A0A093HBU1_STRCA Loading...

Prostaglandin F2-alpha receptor

AlphaFold DB , UniProt , Accession A0A093HBU1, Species STRCA (Struthio camelus australis), Gene n/a, Length 364 aa.

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

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
1M38.2Very low30.6Very low249 Ų249138.3 Ų138.3100%1.22787%0.867SS**  0107.90-87.1157.5141.600107
2N27.5Very low30.8Very low167 Ų167145.8 Ų145.889%0.89388%0.878SS**  trans-86.8153.7-164-85.2-8.7000113.9
3S29.1Very low30.6Very low114 Ų114139.7 Ų139.780%0.79786%0.863SS**  trans-39.9149.4168.5-59.10000118
4S28.3Very low30.7Very low129 Ų129141 Ų14190%0.90286%0.86SS**  174151.811143.50000112.4
5K30.1Very low30.9Very low203 Ų203143.8 Ų143.888%0.88387%0.866SS**  trans-125139.1-171-151.6-179.6-168.7-179.70108.7
6S25.4Very low31.1Very low116 Ų116147.9 Ų147.981%0.81186%0.861SS**  trans73.9162.2162.8-99.60000120.3
7P44.5Very low31.6Very low126 Ų126147.1 Ų147.182%0.81885%0.853SS**  cis-139174.1-4434.5-15.5000113.1
8G23.3Very low32.5Very low76 Ų76144.4 Ų144.478%0.78484%0.839SS**  trans140111.415300000116.6
9L26.6Very low33.6Very low172 Ų172140.3 Ų140.390%0.90182%0.816SS**  157.280115.7-161.570.3000108.6G11L9-G11 PolarHBondContact O-N 3.46Å
10A32.7Very low35.1Very low110 Ų110134.8 Ų134.891%0.90979%0.786SS**  trans-74.3113.316100000107.5
11G30.5Very low36Very low59 Ų59136.4 Ų136.461%0.60879%0.786SS**  trans179.4129.8175.700000111.3L9L9-G11 PolarHBondContact O-N 3.46Å
12F33.3Very low36.7Very low228 Ų228126.1 Ų126.1100%174%0.737SS**  trans73.179.8172.4-78.3-94.5000116.9
13G28.7Very low38Very low67 Ų67124.9 Ų124.969%0.69173%0.726SS**  trans-155108.9160.600000111.7
14I31.1Very low39.3Very low158 Ų158126.4 Ų126.481%0.8172%0.718SS**  trans89.366.8158-45.8165.6000115.5R16I14-R16 HydrophobicContact CG2-CB 3.85Å; I14-R16 PolarHBondContact O-N 2.77Å; I14-R16 VanDerWaalsContact O-N 3.11Å
15L33.6Very low40.7Very low183 Ų183128.2 Ų128.296%0.95871%0.709SS**  trans-74.781.5148.4-157.889.5000107.4N17L15-N17 PolarHBondContact O-N 3.31Å
16R34.1Very low42.2Very low209 Ų209122.5 Ų122.579%0.78969%0.688SS**  trans-68.496179.4-168.9172.9178.7172.4-0.8109.8I14 T18I14-R16 HydrophobicContact CG2-CB 3.85Å; I14-R16 PolarHBondContact O-N 2.77Å; I14-R16 VanDerWaalsContact O-N 3.11Å; R16-T18 PolarHBondContact O-N 3.26Å; R16-T18 PolarHBondContact O-OG1 3.18Å
17N40.7Very low44.2Very low134 Ų134117.2 Ų117.272%0.71765%0.651SS**  trans5.572147.4-143.814.2000116.6L15L15-N17 PolarHBondContact O-N 3.31Å
18T47.1Very low45.5Very low99 Ų99113.2 Ų113.261%0.60762%0.624SS**  trans-119.637.6172.9-390000110.1R16R16-T18 PolarHBondContact O-N 3.26Å; R16-T18 PolarHBondContact O-OG1 3.18Å
19T54.6Low48.1Very low66 Ų66116 Ų11641%0.40562%0.615SS.*  trans-80.6124.2170.937.60000109.6H21T19-H21 PolarHBondContact O-CD2 3.05Å; T19-H21 PolarHBondContact O-N 3.24Å
20C63Low50.5Low31 Ų31112 Ų11221%0.20959%0.59CS.*  trans-62.9108.7174.2-171.90000109.9T22 C280 E281C20-T22 PolarHBondContact O-N 3.21Å; C20-T22 PolarHBondContact SG-OG1 3.38Å; C20-C280 HydrophobicContact CB-CB 3.86Å; C20-C280 WeakPolarHBondContact CB-SG 3.45Å; C20-C280 PolarHBondContact SG-SG 2.89Å; C20-E281 PolarHBondContact SG-OE1 3.37Å
21H52.7Low52.7Low169 Ų169108.2 Ų108.278%0.78256%0.557SS**  trans-80.255.3175.4-83.6-90.1000111T19T19-H21 PolarHBondContact O-CD2 3.05Å; T19-H21 PolarHBondContact O-N 3.24Å
22T53.7Low55.2Low32 Ų32108.7 Ų108.720%0.19655%0.545CS..  trans-71.3132.3161-26.80000107.1C20 K24 E281C20-T22 PolarHBondContact O-N 3.21Å; C20-T22 PolarHBondContact SG-OG1 3.38Å; T22-K24 PolarHBondContact O-N 2.7Å; T22-E281 WeakPolarHBondContact CB-OE1 3.26Å; T22-E281 WeakPolarHBondContact CG2-OE1 3.39Å; T22-E281 PolarHBondContact OG1-OE1 2.69Å
23E55.4Low57.8Low141 Ų141102 Ų10266%0.65952%0.519SS*.  trans-46.2109.3177.3-75.3-156.3155.400110.8K25 I26E23-K25 PolarHBondContact O-N 2.89Å; E23-I26 HydrophobicContact CB-CD1 4.22Å; E23-I26 HydrophobicContact CB-CG1 4.29Å; E23-I26 PolarHBondContact O-N 3.37Å; E23-I26 WeakPolarHBondContact OE2-CD1 3.44Å
24K56.8Low60.6Low147 Ų147100 Ų10064%0.63949%0.491SS*.Hα-helixtrans-49.6-34-168.7-79.3-177.9175.2-176.20112.9T22 V28T22-K24 PolarHBondContact O-N 2.7Å; K24-V28 VanDerWaalsContact O-CG2 3.24Å; K24-V28 WeakPolarHBondContact O-CG2 3.37Å
25K57.8Low63.4Low166 Ų16694.3 Ų94.372%0.72246%0.461SS*.Hα-helixtrans-70.3-48-178.5-67.7-177.1178.6-179.70112.2E23 S27 V28 F29E23-K25 PolarHBondContact O-N 2.89Å; K25-S27 PolarHBondContact O-N 3.48Å; K25-V28 PolarHBondContact O-N 3.01Å; K25-F29 HydrophobicContact CB-CE2 4.5Å; K25-F29 WeakPolarHBondContact O-CD2 3.22Å; K25-F29 PolarHBondContact O-N 3.23Å
26I61.4Low66.1Low83 Ų8388.5 Ų88.543%0.42643%0.434SS..Hα-helixtrans-63.6-41.8-174.1-63.1-179.1000111.1E23 V28 F29 F30E23-I26 HydrophobicContact CB-CD1 4.22Å; E23-I26 HydrophobicContact CB-CG1 4.29Å; E23-I26 PolarHBondContact O-N 3.37Å; E23-I26 WeakPolarHBondContact OE2-CD1 3.44Å; I26-V28 PolarHBondContact O-N 3.01Å; I26-F29 PolarHBondContact O-N 3.01Å; I26-F30 HydrophobicContact CG2-CD2 3.76Å; I26-F30 HydrophobicContact CG2-CE2 3.47Å; I26-F30 VanDerWaalsContact CG2-CE2 3.47Å; I26-F30 WeakPolarHBondContact O-CD2 3.37Å; I26-F30 PolarHBondContact O-N 2.91Å
27S67.2Low68.9Low5 Ų581.7 Ų81.74%0.03542%0.415CS..Hα-helixtrans-66.9-32.8-178.9-171.10000114K25 S31 Y90 R288K25-S27 PolarHBondContact O-N 3.48Å; S27-S31 PolarHBondContact O-N 2.99Å; S27-Y90 PolarHBondContact OG-OH 3.07Å; S27-R288 PolarHBondContact OG-NH2 3.03Å; S27-R288 VanDerWaalsContact OG-NH2 3.11Å
28V71.9Confident71.3Confident42 Ų4275.3 Ų75.326%0.25538%0.381SS..Hα-helixtrans-68.8-46.6178.3175.10000110.3K24 K25 I26 F30 S31 I32 Y90K24-V28 VanDerWaalsContact O-CG2 3.24Å; K24-V28 WeakPolarHBondContact O-CG2 3.37Å; K25-V28 PolarHBondContact O-N 3.01Å; I26-V28 PolarHBondContact O-N 3.01Å; V28-F30 VanDerWaalsContact C-N 3.34Å; V28-F30 PolarHBondContact O-N 3.44Å; V28-S31 WeakPolarHBondContact O-CB 3.47Å; V28-S31 PolarHBondContact O-N 3.27Å; V28-S31 VanDerWaalsContact O-N 3.13Å; V28-I32 HydrophobicContact CG1-CD1 3.72Å; V28-I32 HydrophobicContact CG1-CG1 4.36Å; V28-I32 WeakPolarHBondContact O-CG1 3.4Å; V28-I32 PolarHBondContact O-N 3.01Å; V28-Y90 HydrophobicContact CB-CD1 4.44Å; V28-Y90 HydrophobicContact CG2-CD1 3.36Å; V28-Y90 HydrophobicContact CG2-CE1 3.69Å; V28-Y90 HydrophobicContact CG2-CG 3.91Å
29F77.9Confident73.5Confident134 Ų13472.6 Ų72.659%0.58836%0.363SS*.Hα-helixtrans-57.8-45.8178.4-77.1-68.1000111.7K25 I26 S31 I32 I33K25-F29 HydrophobicContact CB-CE2 4.5Å; K25-F29 WeakPolarHBondContact O-CD2 3.22Å; K25-F29 PolarHBondContact O-N 3.23Å; I26-F29 PolarHBondContact O-N 3.01Å; F29-S31 VanDerWaalsContact C-N 3.33Å; F29-S31 PolarHBondContact O-N 3.05Å; F29-I32 PolarHBondContact O-N 3.34Å; F29-I33 WeakPolarHBondContact O-CB 3.36Å; F29-I33 WeakPolarHBondContact O-CD1 3.28Å; F29-I33 WeakPolarHBondContact O-CG1 3.38Å; F29-I33 PolarHBondContact O-N 3.49Å
30F77.4Confident75.3Confident89 Ų8974.9 Ų74.939%0.3937%0.372SS..Hα-helixtrans-59.7-42.4176.1-81.1-66.8000112.6I26 V28 I33 F34I26-F30 HydrophobicContact CG2-CD2 3.76Å; I26-F30 HydrophobicContact CG2-CE2 3.47Å; I26-F30 VanDerWaalsContact CG2-CE2 3.47Å; I26-F30 WeakPolarHBondContact O-CD2 3.37Å; I26-F30 PolarHBondContact O-N 2.91Å; V28-F30 VanDerWaalsContact C-N 3.34Å; V28-F30 PolarHBondContact O-N 3.44Å; F30-I33 PolarHBondContact O-N 3.01Å; F30-F34 AromaticContact CD1-CE1 3.89Å; F30-F34 HydrophobicContact CD1-CE1 3.89Å; F30-F34 HydrophobicContact CD1-CZ 4.11Å; F30-F34 VanDerWaalsContact O-CB 3.31Å; F30-F34 WeakPolarHBondContact O-CB 3.25Å; F30-F34 VanDerWaalsContact O-CD1 3.31Å; F30-F34 WeakPolarHBondContact O-CD1 3.31Å; F30-F34 VanDerWaalsContact O-CG 3.29Å; F30-F34 WeakPolarHBondContact O-CG 3.42Å; F30-F34 PolarHBondContact O-N 3.4Å
31S77.3Confident76.6Confident31 Ų3173.8 Ų73.822%0.21736%0.364CS..Hα-helixtrans-63.4-44.3178.8-162.40000112.3S27 V28 F29 M35S27-S31 PolarHBondContact O-N 2.99Å; V28-S31 WeakPolarHBondContact O-CB 3.47Å; V28-S31 PolarHBondContact O-N 3.27Å; V28-S31 VanDerWaalsContact O-N 3.13Å; F29-S31 VanDerWaalsContact C-N 3.33Å; F29-S31 PolarHBondContact O-N 3.05Å; S31-M35 VanDerWaalsContact O-CB 3.3Å; S31-M35 WeakPolarHBondContact O-CB 3.47Å; S31-M35 PolarHBondContact O-N 3.47Å
32I84.5Confident78.5Confident69 Ų6965.7 Ų65.735%0.35433%0.327SS..Hα-helixtrans-66.4-44.9178.7-66.1171.5000110.7V28 F29 T36 V87V28-I32 HydrophobicContact CG1-CD1 3.72Å; V28-I32 HydrophobicContact CG1-CG1 4.36Å; V28-I32 WeakPolarHBondContact O-CG1 3.4Å; V28-I32 PolarHBondContact O-N 3.01Å; F29-I32 PolarHBondContact O-N 3.34Å; I32-T36 WeakPolarHBondContact O-CB 3.37Å; I32-T36 PolarHBondContact O-N 3.46Å; I32-T36 PolarHBondContact O-OG1 2.89Å; I32-V87 HydrophobicContact CG1-CG2 4.29Å
33I87.8Confident80.2Confident87 Ų8766.6 Ų66.645%0.44633%0.334SS..Hα-helixtrans-61.7-49.1178.6-68.6166.6000109.8F29 F30 M35 T36 V37F29-I33 WeakPolarHBondContact O-CB 3.36Å; F29-I33 WeakPolarHBondContact O-CD1 3.28Å; F29-I33 WeakPolarHBondContact O-CG1 3.38Å; F29-I33 PolarHBondContact O-N 3.49Å; F30-I33 PolarHBondContact O-N 3.01Å; I33-M35 PolarHBondContact O-N 3.22Å; I33-T36 PolarHBondContact O-N 3.46Å; I33-V37 HydrophobicContact CG2-CG2 4.08Å; I33-V37 WeakPolarHBondContact O-CB 3.33Å; I33-V37 VanDerWaalsContact O-CG2 3.25Å; I33-V37 WeakPolarHBondContact O-CG2 3.35Å; I33-V37 PolarHBondContact O-N 3.47Å
34F87.1Confident81.8Confident25 Ų2563.8 Ų63.811%0.1132%0.323CS..Hα-helixtrans-66.1-39.7-176.1-75.617.8000111.7F30 G38 R288 W292 I295F30-F34 AromaticContact CD1-CE1 3.89Å; F30-F34 HydrophobicContact CD1-CE1 3.89Å; F30-F34 HydrophobicContact CD1-CZ 4.11Å; F30-F34 VanDerWaalsContact O-CB 3.31Å; F30-F34 WeakPolarHBondContact O-CB 3.25Å; F30-F34 VanDerWaalsContact O-CD1 3.31Å; F30-F34 WeakPolarHBondContact O-CD1 3.31Å; F30-F34 VanDerWaalsContact O-CG 3.29Å; F30-F34 WeakPolarHBondContact O-CG 3.42Å; F30-F34 PolarHBondContact O-N 3.4Å; F34-G38 PolarHBondContact O-N 3Å; F34-R288 HydrophobicContact CE2-CB 4.11Å; F34-R288 HydrophobicContact CE2-CG 4.27Å; F34-W292 HydrophobicContact CE1-CZ2 4.04Å; F34-W292 AromaticContact CE2-CD1 3.92Å; F34-W292 AromaticContact CE2-NE1 3.5Å; F34-W292 AromaticContact CZ-CE2 3.74Å; F34-W292 AromaticContact CZ-CZ2 3.96Å; F34-W292 HydrophobicContact CZ-CZ2 3.96Å; F34-W292 AromaticContact CZ-NE1 3.26Å; F34-W292 VanDerWaalsContact CZ-NE1 3.26Å; F34-I295 HydrophobicContact CB-CD1 4.34Å
