D318-L320 VanDerWaalsContact C-N 3.31Å; D318-L320 PolarHBondContact O-N 3.07Å; L320-R324 WeakPolarHBondContact O-CB 3.31Å; L320-R324 WeakPolarHBondContact O-CD 3.27Å; L320-R324 WeakPolarHBondContact O-CG 3.47Å; L320-R324 PolarHBondContact O-N 3.11Å; L320-R324 PolarHBondContact O-NE 2.83Å
321S98.5Very high98Very high63 Ų6380.1 Ų80.144%0.44144%0.437SS..Hα-helixtrans-65.7-40.1174.386.20000112.1E317 D318 Q319 A325E317-S321 WeakPolarHBondContact O-CB 3.37Å; E317-S321 PolarHBondContact O-N 3.37Å; D318-S321 WeakPolarHBondContact O-CA 3.33Å; D318-S321 WeakPolarHBondContact O-CB 3.25Å; D318-S321 PolarHBondContact O-N 3.46Å; D318-S321 PolarHBondContact O-OG 2.86Å; Q319-S321 VanDerWaalsContact C-N 3.33Å; S321-A325 PolarHBondContact O-N 2.84Å; S321-A325 VanDerWaalsContact O-N 3.12Å
322E98.2Very high98Very high128 Ų12880.6 Ų80.660%0.59845%0.448SS*.Hα-helixtrans-66.5-50.2175.8-173.4169.5-143.200111.2D318 Q319 R324 A325 D326D318-E322 PolarHBondContact O-N 3.41Å; Q319-E322 PolarHBondContact O-N 3.46Å; E322-R324 VanDerWaalsContact C-N 3.31Å; E322-R324 PolarHBondContact O-N 3.25Å; E322-A325 CarbonylContact O-C 3.6Å; E322-A325 WeakPolarHBondContact O-CA 3.42Å; E322-A325 WeakPolarHBondContact O-CB 3.34Å; E322-A325 PolarHBondContact O-N 3.33Å; E322-D326 PolarHBondContact O-N 3.13Å
323L98.6Very high98Very high15 Ų1580.2 Ų80.28%0.07944%0.441CS..Hα-helixtrans-58.3-40176.6179.660.4000112.5L305 L308 M315 Q319 A325 D326 I327L305-L323 HydrophobicContact CD2-CD1 4.02Å; L308-L323 HydrophobicContact CB-CD1 3.77Å; L308-L323 HydrophobicContact CB-CD2 4.17Å; L308-L323 HydrophobicContact CD1-CD1 4.3Å; M315-L323 HydrophobicContact CE-CD2 4.46Å; M315-L323 HydrophobicContact SD-CD2 3.99Å; Q319-L323 WeakPolarHBondContact O-CB 3.17Å; Q319-L323 PolarHBondContact O-N 3.05Å; L323-A325 VanDerWaalsContact C-N 3.3Å; L323-A325 PolarHBondContact O-N 3.2Å; L323-D326 PolarHBondContact O-N 3.23Å; L323-I327 HydrophobicContact CD1-CD1 3.91Å; L323-I327 HydrophobicContact CD1-CG1 4.2Å; L323-I327 HydrophobicContact CG-CD1 3.9Å; L323-I327 WeakPolarHBondContact O-CB 3.03Å; L323-I327 WeakPolarHBondContact O-CD1 3.47Å; L323-I327 VanDerWaalsContact O-CG1 3.24Å; L323-I327 WeakPolarHBondContact O-CG1 3.48Å; L323-I327 PolarHBondContact O-N 3.45Å
324R98.6Very high98Very high127 Ų12781.4 Ų81.448%0.47942%0.422SS..Hα-helixtrans-64.3-34.7173.7-69.2162.2-157.7152.10.7111.8E317 L320 E322 K328E317-R324 IonicContact OE1-CZ 3.36Å; E317-R324 IonicContact OE1-NH1 2.67Å; E317-R324 PolarHBondContact OE1-NH1 2.78Å; E317-R324 IonicContact OE1-NH2 3.1Å; E317-R324 PolarHBondContact OE1-NH2 3.14Å; E317-R324 VanDerWaalsContact OE1-NH2 3.1Å; E317-R324 IonicContact OE2-CZ 3.76Å; E317-R324 IonicContact OE2-NH1 3.77Å; E317-R324 IonicContact OE2-NH2 2.84Å; E317-R324 PolarHBondContact OE2-NH2 3.46Å; L320-R324 WeakPolarHBondContact O-CB 3.31Å; L320-R324 WeakPolarHBondContact O-CD 3.27Å; L320-R324 WeakPolarHBondContact O-CG 3.47Å; L320-R324 PolarHBondContact O-N 3.11Å; L320-R324 PolarHBondContact O-NE 2.83Å; E322-R324 VanDerWaalsContact C-N 3.31Å; E322-R324 PolarHBondContact O-N 3.25Å; R324-K328 VanDerWaalsContact O-CB 3.3Å; R324-K328 WeakPolarHBondContact O-CB 3.4Å; R324-K328 PolarHBondContact O-N 3.12Å
325A98.7Very high97.9Very high56 Ų5683.3 Ų83.346%0.46342%0.418SS..Hα-helixtrans-71.2-43.6176.500000111.9S321 E322 L323 K328 H329S321-A325 PolarHBondContact O-N 2.84Å; S321-A325 VanDerWaalsContact O-N 3.12Å; E322-A325 CarbonylContact O-C 3.6Å; E322-A325 WeakPolarHBondContact O-CA 3.42Å; E322-A325 WeakPolarHBondContact O-CB 3.34Å; E322-A325 PolarHBondContact O-N 3.33Å; L323-A325 VanDerWaalsContact C-N 3.3Å; L323-A325 PolarHBondContact O-N 3.2Å; A325-K328 WeakPolarHBondContact O-CB 3.18Å; A325-K328 PolarHBondContact O-N 2.9Å; A325-H329 PolarHBondContact O-N 2.97Å
326D98.5Very high97.8Very high79 Ų7988.3 Ų88.342%0.42244%0.439SS..Hα-helixtrans-64.9-44.4177.5-84.7-9.9000112.6L305 E322 L323 K328 H329 F330L305-D326 HydrophobicContact CD2-CB 3.82Å; E322-D326 PolarHBondContact O-N 3.13Å; L323-D326 PolarHBondContact O-N 3.23Å; D326-K328 VanDerWaalsContact C-N 3.28Å; D326-K328 PolarHBondContact O-N 3.44Å; D326-H329 PolarHBondContact O-N 2.91Å; D326-F330 WeakPolarHBondContact O-CB 3.37Å; D326-F330 PolarHBondContact O-N 2.98Å
327I98.6Very high97.6Very high59 Ų5987.7 Ų87.730%0.30343%0.431SS..Hα-helixtrans-59.6-42.2174-69166.7000110.3L305 T309 L323 V331L305-I327 HydrophobicContact CB-CG1 4.39Å; L305-I327 HydrophobicContact CD2-CG1 4.35Å; T309-I327 WeakPolarHBondContact OG1-CD1 3.04Å; L323-I327 HydrophobicContact CD1-CD1 3.91Å; L323-I327 HydrophobicContact CD1-CG1 4.2Å; L323-I327 HydrophobicContact CG-CD1 3.9Å; L323-I327 WeakPolarHBondContact O-CB 3.03Å; L323-I327 WeakPolarHBondContact O-CD1 3.47Å; L323-I327 VanDerWaalsContact O-CG1 3.24Å; L323-I327 WeakPolarHBondContact O-CG1 3.48Å; L323-I327 PolarHBondContact O-N 3.45Å; I327-V331 WeakPolarHBondContact O-CB 3.35Å; I327-V331 VanDerWaalsContact O-CG2 3.29Å; I327-V331 WeakPolarHBondContact O-CG2 3.31Å; I327-V331 PolarHBondContact O-N 3.1Å
328K98.4Very high97.4Very high162 Ų16287.3 Ų87.370%0.70443%0.429SS*.Hα-helixtrans-64.2-41.5176.2-178.5-177.4177.4-175.50111.9R324 A325 D326 S332R324-K328 VanDerWaalsContact O-CB 3.3Å; R324-K328 WeakPolarHBondContact O-CB 3.4Å; R324-K328 PolarHBondContact O-N 3.12Å; A325-K328 WeakPolarHBondContact O-CB 3.18Å; A325-K328 PolarHBondContact O-N 2.9Å; D326-K328 VanDerWaalsContact C-N 3.28Å; D326-K328 PolarHBondContact O-N 3.44Å; K328-S332 WeakPolarHBondContact O-CB 3.28Å; K328-S332 PolarHBondContact O-N 3.09Å
329H98.3Very high97.2Very high100 Ų10084.6 Ų84.646%0.46342%0.415SS..Hα-helixtrans-64.1-51176.2178.423000111.1A325 D326 V331 S332 E333A325-H329 PolarHBondContact O-N 2.97Å; D326-H329 PolarHBondContact O-N 2.91Å; H329-V331 VanDerWaalsContact C-N 3.32Å; H329-V331 PolarHBondContact O-N 3.03Å; H329-S332 WeakPolarHBondContact O-CB 3.42Å; H329-S332 PolarHBondContact O-N 3.45Å; H329-S332 PolarHBondContact O-OG 3.37Å; H329-E333 IonicContact CE1-OE1 3.54Å; H329-E333 IonicContact NE2-OE1 2.78Å; H329-E333 PolarHBondContact O-N 2.93Å; H329-E333 VanDerWaalsContact O-N 3.17Å
330F98.4Very high97Very high42 Ų4281.8 Ų81.818%0.18440%0.403CS..Hα-helixtrans-52.6-47.3175.9176.9-94.4000112.3R298 R301 A302 L305 D326 S332 E333R298-F330 HydrophobicContact CG-CE2 3.66Å; R298-F330 HydrophobicContact CG-CZ 4.21Å; R298-F330 PolarHBondContact NH2-O 3.44Å; R298-F330 WeakPolarHBondContact O-CE2 3.22Å; R301-F330 HydrophobicContact CB-CE2 4.38Å; R301-F330 HydrophobicContact CG-CD2 4.06Å; R301-F330 HydrophobicContact CG-CE2 4.38Å; A302-F330 HydrophobicContact CB-CE1 4.06Å; A302-F330 HydrophobicContact CB-CE2 4.11Å; A302-F330 HydrophobicContact CB-CZ 3.53Å; L305-F330 HydrophobicContact CD1-CB 3.71Å; L305-F330 HydrophobicContact CD1-CD1 4.47Å; L305-F330 HydrophobicContact CD1-CD2 4.12Å; L305-F330 HydrophobicContact CD1-CG 3.84Å; D326-F330 WeakPolarHBondContact O-CB 3.37Å; D326-F330 PolarHBondContact O-N 2.98Å; F330-S332 VanDerWaalsContact C-N 3.35Å; F330-S332 PolarHBondContact O-N 3.19Å; F330-E333 PolarHBondContact O-N 3.46Å
331V98.2Very high96.5Very high63 Ų6383.3 Ų83.338%0.38243%0.426SS..Hα-helixtrans-66.5-34.7177.9170.50000112.2I327 H329 E333 R334I327-V331 WeakPolarHBondContact O-CB 3.35Å; I327-V331 VanDerWaalsContact O-CG2 3.29Å; I327-V331 WeakPolarHBondContact O-CG2 3.31Å; I327-V331 PolarHBondContact O-N 3.1Å; H329-V331 VanDerWaalsContact C-N 3.32Å; H329-V331 PolarHBondContact O-N 3.03Å; V331-E333 VanDerWaalsContact C-N 3.29Å; V331-E333 PolarHBondContact O-N 3.27Å; V331-R334 WeakPolarHBondContact O-CB 3.47Å; V331-R334 PolarHBondContact O-N 3.15Å
332S97.4Very high96.1Very high82 Ų8285.3 Ų85.357%0.57343%0.427SS*.Hα-helixtrans-66.2-29.8177.5750000113.4K328 H329 F330 R334K328-S332 WeakPolarHBondContact O-CB 3.28Å; K328-S332 PolarHBondContact O-N 3.09Å; H329-S332 WeakPolarHBondContact O-CB 3.42Å; H329-S332 PolarHBondContact O-N 3.45Å; H329-S332 PolarHBondContact O-OG 3.37Å; F330-S332 VanDerWaalsContact C-N 3.35Å; F330-S332 PolarHBondContact O-N 3.19Å; S332-R334 PolarHBondContact O-N 3.47Å
333E96.6Very high95.1Very high38 Ų3881.9 Ų81.918%0.17842%0.421CS..THydrogen-bonded Turntrans-71.6-9.6178.7-70.517712900113.8R298 R301 H329 F330 V331 K335 F336R298-E333 IonicContact CZ-OE2 3.32Å; R298-E333 IonicContact NH1-OE2 2.99Å; R298-E333 PolarHBondContact NH1-OE2 2.75Å; R298-E333 VanDerWaalsContact NH2-CB 3.34Å; R301-E333 IonicContact NH1-OE1 3.87Å; R301-E333 IonicContact NH1-OE2 2.71Å; R301-E333 PolarHBondContact NH1-OE2 3.38Å; H329-E333 IonicContact CE1-OE1 3.54Å; H329-E333 IonicContact NE2-OE1 2.78Å; H329-E333 PolarHBondContact O-N 2.93Å; H329-E333 VanDerWaalsContact O-N 3.17Å; F330-E333 PolarHBondContact O-N 3.46Å; V331-E333 VanDerWaalsContact C-N 3.29Å; V331-E333 PolarHBondContact O-N 3.27Å; E333-K335 PolarHBondContact O-N 3.04Å; E333-F336 HydrophobicContact CB-CD2 4.08Å; E333-F336 HydrophobicContact CG-CD2 4.36Å; E333-F336 WeakPolarHBondContact O-CB 3.3Å; E333-F336 WeakPolarHBondContact O-CD2 3.37Å; E333-F336 PolarHBondContact O-N 3.18Å
334R95.9Very high94Very high136 Ų13685 Ų8551%0.51344%0.44SS..Hα-helixtrans-48.7-34.5-173.2-177.6179.8-65.5117.3-0.1114.6V331 S332 F336 D337 E338V331-R334 WeakPolarHBondContact O-CB 3.47Å; V331-R334 PolarHBondContact O-N 3.15Å; S332-R334 PolarHBondContact O-N 3.47Å; R334-F336 VanDerWaalsContact C-N 3.25Å; R334-F336 PolarHBondContact O-N 2.83Å; R334-D337 WeakPolarHBondContact CA-OD2 3.31Å; R334-D337 VanDerWaalsContact O-CB 3.31Å; R334-D337 WeakPolarHBondContact O-CB 3.45Å; R334-D337 PolarHBondContact O-N 3.37Å; R334-D337 VanDerWaalsContact O-N 3.1Å; R334-E338 PolarHBondContact O-N 3.04Å
335K95Very high93.2Very high137 Ų13786 Ų8660%0.59645%0.448SS*.Hα-helixtrans-59.6-36178.8-173.9-178172.9-169.80112.5E333 D337 E338 D339E333-K335 PolarHBondContact O-N 3.04Å; K335-D337 VanDerWaalsContact C-N 3.26Å; K335-D337 PolarHBondContact O-N 3.38Å; K335-E338 PolarHBondContact O-N 3.45Å; K335-D339 WeakPolarHBondContact CE-OD2 3.5Å; K335-D339 WeakPolarHBondContact O-CB 3.29Å; K335-D339 PolarHBondContact O-N 3.17Å