35M89.3Confident83.2Confident38 Ų3856.8 Ų56.819%0.18729%0.293CS..Hα-helixtrans-60.1-51.1172.3178.5-172.271.700111.1S31 I33 G38 I39 G83 V87S31-M35 VanDerWaalsContact O-CB 3.3Å; S31-M35 WeakPolarHBondContact O-CB 3.47Å; S31-M35 PolarHBondContact O-N 3.47Å; I33-M35 PolarHBondContact O-N 3.22Å; M35-G38 PolarHBondContact O-N 2.93Å; M35-I39 HydrophobicContact CG-CD1 3.77Å; M35-I39 WeakPolarHBondContact O-CB 3.29Å; M35-I39 VanDerWaalsContact O-CG1 3.26Å; M35-I39 WeakPolarHBondContact O-CG1 3.5Å; M35-I39 PolarHBondContact O-N 3.39Å; M35-G83 VanDerWaalsContact SD-CA 3.52Å; M35-V87 HydrophobicContact CE-CG2 3.88Å; M35-V87 HydrophobicContact SD-CG2 3.95Å
36T90.9Very high84.6Confident61 Ų6151 Ų5137%0.37427%0.27SS..Hα-helixtrans-64.6-47.1-176-53.30000111.3I32 I33 G38 I39 L40I32-T36 WeakPolarHBondContact O-CB 3.37Å; I32-T36 PolarHBondContact O-N 3.46Å; I32-T36 PolarHBondContact O-OG1 2.89Å; I33-T36 PolarHBondContact O-N 3.46Å; T36-G38 VanDerWaalsContact C-N 3.34Å; T36-G38 PolarHBondContact O-N 2.9Å; T36-I39 PolarHBondContact O-N 3.38Å; T36-L40 HydrophobicContact CG2-CD1 4.02Å; T36-L40 WeakPolarHBondContact O-CB 3.37Å; T36-L40 VanDerWaalsContact O-CG 3.27Å; T36-L40 WeakPolarHBondContact O-CG 3.3Å; T36-L40 PolarHBondContact O-N 3.35Å
37V92.4Very high85.6Confident67 Ų6749.4 Ų49.441%0.40627%0.269SS..Hα-helixtrans-62.6-42.8176.9173.60000110.5I33 L40 S41 I295I33-V37 HydrophobicContact CG2-CG2 4.08Å; I33-V37 WeakPolarHBondContact O-CB 3.33Å; I33-V37 VanDerWaalsContact O-CG2 3.25Å; I33-V37 WeakPolarHBondContact O-CG2 3.35Å; I33-V37 PolarHBondContact O-N 3.47Å; V37-L40 PolarHBondContact O-N 2.91Å; V37-S41 WeakPolarHBondContact O-CB 3.26Å; V37-S41 PolarHBondContact O-N 2.76Å; V37-I295 HydrophobicContact CG1-CG2 3.8Å
38G91.5Very high86.3Confident0 Ų050.7 Ų50.70%028%0.275CS..Hα-helixtrans-61.8-44.3176.900000113.3F34 M35 T36 N42F34-G38 PolarHBondContact O-N 3Å; M35-G38 PolarHBondContact O-N 2.93Å; T36-G38 VanDerWaalsContact C-N 3.34Å; T36-G38 PolarHBondContact O-N 2.9Å; G38-N42 WeakPolarHBondContact O-CB 3.45Å; G38-N42 PolarHBondContact O-N 3.41Å; G38-N42 PolarHBondContact O-ND2 3.38Å
39I93.6Very high86.7Confident42 Ų4249.1 Ų49.122%0.21527%0.265CS..Hα-helixtrans-64-48.7176.7-69.2168.1000110.7M35 T36 S43 L76 H79 L80M35-I39 HydrophobicContact CG-CD1 3.77Å; M35-I39 WeakPolarHBondContact O-CB 3.29Å; M35-I39 VanDerWaalsContact O-CG1 3.26Å; M35-I39 WeakPolarHBondContact O-CG1 3.5Å; M35-I39 PolarHBondContact O-N 3.39Å; T36-I39 PolarHBondContact O-N 3.38Å; I39-S43 WeakPolarHBondContact O-CB 3.16Å; I39-S43 PolarHBondContact O-N 3Å; I39-S43 PolarHBondContact O-OG 3.47Å; I39-L76 HydrophobicContact CB-CD1 4.3Å; I39-L76 HydrophobicContact CG1-CD1 4.36Å; I39-L76 HydrophobicContact CG2-CD1 4.03Å; I39-H79 HydrophobicContact CG1-CB 3.91Å; I39-L80 HydrophobicContact CD1-CD1 4.3Å
40L92.4Very high86.6Confident114 Ų11447.4 Ų47.460%0.59726%0.26SS*.Hα-helixtrans-63.1-45.1179.8-70.2174.1000111.6T36 V37 L44T36-L40 HydrophobicContact CG2-CD1 4.02Å; T36-L40 WeakPolarHBondContact O-CB 3.37Å; T36-L40 VanDerWaalsContact O-CG 3.27Å; T36-L40 WeakPolarHBondContact O-CG 3.3Å; T36-L40 PolarHBondContact O-N 3.35Å; V37-L40 PolarHBondContact O-N 2.91Å; L40-L44 VanDerWaalsContact O-CB 3.3Å; L40-L44 WeakPolarHBondContact O-CB 3.36Å; L40-L44 PolarHBondContact O-N 3.5Å
41S89.9Confident86.5Confident7 Ų750.6 Ų50.65%0.04927%0.274CS..Hα-helixtrans-55.9-56.1176.9175.70000111.5V37 L44 A45 I295 W299V37-S41 WeakPolarHBondContact O-CB 3.26Å; V37-S41 PolarHBondContact O-N 2.76Å; S41-L44 PolarHBondContact O-N 3.42Å; S41-A45 WeakPolarHBondContact O-CB 3.39Å; S41-A45 PolarHBondContact O-N 2.84Å; S41-I295 PolarHBondContact OG-O 2.95Å; S41-W299 PolarHBondContact OG-NE1 2.82Å
42N91.8Very high86.2Confident0 Ų050.2 Ų50.20%027%0.272CS..Hα-helixtrans-69.9-35.6-176.6-76.1-71.9000112.2G38 L44 A45 I46 V72 L76 Q294G38-N42 WeakPolarHBondContact O-CB 3.45Å; G38-N42 PolarHBondContact O-N 3.41Å; G38-N42 PolarHBondContact O-ND2 3.38Å; N42-L44 PolarHBondContact O-N 2.97Å; N42-A45 WeakPolarHBondContact O-CB 3.47Å; N42-A45 PolarHBondContact O-N 2.99Å; N42-I46 WeakPolarHBondContact O-CG1 3.36Å; N42-I46 PolarHBondContact O-N 3.22Å; N42-V72 HydrophobicContact CB-CG1 3.85Å; N42-V72 WeakPolarHBondContact O-CG1 3.49Å; N42-V72 WeakPolarHBondContact OD1-CG1 3.44Å; N42-L76 HydrophobicContact CB-CB 3.97Å; N42-L76 HydrophobicContact CB-CD1 4.27Å; N42-Q294 PolarHBondContact ND2-O 2.93Å
43S90.8Very high85.6Confident50 Ų5052.1 Ų52.135%0.3528%0.276SS..Hα-helixtrans-62.8-43.7174.6-600000112I39 A45 I46 A47I39-S43 WeakPolarHBondContact O-CB 3.16Å; I39-S43 PolarHBondContact O-N 3Å; I39-S43 PolarHBondContact O-OG 3.47Å; S43-A45 VanDerWaalsContact C-N 3.34Å; S43-I46 PolarHBondContact O-N 3.45Å; S43-A47 PolarHBondContact O-N 3.28Å
44L87.9Confident84.7Confident83 Ų8354.9 Ų54.944%0.43529%0.287SS..Hα-helixtrans-64.8-39.9175.818051.9000111.3L40 S41 N42 A47 I48 W299L40-L44 VanDerWaalsContact O-CB 3.3Å; L40-L44 WeakPolarHBondContact O-CB 3.36Å; L40-L44 PolarHBondContact O-N 3.5Å; S41-L44 PolarHBondContact O-N 3.42Å; N42-L44 PolarHBondContact O-N 2.97Å; L44-A47 PolarHBondContact O-N 2.91Å; L44-I48 HydrophobicContact CD1-CD1 4.2Å; L44-I48 HydrophobicContact CD1-CG1 4.38Å; L44-I48 HydrophobicContact CG-CD1 4.16Å; L44-I48 WeakPolarHBondContact O-CG1 3.35Å; L44-I48 PolarHBondContact O-N 3.35Å; L44-W299 HydrophobicContact CD2-CH2 3.56Å; L44-W299 HydrophobicContact CD2-CZ2 4.09Å; L44-W299 HydrophobicContact CG-CH2 3.94Å
45A86.6Confident83.8Confident0 Ų062.6 Ų62.60%032%0.315CS..Hα-helixtrans-61.6-42.8175.100000112.7S41 N42 S43 A47 I48 L49 V72 P298 I302S41-A45 WeakPolarHBondContact O-CB 3.39Å; S41-A45 PolarHBondContact O-N 2.84Å; N42-A45 WeakPolarHBondContact O-CB 3.47Å; N42-A45 PolarHBondContact O-N 2.99Å; S43-A45 VanDerWaalsContact C-N 3.34Å; A45-A47 PolarHBondContact O-N 3.09Å; A45-I48 PolarHBondContact O-N 3.3Å; A45-L49 WeakPolarHBondContact O-CB 3.21Å; A45-L49 VanDerWaalsContact O-CG 3.3Å; A45-L49 WeakPolarHBondContact O-CG 3.27Å; A45-L49 PolarHBondContact O-N 3.24Å; A45-V72 HydrophobicContact CB-CG1 3.75Å; A45-V72 HydrophobicContact CB-CG2 4.25Å; A45-P298 HydrophobicContact CB-CB 3.33Å; A45-P298 HydrophobicContact CB-CG 4.2Å; A45-I302 HydrophobicContact CB-CD1 3.63Å
46I86.8Confident82.4Confident45 Ų4564.6 Ų64.623%0.23132%0.323CS..Hα-helixtrans-59.4-47173.3-68.3172.3000110.4N42 S43 I48 L49 M50 V72 I73 L76N42-I46 WeakPolarHBondContact O-CG1 3.36Å; N42-I46 PolarHBondContact O-N 3.22Å; S43-I46 PolarHBondContact O-N 3.45Å; I46-I48 VanDerWaalsContact C-N 3.29Å; I46-I48 PolarHBondContact O-N 2.88Å; I46-L49 PolarHBondContact O-N 2.94Å; I46-M50 HydrophobicContact CG2-CG 4.03Å; I46-M50 WeakPolarHBondContact O-CB 3.49Å; I46-M50 VanDerWaalsContact O-CG 3.26Å; I46-M50 WeakPolarHBondContact O-CG 3.34Å; I46-M50 PolarHBondContact O-N 2.82Å; I46-V72 HydrophobicContact CD1-CG1 4.21Å; I46-V72 HydrophobicContact CG1-CB 4.36Å; I46-V72 HydrophobicContact CG1-CG1 3.53Å; I46-I73 HydrophobicContact CD1-CG1 3.93Å; I46-I73 HydrophobicContact CG1-CG1 4.45Å; I46-L76 HydrophobicContact CD1-CD2 3.69Å
47A83.1Confident80.7Confident49 Ų4972.5 Ų72.541%0.40535%0.346SS..Hα-helixtrans-59.5-40.6179.500000112.2S43 L44 A45 K51S43-A47 PolarHBondContact O-N 3.28Å; L44-A47 PolarHBondContact O-N 2.91Å; A45-A47 PolarHBondContact O-N 3.09Å; A47-K51 WeakPolarHBondContact O-CG 3.3Å; A47-K51 PolarHBondContact O-N 3.11Å
48I81.7Confident78.9Confident31 Ų3175.9 Ų75.916%0.15936%0.357CS..Hα-helixtrans-67-46.4175.7-66.2167.1000110.8L44 A45 I46 M50 K51 A52 I302 V308L44-I48 HydrophobicContact CD1-CD1 4.2Å; L44-I48 HydrophobicContact CD1-CG1 4.38Å; L44-I48 HydrophobicContact CG-CD1 4.16Å; L44-I48 WeakPolarHBondContact O-CG1 3.35Å; L44-I48 PolarHBondContact O-N 3.35Å; A45-I48 PolarHBondContact O-N 3.3Å; I46-I48 VanDerWaalsContact C-N 3.29Å; I46-I48 PolarHBondContact O-N 2.88Å; I48-M50 PolarHBondContact O-N 3.39Å; I48-K51 PolarHBondContact O-N 3.19Å; I48-A52 WeakPolarHBondContact O-CB 3.3Å; I48-A52 PolarHBondContact O-N 3Å; I48-I302 HydrophobicContact CD1-CG2 4.28Å; I48-I302 HydrophobicContact CG2-CG2 3.96Å; I48-V308 HydrophobicContact CG2-CG1 4.19Å
49L79.4Confident77.1Confident10 Ų1085 Ų855%0.05240%0.397CS..Hα-helixtrans-62.9-40.6179.5-76.5169000111.9A45 I46 A52 Y53 L65 A68 V72 I302A45-L49 WeakPolarHBondContact O-CB 3.21Å; A45-L49 VanDerWaalsContact O-CG 3.3Å; A45-L49 WeakPolarHBondContact O-CG 3.27Å; A45-L49 PolarHBondContact O-N 3.24Å; I46-L49 PolarHBondContact O-N 2.94Å; L49-A52 CarbonylContact O-C 3.32Å; L49-A52 PolarHBondContact O-N 2.84Å; L49-Y53 VanDerWaalsContact O-CB 3.32Å; L49-Y53 WeakPolarHBondContact O-CB 3.38Å; L49-Y53 PolarHBondContact O-N 3.26Å; L49-L65 HydrophobicContact CD2-CD2 3.68Å; L49-A68 HydrophobicContact CD1-CB 4.41Å; L49-A68 HydrophobicContact CD2-CB 4.26Å; L49-V72 HydrophobicContact CD1-CB 4.44Å; L49-V72 HydrophobicContact CD1-CG2 4.02Å; L49-I302 HydrophobicContact CG-CD1 4.38Å
50M76.8Confident75.2Confident97 Ų9786.8 Ų86.848%0.47841%0.413SS..Hα-helixtrans-62.7-46.4176.8-75.3-63.4-69.600111.8I46 I48 A52 Y53 Q54I46-M50 HydrophobicContact CG2-CG 4.03Å; I46-M50 WeakPolarHBondContact O-CB 3.49Å; I46-M50 VanDerWaalsContact O-CG 3.26Å; I46-M50 WeakPolarHBondContact O-CG 3.34Å; I46-M50 PolarHBondContact O-N 2.82Å; I48-M50 PolarHBondContact O-N 3.39Å; M50-A52 VanDerWaalsContact C-N 3.32Å; M50-A52 PolarHBondContact O-N 3.07Å; M50-Y53 PolarHBondContact O-N 3.24Å; M50-Q54 WeakPolarHBondContact O-CG 3.26Å; M50-Q54 PolarHBondContact O-N 3.38Å
51K74.5Confident73.8Confident157 Ų15785.4 Ų85.468%0.68340%0.402SS*.Hα-helixtrans-62.6-39.9174-74.3-176.4178.2-178.60111.7A47 I48 R55A47-K51 WeakPolarHBondContact O-CG 3.3Å; A47-K51 PolarHBondContact O-N 3.11Å; I48-K51 PolarHBondContact O-N 3.19Å; K51-R55 WeakPolarHBondContact O-CB 3.31Å; K51-R55 PolarHBondContact O-N 2.89Å; K51-R55 VanDerWaalsContact O-N 3.12Å
52A72.5Confident72.8Confident23 Ų2385.6 Ų85.619%0.1940%0.404CS..Hα-helixtrans-66.2-39.2176.600000112I48 L49 M50 R55 F56 L65I48-A52 WeakPolarHBondContact O-CB 3.3Å; I48-A52 PolarHBondContact O-N 3Å; L49-A52 CarbonylContact O-C 3.32Å; L49-A52 PolarHBondContact O-N 2.84Å; M50-A52 VanDerWaalsContact C-N 3.32Å; M50-A52 PolarHBondContact O-N 3.07Å; A52-R55 PolarHBondContact O-N 2.76Å; A52-F56 HydrophobicContact CB-CD2 4.46Å; A52-F56 WeakPolarHBondContact O-CB 3.31Å; A52-F56 WeakPolarHBondContact O-CD2 3.38Å; A52-F56 PolarHBondContact O-N 3.45Å; A52-L65 HydrophobicContact CB-CD2 4.38Å
53Y70.3Confident72Confident108 Ų10885.7 Ų85.742%0.42441%0.405SS..Hα-helixtrans-63-45.2177.6-176.4-96.9000111.7L49 M50 R55 L66L49-Y53 VanDerWaalsContact O-CB 3.32Å; L49-Y53 WeakPolarHBondContact O-CB 3.38Å; L49-Y53 PolarHBondContact O-N 3.26Å; M50-Y53 PolarHBondContact O-N 3.24Å; Y53-R55 VanDerWaalsContact C-N 3.32Å; Y53-R55 PolarHBondContact O-N 3.49Å; Y53-L66 HydrophobicContact CE2-CD2 4.43Å
54Q70.3Confident71.4Confident145 Ų14583.9 Ų83.968%0.67839%0.391SS*.Hα-helixtrans-61.7-39.9175.3-70.7174.4-9.300112M50M50-Q54 WeakPolarHBondContact O-CG 3.26Å; M50-Q54 PolarHBondContact O-N 3.38Å
55R67Low71Confident188 Ų18880.3 Ų80.371%0.70937%0.372SS*.Hα-helixtrans-78.2-34.1-177.1-169.8174-171.4168.95.5114.2K51 A52 Y53K51-R55 WeakPolarHBondContact O-CB 3.31Å; K51-R55 PolarHBondContact O-N 2.89Å; K51-R55 VanDerWaalsContact O-N 3.12Å; A52-R55 PolarHBondContact O-N 2.76Å; Y53-R55 VanDerWaalsContact C-N 3.32Å; Y53-R55 PolarHBondContact O-N 3.49Å
56F59.5Low70.8Confident80 Ų8081.9 Ų81.935%0.35138%0.38SS..  trans-112.844.8-170.6-67.6-72.4000113.1A52 Q58A52-F56 HydrophobicContact CB-CD2 4.46Å; A52-F56 WeakPolarHBondContact O-CB 3.31Å; A52-F56 WeakPolarHBondContact O-CD2 3.38Å; A52-F56 PolarHBondContact O-N 3.45Å; F56-Q58 PolarHBondContact O-N 3.44Å
57R55.8Low70.8Confident227 Ų22779.8 Ų79.886%0.85737%0.37SS*.  trans-57.82177.7-156177.8179.1177.10.1115.1K59R57-K59 PolarHBondContact O-N 2.94Å
58Q54.2Low71.1Confident138 Ų13877.6 Ų77.665%0.64535%0.352SS*.SBendtrans-64.3127.1171.3-69.1-172.9-3.800110.8F56 S60 K61F56-Q58 PolarHBondContact O-N 3.44Å; Q58-S60 PolarHBondContact O-N 3.39Å; Q58-K61 PolarHBondContact O-N 3.19Å
59K54.7Low71.3Confident191 Ų19177.5 Ų77.583%0.8335%0.354SS*.Hα-helixtrans-52.3-30-167.7-69.5-175.1176.7177.40115.3R57 K61R57-K59 PolarHBondContact O-N 2.94Å; K59-K61 PolarHBondContact O-N 2.94Å
60S52.8Low71.9Confident79 Ų7977.4 Ų77.455%0.55236%0.355SS*.Hα-helixtrans-72.8-26-174.959.40000115Q58Q58-S60 PolarHBondContact O-N 3.39Å
61K63.4Low72.7Confident85 Ų8572.8 Ų72.837%0.3733%0.332SS..Hα-helixtrans-97.8-9179.9-67.7-179.7-179.1171.70113.3Q58 K59 L65Q58-K61 PolarHBondContact O-N 3.19Å; K59-K61 PolarHBondContact O-N 2.94Å; K61-L65 VanDerWaalsContact O-CG 3.27Å; K61-L65 WeakPolarHBondContact O-CG 3.34Å; K61-L65 PolarHBondContact O-N 3.2Å
62A69Low73.5Confident11 Ų1165.4 Ų65.49%0.09130%0.3CS..Hα-helixtrans-67.4-37.6-17600000112.5L65 L66A62-L65 PolarHBondContact O-N 3.47Å; A62-L66 WeakPolarHBondContact O-CB 3.26Å; A62-L66 VanDerWaalsContact O-CG 3.25Å; A62-L66 WeakPolarHBondContact O-CG 3.47Å; A62-L66 PolarHBondContact O-N 3.19Å
63S74.4Confident74.5Confident2 Ų267.9 Ų67.91%0.01431%0.31CS..Hα-helixtrans-62.4-51.9179.9-590000112.2L65 L66 L67S63-L65 PolarHBondContact O-N 3.37Å; S63-L66 PolarHBondContact O-N 3.47Å; S63-L67 PolarHBondContact O-N 3.15Å; S63-L67 VanDerWaalsContact O-N 3.14Å
64F78.3Confident75.7Confident12 Ų1263.3 Ų63.35%0.05329%0.293CS..Hα-helixtrans-58.8-45175.8174.5-104.1000112.3L66 L67 A68 R131F64-L66 VanDerWaalsContact C-N 3.32Å; F64-L66 PolarHBondContact O-N 2.9Å; F64-L67 PolarHBondContact O-N 3.31Å; F64-A68 HydrophobicContact CZ-CB 4.27Å; F64-A68 VanDerWaalsContact O-CB 3.31Å; F64-A68 WeakPolarHBondContact O-CB 3.49Å; F64-A68 PolarHBondContact O-N 2.97Å; F64-R131 VanDerWaalsContact CZ-NH2 3.33Å
65L79.1Confident76.9Confident8 Ų856.4 Ų56.44%0.04226%0.261CS..Hα-helixtrans-64.2-36.2179.7-72171.9000112.3L49 A52 K61 A62 S63 S69L49-L65 HydrophobicContact CD2-CD2 3.68Å; A52-L65 HydrophobicContact CB-CD2 4.38Å; K61-L65 VanDerWaalsContact O-CG 3.27Å; K61-L65 WeakPolarHBondContact O-CG 3.34Å; K61-L65 PolarHBondContact O-N 3.2Å; A62-L65 PolarHBondContact O-N 3.47Å; S63-L65 PolarHBondContact O-N 3.37Å; L65-S69 VanDerWaalsContact O-CB 3.3Å; L65-S69 WeakPolarHBondContact O-CB 3.27Å; L65-S69 PolarHBondContact O-N 3.26Å; L65-S69 PolarHBondContact O-OG 2.84Å
66L84.2Confident78.2Confident33 Ų3349 Ų4917%0.17324%0.235CC..Hα-helixtrans-67.4-45.1176.9-75.4170.6000112Y53 A62 S63 F64 S69 G70 V150Y53-L66 HydrophobicContact CE2-CD2 4.43Å; A62-L66 WeakPolarHBondContact O-CB 3.26Å; A62-L66 VanDerWaalsContact O-CG 3.25Å; A62-L66 WeakPolarHBondContact O-CG 3.47Å; A62-L66 PolarHBondContact O-N 3.19Å; S63-L66 PolarHBondContact O-N 3.47Å; F64-L66 VanDerWaalsContact C-N 3.32Å; F64-L66 PolarHBondContact O-N 2.9Å; L66-S69 PolarHBondContact O-N 3.48Å; L66-G70 PolarHBondContact O-N 2.9Å; L66-V150 HydrophobicContact CB-CG1 3.95Å; L66-V150 HydrophobicContact CD1-CG1 4.47Å
67L87Confident79.9Confident1 Ų150.2 Ų50.21%0.00524%0.241CC..Hα-helixtrans-64.4-45.3176.4-70.1171000111.7S63 F64 S69 G70 L71 V126 M127 E130 V150S63-L67 PolarHBondContact O-N 3.15Å; S63-L67 VanDerWaalsContact O-N 3.14Å; F64-L67 PolarHBondContact O-N 3.31Å; L67-S69 VanDerWaalsContact C-N 3.3Å; L67-S69 PolarHBondContact O-N 2.82Å; L67-G70 PolarHBondContact O-N 3.46Å; L67-L71 PolarHBondContact O-N 3.27Å; L67-V126 HydrophobicContact CD1-CG1 4.02Å; L67-V126 HydrophobicContact CD2-CG1 4.11Å; L67-M127 HydrophobicContact CB-CG 3.67Å; L67-M127 HydrophobicContact CB-SD 4.18Å; L67-M127 HydrophobicContact CD1-CG 4.08Å; L67-M127 HydrophobicContact CG-CG 4.45Å; L67-E130 HydrophobicContact CD1-CB 4.46Å; L67-E130 HydrophobicContact CD1-CG 4.5Å; L67-V150 HydrophobicContact CD1-CG1 4.39Å; L67-V150 HydrophobicContact CD2-CG1 3.93Å; L67-V150 HydrophobicContact CG-CG1 3.71Å
68A87.8Confident81.8Confident4 Ų439.5 Ų39.53%0.03320%0.2CC..Hα-helixtrans-61.7-38.5176.200000111.8L49 F64 L71 V72L49-A68 HydrophobicContact CD1-CB 4.41Å; L49-A68 HydrophobicContact CD2-CB 4.26Å; F64-A68 HydrophobicContact CZ-CB 4.27Å; F64-A68 VanDerWaalsContact O-CB 3.31Å; F64-A68 WeakPolarHBondContact O-CB 3.49Å; F64-A68 PolarHBondContact O-N 2.97Å; A68-L71 PolarHBondContact O-N 2.94Å; A68-V72 VanDerWaalsContact O-CG2 3.29Å; A68-V72 WeakPolarHBondContact O-CG2 3.32Å; A68-V72 PolarHBondContact O-N 3.5Å
69S87.4Confident83.7Confident28 Ų2833.4 Ų33.420%0.19617%0.172CC..Hα-helixtrans-65.7-42.8175.1-57.10000111.4L65 L66 L67 L71 V72 I73L65-S69 VanDerWaalsContact O-CB 3.3Å; L65-S69 WeakPolarHBondContact O-CB 3.27Å; L65-S69 PolarHBondContact O-N 3.26Å; L65-S69 PolarHBondContact O-OG 2.84Å; L66-S69 PolarHBondContact O-N 3.48Å; L67-S69 VanDerWaalsContact C-N 3.3Å; L67-S69 PolarHBondContact O-N 2.82Å; S69-L71 VanDerWaalsContact C-N 3.34Å; S69-L71 PolarHBondContact O-N 2.91Å; S69-V72 PolarHBondContact O-N 2.72Å; S69-I73 WeakPolarHBondContact O-CB 3.25Å; S69-I73 WeakPolarHBondContact O-CD1 3.41Å; S69-I73 WeakPolarHBondContact O-CG1 3.46Å; S69-I73 PolarHBondContact O-N 3.43Å
70G91.1Very high85.6Confident8 Ų828.5 Ų28.58%0.08215%0.154CC..Hα-helixtrans-60.4-41.517600000112.9L66 L67 T74L66-G70 PolarHBondContact O-N 2.9Å; L67-G70 PolarHBondContact O-N 3.46Å; G70-T74 WeakPolarHBondContact O-CB 3.14Å; G70-T74 PolarHBondContact O-N 3.06Å; G70-T74 PolarHBondContact O-OG1 2.85Å
71L92.9Very high87.6Confident0 Ų027.5 Ų27.50%014%0.142CC..Hα-helixtrans-59.8-57.2174.5-17878.2000111.4L67 A68 S69 I73 T74 D75 P120 L123 M127 D297 Y301L67-L71 PolarHBondContact O-N 3.27Å; A68-L71 PolarHBondContact O-N 2.94Å; S69-L71 VanDerWaalsContact C-N 3.34Å; S69-L71 PolarHBondContact O-N 2.91Å; L71-I73 VanDerWaalsContact C-N 3.28Å; L71-I73 PolarHBondContact O-N 3.47Å; L71-T74 CarbonylContact O-C 3.36Å; L71-T74 WeakPolarHBondContact O-CA 3.43Å; L71-T74 WeakPolarHBondContact O-CB 3.49Å; L71-T74 PolarHBondContact O-N 2.85Å; L71-D75 PolarHBondContact O-N 3.39Å; L71-P120 HydrophobicContact CD1-CB 3.77Å; L71-L123 HydrophobicContact CB-CD1 4.33Å; L71-L123 HydrophobicContact CD1-CB 3.88Å; L71-L123 HydrophobicContact CD1-CD1 4.31Å; L71-M127 HydrophobicContact CB-CE 4.36Å; L71-M127 HydrophobicContact CD1-CE 4.28Å; L71-M127 HydrophobicContact CD2-CE 3.56Å; L71-M127 HydrophobicContact CG-CE 4.28Å; L71-D297 HydrophobicContact CD2-CB 4.17Å; L71-D297 WeakPolarHBondContact CD2-OD2 3.32Å; L71-Y301 HydrophobicContact CD2-CD2 4.02Å; L71-Y301 HydrophobicContact CD2-CE2 3.49Å; L71-Y301 VanDerWaalsContact CD2-CE2 3.49Å
72V92.6Very high89Confident2 Ų224.3 Ų24.31%0.01213%0.129CC..Hα-helixtrans-62.8-35.4-176.3176.70000111.8N42 A45 I46 L49 A68 S69 L76 P298N42-V72 HydrophobicContact CB-CG1 3.85Å; N42-V72 WeakPolarHBondContact O-CG1 3.49Å; N42-V72 WeakPolarHBondContact OD1-CG1 3.44Å; A45-V72 HydrophobicContact CB-CG1 3.75Å; A45-V72 HydrophobicContact CB-CG2 4.25Å; I46-V72 HydrophobicContact CD1-CG1 4.21Å; I46-V72 HydrophobicContact CG1-CB 4.36Å; I46-V72 HydrophobicContact CG1-CG1 3.53Å; L49-V72 HydrophobicContact CD1-CB 4.44Å; L49-V72 HydrophobicContact CD1-CG2 4.02Å; A68-V72 VanDerWaalsContact O-CG2 3.29Å; A68-V72 WeakPolarHBondContact O-CG2 3.32Å; A68-V72 PolarHBondContact O-N 3.5Å; S69-V72 PolarHBondContact O-N 2.72Å; V72-L76 VanDerWaalsContact O-CB 3.29Å; V72-L76 WeakPolarHBondContact O-CB 3.15Å; V72-L76 PolarHBondContact O-N 3.5Å; V72-P298 HydrophobicContact CG2-CB 3.97Å
73I93.7Very high90.1Very high75 Ų7524.2 Ų24.239%0.38513%0.129SC..Hα-helixtrans-63.9-44.4172.6-71.4166.7000110.4I46 S69 L71 L76 F77I46-I73 HydrophobicContact CD1-CG1 3.93Å; I46-I73 HydrophobicContact CG1-CG1 4.45Å; S69-I73 WeakPolarHBondContact O-CB 3.25Å; S69-I73 WeakPolarHBondContact O-CD1 3.41Å; S69-I73 WeakPolarHBondContact O-CG1 3.46Å; S69-I73 PolarHBondContact O-N 3.43Å; L71-I73 VanDerWaalsContact C-N 3.28Å; L71-I73 PolarHBondContact O-N 3.47Å; I73-L76 PolarHBondContact O-N 3.37Å; I73-F77 HydrophobicContact CG2-CD2 3.68Å; I73-F77 HydrophobicContact CG2-CE2 3.63Å; I73-F77 WeakPolarHBondContact O-CD2 3.34Å; I73-F77 PolarHBondContact O-N 3.49Å