336F95.4Very high92.9Very high146 Ų14689 Ų8964%0.6445%0.451SS*.Hα-helixtrans-64.8-32.5177.7-60.8-64.3000111.8E333 R334 D339 L340E333-F336 HydrophobicContact CB-CD2 4.08Å; E333-F336 HydrophobicContact CG-CD2 4.36Å; E333-F336 WeakPolarHBondContact O-CB 3.3Å; E333-F336 WeakPolarHBondContact O-CD2 3.37Å; E333-F336 PolarHBondContact O-N 3.18Å; R334-F336 VanDerWaalsContact C-N 3.25Å; R334-F336 PolarHBondContact O-N 2.83Å; F336-D339 PolarHBondContact O-N 2.94Å; F336-L340 WeakPolarHBondContact O-CB 3.38Å; F336-L340 PolarHBondContact O-N 2.69Å
337D94.8Very high92.7Very high41 Ų4190.9 Ų90.922%0.21947%0.465CS..Hα-helixtrans-65.7-46.8177.2-49.9-32.6000110.9L295 R298 R334 K335 D339 G341L295-D337 HydrophobicContact CD2-CB 4.45Å; R298-D337 WeakPolarHBondContact CD-OD1 3.36Å; R298-D337 IonicContact CZ-OD1 3.71Å; R298-D337 IonicContact CZ-OD2 3.98Å; R298-D337 IonicContact NE-OD1 3.39Å; R298-D337 PolarHBondContact NE-OD1 3.43Å; R298-D337 IonicContact NE-OD2 3.66Å; R298-D337 PolarHBondContact NE-OD2 3.22Å; R298-D337 IonicContact NH2-OD1 2.75Å; R298-D337 IonicContact NH2-OD2 3.6Å; R298-D337 PolarHBondContact NH2-OD2 2.98Å; R334-D337 WeakPolarHBondContact CA-OD2 3.31Å; R334-D337 VanDerWaalsContact O-CB 3.31Å; R334-D337 WeakPolarHBondContact O-CB 3.45Å; R334-D337 PolarHBondContact O-N 3.37Å; R334-D337 VanDerWaalsContact O-N 3.1Å; K335-D337 VanDerWaalsContact C-N 3.26Å; K335-D337 PolarHBondContact O-N 3.38Å; D337-D339 VanDerWaalsContact C-N 3.35Å; D337-G341 PolarHBondContact O-N 2.89Å
338E93.5Very high92.5Very high104 Ų10494.8 Ų94.849%0.48648%0.48SS..Hα-helixtrans-64.2-40.3176.7-61.5-178.2-150.500112R334 K335 K342R334-E338 PolarHBondContact O-N 3.04Å; K335-E338 PolarHBondContact O-N 3.45Å; E338-K342 WeakPolarHBondContact O-CD 3.39Å; E338-K342 WeakPolarHBondContact O-CE 3.4Å; E338-K342 WeakPolarHBondContact O-CG 3.42Å; E338-K342 PolarHBondContact O-N 2.77Å; E338-K342 PolarHBondContact O-NZ 2.98Å; E338-K342 IonicContact OE2-NZ 3.39Å; E338-K342 PolarHBondContact OE2-NZ 2.77Å
339D93.6Very high92.3Very high70 Ų7094.6 Ų94.637%0.37448%0.482SS..Hα-helixtrans-75.5-33.4-178.7-70.7-15.7000111.8K335 F336 D337 K342 A343K335-D339 WeakPolarHBondContact CE-OD2 3.5Å; K335-D339 WeakPolarHBondContact O-CB 3.29Å; K335-D339 PolarHBondContact O-N 3.17Å; F336-D339 PolarHBondContact O-N 2.94Å; D337-D339 VanDerWaalsContact C-N 3.35Å; D339-K342 CarbonylContact O-C 3.59Å; D339-K342 PolarHBondContact O-N 2.84Å; D339-K342 VanDerWaalsContact O-N 3.14Å; D339-K342 IonicContact OD1-NZ 3.07Å; D339-K342 PolarHBondContact OD1-NZ 2.92Å; D339-A343 PolarHBondContact O-N 3.5Å; D339-A343 VanDerWaalsContact O-N 3.15Å
340L93.6Very high92.2Very high39 Ų3993.5 Ų93.520%0.20448%0.479CS..Hα-helixtrans-62.3-45170-178.664000111.4A291 I294 L295 F336 K342 A343A291-L340 HydrophobicContact CB-CD1 3.83Å; A291-L340 HydrophobicContact CB-CD2 4.4Å; A291-L340 HydrophobicContact CB-CG 4.11Å; I294-L340 HydrophobicContact CB-CD2 3.97Å; I294-L340 HydrophobicContact CD1-CD2 4.36Å; I294-L340 HydrophobicContact CG2-CD2 3.72Å; L295-L340 HydrophobicContact CD2-CD2 4.25Å; L295-L340 HydrophobicContact CG-CD2 4.14Å; F336-L340 WeakPolarHBondContact O-CB 3.38Å; F336-L340 PolarHBondContact O-N 2.69Å; L340-K342 PolarHBondContact O-N 3.48Å; L340-K342 VanDerWaalsContact O-N 3.11Å; L340-A343 VanDerWaalsContact O-CB 3.28Å; L340-A343 WeakPolarHBondContact O-CB 3.43Å; L340-A343 PolarHBondContact O-N 3.47Å
341G88.3Confident92.2Very high63 Ų6396.6 Ų96.665%0.64949%0.494SS*.THydrogen-bonded Turntrans-61.5-15.8173.400000114.6D337D337-G341 PolarHBondContact O-N 2.89Å
342K89.4Confident92.2Very high104 Ų10497.2 Ų97.245%0.45250%0.499SS..THydrogen-bonded Turntrans-1062.8176.4-58.9158.9-154.6154.50113E338 D339 L340 K345E338-K342 WeakPolarHBondContact O-CD 3.39Å; E338-K342 WeakPolarHBondContact O-CE 3.4Å; E338-K342 WeakPolarHBondContact O-CG 3.42Å; E338-K342 PolarHBondContact O-N 2.77Å; E338-K342 PolarHBondContact O-NZ 2.98Å; E338-K342 IonicContact OE2-NZ 3.39Å; E338-K342 PolarHBondContact OE2-NZ 2.77Å; D339-K342 CarbonylContact O-C 3.59Å; D339-K342 PolarHBondContact O-N 2.84Å; D339-K342 VanDerWaalsContact O-N 3.14Å; D339-K342 IonicContact OD1-NZ 3.07Å; D339-K342 PolarHBondContact OD1-NZ 2.92Å; L340-K342 PolarHBondContact O-N 3.48Å; L340-K342 VanDerWaalsContact O-N 3.11Å; K342-K345 WeakPolarHBondContact O-CE 3.19Å; K342-K345 PolarHBondContact O-NZ 3.28Å
343A77.8Confident92.1Very high57 Ų5797.2 Ų97.247%0.47149%0.493SS..  trans-82.9-28.5-168.700000114.2D339 L340 K345D339-A343 PolarHBondContact O-N 3.5Å; D339-A343 VanDerWaalsContact O-N 3.15Å; L340-A343 VanDerWaalsContact O-CB 3.28Å; L340-A343 WeakPolarHBondContact O-CB 3.43Å; L340-A343 PolarHBondContact O-N 3.47Å; A343-K345 PolarHBondContact O-N 3.03Å
344V75.8Confident92.2Very high79 Ų79100 Ų10048%0.47950%0.504SS..  trans-68.6100.1-175.4-1740000110.6M284M284-V344 HydrophobicContact SD-CG1 3.54Å; M284-V344 VanDerWaalsContact SD-CG1 3.54Å
345K81.6Confident92.3Very high150 Ų15098.4 Ų98.465%0.65251%0.509SS*.  trans-140.8115.4-174.9-72.1171.2179.3145.90111.3K342 A343K342-K345 WeakPolarHBondContact O-CE 3.19Å; K342-K345 PolarHBondContact O-NZ 3.28Å; A343-K345 PolarHBondContact O-N 3.03Å
346F92.2Very high92.4Very high118 Ų11895.8 Ų95.852%0.51851%0.508SS..  trans-83.3137.6163.5178.7-120.1000109.9L280 M284 F348L280-F346 HydrophobicContact CD1-CE2 3.98Å; L280-F346 HydrophobicContact CD1-CZ 4.45Å; L280-F346 HydrophobicContact CD2-CE2 4.22Å; M284-F346 HydrophobicContact CE-CB 3.96Å; F346-F348 AromaticContact CD1-CD1 3.84Å; F346-F348 HydrophobicContact CD1-CD1 3.84Å; F346-F348 HydrophobicContact CD1-CE1 4.39Å; F346-F348 HydrophobicContact CE1-CB 4.1Å; F346-F348 AromaticContact CE1-CD1 3.38Å; F346-F348 HydrophobicContact CE1-CD1 3.38Å; F346-F348 HydrophobicContact CE1-CE1 4.08Å; F346-F348 AromaticContact CE1-CG 3.98Å; F346-F348 HydrophobicContact CE1-CG 3.98Å; F346-F348 HydrophobicContact CZ-CB 3.9Å; F346-F348 HydrophobicContact CZ-CD1 4.09Å; F346-F348 HydrophobicContact CZ-CG 4.27Å
347T93Very high92.4Very high119 Ų11993 Ų9373%0.7350%0.499SS*.  trans-137.9139.2178.854.70000110
348F94.6Very high92.5Very high140 Ų14095.6 Ų95.661%0.61453%0.526SS*.  trans-152.2153.1-175.366.4-82.9000112.2F346 L350F346-F348 AromaticContact CD1-CD1 3.84Å; F346-F348 HydrophobicContact CD1-CD1 3.84Å; F346-F348 HydrophobicContact CD1-CE1 4.39Å; F346-F348 HydrophobicContact CE1-CB 4.1Å; F346-F348 AromaticContact CE1-CD1 3.38Å; F346-F348 HydrophobicContact CE1-CD1 3.38Å; F346-F348 HydrophobicContact CE1-CE1 4.08Å; F346-F348 AromaticContact CE1-CG 3.98Å; F346-F348 HydrophobicContact CE1-CG 3.98Å; F346-F348 HydrophobicContact CZ-CB 3.9Å; F346-F348 HydrophobicContact CZ-CD1 4.09Å; F346-F348 HydrophobicContact CZ-CG 4.27Å; F348-L350 HydrophobicContact CD2-CB 4.02Å; F348-L350 HydrophobicContact CE2-CB 3.99Å
349E95.4Very high92.7Very high159 Ų15993.6 Ų93.674%0.74353%0.534SS*.  trans-118.5100.3174-68.2-173.3-176.900109.9P352E349-P352 HydrophobicContact CB-CG 4.29Å
350L96.1Very high92.9Very high77 Ų7795 Ų9540%0.40354%0.536SS..Hα-helixtrans-82.5-38.5-171.1-176.259000114.1F348 L353 K354F348-L350 HydrophobicContact CD2-CB 4.02Å; F348-L350 HydrophobicContact CE2-CB 3.99Å; L350-L353 PolarHBondContact O-N 2.9Å; L350-K354 HydrophobicContact CD1-CG 4.3Å; L350-K354 HydrophobicContact CG-CD 3.99Å; L350-K354 HydrophobicContact CG-CG 4.23Å; L350-K354 PolarHBondContact O-N 3.12Å
351E97.8Very high93Very high107 Ų10795.9 Ų95.950%0.556%0.555SS.*Hα-helixtrans-69.2-37.6-173.2-55.5-47121.100114.5L353 K354 T355E351-L353 VanDerWaalsContact C-N 3.3Å; E351-L353 PolarHBondContact O-N 3.11Å; E351-K354 PolarHBondContact O-N 2.93Å; E351-K354 WeakPolarHBondContact OE1-CD 3.38Å; E351-K354 IonicContact OE1-NZ 2.71Å; E351-K354 PolarHBondContact OE1-NZ 3.15Å; E351-K354 WeakPolarHBondContact OE2-CD 3.36Å; E351-K354 IonicContact OE2-NZ 3.82Å; E351-K354 PolarHBondContact OE2-NZ 3.35Å; E351-T355 WeakPolarHBondContact O-CB 3.39Å; E351-T355 PolarHBondContact O-N 2.6Å; E351-T355 PolarHBondContact O-OG1 2.96Å
352P97.8Very high93.4Very high76 Ų7698.6 Ų98.649%0.49456%0.564SS.*Hα-helixtrans-61-39.8171.1-23.435000112.2E349 T355 S356E349-P352 HydrophobicContact CB-CG 4.29Å; P352-T355 PolarHBondContact O-N 3.45Å; P352-S356 WeakPolarHBondContact O-CB 3.21Å; P352-S356 PolarHBondContact O-N 3.35Å
353L96.7Very high93.7Very high82 Ų8298.1 Ų98.143%0.42957%0.57SS.*Hα-helixtrans-67-47.6177.8179.859.2000111.7L350 E351 T355 S356 I357L350-L353 PolarHBondContact O-N 2.9Å; E351-L353 VanDerWaalsContact C-N 3.3Å; E351-L353 PolarHBondContact O-N 3.11Å; L353-T355 VanDerWaalsContact C-N 3.29Å; L353-T355 PolarHBondContact O-N 3.2Å; L353-S356 WeakPolarHBondContact O-CB 3.32Å; L353-S356 PolarHBondContact O-N 2.75Å; L353-I357 HydrophobicContact CD1-CD1 4.04Å; L353-I357 HydrophobicContact CD1-CG1 4.3Å; L353-I357 HydrophobicContact CG-CD1 3.94Å; L353-I357 VanDerWaalsContact O-CG1 3.31Å; L353-I357 WeakPolarHBondContact O-CG1 3.35Å; L353-I357 PolarHBondContact O-N 3.39Å
354K97.1Very high94.4Very high97 Ų97103.4 Ų103.442%0.42258%0.579SS.*Hα-helixtrans-55-44.3172.4-78.3169.1170.5171.30112.1L350 E351 S356 I357 A358L350-K354 HydrophobicContact CD1-CG 4.3Å; L350-K354 HydrophobicContact CG-CD 3.99Å; L350-K354 HydrophobicContact CG-CG 4.23Å; L350-K354 PolarHBondContact O-N 3.12Å; E351-K354 PolarHBondContact O-N 2.93Å; E351-K354 WeakPolarHBondContact OE1-CD 3.38Å; E351-K354 IonicContact OE1-NZ 2.71Å; E351-K354 PolarHBondContact OE1-NZ 3.15Å; E351-K354 WeakPolarHBondContact OE2-CD 3.36Å; E351-K354 IonicContact OE2-NZ 3.82Å; E351-K354 PolarHBondContact OE2-NZ 3.35Å; K354-S356 VanDerWaalsContact C-N 3.33Å; K354-S356 PolarHBondContact O-N 3.42Å; K354-I357 PolarHBondContact O-N 3.49Å; K354-A358 WeakPolarHBondContact O-CB 3.47Å; K354-A358 PolarHBondContact O-N 3.21Å