74T95.1Very high90.9Very high12 Ų1226.7 Ų26.77%0.07415%0.15CC..Hα-helixtrans-62.2-45.4177.9-57.40000111G70 L71 F77 G78 F115 F116 C119 P120G70-T74 WeakPolarHBondContact O-CB 3.14Å; G70-T74 PolarHBondContact O-N 3.06Å; G70-T74 PolarHBondContact O-OG1 2.85Å; L71-T74 CarbonylContact O-C 3.36Å; L71-T74 WeakPolarHBondContact O-CA 3.43Å; L71-T74 WeakPolarHBondContact O-CB 3.49Å; L71-T74 PolarHBondContact O-N 2.85Å; T74-F77 PolarHBondContact O-N 3.3Å; T74-G78 PolarHBondContact O-N 3.32Å; T74-F115 HydrophobicContact CG2-CE1 4.37Å; T74-F116 HydrophobicContact CG2-CD1 3.81Å; T74-F116 HydrophobicContact CG2-CE1 4.18Å; T74-F116 WeakPolarHBondContact O-CD1 3.47Å; T74-F116 VanDerWaalsContact O-CE1 3.27Å; T74-F116 WeakPolarHBondContact O-CE1 3.4Å; T74-C119 HydrophobicContact CG2-CB 4Å; T74-P120 HydrophobicContact CG2-CG 4.04Å
75D94.8Very high91.6Very high0 Ų027.2 Ų27.20%015%0.153CC..Hα-helixtrans-64.6-40.4177.6-66.7-23.2000111.8L71 G78 H79 P120 Q294L71-D75 PolarHBondContact O-N 3.39Å; D75-G78 PolarHBondContact O-N 3.5Å; D75-H79 PolarHBondContact O-CD2 2.96Å; D75-H79 PolarHBondContact O-N 3.15Å; D75-P120 WeakPolarHBondContact OD1-CG 3.42Å; D75-Q294 HydrophobicContact CB-CB 4.32Å
76L95.1Very high92.1Very high34 Ų3427.3 Ų27.318%0.17815%0.154CC..Hα-helixtrans-60.2-48.9175.3179.762.3000111.6I39 N42 I46 V72 I73 G78 H79 L80I39-L76 HydrophobicContact CB-CD1 4.3Å; I39-L76 HydrophobicContact CG1-CD1 4.36Å; I39-L76 HydrophobicContact CG2-CD1 4.03Å; N42-L76 HydrophobicContact CB-CB 3.97Å; N42-L76 HydrophobicContact CB-CD1 4.27Å; I46-L76 HydrophobicContact CD1-CD2 3.69Å; V72-L76 VanDerWaalsContact O-CB 3.29Å; V72-L76 WeakPolarHBondContact O-CB 3.15Å; V72-L76 PolarHBondContact O-N 3.5Å; I73-L76 PolarHBondContact O-N 3.37Å; L76-G78 VanDerWaalsContact C-N 3.27Å; L76-G78 PolarHBondContact O-N 3.31Å; L76-H79 PolarHBondContact O-N 2.87Å; L76-L80 WeakPolarHBondContact O-CB 3.27Å; L76-L80 PolarHBondContact O-N 3.07Å
77F95.6Very high92.3Very high105 Ų10528 Ų2846%0.46116%0.16SC..Hα-helixtrans-64.6-34.7175.7-81.1-65.9000111.8I73 T74 L80 I81 F116I73-F77 HydrophobicContact CG2-CD2 3.68Å; I73-F77 HydrophobicContact CG2-CE2 3.63Å; I73-F77 WeakPolarHBondContact O-CD2 3.34Å; I73-F77 PolarHBondContact O-N 3.49Å; T74-F77 PolarHBondContact O-N 3.3Å; F77-L80 PolarHBondContact O-N 3.34Å; F77-I81 HydrophobicContact CB-CD1 4.44Å; F77-I81 HydrophobicContact CD1-CD1 4.31Å; F77-I81 VanDerWaalsContact O-CB 3.31Å; F77-I81 WeakPolarHBondContact O-CB 3.42Å; F77-I81 WeakPolarHBondContact O-CG1 3.27Å; F77-I81 PolarHBondContact O-N 2.92Å; F77-F116 HydrophobicContact CB-CE1 3.63Å; F77-F116 HydrophobicContact CB-CZ 3.68Å
78G94.8Very high92.4Very high1 Ų132.7 Ų32.71%0.0118%0.181CC..Hα-helixtrans-58.9-51173.600000111.9T74 D75 L76 N82 F116T74-G78 PolarHBondContact O-N 3.32Å; D75-G78 PolarHBondContact O-N 3.5Å; L76-G78 VanDerWaalsContact C-N 3.27Å; L76-G78 PolarHBondContact O-N 3.31Å; G78-N82 WeakPolarHBondContact O-CB 3.38Å; G78-N82 PolarHBondContact O-N 2.9Å; G78-N82 PolarHBondContact O-ND2 3.49Å; G78-F116 VanDerWaalsContact CA-CD1 3.48Å
79H94.2Very high92.5Very high11 Ų1132.5 Ų32.55%0.05118%0.179CC..Hα-helixtrans-65.9-38.5176-71.7-61.3000112.9I39 D75 L76 G83I39-H79 HydrophobicContact CG1-CB 3.91Å; D75-H79 PolarHBondContact O-CD2 2.96Å; D75-H79 PolarHBondContact O-N 3.15Å; L76-H79 PolarHBondContact O-N 2.87Å; H79-G83 WeakPolarHBondContact O-CA 3.44Å; H79-G83 PolarHBondContact O-N 3.46Å
80L94.5Very high92.4Very high87 Ų8732.5 Ų32.546%0.45518%0.175SC..Hα-helixtrans-68.2-52.1-179.3-174.368.4000111.7I39 L76 F77 A84I39-L80 HydrophobicContact CD1-CD1 4.3Å; L76-L80 WeakPolarHBondContact O-CB 3.27Å; L76-L80 PolarHBondContact O-N 3.07Å; F77-L80 PolarHBondContact O-N 3.34Å; L80-A84 WeakPolarHBondContact O-CB 3.22Å; L80-A84 PolarHBondContact O-N 2.92Å
81I95.1Very high92.1Very high59 Ų5936 Ų3630%0.30320%0.203SC..Hα-helixtrans-74.5-55.1-174.7-62.3175.3000110.2F77 G83 A84 I85 C112 F116F77-I81 HydrophobicContact CB-CD1 4.44Å; F77-I81 HydrophobicContact CD1-CD1 4.31Å; F77-I81 VanDerWaalsContact O-CB 3.31Å; F77-I81 WeakPolarHBondContact O-CB 3.42Å; F77-I81 WeakPolarHBondContact O-CG1 3.27Å; F77-I81 PolarHBondContact O-N 2.92Å; I81-G83 VanDerWaalsContact C-N 3.3Å; I81-G83 PolarHBondContact O-N 3.33Å; I81-A84 PolarHBondContact O-N 3.1Å; I81-I85 HydrophobicContact CG2-CD1 3.96Å; I81-I85 VanDerWaalsContact O-CG1 3.29Å; I81-I85 WeakPolarHBondContact O-CG1 3.34Å; I81-I85 PolarHBondContact O-N 3.44Å; I81-C112 HydrophobicContact CG2-CB 4.32Å; I81-F116 HydrophobicContact CB-CE2 4.22Å; I81-F116 HydrophobicContact CD1-CE2 4.06Å; I81-F116 HydrophobicContact CD1-CZ 3.94Å
82N93.5Very high91.9Very high18 Ų1837.8 Ų37.810%0.09622%0.215CC..Hα-helixtrans-65.9-37-179.7-64.3-28.4000111G78 A86 F109 C112 M113G78-N82 WeakPolarHBondContact O-CB 3.38Å; G78-N82 PolarHBondContact O-N 2.9Å; G78-N82 PolarHBondContact O-ND2 3.49Å; N82-A86 WeakPolarHBondContact O-CB 3.2Å; N82-A86 PolarHBondContact O-N 2.88Å; N82-F109 HydrophobicContact CB-CE2 3.88Å; N82-C112 WeakPolarHBondContact OD1-CB 3.33Å; N82-M113 HydrophobicContact CB-SD 4.18Å
83G90.9Very high91.5Very high8 Ų843.9 Ų43.98%0.08225%0.248CC..Hα-helixtrans-67-45.5177.200000112.8M35 H79 I81 I85 A86 V87M35-G83 VanDerWaalsContact SD-CA 3.52Å; H79-G83 WeakPolarHBondContact O-CA 3.44Å; H79-G83 PolarHBondContact O-N 3.46Å; I81-G83 VanDerWaalsContact C-N 3.3Å; I81-G83 PolarHBondContact O-N 3.33Å; G83-I85 PolarHBondContact O-N 3.43Å; G83-A86 PolarHBondContact O-N 3.25Å; G83-V87 WeakPolarHBondContact O-CB 3.36Å; G83-V87 VanDerWaalsContact O-CG2 3.3Å; G83-V87 WeakPolarHBondContact O-CG2 3.12Å; G83-V87 PolarHBondContact O-N 3.17Å
84A91.7Very high91.1Very high55 Ų5541.8 Ų41.846%0.45524%0.236SC..Hα-helixtrans-61.8-44.7176.900000111.9L80 I81 V87 F88L80-A84 WeakPolarHBondContact O-CB 3.22Å; L80-A84 PolarHBondContact O-N 2.92Å; I81-A84 PolarHBondContact O-N 3.1Å; A84-V87 PolarHBondContact O-N 3.38Å; A84-F88 WeakPolarHBondContact O-CB 3.4Å; A84-F88 PolarHBondContact O-N 2.91Å
85I91.9Very high90.5Very high23 Ų2344.3 Ų44.312%0.11825%0.249CC..Hα-helixtrans-63.8-44.4176.5-62.2167.9000110.3I81 G83 V87 F88 V89 L105 F109I81-I85 HydrophobicContact CG2-CD1 3.96Å; I81-I85 VanDerWaalsContact O-CG1 3.29Å; I81-I85 WeakPolarHBondContact O-CG1 3.34Å; I81-I85 PolarHBondContact O-N 3.44Å; G83-I85 PolarHBondContact O-N 3.43Å; I85-V87 PolarHBondContact O-N 2.98Å; I85-F88 WeakPolarHBondContact O-CB 3.4Å; I85-F88 PolarHBondContact O-N 3.49Å; I85-V89 HydrophobicContact CG2-CG2 4.47Å; I85-V89 WeakPolarHBondContact O-CG2 3.37Å; I85-V89 PolarHBondContact O-N 3.43Å; I85-L105 HydrophobicContact CG2-CD1 4.47Å; I85-F109 HydrophobicContact CB-CD2 4.34Å; I85-F109 HydrophobicContact CB-CG 4.37Å; I85-F109 HydrophobicContact CD1-CB 4.33Å; I85-F109 HydrophobicContact CD1-CD2 4.33Å; I85-F109 HydrophobicContact CD1-CG 4.46Å; I85-F109 HydrophobicContact CG2-CB 4.01Å; I85-F109 HydrophobicContact CG2-CD1 3.55Å; I85-F109 HydrophobicContact CG2-CD2 4.13Å; I85-F109 HydrophobicContact CG2-CE1 3.92Å; I85-F109 HydrophobicContact CG2-CE2 4.5Å; I85-F109 HydrophobicContact CG2-CG 3.66Å; I85-F109 HydrophobicContact CG2-CZ 4.4Å
86A89.9Confident90.1Very high9 Ų944.7 Ų44.77%0.07425%0.251CS..Hα-helixtrans-60.4-46.6177.600000111.8N82 G83 F88 V89 Y90 F109N82-A86 WeakPolarHBondContact O-CB 3.2Å; N82-A86 PolarHBondContact O-N 2.88Å; G83-A86 PolarHBondContact O-N 3.25Å; A86-F88 VanDerWaalsContact C-N 3.33Å; A86-F88 PolarHBondContact O-N 2.77Å; A86-V89 PolarHBondContact O-N 3.43Å; A86-Y90 HydrophobicContact CB-CE2 4.48Å; A86-Y90 WeakPolarHBondContact O-CD2 3.27Å; A86-Y90 PolarHBondContact O-N 2.69Å; A86-F109 HydrophobicContact CB-CZ 4.19Å
87V88.5Confident89.5Confident49 Ų4949.2 Ų49.230%0.29727%0.274SS..Hα-helixtrans-61.1-41.9176.91700000111I32 M35 G83 A84 I85 V89 Y90 A91I32-V87 HydrophobicContact CG1-CG2 4.29Å; M35-V87 HydrophobicContact CE-CG2 3.88Å; M35-V87 HydrophobicContact SD-CG2 3.95Å; G83-V87 WeakPolarHBondContact O-CB 3.36Å; G83-V87 VanDerWaalsContact O-CG2 3.3Å; G83-V87 WeakPolarHBondContact O-CG2 3.12Å; G83-V87 PolarHBondContact O-N 3.17Å; A84-V87 PolarHBondContact O-N 3.38Å; I85-V87 PolarHBondContact O-N 2.98Å; V87-V89 PolarHBondContact O-N 3.14Å; V87-Y90 PolarHBondContact O-N 3.21Å; V87-A91 WeakPolarHBondContact O-CB 3.44Å; V87-A91 PolarHBondContact O-N 3.41Å
88F89.4Confident88.9Confident99 Ų9954.3 Ų54.343%0.43429%0.29SS..Hα-helixtrans-59.9-44.1174.7173.7-98.4000112.3A84 I85 A86 Y90 A91 S92 F99 L105A84-F88 WeakPolarHBondContact O-CB 3.4Å; A84-F88 PolarHBondContact O-N 2.91Å; I85-F88 WeakPolarHBondContact O-CB 3.4Å; I85-F88 PolarHBondContact O-N 3.49Å; A86-F88 VanDerWaalsContact C-N 3.33Å; A86-F88 PolarHBondContact O-N 2.77Å; F88-Y90 VanDerWaalsContact C-N 3.33Å; F88-Y90 PolarHBondContact O-N 3.16Å; F88-A91 PolarHBondContact O-N 2.89Å; F88-S92 WeakPolarHBondContact O-CB 3.31Å; F88-S92 PolarHBondContact O-N 2.94Å; F88-S92 PolarHBondContact O-OG 2.77Å; F88-F99 HydrophobicContact CE1-CB 4.18Å; F88-F99 HydrophobicContact CE1-CD1 4.25Å; F88-F99 AromaticContact CE1-CD2 3.85Å; F88-F99 HydrophobicContact CE1-CD2 3.85Å; F88-F99 HydrophobicContact CE1-CE2 4.29Å; F88-F99 AromaticContact CE1-CG 3.83Å; F88-F99 HydrophobicContact CE1-CG 3.83Å; F88-F99 HydrophobicContact CZ-CB 4.21Å; F88-F99 HydrophobicContact CZ-CG 4.28Å; F88-L105 HydrophobicContact CD1-CD2 4.08Å; F88-L105 HydrophobicContact CE1-CD2 3.88Å
89V89.3Confident88.4Confident0 Ų056.5 Ų56.50%030%0.299CS..Hα-helixtrans-61.9-41.6175.7170.80000111I85 A86 V87 S92 K94 W96 F99 R181I85-V89 HydrophobicContact CG2-CG2 4.47Å; I85-V89 WeakPolarHBondContact O-CG2 3.37Å; I85-V89 PolarHBondContact O-N 3.43Å; A86-V89 PolarHBondContact O-N 3.43Å; V87-V89 PolarHBondContact O-N 3.14Å; V89-S92 CarbonylContact O-C 3.24Å; V89-S92 PolarHBondContact O-N 3.44Å; V89-K94 HydrophobicContact CG1-CB 4.41Å; V89-K94 HydrophobicContact CG1-CG 4.39Å; V89-K94 WeakPolarHBondContact O-CA 3.25Å; V89-K94 PolarHBondContact O-N 3.45Å; V89-W96 HydrophobicContact CB-CZ2 4.33Å; V89-W96 HydrophobicContact CG1-CZ2 3.69Å; V89-W96 HydrophobicContact CG2-CH2 3.69Å; V89-W96 HydrophobicContact CG2-CZ2 3.62Å; V89-W96 HydrophobicContact CG2-CZ3 4.44Å; V89-F99 HydrophobicContact CG1-CZ 4.49Å; V89-F99 HydrophobicContact CG2-CE2 4.25Å; V89-F99 HydrophobicContact CG2-CZ 4.05Å; V89-R181 WeakPolarHBondContact CG1-O 3.33Å