355T98Very high95.2Very high101 Ų101106.6 Ų106.662%0.6259%0.588SS**Hα-helixtrans-63.3-41.1179.6-55.80000111.1E351 P352 L353 G359E351-T355 WeakPolarHBondContact O-CB 3.39Å; E351-T355 PolarHBondContact O-N 2.6Å; E351-T355 PolarHBondContact O-OG1 2.96Å; P352-T355 PolarHBondContact O-N 3.45Å; L353-T355 VanDerWaalsContact C-N 3.29Å; L353-T355 PolarHBondContact O-N 3.2Å; T355-G359 PolarHBondContact O-N 3.12Å
356S97.3Very high95.7Very high82 Ų82105.1 Ų105.157%0.57359%0.594SS**Hα-helixtrans-62.9-46.5174.7-168.70000112.2P352 L353 K354 G359 F360P352-S356 WeakPolarHBondContact O-CB 3.21Å; P352-S356 PolarHBondContact O-N 3.35Å; L353-S356 WeakPolarHBondContact O-CB 3.32Å; L353-S356 PolarHBondContact O-N 2.75Å; K354-S356 VanDerWaalsContact C-N 3.33Å; K354-S356 PolarHBondContact O-N 3.42Å; S356-G359 CarbonylContact O-C 3.35Å; S356-G359 PolarHBondContact O-N 3.17Å; S356-F360 PolarHBondContact O-N 3.06Å
357I96.3Very high95.5Very high89 Ų89107.2 Ų107.246%0.45661%0.605SS.*Hα-helixtrans-63.9-42.9177.7-65.5168.4000110.9L353 K354 G359 F360L353-I357 HydrophobicContact CD1-CD1 4.04Å; L353-I357 HydrophobicContact CD1-CG1 4.3Å; L353-I357 HydrophobicContact CG-CD1 3.94Å; L353-I357 VanDerWaalsContact O-CG1 3.31Å; L353-I357 WeakPolarHBondContact O-CG1 3.35Å; L353-I357 PolarHBondContact O-N 3.39Å; K354-I357 PolarHBondContact O-N 3.49Å; I357-G359 PolarHBondContact O-N 3.29Å; I357-F360 WeakPolarHBondContact O-CB 3.29Å; I357-F360 PolarHBondContact O-N 3.23Å
358A97.1Very high95Very high94 Ų94107.1 Ų107.178%0.77761%0.605SS**Hα-helixtrans-65-24.3178.400000113.3K354K354-A358 WeakPolarHBondContact O-CB 3.47Å; K354-A358 PolarHBondContact O-N 3.21Å
359G96.9Very high94.4Very high63 Ų63104.3 Ų104.365%0.64962%0.615SS**THydrogen-bonded Turntrans-92.64.1172.200000114.9T355 S356 I357T355-G359 PolarHBondContact O-N 3.12Å; S356-G359 CarbonylContact O-C 3.35Å; S356-G359 PolarHBondContact O-N 3.17Å; I357-G359 PolarHBondContact O-N 3.29Å
360F97.4Very high93.9Very high98 Ų98106.2 Ų106.243%0.4362%0.617SS.*  trans-85.8122.6-172.8-174.7-94.1000113T265 F266 L269 S356 I357T265-F360 HydrophobicContact CG2-CE1 3.96Å; T265-F360 HydrophobicContact CG2-CZ 3.82Å; F266-F360 HydrophobicContact CE1-CD1 4.07Å; F266-F360 AromaticContact CZ-CD1 3.86Å; F266-F360 HydrophobicContact CZ-CD1 3.86Å; F266-F360 HydrophobicContact CZ-CE1 4.33Å; L269-F360 HydrophobicContact CD1-CD1 3.9Å; L269-F360 HydrophobicContact CD1-CE1 3.54Å; L269-F360 HydrophobicContact CD1-CE2 4.43Å; L269-F360 HydrophobicContact CD1-CG 4.49Å; L269-F360 HydrophobicContact CD1-CZ 3.84Å; S356-F360 PolarHBondContact O-N 3.06Å; I357-F360 WeakPolarHBondContact O-CB 3.29Å; I357-F360 PolarHBondContact O-N 3.23Å
361G96.4Very high93.1Very high58 Ų58108 Ų10860%0.59864%0.636SS**  trans88.8159.1177.500000113.9
362S95.8Very high92Very high120 Ų120108.5 Ų108.584%0.83965%0.651SS**  trans-158.6162.1174.462.10000110.8
363V95.8Very high90.9Very high94 Ų94116.2 Ų116.257%0.5767%0.67SS**  trans-123.4126.8178.4-179.90000109.6M262 H365M262-V363 HydrophobicContact CE-CG2 3.98Å; V363-H365 PolarHBondContact O-CE1 3.2Å; V363-H365 PolarHBondContact O-ND1 2.96Å
364Y92.9Very high89.4Confident168 Ų168117.7 Ų117.766%0.65969%0.688SS**  trans-76.8138.7177.1-177.4-99.5000111.5Q367Y364-Q367 WeakPolarHBondContact OH-CG 3.34Å
365H93Very high87.7Confident146 Ų146124.1 Ų124.168%0.67671%0.709SS**  trans-105.4131-178.1-70.265.3000110.5V363 Q367V363-H365 PolarHBondContact O-CE1 3.2Å; V363-H365 PolarHBondContact O-ND1 2.96Å; H365-Q367 PolarHBondContact O-N 3.27Å
366P91.4Very high84.9Confident119 Ų119124.9 Ų124.977%0.77372%0.717SS**  trans-59.5127.2-176.8-25.434.3000113.7
367Q88.9Confident82.3Confident162 Ų162126.7 Ų126.776%0.75773%0.73SS**  trans-89.2119.8175.4-71.5-175.60.100112Y364 H365 G369Y364-Q367 WeakPolarHBondContact OH-CG 3.34Å; H365-Q367 PolarHBondContact O-N 3.27Å; Q367-G369 PolarHBondContact O-N 3.41Å; Q367-G369 VanDerWaalsContact O-N 3.13Å
368T82.7Confident80.3Confident118 Ų118127.6 Ų127.672%0.72474%0.744SS**  trans-88.765.6-176.952.10000112.6Y370T368-Y370 PolarHBondContact O-N 2.88Å
369G80.8Confident77.6Confident80 Ų80129.5 Ų129.583%0.82575%0.746SS**  trans-69.826.8178.700000116.1Q367 S371Q367-G369 PolarHBondContact O-N 3.41Å; Q367-G369 VanDerWaalsContact O-N 3.13Å; G369-S371 PolarHBondContact O-N 3.34Å
370Y85.1Confident74.7Confident200 Ų200133 Ų13378%0.78476%0.756SS**  trans-75.5115.7-175.4-70.2-72000111.7T368 S372T368-Y370 PolarHBondContact O-N 2.88Å; Y370-S372 PolarHBondContact O-N 2.75Å
371S80.2Confident72.2Confident114 Ų114133.9 Ų133.980%0.79777%0.773SS**  trans-66.4116.4179-175.60000111.7G369 R373G369-S371 PolarHBondContact O-N 3.34Å; S371-R373 PolarHBondContact O-N 2.85Å; S371-R373 VanDerWaalsContact O-N 3.09Å
372S74.7Confident69.6Low118 Ų118136.3 Ų136.383%0.82578%0.781SS**  trans-72.697.1169-720000110Y370 S374Y370-S372 PolarHBondContact O-N 2.75Å; S372-S374 VanDerWaalsContact C-N 3.3Å; S372-S374 PolarHBondContact O-N 3.04Å
373R75.3Confident67.1Low237 Ų237138 Ų13889%0.89478%0.779SS**  trans-66.487.9170.1-102.2-175.7170.6-101.61.9110.1S371 R375S371-R373 PolarHBondContact O-N 2.85Å; S371-R373 VanDerWaalsContact O-N 3.09Å; R373-R375 PolarHBondContact O-N 3.06Å
374S63.5Low64.5Low113 Ų113140.1 Ų140.179%0.7979%0.793SS**  trans-55.2135.6168.9-171.40000110S372S372-S374 VanDerWaalsContact C-N 3.3Å; S372-S374 PolarHBondContact O-N 3.04Å
375R61.2Low61.8Low233 Ų233135.3 Ų135.388%0.87979%0.794SS**  trans-86.8120-176.2-76.3-177.5166.6-166.1-3.6110.2R373R373-R375 PolarHBondContact O-N 3.06Å
376C41.1Very low60.1Low117 Ų117135 Ų13579%0.79181%0.805SS**  trans61.970.7157.7-56.80000116.9
377S41.8Very low57.4Low120 Ų120133 Ų13384%0.83981%0.806SS**  trans-100108.9143.5-65.30000108.1
378S53.9Low54.9Low108 Ų108131 Ų13176%0.75581%0.81SS**  trans-15361.4-175.1-64.70000112.3
379T40.3Very low53.2Low133 Ų133131.3 Ų131.382%0.81681%0.811SS**SBendtrans-156.4162.1158.5-2.70000109.5
380T35.9Very low51Low138 Ų138136.1 Ų136.185%0.84781%0.812SS**  trans50.589.517352.30000117.4
381S45.2Very low49.1Very low115 Ų115132.3 Ų132.380%0.80481%0.81SS**  trans-69.7125.1143.950.70000110.5
382S41.1Very low47.3Very low109 Ų109132.5 Ų132.576%0.76281%0.808SS**  160.9146.8127.9-74.80000114.9
383I43.9Very low45.9Very low155 Ų155131.9 Ų131.980%0.79580%0.802SS**  trans83.5127.8152-122.1166000119.8
384T42.3Very low44.7Very low140 Ų140126.7 Ų126.786%0.85980%0.799SS**  trans58.5141.4173.359.30000117.4
385G34.7Very low43.4Very low66 Ų66126.5 Ų126.568%0.6880%0.798SS**  cis-167.4174.8-5.500000110.2
386P58.5Low42.1Very low141 Ų141120.7 Ų120.792%0.91679%0.792SS**  trans-89.1146.4-176.634.5-34.1000114
387G33.7Very low41.6Very low77 Ų77125.1 Ų125.179%0.79479%0.794SS**  trans111.9148.2-179.600000112
388S37.2Very low41.1Very low118 Ų118128.6 Ų128.683%0.82580%0.797SS**  cis-143.8179.6-1.1-162.80000110.8
389V47.3Very low39.8Very low125 Ų125127.2 Ų127.276%0.75880%0.799SS**  trans-61.1148.9166.1-75.40000111.7
390E34.8Very low39.5Very low182 Ų182129.1 Ų129.185%0.8579%0.792SS**  -153.4143.7122.6-144.4165.9123.300112
391T43.5Very low39.7Very low120 Ų120127.5 Ų127.574%0.73678%0.783SS**  trans-111.8120.7172.9-57.40000107.3P393T391-P393 WeakPolarHBondContact O-CD 3.33Å
392P43.8Very low39Very low117 Ų117127.6 Ų127.676%0.7678%0.779SS**PPolyproline II helixtrans-68.7124.9178.727.3-33.1000110.4
393P45.7Very low38.8Very low106 Ų106129.1 Ų129.169%0.68878%0.775SS**PPolyproline II helixtrans-83.6151178.533.6-34.5000111.8T391T391-P393 WeakPolarHBondContact O-CD 3.33Å
394P49.2Very low38.7Very low127 Ų127127.3 Ų127.383%0.82577%0.773SS**PPolyproline II helixtrans-68.7135.1164.329.7-32.8000110.3
395S36.8Very low38.5Very low110 Ų110127.6 Ų127.677%0.76977%0.769SS**PPolyproline II helixtrans-70.9144.5177.750.40000112.4
396S33.4Very low38.6Very low110 Ų110133.3 Ų133.377%0.76978%0.775SS**PPolyproline II helixtrans-90.3146.5-177.255.60000114
397Y31.4Very low37.4Very low210 Ų210132 Ų13282%0.82477%0.765SS**  trans-133.8120.1141.518.9-92.4000109.8
398E30.4Very low37.1Very low194 Ų194134.2 Ų134.291%0.90776%0.763SS**  trans38.3135.4144.2-56.2179.4142.600120.6
399G27.5Very low36.7Very low78 Ų78137.4 Ų137.480%0.80476%0.762SS**  cis-156.5173.911.900000114.5
400R33.2Very low35.9Very low173 Ų173139.1 Ų139.165%0.65377%0.767SS**  trans-156.3146.9-172.7-177.2-177.4-172.4-67.9-22.7110.8T402 Q403R400-T402 VanDerWaalsContact NH1-N 3.19Å; R400-Q403 VanDerWaalsContact NH2-CG 3.33Å
401P39.4Very low35.6Very low104 Ų104134.2 Ų134.268%0.67577%0.765SS**  trans-121.5157.5144.235.5-27.2000114
402T32.2Very low35.3Very low117 Ų117136.4 Ų136.472%0.71877%0.772SS**  trans25.9113.9149.853.40000118.6R400R400-T402 VanDerWaalsContact NH1-N 3.19Å
403Q36Very low34.8Very low142 Ų142140.8 Ų140.866%0.66477%0.773SS**  cis53.7141.841.5-88.4-114.416.600112.8R400R400-Q403 VanDerWaalsContact NH2-CG 3.33Å
404P42.3Very low34.7Very low117 Ų117146.5 Ų146.576%0.7678%0.781SS**  cis-125176.825.242.2-29.8000116.6
405N38.2Very low34Very low145 Ų145149.3 Ų149.378%0.77578%0.777SS**  trans-146.8111.4166.5-176.3-1.1000110.8
406K36.6Very low33.9Very low186 Ų186149.7 Ų149.781%0.80978%0.775SS**  trans-153.2106.8169.6-76.5-162.6179.5179.30109.3
407T32.9Very low33.9Very low115 Ų115149.3 Ų149.371%0.70678%0.778SS**  82.6143.496.767.30000116.8
408T27.3Very low33.8Very low122 Ų122142.8 Ų142.875%0.74878%0.775SS**  trans99.895.5144.6-52.60000120.3
409F28.2Very low34.5Very low185 Ų185140 Ų14081%0.81177%0.774SS**  82.8155.1128.8-126.1-137.3000123.4
410L31Very low34.7Very low162 Ų162139 Ų13985%0.84876%0.763SS**  trans69.4139.9166-59.2169.8000119.4
411G28.4Very low35Very low79 Ų79141.3 Ų141.381%0.81477%0.774SS**  trans168.210.2176.400000118.8R413G411-R413 PolarHBondContact O-N 3.12Å
412N37.5Very low34.8Very low166 Ų166145 Ų14589%0.88878%0.781SS**  trans-88.9108.5-174.4-166.226.4000112.6