90Y85.4Confident88Confident28 Ų2856.8 Ų56.811%0.1130%0.301CS..Hα-helixtrans-67.8-41.5176.6-76.6-65.2000112.9S27 V28 A86 V87 F88 S92 D93 T182S27-Y90 PolarHBondContact OG-OH 3.07Å; V28-Y90 HydrophobicContact CB-CD1 4.44Å; V28-Y90 HydrophobicContact CG2-CD1 3.36Å; V28-Y90 HydrophobicContact CG2-CE1 3.69Å; V28-Y90 HydrophobicContact CG2-CG 3.91Å; A86-Y90 HydrophobicContact CB-CE2 4.48Å; A86-Y90 WeakPolarHBondContact O-CD2 3.27Å; A86-Y90 PolarHBondContact O-N 2.69Å; V87-Y90 PolarHBondContact O-N 3.21Å; F88-Y90 VanDerWaalsContact C-N 3.33Å; F88-Y90 PolarHBondContact O-N 3.16Å; Y90-S92 PolarHBondContact O-N 3.43Å; Y90-D93 PolarHBondContact O-N 3.03Å; Y90-D93 VanDerWaalsContact O-N 3.16Å; Y90-T182 HydrophobicContact CD1-CG2 4.36Å; Y90-T182 HydrophobicContact CE1-CG2 3.43Å; Y90-T182 VanDerWaalsContact CE1-CG2 3.43Å; Y90-T182 HydrophobicContact CE2-CG2 4.42Å; Y90-T182 VanDerWaalsContact CZ-CG2 3.46Å; Y90-T182 VanDerWaalsContact OH-CG2 3.29Å; Y90-T182 WeakPolarHBondContact OH-CG2 3.32Å
91A86.3Confident87.1Confident81 Ų8161 Ų6167%0.66932%0.318SS*.Hα-helixtrans-64.9-24176.300000112.4V87 F88 D93V87-A91 WeakPolarHBondContact O-CB 3.44Å; V87-A91 PolarHBondContact O-N 3.41Å; F88-A91 PolarHBondContact O-N 2.89Å; A91-D93 VanDerWaalsContact C-N 3.33Å
92S86.8Confident86.4Confident37 Ų3762.7 Ų62.726%0.25934%0.336SS..THydrogen-bonded Turntrans-94.321.9176.2-52.80000113F88 V89 Y90 K94 D95F88-S92 WeakPolarHBondContact O-CB 3.31Å; F88-S92 PolarHBondContact O-N 2.94Å; F88-S92 PolarHBondContact O-OG 2.77Å; V89-S92 CarbonylContact O-C 3.24Å; V89-S92 PolarHBondContact O-N 3.44Å; Y90-S92 PolarHBondContact O-N 3.43Å; S92-K94 PolarHBondContact O-N 3.35Å; S92-D95 PolarHBondContact O-N 3.45Å
93D85.1Confident86Confident130 Ų13064.1 Ų64.170%0.69534%0.343SS*.THydrogen-bonded Turntrans54.622.6-179.9-74.4-53.3000115.2Y90 A91 D95Y90-D93 PolarHBondContact O-N 3.03Å; Y90-D93 VanDerWaalsContact O-N 3.16Å; A91-D93 VanDerWaalsContact C-N 3.33Å; D93-D95 PolarHBondContact O-N 3.24Å
94K84.4Confident85.9Confident32 Ų3269 Ų6914%0.13937%0.366CS..THydrogen-bonded Turntrans59.725.9-173-43.4176.5-174-174.40113.1V89 S92 W96 S180 R181 T182V89-K94 HydrophobicContact CG1-CB 4.41Å; V89-K94 HydrophobicContact CG1-CG 4.39Å; V89-K94 WeakPolarHBondContact O-CA 3.25Å; V89-K94 PolarHBondContact O-N 3.45Å; S92-K94 PolarHBondContact O-N 3.35Å; K94-W96 VanDerWaalsContact C-N 3.34Å; K94-W96 PolarHBondContact O-N 3.2Å; K94-S180 PolarHBondContact NZ-O 2.97Å; K94-R181 HydrophobicContact CB-CB 4.07Å; K94-R181 HydrophobicContact CD-CB 4.29Å; K94-T182 HydrophobicContact CD-CG2 3.93Å; K94-T182 VanDerWaalsContact CE-CG2 3.44Å
95D83.9Confident85.9Confident65 Ų6568.5 Ų68.535%0.34836%0.356SS..  trans-84.575.7178.5-171.114.7000112.2S92 D93 I97 R98 F99S92-D95 PolarHBondContact O-N 3.45Å; D93-D95 PolarHBondContact O-N 3.24Å; D95-I97 PolarHBondContact O-N 3Å; D95-I97 PolarHBondContact OD1-N 3.4Å; D95-R98 PolarHBondContact O-N 3.42Å; D95-R98 VanDerWaalsContact O-N 3.14Å; D95-F99 VanDerWaalsContact C-CE1 3.43Å; D95-F99 WeakPolarHBondContact O-CD1 3.4Å; D95-F99 WeakPolarHBondContact O-CE1 3.44Å
96W86.3Confident86Confident7 Ų767.4 Ų67.43%0.02735%0.35CS..Hα-helixtrans-57.3-21.1-179.6-69.187.4000114.3V89 K94 R98 F99 N100 C106 F109 I177 R181 C184V89-W96 HydrophobicContact CB-CZ2 4.33Å; V89-W96 HydrophobicContact CG1-CZ2 3.69Å; V89-W96 HydrophobicContact CG2-CH2 3.69Å; V89-W96 HydrophobicContact CG2-CZ2 3.62Å; V89-W96 HydrophobicContact CG2-CZ3 4.44Å; K94-W96 VanDerWaalsContact C-N 3.34Å; K94-W96 PolarHBondContact O-N 3.2Å; W96-R98 VanDerWaalsContact C-N 3.27Å; W96-R98 PolarHBondContact O-N 2.85Å; W96-F99 HydrophobicContact CB-CZ 4.35Å; W96-F99 AromaticContact CD2-CE2 3.85Å; W96-F99 HydrophobicContact CD2-CE2 3.85Å; W96-F99 AromaticContact CD2-CZ 3.77Å; W96-F99 HydrophobicContact CD2-CZ 3.77Å; W96-F99 AromaticContact CE3-CE2 3.47Å; W96-F99 HydrophobicContact CE3-CE2 3.47Å; W96-F99 VanDerWaalsContact CE3-CE2 3.47Å; W96-F99 AromaticContact CE3-CZ 3.91Å; W96-F99 HydrophobicContact CE3-CZ 3.91Å; W96-F99 HydrophobicContact CG-CE2 4.38Å; W96-F99 AromaticContact CG-CZ 3.99Å; W96-F99 HydrophobicContact CG-CZ 3.99Å; W96-F99 AromaticContact CZ3-CE2 3.84Å; W96-F99 HydrophobicContact CZ3-CE2 3.84Å; W96-F99 HydrophobicContact CZ3-CZ 4.45Å; W96-N100 HydrophobicContact CE3-CB 3.88Å; W96-N100 VanDerWaalsContact O-CB 3.3Å; W96-N100 WeakPolarHBondContact O-CB 3.21Å; W96-N100 PolarHBondContact O-N 2.96Å; W96-C106 HydrophobicContact CE3-CB 4.45Å; W96-C106 HydrophobicContact CZ3-CB 3.9Å; W96-F109 HydrophobicContact CH2-CD1 4.18Å; W96-I177 HydrophobicContact CB-CD1 3.62Å; W96-I177 HydrophobicContact CD2-CD1 3.59Å; W96-I177 HydrophobicContact CD2-CG1 3.84Å; W96-I177 HydrophobicContact CD2-CG2 4.27Å; W96-I177 HydrophobicContact CE3-CD1 3.79Å; W96-I177 HydrophobicContact CE3-CG1 3.94Å; W96-I177 HydrophobicContact CG-CD1 3.51Å; W96-I177 HydrophobicContact CG-CG1 4.2Å; W96-I177 HydrophobicContact CG-CG2 4.32Å; W96-I177 HydrophobicContact CZ2-CG2 4.45Å; W96-I177 HydrophobicContact CZ3-CG1 4.39Å; W96-R181 PolarHBondContact NE1-O 2.77Å; W96-C184 WeakPolarHBondContact CH2-SG 3.41Å
97I83.1Confident86.2Confident129 Ų12968 Ų6866%0.66235%0.354SS*.Hα-helixtrans-66.2-34.8-179.5-60.3170.9000110.3D95D95-I97 PolarHBondContact O-N 3Å; D95-I97 PolarHBondContact OD1-N 3.4Å
98R82.1Confident86.5Confident212 Ų21268.7 Ų68.780%0.836%0.358SS*.Hα-helixtrans-76.4-35.1-173.7-168.6175.2179.8-172.3-0.1113.8D95 W96D95-R98 PolarHBondContact O-N 3.42Å; D95-R98 VanDerWaalsContact O-N 3.14Å; W96-R98 VanDerWaalsContact C-N 3.27Å; W96-R98 PolarHBondContact O-N 2.85Å
99F83.6Confident86.8Confident48 Ų4864.2 Ų64.221%0.21134%0.338CS..Hα-helixtrans-118.8-9.2-170.761.3-103.2000115F88 V89 D95 W96 L105F88-F99 HydrophobicContact CE1-CB 4.18Å; F88-F99 HydrophobicContact CE1-CD1 4.25Å; F88-F99 AromaticContact CE1-CD2 3.85Å; F88-F99 HydrophobicContact CE1-CD2 3.85Å; F88-F99 HydrophobicContact CE1-CE2 4.29Å; F88-F99 AromaticContact CE1-CG 3.83Å; F88-F99 HydrophobicContact CE1-CG 3.83Å; F88-F99 HydrophobicContact CZ-CB 4.21Å; F88-F99 HydrophobicContact CZ-CG 4.28Å; V89-F99 HydrophobicContact CG1-CZ 4.49Å; V89-F99 HydrophobicContact CG2-CE2 4.25Å; V89-F99 HydrophobicContact CG2-CZ 4.05Å; D95-F99 VanDerWaalsContact C-CE1 3.43Å; D95-F99 WeakPolarHBondContact O-CD1 3.4Å; D95-F99 WeakPolarHBondContact O-CE1 3.44Å; W96-F99 HydrophobicContact CB-CZ 4.35Å; W96-F99 AromaticContact CD2-CE2 3.85Å; W96-F99 HydrophobicContact CD2-CE2 3.85Å; W96-F99 AromaticContact CD2-CZ 3.77Å; W96-F99 HydrophobicContact CD2-CZ 3.77Å; W96-F99 AromaticContact CE3-CE2 3.47Å; W96-F99 HydrophobicContact CE3-CE2 3.47Å; W96-F99 VanDerWaalsContact CE3-CE2 3.47Å; W96-F99 AromaticContact CE3-CZ 3.91Å; W96-F99 HydrophobicContact CE3-CZ 3.91Å; W96-F99 HydrophobicContact CG-CE2 4.38Å; W96-F99 AromaticContact CG-CZ 3.99Å; W96-F99 HydrophobicContact CG-CZ 3.99Å; W96-F99 AromaticContact CZ3-CE2 3.84Å; W96-F99 HydrophobicContact CZ3-CE2 3.84Å; W96-F99 HydrophobicContact CZ3-CZ 4.45Å; F99-L105 HydrophobicContact CD2-CD2 3.42Å; F99-L105 VanDerWaalsContact CD2-CD2 3.42Å; F99-L105 HydrophobicContact CE2-CD2 3.57Å
100N85.8Confident87.1Confident17 Ų1764.2 Ų64.29%0.09134%0.338CS..  trans-119.138.2-177.4-169.353.3000112.7W96 S102 N103 I104 L105 C106W96-N100 HydrophobicContact CE3-CB 3.88Å; W96-N100 VanDerWaalsContact O-CB 3.3Å; W96-N100 WeakPolarHBondContact O-CB 3.21Å; W96-N100 PolarHBondContact O-N 2.96Å; N100-S102 VanDerWaalsContact C-N 3.29Å; N100-S102 PolarHBondContact O-N 3.48Å; N100-N103 PolarHBondContact ND2-OD1 3.36Å; N100-N103 PolarHBondContact O-N 2.99Å; N100-N103 VanDerWaalsContact O-N 3.12Å; N100-N103 VanDerWaalsContact OD1-C 3.29Å; N100-N103 VanDerWaalsContact OD1-CA 3.26Å; N100-N103 WeakPolarHBondContact OD1-CA 3.32Å; N100-I104 PolarHBondContact OD1-N 3Å; N100-L105 PolarHBondContact OD1-N 3.31Å; N100-L105 VanDerWaalsContact OD1-N 3.16Å; N100-C106 WeakPolarHBondContact ND2-CB 3.49Å; N100-C106 PolarHBondContact OD1-N 3.32Å
101Q76.4Confident87.6Confident175 Ų17564.5 Ų64.582%0.81834%0.341SS*.THydrogen-bonded Turntrans-57.5-37.8-179.3-75.3177.3-31.500113.4
102S79.3Confident88.1Confident95 Ų9561.6 Ų61.666%0.66432%0.316SS*.THydrogen-bonded Turntrans-91.76.2179.3-48.30000114.3N100 I104N100-S102 VanDerWaalsContact C-N 3.29Å; N100-S102 PolarHBondContact O-N 3.48Å; S102-I104 PolarHBondContact O-N 3.4Å
103N85.3Confident88.6Confident47 Ų4761.3 Ų61.325%0.25131%0.311SS..SBendtrans56.212.7-173.4-153.525.7000116.9N100 C106 S107 A174N100-N103 PolarHBondContact ND2-OD1 3.36Å; N100-N103 PolarHBondContact O-N 2.99Å; N100-N103 VanDerWaalsContact O-N 3.12Å; N100-N103 VanDerWaalsContact OD1-C 3.29Å; N100-N103 VanDerWaalsContact OD1-CA 3.26Å; N100-N103 WeakPolarHBondContact OD1-CA 3.32Å; N103-C106 WeakPolarHBondContact OD1-CB 3.38Å; N103-S107 WeakPolarHBondContact O-CB 3.44Å; N103-S107 PolarHBondContact O-N 3.47Å; N103-S107 PolarHBondContact O-OG 3.45Å; N103-A174 VanDerWaalsContact ND2-CB 3.35Å; N103-A174 WeakPolarHBondContact ND2-CB 3.37Å
104I89.9Confident89.2Confident110 Ų11055.1 Ų55.156%0.56428%0.278SS*.Hα-helixtrans-69.8-46.3-176.8-63.7168.5000110.3N100 S102 C106 S107 V108N100-I104 PolarHBondContact OD1-N 3Å; S102-I104 PolarHBondContact O-N 3.4Å; I104-C106 PolarHBondContact O-N 2.89Å; I104-S107 PolarHBondContact O-N 2.92Å; I104-V108 HydrophobicContact CG2-CG2 4.31Å; I104-V108 WeakPolarHBondContact O-CG2 3.36Å; I104-V108 PolarHBondContact O-N 2.84Å
105L91.9Very high89.8Confident46 Ų4655.3 Ų55.324%0.24128%0.278CS..Hα-helixtrans-65.2-42.3-175-171.771.6000111.2I85 F88 F99 N100 S107 V108 F109I85-L105 HydrophobicContact CG2-CD1 4.47Å; F88-L105 HydrophobicContact CD1-CD2 4.08Å; F88-L105 HydrophobicContact CE1-CD2 3.88Å; F99-L105 HydrophobicContact CD2-CD2 3.42Å; F99-L105 VanDerWaalsContact CD2-CD2 3.42Å; F99-L105 HydrophobicContact CE2-CD2 3.57Å; N100-L105 PolarHBondContact OD1-N 3.31Å; N100-L105 VanDerWaalsContact OD1-N 3.16Å; L105-S107 VanDerWaalsContact C-N 3.34Å; L105-V108 PolarHBondContact O-N 3.39Å; L105-F109 VanDerWaalsContact O-CB 3.31Å; L105-F109 WeakPolarHBondContact O-CB 3.45Å; L105-F109 PolarHBondContact O-N 3.16Å
106C93.3Very high90.4Very high0 Ų052.8 Ų52.80%026%0.264CS..Hα-helixtrans-66.4-37.8176.4-171.70000112.1W96 N100 N103 I104 F109 G110 I177 C184W96-C106 HydrophobicContact CE3-CB 4.45Å; W96-C106 HydrophobicContact CZ3-CB 3.9Å; N100-C106 WeakPolarHBondContact ND2-CB 3.49Å; N100-C106 PolarHBondContact OD1-N 3.32Å; N103-C106 WeakPolarHBondContact OD1-CB 3.38Å; I104-C106 PolarHBondContact O-N 2.89Å; C106-F109 PolarHBondContact O-N 2.96Å; C106-G110 PolarHBondContact O-N 2.94Å; C106-I177 HydrophobicContact CB-CG1 4.44Å; C106-C184 WeakPolarHBondContact CA-SG 3.45Å; C106-C184 HydrophobicContact CB-CB 4.09Å; C106-C184 WeakPolarHBondContact CB-SG 3.35Å; C106-C184 VanDerWaalsContact O-CB 3.24Å; C106-C184 WeakPolarHBondContact O-CB 3.36Å; C106-C184 WeakPolarHBondContact SG-CB 3.45Å; C106-C184 CovalentContact SG-SG 2.04Å; C106-C184 PolarHBondContact SG-SG 2.71Å
107S93.7Very high90.8Very high21 Ų2152.7 Ų52.715%0.14727%0.266CS..Hα-helixtrans-62.4-50.3174.6-60.80000111.5N103 I104 L105 F109 G110 I111N103-S107 WeakPolarHBondContact O-CB 3.44Å; N103-S107 PolarHBondContact O-N 3.47Å; N103-S107 PolarHBondContact O-OG 3.45Å; I104-S107 PolarHBondContact O-N 2.92Å; L105-S107 VanDerWaalsContact C-N 3.34Å; S107-F109 VanDerWaalsContact C-N 3.33Å; S107-F109 PolarHBondContact O-N 3.49Å; S107-G110 PolarHBondContact O-N 3.41Å; S107-I111 WeakPolarHBondContact O-CD1 3.44Å; S107-I111 WeakPolarHBondContact O-CG1 3.45Å; S107-I111 PolarHBondContact O-N 3.2Å
108V94.7Very high91.5Very high64 Ų6446.5 Ų46.539%0.38823%0.234SC..Hα-helixtrans-58.5-46.5176.2171.70000110.8I104 L105 G110 I111 C112I104-V108 HydrophobicContact CG2-CG2 4.31Å; I104-V108 WeakPolarHBondContact O-CG2 3.36Å; I104-V108 PolarHBondContact O-N 2.84Å; L105-V108 PolarHBondContact O-N 3.39Å; V108-G110 VanDerWaalsContact C-N 3.35Å; V108-G110 PolarHBondContact O-N 2.94Å; V108-I111 PolarHBondContact O-N 3.5Å; V108-C112 WeakPolarHBondContact O-CB 3.21Å; V108-C112 PolarHBondContact O-N 3.31Å; V108-C112 PolarHBondContact O-SG 3.42Å
109F95.4Very high92.2Very high4 Ų436.4 Ų36.42%0.01820%0.196CC..Hα-helixtrans-62.9-42.4179.6-168.2-170.5000111.8N82 I85 A86 W96 L105 C106 S107 C112 M113 W183 C184N82-F109 HydrophobicContact CB-CE2 3.88Å; I85-F109 HydrophobicContact CB-CD2 4.34Å; I85-F109 HydrophobicContact CB-CG 4.37Å; I85-F109 HydrophobicContact CD1-CB 4.33Å; I85-F109 HydrophobicContact CD1-CD2 4.33Å; I85-F109 HydrophobicContact CD1-CG 4.46Å; I85-F109 HydrophobicContact CG2-CB 4.01Å; I85-F109 HydrophobicContact CG2-CD1 3.55Å; I85-F109 HydrophobicContact CG2-CD2 4.13Å; I85-F109 HydrophobicContact CG2-CE1 3.92Å; I85-F109 HydrophobicContact CG2-CE2 4.5Å; I85-F109 HydrophobicContact CG2-CG 3.66Å; I85-F109 HydrophobicContact CG2-CZ 4.4Å; A86-F109 HydrophobicContact CB-CZ 4.19Å; W96-F109 HydrophobicContact CH2-CD1 4.18Å; L105-F109 VanDerWaalsContact O-CB 3.31Å; L105-F109 WeakPolarHBondContact O-CB 3.45Å; L105-F109 PolarHBondContact O-N 3.16Å; C106-F109 PolarHBondContact O-N 2.96Å; S107-F109 VanDerWaalsContact C-N 3.33Å; S107-F109 PolarHBondContact O-N 3.49Å; F109-C112 PolarHBondContact O-N 3.3Å; F109-M113 HydrophobicContact CD2-CG 3.77Å; F109-M113 HydrophobicContact CD2-SD 4.45Å; F109-M113 HydrophobicContact CE2-CG 3.7Å; F109-M113 HydrophobicContact CE2-SD 3.8Å; F109-M113 WeakPolarHBondContact O-CB 3.22Å; F109-M113 WeakPolarHBondContact O-CG 3.49Å; F109-M113 PolarHBondContact O-N 2.91Å; F109-W183 HydrophobicContact CE1-CB 4.14Å; F109-W183 HydrophobicContact CZ-CB 4.16Å; F109-C184 HydrophobicContact CB-CB 4.19Å; F109-C184 HydrophobicContact CD1-CB 4.25Å; F109-C184 HydrophobicContact CG-CB 4.42Å
110G96Very high92.8Very high0 Ų034.2 Ų34.20%019%0.187CC..Hα-helixtrans-62.5-44.7175.900000113.4C106 S107 V108 C112 M113 V114 Y175 C184C106-G110 PolarHBondContact O-N 2.94Å; S107-G110 PolarHBondContact O-N 3.41Å; V108-G110 VanDerWaalsContact C-N 3.35Å; V108-G110 PolarHBondContact O-N 2.94Å; G110-C112 VanDerWaalsContact C-N 3.34Å; G110-C112 PolarHBondContact O-N 3.01Å; G110-M113 PolarHBondContact O-N 3.49Å; G110-V114 WeakPolarHBondContact O-CG2 3.42Å; G110-V114 PolarHBondContact O-N 2.96Å; G110-Y175 VanDerWaalsContact C-CE1 3.48Å; G110-Y175 VanDerWaalsContact CA-CD1 3.46Å; G110-C184 WeakPolarHBondContact CA-O 3.3Å
111I96.9Very high93.3Very high34 Ų3433.9 Ų33.917%0.17419%0.185CC..Hα-helixtrans-57.7-48.6173.9-64159.9000109.9S107 V108 M113 V114 F115 A165 L166 I169 Y175S107-I111 WeakPolarHBondContact O-CD1 3.44Å; S107-I111 WeakPolarHBondContact O-CG1 3.45Å; S107-I111 PolarHBondContact O-N 3.2Å; V108-I111 PolarHBondContact O-N 3.5Å; I111-M113 PolarHBondContact O-N 3.38Å; I111-V114 PolarHBondContact O-N 3.43Å; I111-F115 WeakPolarHBondContact O-CB 3.32Å; I111-F115 PolarHBondContact O-N 3.29Å; I111-A165 HydrophobicContact CG2-CB 3.91Å; I111-L166 HydrophobicContact CD1-CD2 3.98Å; I111-L166 HydrophobicContact CG1-CD2 4.33Å; I111-L166 HydrophobicContact CG2-CD2 4.12Å; I111-I169 HydrophobicContact CD1-CD1 3.2Å; I111-I169 HydrophobicContact CG1-CD1 3.54Å; I111-Y175 HydrophobicContact CG1-CD2 4.3Å; I111-Y175 HydrophobicContact CG1-CE2 3.69Å
112C96.9Very high94.3Very high20 Ų2026.4 Ų26.414%0.13515%0.15CC..Hα-helixtrans-62.4-42.9179.7-67.90000111.7I81 N82 V108 F109 G110 V114 F115 F116I81-C112 HydrophobicContact CG2-CB 4.32Å; N82-C112 WeakPolarHBondContact OD1-CB 3.33Å; V108-C112 WeakPolarHBondContact O-CB 3.21Å; V108-C112 PolarHBondContact O-N 3.31Å; V108-C112 PolarHBondContact O-SG 3.42Å; F109-C112 PolarHBondContact O-N 3.3Å; G110-C112 VanDerWaalsContact C-N 3.34Å; G110-C112 PolarHBondContact O-N 3.01Å; C112-V114 VanDerWaalsContact C-N 3.35Å; C112-V114 PolarHBondContact O-N 3.4Å; C112-F115 PolarHBondContact O-N 3Å; C112-F116 HydrophobicContact CB-CD2 3.98Å; C112-F116 HydrophobicContact CB-CE2 4.02Å; C112-F116 WeakPolarHBondContact O-CB 3.29Å; C112-F116 WeakPolarHBondContact O-CD2 3.26Å; C112-F116 PolarHBondContact O-N 2.84Å
113M95.9Very high95Very high31 Ų3121.9 Ų21.915%0.15312%0.118CC..Hα-helixtrans-60.4-42.5176.7-72.9-70.6-77.900112.1N82 F109 G110 I111 G117 W183 F185 L287N82-M113 HydrophobicContact CB-SD 4.18Å; F109-M113 HydrophobicContact CD2-CG 3.77Å; F109-M113 HydrophobicContact CD2-SD 4.45Å; F109-M113 HydrophobicContact CE2-CG 3.7Å; F109-M113 HydrophobicContact CE2-SD 3.8Å; F109-M113 WeakPolarHBondContact O-CB 3.22Å; F109-M113 WeakPolarHBondContact O-CG 3.49Å; F109-M113 PolarHBondContact O-N 2.91Å; G110-M113 PolarHBondContact O-N 3.49Å; I111-M113 PolarHBondContact O-N 3.38Å; M113-G117 PolarHBondContact O-N 3.37Å; M113-W183 HydrophobicContact CE-CB 4.41Å; M113-W183 HydrophobicContact CE-CD2 4.46Å; M113-W183 HydrophobicContact CE-CE3 3.74Å; M113-W183 HydrophobicContact CE-CZ3 4.48Å; M113-F185 HydrophobicContact CB-CD2 4.22Å; M113-L287 HydrophobicContact CE-CD1 3.69Å; M113-L287 HydrophobicContact CE-CD2 4.06Å; M113-L287 HydrophobicContact CE-CG 4.45Å
114V97.4Very high95.4Very high0 Ų020.1 Ų20.10%011%0.11CC..Hα-helixtrans-68.3-47.1176.9172.50000111.4G110 I111 C112 G117 L118 A165 Y175 F185 Y186 F203G110-V114 WeakPolarHBondContact O-CG2 3.42Å; G110-V114 PolarHBondContact O-N 2.96Å; I111-V114 PolarHBondContact O-N 3.43Å; C112-V114 VanDerWaalsContact C-N 3.35Å; C112-V114 PolarHBondContact O-N 3.4Å; V114-G117 PolarHBondContact O-N 2.97Å; V114-L118 HydrophobicContact CG1-CD1 4.07Å; V114-L118 PolarHBondContact O-N 3.34Å; V114-A165 HydrophobicContact CB-CB 4.03Å; V114-A165 HydrophobicContact CG1-CB 3.81Å; V114-Y175 HydrophobicContact CG2-CE1 3.81Å; V114-F185 HydrophobicContact CG2-CD2 4.02Å; V114-F185 HydrophobicContact CG2-CE2 3.52Å; V114-F185 HydrophobicContact CG2-CZ 4.31Å; V114-Y186 WeakPolarHBondContact CG1-OH 3.39Å; V114-Y186 HydrophobicContact CG2-CD2 4.41Å; V114-Y186 HydrophobicContact CG2-CE1 4.29Å; V114-Y186 HydrophobicContact CG2-CE2 3.6Å; V114-F203 HydrophobicContact CG1-CD2 4.08Å; V114-F203 HydrophobicContact CG1-CE2 4.46Å
115F97.8Very high95.6Very high36 Ų3615.5 Ų15.516%0.1589%0.088CC..Hα-helixtrans-62.3-53-179.1171.1-104.1000112.1T74 I111 C112 G117 L118 C119 A161 V162 A165T74-F115 HydrophobicContact CG2-CE1 4.37Å; I111-F115 WeakPolarHBondContact O-CB 3.32Å; I111-F115 PolarHBondContact O-N 3.29Å; C112-F115 PolarHBondContact O-N 3Å; F115-G117 PolarHBondContact O-N 2.94Å; F115-L118 PolarHBondContact O-N 3.27Å; F115-C119 HydrophobicContact CD2-CB 4.3Å; F115-C119 HydrophobicContact CE2-CB 3.99Å; F115-C119 HydrophobicContact CZ-CB 4.23Å; F115-C119 WeakPolarHBondContact O-CB 3.49Å; F115-C119 PolarHBondContact O-N 2.9Å; F115-A161 HydrophobicContact CD2-CB 3.79Å; F115-A161 HydrophobicContact CE2-CB 4.03Å; F115-V162 HydrophobicContact CD2-CG2 3.68Å; F115-V162 HydrophobicContact CE2-CG2 3.62Å; F115-A165 HydrophobicContact CB-CB 4.13Å
116F96.5Very high95.7Very high12 Ų1214.4 Ų14.45%0.0538%0.083CC..Hα-helixtrans-71.4-10.4177.1-64.5-61.4000112.6T74 F77 G78 I81 C112 P120 Q294T74-F116 HydrophobicContact CG2-CD1 3.81Å; T74-F116 HydrophobicContact CG2-CE1 4.18Å; T74-F116 WeakPolarHBondContact O-CD1 3.47Å; T74-F116 VanDerWaalsContact O-CE1 3.27Å; T74-F116 WeakPolarHBondContact O-CE1 3.4Å; F77-F116 HydrophobicContact CB-CE1 3.63Å; F77-F116 HydrophobicContact CB-CZ 3.68Å; G78-F116 VanDerWaalsContact CA-CD1 3.48Å; I81-F116 HydrophobicContact CB-CE2 4.22Å; I81-F116 HydrophobicContact CD1-CE2 4.06Å; I81-F116 HydrophobicContact CD1-CZ 3.94Å; C112-F116 HydrophobicContact CB-CD2 3.98Å; C112-F116 HydrophobicContact CB-CE2 4.02Å; C112-F116 WeakPolarHBondContact O-CB 3.29Å; C112-F116 WeakPolarHBondContact O-CD2 3.26Å; C112-F116 PolarHBondContact O-N 2.84Å; F116-P120 WeakPolarHBondContact O-CD 3.4Å; F116-P120 VanDerWaalsContact O-CG 3.27Å; F116-P120 WeakPolarHBondContact O-CG 3.47Å; F116-Q294 PolarHBondContact O-NE2 3.29Å; F116-Q294 VanDerWaalsContact O-NE2 3.09Å