413R34.1Very low34.9Very low208 Ų208145.4 Ų145.479%0.78579%0.789SS**  trans-156.3126.8168.1-162.6171.8-79.6-138.32.9113.1G411 Y415G411-R413 PolarHBondContact O-N 3.12Å; R413-Y415 HydrophobicContact CG-CD2 3.81Å; R413-Y415 HydrophobicContact CG-CE2 3.77Å
414R42.3Very low34.9Very low227 Ų227142.5 Ų142.586%0.85780%0.797SS**  trans-100.7141.1165.6-61.5174.3175.9177.5-3.2109.5
415Y35.3Very low34.3Very low185 Ų185140.8 Ų140.873%0.72580%0.801SS**  trans-164.9162.4156-75.9-65.8000109R413R413-Y415 HydrophobicContact CG-CD2 3.81Å; R413-Y415 HydrophobicContact CG-CE2 3.77Å
416T33.5Very low34.2Very low119 Ų119142.4 Ų142.473%0.7380%0.804SS**  -166.5138.9-61.825.70000109.7
417A33.3Very low34Very low102 Ų102143.6 Ų143.684%0.84380%0.803SS**  trans59.8111.5145.800000123.7
418G29.9Very low34.1Very low73 Ų73148.8 Ų148.875%0.75381%0.811SS**  79.7172.113000000119.8
419P46.3Very low34.3Very low136 Ų136150 Ų15088%0.88381%0.813SS**  cis-96-147.9-3.243.3-37.5000111
420G30.7Very low34.4Very low57 Ų57144.8 Ų144.859%0.58881%0.812SS**  cis177178.70.100000114.6
421Y38.8Very low34.3Very low221 Ų221142.3 Ų142.387%0.86781%0.808SS**  trans68.4155168-63.8-72.2000120.9
422H35.8Very low34.5Very low180 Ų180144.1 Ų144.183%0.83381%0.808SS**  trans-151.5147.9-158.4-44.6-43.9000114.8
423S35.6Very low34.3Very low127 Ų127147.2 Ų147.289%0.88881%0.809SS**  trans-176.4146.1147.1-78.10000106.2
424G34.3Very low34.3Very low80 Ų80149.4 Ų149.483%0.82582%0.817SS**  cis113.3116.324.900000107.8
425G30.9Very low33.8Very low82 Ų82146 Ų14685%0.84582%0.816SS**  cis-160.7-159.63.400000113.8
426Q36.3Very low33.8Very low178 Ų178148 Ų14883%0.83282%0.823SS**  trans-77.2144.3-167.4-83.4-86.4-5.600116.4
427R32.6Very low33.5Very low211 Ų211149.8 Ų149.880%0.79683%0.827SS**  159.6120.5112.9-85.2175.9-166.2-138.21.1113.1
428Y34.1Very low33.7Very low224 Ų224149.6 Ų149.688%0.87882%0.816SS**  -176.3165.9107.8-112.9-87.3000111.6
429N31.8Very low33.8Very low148 Ų148153.8 Ų153.879%0.79182%0.821SS**  trans-115.5148.8-171-179.922.3000111.2
430G29.6Very low33.2Very low76 Ų76159.6 Ų159.678%0.78483%0.826SS**  trans-179.754.1-176.100000116.9
431S29.3Very low33.2Very low109 Ų109160.7 Ų160.776%0.76284%0.837SS**  trans-75.1139.6174.1-64.50000113.6
432S33.3Very low32.8Very low117 Ų117153.3 Ų153.382%0.81883%0.828SS**  -171.4123126.939.10000113
433Y32.9Very low32.6Very low232 Ų232155.8 Ų155.891%0.9183%0.831SS**  trans-83.3146.6159.8-73.2-102.5000108.8
434R34.4Very low32.3Very low253 Ų253160.8 Ų160.896%0.95583%0.831SS**  trans-118.8109.8163.4-104.5-161.2179.9-143.25.3109.9
435D32Very low32.1Very low156 Ų156161.1 Ų161.183%0.83482%0.82SS**  trans-139.3123.9165.4-146.6-31.3000107.8
436R33.8Very low32.3Very low228 Ų228166.1 Ų166.186%0.8682%0.821SS**  trans-158.568.6-178.8-147.4176.2-162.4-1765.1114.2T438R436-T438 PolarHBondContact O-N 2.87Å; R436-T438 PolarHBondContact O-OG1 3.04Å
437N28.4Very low31.9Very low155 Ų155161.1 Ų161.183%0.82982%0.818SS**  trans-53.1133.9162.9-174.2-2.5000110.8
438T37.8Very low32Very low99 Ų99161.5 Ų161.561%0.60782%0.821SS**  trans-142.5100.9-176.3-52.50000111.3R436R436-T438 PolarHBondContact O-N 2.87Å; R436-T438 PolarHBondContact O-OG1 3.04Å
439N30.4Very low32Very low161 Ų161160 Ų16086%0.86182%0.822SS**  trans178.4121.6142.2-98.4-27.3000112.8
440R33.9Very low31.8Very low258 Ų258156 Ų15697%0.97482%0.816SS**  trans-160.6127.8158-149.2179.6-167.5-146.52.8112.7
441G30.7Very low32Very low80 Ų80162.5 Ų162.583%0.82583%0.826SS**  trans100.4138.417300000114.3
442G30.1Very low32Very low65 Ų65160.4 Ų160.467%0.6782%0.822SS**  cis174.5149.7-10.700000115.2
443Y32.1Very low31.9Very low233 Ų233163.2 Ų163.291%0.91483%0.827SS**  trans63.2113.1153.1-60.4-70.7000122.7
444R30.7Very low31.7Very low232 Ų232155.7 Ų155.788%0.87582%0.82SS**  98.294.5117.4-160.8176.4-157.2-156.24.8122.4
445S28.6Very low32.6Very low86 Ų86149.6 Ų149.660%0.60181%0.814SS**  88.3121.4120.8-148.50000124.1
446Q35.5Very low32.8Very low187 Ų187148.2 Ų148.287%0.87482%0.816SS**  trans61.7136.4140-71.5170-34.200122.3
447G27.8Very low32.8Very low73 Ų73146.3 Ų146.375%0.75382%0.817SS**  trans179.923.2172.900000123.5
448Y34.1Very low34Very low220 Ų220143.9 Ų143.986%0.86381%0.809SS**  trans52.9158.3158.7-87-88.2000124.2
449Q34.5Very low33.7Very low191 Ų191146.2 Ų146.289%0.89382%0.824SS**  trans68.2146.4165.1-68.3155.3-39.500118.3
450G28.7Very low33.8Very low65 Ų65142.9 Ų142.967%0.6782%0.818SS**  cis161.1139.1-14.500000114.3
451Q33.3Very low33.8Very low212 Ų212136.5 Ų136.599%0.99181%0.808SS**  trans63164.3176.3-67.1170.6-1900115.3
452G28.7Very low34Very low66 Ų66141 Ų14168%0.6881%0.808SS**  cis-172.9178.7-1.800000112.5
453D32.2Very low34.2Very low175 Ų175142.7 Ų142.794%0.93681%0.809SS**  trans-47163.4-172.4-51.6-88.2000119.5
454G28.7Very low34.3Very low74 Ų74135.9 Ų135.976%0.76380%0.796SS**  trans149.3132148.100000117.7
455P53.8Low34.3Very low126 Ų126132.2 Ų132.282%0.81879%0.794SS**  trans-120.7158.1-174.741-30.6000116.1