117G95.6Very high95.5Very high5 Ų514.4 Ų14.45%0.0528%0.083CC..Hα-helixtrans-79.2-56168.200000112.9M113 V114 F115 W259M113-G117 PolarHBondContact O-N 3.37Å; V114-G117 PolarHBondContact O-N 2.97Å; F115-G117 PolarHBondContact O-N 2.94Å; G117-W259 WeakPolarHBondContact O-CH2 3.49Å
118L97.4Very high95.4Very high0 Ų013.5 Ų13.50%08%0.077CC..Hα-helixtrans-81.4-36.5-173-70.3176.9000113.8V114 F115 L121 F122 I164 F203 L206V114-L118 HydrophobicContact CG1-CD1 4.07Å; V114-L118 PolarHBondContact O-N 3.34Å; F115-L118 PolarHBondContact O-N 3.27Å; L118-L121 WeakPolarHBondContact O-CB 3.39Å; L118-L121 PolarHBondContact O-N 3.41Å; L118-F122 HydrophobicContact CB-CD2 4.33Å; L118-F122 HydrophobicContact CB-CE2 3.85Å; L118-F122 HydrophobicContact CB-CZ 4.25Å; L118-F122 HydrophobicContact CD2-CZ 4.32Å; L118-F122 WeakPolarHBondContact O-CD2 3.32Å; L118-F122 WeakPolarHBondContact O-CG 3.34Å; L118-F122 PolarHBondContact O-N 3.41Å; L118-I164 HydrophobicContact CD1-CB 4.17Å; L118-I164 HydrophobicContact CD1-CG2 3.62Å; L118-F203 HydrophobicContact CD1-CD2 3.78Å; L118-F203 HydrophobicContact CD1-CE2 4.32Å; L118-F203 HydrophobicContact CD2-CD2 3.78Å; L118-F203 HydrophobicContact CD2-CE2 3.88Å; L118-F203 HydrophobicContact CD2-CG 4.44Å; L118-F203 HydrophobicContact CG-CD2 3.61Å; L118-F203 HydrophobicContact CG-CE2 3.66Å; L118-L206 HydrophobicContact CD2-CB 4.38Å
119C97.3Very high95.2Very high0 Ų012.9 Ų12.90%07%0.073CC..Hα-helixtrans-60.1-48.6-176-173.60000111.8T74 F115 L121 F122 L123 A161T74-C119 HydrophobicContact CG2-CB 4Å; F115-C119 HydrophobicContact CD2-CB 4.3Å; F115-C119 HydrophobicContact CE2-CB 3.99Å; F115-C119 HydrophobicContact CZ-CB 4.23Å; F115-C119 WeakPolarHBondContact O-CB 3.49Å; F115-C119 PolarHBondContact O-N 2.9Å; C119-L121 VanDerWaalsContact C-N 3.34Å; C119-L121 PolarHBondContact O-N 3.5Å; C119-F122 PolarHBondContact O-N 3.22Å; C119-L123 WeakPolarHBondContact O-CB 3.47Å; C119-L123 VanDerWaalsContact O-CG 3.31Å; C119-L123 WeakPolarHBondContact O-CG 3.5Å; C119-L123 PolarHBondContact O-N 3.17Å; C119-A161 HydrophobicContact CB-CB 3.84Å
120P95.3Very high94.8Very high2 Ų213.4 Ų13.41%0.0138%0.076CC..Hα-helixtrans-60.8-38.9175.3-2637.9000113.7L71 T74 D75 F116 L123 G124L71-P120 HydrophobicContact CD1-CB 3.77Å; T74-P120 HydrophobicContact CG2-CG 4.04Å; D75-P120 WeakPolarHBondContact OD1-CG 3.42Å; F116-P120 WeakPolarHBondContact O-CD 3.4Å; F116-P120 VanDerWaalsContact O-CG 3.27Å; F116-P120 WeakPolarHBondContact O-CG 3.47Å; P120-L123 PolarHBondContact O-N 3.09Å; P120-G124 PolarHBondContact O-N 3.34Å
121L96.2Very high94.2Very high9 Ų915 Ų155%0.0478%0.082CC..Hα-helixtrans-60.7-46.9175.9-75.9173.6000112.1L118 C119 G124 S125 A210 L211 W259 L263L118-L121 WeakPolarHBondContact O-CB 3.39Å; L118-L121 PolarHBondContact O-N 3.41Å; C119-L121 VanDerWaalsContact C-N 3.34Å; C119-L121 PolarHBondContact O-N 3.5Å; L121-G124 PolarHBondContact O-N 3.45Å; L121-S125 PolarHBondContact O-N 3.3Å; L121-A210 HydrophobicContact CB-CB 4.18Å; L121-L211 HydrophobicContact CD2-CD2 3.56Å; L121-L211 HydrophobicContact CD2-CG 3.81Å; L121-W259 HydrophobicContact CD1-CD2 4.03Å; L121-W259 HydrophobicContact CD1-CE3 3.85Å; L121-W259 HydrophobicContact CD1-CZ3 4.14Å; L121-W259 HydrophobicContact CD2-CB 4.23Å; L121-W259 HydrophobicContact CD2-CD2 3.68Å; L121-W259 HydrophobicContact CD2-CE3 4.36Å; L121-W259 HydrophobicContact CD2-CG 3.6Å; L121-W259 HydrophobicContact CG-CD2 3.96Å; L121-W259 HydrophobicContact CG-CE3 4.26Å; L121-W259 HydrophobicContact CG-CG 4.41Å; L121-W259 HydrophobicContact CG-CZ2 4.22Å; L121-L263 HydrophobicContact CD1-CD1 4.11Å; L121-L263 HydrophobicContact CD1-CD2 4.38Å
122F97.5Very high93.7Very high19 Ų1914.3 Ų14.38%0.0838%0.079CC..Hα-helixtrans-65.1-44.1176.7-64.5-33.1000111.7L118 C119 G124 S125 V126 V157 F160 A161 L206 A210L118-F122 HydrophobicContact CB-CD2 4.33Å; L118-F122 HydrophobicContact CB-CE2 3.85Å; L118-F122 HydrophobicContact CB-CZ 4.25Å; L118-F122 HydrophobicContact CD2-CZ 4.32Å; L118-F122 WeakPolarHBondContact O-CD2 3.32Å; L118-F122 WeakPolarHBondContact O-CG 3.34Å; L118-F122 PolarHBondContact O-N 3.41Å; C119-F122 PolarHBondContact O-N 3.22Å; F122-G124 VanDerWaalsContact C-N 3.31Å; F122-G124 PolarHBondContact O-N 3.34Å; F122-S125 PolarHBondContact O-N 3.45Å; F122-S125 PolarHBondContact O-OG 3.25Å; F122-V126 WeakPolarHBondContact O-CG2 3.43Å; F122-V126 PolarHBondContact O-N 2.92Å; F122-V157 HydrophobicContact CB-CG1 3.45Å; F122-V157 VanDerWaalsContact CB-CG1 3.45Å; F122-V157 HydrophobicContact CD2-CG1 4.33Å; F122-V157 HydrophobicContact CG-CG1 4.38Å; F122-F160 HydrophobicContact CD2-CD1 4.11Å; F122-F160 HydrophobicContact CE1-CE1 4.44Å; F122-F160 AromaticContact CE2-CD1 3.53Å; F122-F160 HydrophobicContact CE2-CD1 3.53Å; F122-F160 AromaticContact CE2-CE1 3.73Å; F122-F160 HydrophobicContact CE2-CE1 3.73Å; F122-F160 AromaticContact CZ-CD1 3.94Å; F122-F160 HydrophobicContact CZ-CD1 3.94Å; F122-F160 AromaticContact CZ-CE1 3.63Å; F122-F160 HydrophobicContact CZ-CE1 3.63Å; F122-A161 HydrophobicContact CD2-CB 4.39Å; F122-A161 HydrophobicContact CE2-CB 4.46Å; F122-L206 HydrophobicContact CE1-CB 4.13Å; F122-L206 HydrophobicContact CZ-CB 3.93Å; F122-L206 HydrophobicContact CZ-CD1 4.29Å; F122-L206 HydrophobicContact CZ-CG 4.5Å; F122-A210 HydrophobicContact CD1-CB 3.79Å; F122-A210 HydrophobicContact CE1-CB 4.14Å
123L94.3Very high93.2Very high0 Ų016.3 Ų16.30%09%0.089CC..Hα-helixtrans-60.9-41.3175.4-68.8176.5000111.6L71 C119 P120 S125 V126 M127 L154 V157L71-L123 HydrophobicContact CB-CD1 4.33Å; L71-L123 HydrophobicContact CD1-CB 3.88Å; L71-L123 HydrophobicContact CD1-CD1 4.31Å; C119-L123 WeakPolarHBondContact O-CB 3.47Å; C119-L123 VanDerWaalsContact O-CG 3.31Å; C119-L123 WeakPolarHBondContact O-CG 3.5Å; C119-L123 PolarHBondContact O-N 3.17Å; P120-L123 PolarHBondContact O-N 3.09Å; L123-S125 PolarHBondContact O-N 3.45Å; L123-V126 PolarHBondContact O-N 2.78Å; L123-M127 WeakPolarHBondContact O-CB 3.13Å; L123-M127 VanDerWaalsContact O-CG 3.27Å; L123-M127 WeakPolarHBondContact O-CG 3.47Å; L123-M127 PolarHBondContact O-N 3.49Å; L123-L154 HydrophobicContact CD1-CD1 4.18Å; L123-L154 HydrophobicContact CD2-CD1 3.52Å; L123-V157 HydrophobicContact CD2-CB 4.23Å; L123-V157 HydrophobicContact CD2-CG1 3.82Å; L123-V157 HydrophobicContact CG-CG1 3.98Å
124G93.2Very high92.4Very high9 Ų916 Ų169%0.0939%0.093CC..Hα-helixtrans-53.6-49.5171.200000112.6P120 L121 F122 M127 A128P120-G124 PolarHBondContact O-N 3.34Å; L121-G124 PolarHBondContact O-N 3.45Å; F122-G124 VanDerWaalsContact C-N 3.31Å; F122-G124 PolarHBondContact O-N 3.34Å; G124-M127 PolarHBondContact O-N 3.3Å; G124-A128 PolarHBondContact O-N 3.48Å
125S94.7Very high91.7Very high14 Ų1418.2 Ų18.210%0.09811%0.106CC..Hα-helixtrans-63.8-43.4178.276.80000112.6L121 F122 L123 M127 A128 V129 A210L121-S125 PolarHBondContact O-N 3.3Å; F122-S125 PolarHBondContact O-N 3.45Å; F122-S125 PolarHBondContact O-OG 3.25Å; L123-S125 PolarHBondContact O-N 3.45Å; S125-M127 PolarHBondContact O-N 2.86Å; S125-A128 PolarHBondContact O-N 3.48Å; S125-V129 WeakPolarHBondContact O-CG2 3.49Å; S125-V129 PolarHBondContact O-N 3.42Å; S125-A210 WeakPolarHBondContact CB-O 3.47Å
126V93.4Very high90.8Very high22 Ų2219.3 Ų19.313%0.13312%0.116CC..Hα-helixtrans-64.2-41.1177.8170.10000111L67 F122 L123 A128 V129 E130 M153 V157L67-V126 HydrophobicContact CD1-CG1 4.02Å; L67-V126 HydrophobicContact CD2-CG1 4.11Å; F122-V126 WeakPolarHBondContact O-CG2 3.43Å; F122-V126 PolarHBondContact O-N 2.92Å; L123-V126 PolarHBondContact O-N 2.78Å; V126-A128 VanDerWaalsContact C-N 3.34Å; V126-A128 PolarHBondContact O-N 2.86Å; V126-V129 PolarHBondContact O-N 3.45Å; V126-E130 WeakPolarHBondContact O-CB 2.99Å; V126-E130 PolarHBondContact O-N 2.99Å; V126-M153 HydrophobicContact CG1-CE 3.6Å; V126-M153 HydrophobicContact CG1-SD 4.47Å; V126-M153 HydrophobicContact CG2-CE 4.23Å; V126-V157 HydrophobicContact CG2-CG2 4.05Å
127M90.1Very high90Very high0 Ų025 Ų250%014%0.141CC..Hα-helixtrans-63.2-39174.7-73.8-173.2-64.300112.3L67 L71 L123 G124 S125 R131 Y301L67-M127 HydrophobicContact CB-CG 3.67Å; L67-M127 HydrophobicContact CB-SD 4.18Å; L67-M127 HydrophobicContact CD1-CG 4.08Å; L67-M127 HydrophobicContact CG-CG 4.45Å; L71-M127 HydrophobicContact CB-CE 4.36Å; L71-M127 HydrophobicContact CD1-CE 4.28Å; L71-M127 HydrophobicContact CD2-CE 3.56Å; L71-M127 HydrophobicContact CG-CE 4.28Å; L123-M127 WeakPolarHBondContact O-CB 3.13Å; L123-M127 VanDerWaalsContact O-CG 3.27Å; L123-M127 WeakPolarHBondContact O-CG 3.47Å; L123-M127 PolarHBondContact O-N 3.49Å; G124-M127 PolarHBondContact O-N 3.3Å; S125-M127 PolarHBondContact O-N 2.86Å; M127-R131 WeakPolarHBondContact O-CG 3.31Å; M127-R131 PolarHBondContact O-N 3.42Å; M127-R131 VanDerWaalsContact O-N 3.15Å; M127-Y301 HydrophobicContact CE-CE1 4.34Å; M127-Y301 HydrophobicContact CE-CE2 3.96Å; M127-Y301 WeakPolarHBondContact CE-OH 3.31Å
128A90.5Very high89.1Confident2 Ų228.3 Ų28.32%0.01716%0.162CC..Hα-helixtrans-67-42.6176.400000111.8G124 S125 V126 R131 C132 C217G124-A128 PolarHBondContact O-N 3.48Å; S125-A128 PolarHBondContact O-N 3.48Å; V126-A128 VanDerWaalsContact C-N 3.34Å; V126-A128 PolarHBondContact O-N 2.86Å; A128-R131 PolarHBondContact O-N 3.19Å; A128-C132 WeakPolarHBondContact O-CB 3.39Å; A128-C132 PolarHBondContact O-N 3Å; A128-C217 HydrophobicContact CB-CB 3.88Å
129V91.1Very high87.8Confident51 Ų5135 Ų3531%0.30920%0.196SC..Hα-helixtrans-62-45.2175171.60000110.9S125 V126 R131 C132 L133 I213S125-V129 WeakPolarHBondContact O-CG2 3.49Å; S125-V129 PolarHBondContact O-N 3.42Å; V126-V129 PolarHBondContact O-N 3.45Å; V129-R131 VanDerWaalsContact C-N 3.31Å; V129-R131 PolarHBondContact O-N 3.07Å; V129-C132 PolarHBondContact O-N 3.24Å; V129-L133 HydrophobicContact CG1-CD1 3.95Å; V129-L133 HydrophobicContact CG1-CG 4.31Å; V129-L133 WeakPolarHBondContact O-CG 3.34Å; V129-L133 PolarHBondContact O-N 3.44Å; V129-I213 HydrophobicContact CG2-CG2 3.82Å