456S34.2Very low34.5Very low127 Ų127133 Ų13389%0.88880%0.799SS**  trans-150.5136.2160-68.40000112.9
457H34.9Very low34.3Very low187 Ų187130.7 Ų130.787%0.86680%0.798SS**  trans-133.9-177.1168.3-110.7-63.4000105.9
458P54.1Low34.6Very low104 Ų104136.7 Ų136.768%0.67580%0.804SS**  cis-131.3-177.6-26.939.3-24.3000112.3
459T30.9Very low34.5Very low149 Ų149130.7 Ų130.791%0.91480%0.799SS**  trans-147.5149.8135.7-26.60000109.9
460A31.8Very low35.1Very low90 Ų90127.6 Ų127.674%0.74480%0.796SS**  trans-151.2143.3177.600000112.9
461T34.1Very low35.3Very low124 Ų124129.3 Ų129.376%0.76180%0.797SS**  trans-140111.8164.632.50000106.6
462Q35.8Very low35.2Very low175 Ų175126.5 Ų126.582%0.81879%0.789SS**  68.5127.395.5-71-175.872.800113.4
463S33.4Very low35.4Very low100 Ų100129 Ų12970%0.69980%0.797SS**  cis-163.7162.42.148.30000113.7
464S33.8Very low35.8Very low90 Ų90125 Ų12563%0.62979%0.788SS**  trans13.1151.1148.459.80000122.2
465N31.3Very low36.5Very low156 Ų156127.6 Ų127.683%0.83479%0.791SS**  cis-169.5157.9-6.8-104.7-15000110.7
466S32.5Very low35.6Very low103 Ų103127.2 Ų127.272%0.7279%0.791SS**  trans-43.9145.3163.6-45.90000117.1
467T32.6Very low35.5Very low138 Ų138125.9 Ų125.985%0.84778%0.782SS**  -176.5121104.532.10000116.7
468K33.8Very low35.4Very low199 Ų199121.2 Ų121.287%0.86577%0.77SS**  37.8105128.4-160.7175-176.3-178.80122.6
469A30.6Very low34.3Very low94 Ų94126.6 Ų126.678%0.77778%0.779SS**  trans81154.513600000122
470P48.3Very low34.4Very low125 Ų125129.2 Ų129.281%0.81277%0.772SS**  trans-123.5169.2-168.543.3-30.1000116.1
471S32.6Very low34.6Very low101 Ų101130.8 Ų130.871%0.70676%0.764SS**  trans-166.4139.9157.9520000115.7
472N31.9Very low34.5Very low153 Ų153130.8 Ų130.882%0.81876%0.759SS**  trans68.3152.8155.7-53.4-16.2000118.4
473S32.3Very low34.6Very low120 Ų120130.8 Ų130.884%0.83976%0.759SS**  cis-137.3167.218.7-65.50000114.8
474A40.1Very low35Very low90 Ų90132.1 Ų132.174%0.74477%0.765SS**  trans-81.7-171.9-17200000115.9
475P43.3Very low35.4Very low129 Ų129133.1 Ų133.184%0.83877%0.772SS**  -128173.290.713.57.4000116.4
476S36.4Very low35.7Very low117 Ų117134.7 Ų134.782%0.81877%0.774SS**  trans-63.7166.8-177.9-144.40000113.5
477S31.3Very low36.1Very low100 Ų100137.6 Ų137.670%0.69978%0.781SS**  cis-166.8155.525.7-179.40000108.3
478S33.1Very low36.2Very low89 Ų89134.6 Ų134.662%0.62278%0.778SS**  cis-164.1-162.9-12.945.90000106
479Y31.5Very low37Very low216 Ų216133 Ų13385%0.84778%0.778SS**  cis-151.8-177.52.4-127.2-55.3000108.6
480R31.7Very low37.9Very low204 Ų204134.5 Ų134.577%0.7778%0.78SS**  trans-155.5157.6-176.1-83.6174.9173.4-104-1108.3
481Q35.9Very low37.9Very low124 Ų124137.5 Ų137.558%0.57978%0.783SS**  cis-156.3-164.1-0.8-126.3168.7-77.700107.2
482D31.8Very low38.6Very low123 Ų123143.9 Ų143.966%0.65879%0.792SS**  cis-158-177.88.9-136.6-26.4000112.8
483H37.4Very low39.8Very low176 Ų176141.9 Ų141.982%0.81579%0.787SS**  trans-93.4160.8164.9-72.1-78.9000113.2
484P43.7Very low40.8Very low128 Ų128141.7 Ų141.783%0.83178%0.783SS**  -137162.7120.838.4-28.9000114.9
485S41.6Very low41.3Very low111 Ų111149.2 Ų149.278%0.77679%0.792SS**  trans-83.3151-176.8-39.90000113.7
486H38.3Very low41.5Very low189 Ų189149.2 Ų149.288%0.87579%0.79SS**  trans-158.5140.4148.3-119.2-77.4000114.3
487N40.7Very low41.9Very low163 Ų163152.3 Ų152.387%0.87279%0.791SS**  trans-79.1145.5161.4-78.5-26.3000109.8
488G34.3Very low42.2Very low76 Ų76153 Ų15378%0.78480%0.795SS**  trans-169.1113.917100000113.7
489L50.1Low43.3Very low164 Ų164158.4 Ų158.486%0.85983%0.828SS**PPolyproline II helixtrans-77.5143.1161.6-72.2165.5000109
490P48.7Very low43.8Very low126 Ų126155.6 Ų155.682%0.81883%0.827SS**PPolyproline II helixtrans-65.2136.6175.427.2-33.7000111.1
491Q48.3Very low44.5Very low188 Ų188153 Ų15388%0.87983%0.83SS**PPolyproline II helixtrans-81159.4179-64.3-168.424.100112.4
492R48.3Very low45Very low236 Ų236154.6 Ų154.689%0.89184%0.844SS**PPolyproline II helixtrans-78.6133.5-179.2-172.8-176.1-172.71685.4111.4
493P57.5Low45.7Very low110 Ų110156.5 Ų156.571%0.71486%0.855SS**PPolyproline II helixtrans-61.2151172.7-24.434.8000113.6
494P52.2Low46.3Very low116 Ų116155.3 Ų155.375%0.75386%0.857SS**PPolyproline II helixtrans-74.8159.3178.632.2-35.8000112.5
495R51.3Low46.4Very low248 Ų248157.1 Ų157.194%0.93686%0.859SS**PPolyproline II helixtrans-74.7124167.3-82178.5165.2160.3-7110
496T47.8Very low46.8Very low129 Ų129160.4 Ų160.479%0.79187%0.865SS**PPolyproline II helixtrans-92.6147.8159.943.20000110.2
497H44.9Very low47.4Very low183 Ų183158.2 Ų158.285%0.84786%0.864SS**PPolyproline II helixtrans-81.8159.3165.4-85.1-106000110.3
498C36.5Very low48Very low115 Ų115157.8 Ų157.878%0.77786%0.863SS**  trans-132.7162.4164.2-91.50000108.3
499P55.9Low49.2Very low202 Ų202165.2 Ų165.2100%1.31287%0.871SS**  trans-77.30-150.330.9-37000115.3

Retrieved 499 of 499 residues in 872.9 ms (Link to these results)