130E86.6Confident86.3Confident15 Ų1539.6 Ų39.67%0.0722%0.216CC..Hα-helixtrans-56.2-46.1177.9-174.8-90.1154.600111.6L67 V126 L133 G134 H141 M145L67-E130 HydrophobicContact CD1-CB 4.46Å; L67-E130 HydrophobicContact CD1-CG 4.5Å; V126-E130 WeakPolarHBondContact O-CB 2.99Å; V126-E130 PolarHBondContact O-N 2.99Å; E130-L133 PolarHBondContact O-N 3.35Å; E130-G134 PolarHBondContact O-N 2.94Å; E130-H141 IonicContact OE1-CD2 3.93Å; E130-H141 IonicContact OE1-CE1 3.45Å; E130-H141 PolarHBondContact OE1-CE1 3.36Å; E130-H141 IonicContact OE1-NE2 2.76Å; E130-H141 PolarHBondContact OE1-NE2 3.07Å; E130-M145 HydrophobicContact CG-CE 4.1Å; E130-M145 HydrophobicContact CG-SD 3.57Å; E130-M145 VanDerWaalsContact CG-SD 3.57Å
131R83.6Confident85.1Confident35 Ų3540.7 Ų40.713%0.13222%0.221CC..Hα-helixtrans-65.6-43.1176.1-70.3174.4-175.3169.44112.9F64 M127 A128 V129 L133 G134 V135F64-R131 VanDerWaalsContact CZ-NH2 3.33Å; M127-R131 WeakPolarHBondContact O-CG 3.31Å; M127-R131 PolarHBondContact O-N 3.42Å; M127-R131 VanDerWaalsContact O-N 3.15Å; A128-R131 PolarHBondContact O-N 3.19Å; V129-R131 VanDerWaalsContact C-N 3.31Å; V129-R131 PolarHBondContact O-N 3.07Å; R131-L133 VanDerWaalsContact C-N 3.32Å; R131-L133 PolarHBondContact O-N 2.91Å; R131-G134 PolarHBondContact O-N 3.47Å; R131-V135 PolarHBondContact O-N 3.36Å
132C86.4Confident83.7Confident18 Ų1845 Ų4512%0.12225%0.252CS..Hα-helixtrans-60-44.7178.2-175.80000110.8A128 V129 V135 T136 C217 T221A128-C132 WeakPolarHBondContact O-CB 3.39Å; A128-C132 PolarHBondContact O-N 3Å; V129-C132 PolarHBondContact O-N 3.24Å; C132-V135 PolarHBondContact O-N 2.87Å; C132-T136 WeakPolarHBondContact O-CB 3.44Å; C132-T136 WeakPolarHBondContact O-CG2 3.39Å; C132-T136 PolarHBondContact O-N 2.9Å; C132-T136 PolarHBondContact O-OG1 3.26Å; C132-C217 HydrophobicContact CB-CB 3.99Å; C132-T221 VanDerWaalsContact CA-OG1 3.28Å; C132-T221 WeakPolarHBondContact CA-OG1 3.4Å
133L85.5Confident82.1Confident63 Ų6348.9 Ų48.933%0.3328%0.277SS..Hα-helixtrans-65.4-40.4175.1-68.3175.6000112.3V129 E130 R131 V135 K137V129-L133 HydrophobicContact CG1-CD1 3.95Å; V129-L133 HydrophobicContact CG1-CG 4.31Å; V129-L133 WeakPolarHBondContact O-CG 3.34Å; V129-L133 PolarHBondContact O-N 3.44Å; E130-L133 PolarHBondContact O-N 3.35Å; R131-L133 VanDerWaalsContact C-N 3.32Å; R131-L133 PolarHBondContact O-N 2.91Å; L133-V135 VanDerWaalsContact C-N 3.29Å; L133-V135 PolarHBondContact O-N 3.3Å; L133-K137 CarbonylContact O-C 3.6Å; L133-K137 VanDerWaalsContact O-C 3.29Å; L133-K137 WeakPolarHBondContact O-CA 3.4Å; L133-K137 PolarHBondContact O-N 2.99Å
134G80.8Confident80.8Confident23 Ų2354.9 Ų54.924%0.23730%0.303CS..Hα-helixtrans-61.1-35.4176.600000113.5E130 R131E130-G134 PolarHBondContact O-N 2.94Å; R131-G134 PolarHBondContact O-N 3.47Å
135V81.3Confident79.6Confident47 Ų4756.4 Ų56.429%0.28531%0.308SS..Hα-helixtrans-85-41.5179.2173.50000112.5R131 C132 L133 T221 T224 L225R131-V135 PolarHBondContact O-N 3.36Å; C132-V135 PolarHBondContact O-N 2.87Å; L133-V135 VanDerWaalsContact C-N 3.29Å; L133-V135 PolarHBondContact O-N 3.3Å; V135-T221 HydrophobicContact CB-CG2 4.2Å; V135-T221 HydrophobicContact CG1-CG2 4.49Å; V135-T221 HydrophobicContact CG2-CG2 3.8Å; V135-T224 HydrophobicContact CG1-CG2 3.78Å; V135-L225 HydrophobicContact CG1-CD2 4.32Å; V135-L225 HydrophobicContact CG1-CG 4.42Å
136T80.6Confident78.8Confident59 Ų5958.7 Ų58.736%0.36232%0.322SS..Hα-helixtrans-83.7-33.6-174.757.50000113.4C132 V220C132-T136 WeakPolarHBondContact O-CB 3.44Å; C132-T136 WeakPolarHBondContact O-CG2 3.39Å; C132-T136 PolarHBondContact O-N 2.9Å; C132-T136 PolarHBondContact O-OG1 3.26Å; T136-V220 HydrophobicContact CG2-CG1 4.24Å
137K78.8Confident78.2Confident132 Ų13260.2 Ų60.257%0.57433%0.333SS*.  trans-135.666.5-176.4-63.1-171.4-179-177.30111.3L133 I139 F140 H141L133-K137 CarbonylContact O-C 3.6Å; L133-K137 VanDerWaalsContact O-C 3.29Å; L133-K137 WeakPolarHBondContact O-CA 3.4Å; L133-K137 PolarHBondContact O-N 2.99Å; K137-I139 VanDerWaalsContact C-N 3.32Å; K137-I139 PolarHBondContact O-N 3.36Å; K137-F140 HydrophobicContact CB-CB 4.12Å; K137-F140 PolarHBondContact O-N 3.27Å; K137-H141 PolarHBondContact O-N 2.96Å
138P76.1Confident77.9Confident75 Ų7568.5 Ų68.549%0.48737%0.369SS..Hα-helixtrans-61.3-34.5-171.923.4-34.2000114H141 S142P138-H141 PolarHBondContact O-N 3.44Å; P138-S142 WeakPolarHBondContact O-CB 3.44Å; P138-S142 PolarHBondContact O-N 3.18Å
139I69.6Low77.7Confident140 Ų14072.8 Ų72.872%0.71839%0.389SS*.Hα-helixtrans-69.4-38.6-179.6-56.6174.1000111K137 T143K137-I139 VanDerWaalsContact C-N 3.32Å; K137-I139 PolarHBondContact O-N 3.36Å; I139-T143 WeakPolarHBondContact O-CG2 3.37Å; I139-T143 PolarHBondContact O-N 3.43Å; I139-T143 PolarHBondContact O-OG1 2.96Å
140F67.8Low77.4Confident96 Ų9670.5 Ų70.542%0.42138%0.375SS..Hα-helixtrans-71.1-39.5176.3-176.1-96.2000111.8K137 T143 K144K137-F140 HydrophobicContact CB-CB 4.12Å; K137-F140 PolarHBondContact O-N 3.27Å; F140-T143 PolarHBondContact O-N 3.47Å; F140-T143 PolarHBondContact O-OG1 3.23Å; F140-K144 HydrophobicContact CD2-CD 4.32Å; F140-K144 HydrophobicContact CD2-CG 4.39Å; F140-K144 HydrophobicContact CE1-CD 4.12Å; F140-K144 HydrophobicContact CE2-CD 3.58Å; F140-K144 HydrophobicContact CE2-CG 4.13Å; F140-K144 HydrophobicContact CZ-CD 3.47Å; F140-K144 VanDerWaalsContact CZ-CD 3.47Å; F140-K144 HydrophobicContact CZ-CG 4.23Å; F140-K144 WeakPolarHBondContact O-CB 3.46Å; F140-K144 PolarHBondContact O-N 2.92Å
141H69.4Low77.6Confident26 Ų2675.7 Ų75.712%0.1240%0.397CS..Hα-helixtrans-62.5-47.1176.3-179.9-86.9000111.8E130 K137 P138 T143 M145E130-H141 IonicContact OE1-CD2 3.93Å; E130-H141 IonicContact OE1-CE1 3.45Å; E130-H141 PolarHBondContact OE1-CE1 3.36Å; E130-H141 IonicContact OE1-NE2 2.76Å; E130-H141 PolarHBondContact OE1-NE2 3.07Å; K137-H141 PolarHBondContact O-N 2.96Å; P138-H141 PolarHBondContact O-N 3.44Å; H141-T143 VanDerWaalsContact C-N 3.31Å; H141-T143 PolarHBondContact O-N 2.9Å; H141-M145 WeakPolarHBondContact O-CB 3.23Å; H141-M145 PolarHBondContact O-N 3.28Å
142S66.3Low77.9Confident100 Ų10079.4 Ų79.470%0.69942%0.418SS*.Hα-helixtrans-63.1-34-179.9-170.50000113.5P138P138-S142 WeakPolarHBondContact O-CB 3.44Å; P138-S142 PolarHBondContact O-N 3.18Å
143T63.7Low78.2Confident99 Ų9982 Ų8261%0.60743%0.429SS*.Hα-helixtrans-88.8-34.1-176.248.70000113.7I139 F140 H141I139-T143 WeakPolarHBondContact O-CG2 3.37Å; I139-T143 PolarHBondContact O-N 3.43Å; I139-T143 PolarHBondContact O-OG1 2.96Å; F140-T143 PolarHBondContact O-N 3.47Å; F140-T143 PolarHBondContact O-OG1 3.23Å; H141-T143 VanDerWaalsContact C-N 3.31Å; H141-T143 PolarHBondContact O-N 2.9Å
144K66.6Low78.6Confident126 Ų12680.8 Ų80.855%0.54842%0.422SS..Hα-helixtrans-97.5-29.5-177.2-71.8-148.1-176.7-1790115.4F140 T146F140-K144 HydrophobicContact CD2-CD 4.32Å; F140-K144 HydrophobicContact CD2-CG 4.39Å; F140-K144 HydrophobicContact CE1-CD 4.12Å; F140-K144 HydrophobicContact CE2-CD 3.58Å; F140-K144 HydrophobicContact CE2-CG 4.13Å; F140-K144 HydrophobicContact CZ-CD 3.47Å; F140-K144 VanDerWaalsContact CZ-CD 3.47Å; F140-K144 HydrophobicContact CZ-CG 4.23Å; F140-K144 WeakPolarHBondContact O-CB 3.46Å; F140-K144 PolarHBondContact O-N 2.92Å; K144-T146 PolarHBondContact O-N 3.36Å
145M68.8Low79.2Confident42 Ų4283.4 Ų83.421%0.20743%0.434CS..  trans-83.185.5-175.2-70.3-142.690.600112.2E130 H141 V150 M153E130-M145 HydrophobicContact CG-CE 4.1Å; E130-M145 HydrophobicContact CG-SD 3.57Å; E130-M145 VanDerWaalsContact CG-SD 3.57Å; H141-M145 WeakPolarHBondContact O-CB 3.23Å; H141-M145 PolarHBondContact O-N 3.28Å; M145-V150 HydrophobicContact CE-CG2 3.87Å; M145-M153 HydrophobicContact CE-SD 4.39Å
146T78.5Confident79.9Confident62 Ų6286.7 Ų86.738%0.3845%0.447SS..  trans-90.8157.3169.677.20000111.3K144 K148 H149 V150K144-T146 PolarHBondContact O-N 3.36Å; T146-K148 PolarHBondContact O-N 3.38Å; T146-K148 VanDerWaalsContact O-N 3.11Å; T146-H149 PolarHBondContact O-N 3.2Å; T146-H149 VanDerWaalsContact O-N 3.07Å; T146-H149 PolarHBondContact OG1-ND1 3.41Å; T146-V150 PolarHBondContact O-N 2.95Å
147S79.5Confident80.7Confident53 Ų5384.9 Ų84.937%0.37144%0.436SS..Hα-helixtrans-59.1-25.4177.2-51.50000113.4K151S147-K151 VanDerWaalsContact O-CG 3.32Å; S147-K151 WeakPolarHBondContact O-CG 3.46Å; S147-K151 PolarHBondContact O-N 2.9Å; S147-K151 VanDerWaalsContact O-N 3.1Å
148K84.4Confident81.6Confident175 Ų17580.1 Ų80.176%0.76142%0.419SS*.Hα-helixtrans-66.1-46.8174.7-68.4-174.7178.8-178.50111.2T146 V150 K151 M152T146-K148 PolarHBondContact O-N 3.38Å; T146-K148 VanDerWaalsContact O-N 3.11Å; K148-V150 VanDerWaalsContact C-N 3.33Å; K148-V150 PolarHBondContact O-N 2.66Å; K148-K151 PolarHBondContact O-N 2.87Å; K148-M152 WeakPolarHBondContact O-CB 3.48Å; K148-M152 PolarHBondContact O-N 3.22Å
149H85.4Confident82.6Confident92 Ų9281.5 Ų81.543%0.42642%0.422SS..Hα-helixtrans-62-41.7177.9-68.189.5000111.6T146 M152 M153T146-H149 PolarHBondContact O-N 3.2Å; T146-H149 VanDerWaalsContact O-N 3.07Å; T146-H149 PolarHBondContact OG1-ND1 3.41Å; H149-M152 WeakPolarHBondContact O-CB 3.49Å; H149-M152 PolarHBondContact O-N 3.41Å; H149-M153 WeakPolarHBondContact O-CG 2.84Å; H149-M153 PolarHBondContact O-N 2.94Å
150V86.2Confident83.9Confident2 Ų279 Ų791%0.01241%0.406CS..Hα-helixtrans-64.2-43.6178.5177.80000111.8L66 L67 M145 T146 K148 M152 M153 L154L66-V150 HydrophobicContact CB-CG1 3.95Å; L66-V150 HydrophobicContact CD1-CG1 4.47Å; L67-V150 HydrophobicContact CD1-CG1 4.39Å; L67-V150 HydrophobicContact CD2-CG1 3.93Å; L67-V150 HydrophobicContact CG-CG1 3.71Å; M145-V150 HydrophobicContact CE-CG2 3.87Å; T146-V150 PolarHBondContact O-N 2.95Å; K148-V150 VanDerWaalsContact C-N 3.33Å; K148-V150 PolarHBondContact O-N 2.66Å; V150-M152 VanDerWaalsContact C-N 3.33Å; V150-M152 PolarHBondContact O-N 3.49Å; V150-M153 PolarHBondContact O-N 3.34Å; V150-L154 WeakPolarHBondContact O-CB 3.47Å; V150-L154 PolarHBondContact O-N 3.29Å
151K89.6Confident85.4Confident124 Ų12474.5 Ų74.554%0.53939%0.386SS..Hα-helixtrans-60.8-43.7174.3-74.1178.9-179.7-170.70111.3S147 K148 L154 T155S147-K151 VanDerWaalsContact O-CG 3.32Å; S147-K151 WeakPolarHBondContact O-CG 3.46Å; S147-K151 PolarHBondContact O-N 2.9Å; S147-K151 VanDerWaalsContact O-N 3.1Å; K148-K151 PolarHBondContact O-N 2.87Å; K151-L154 PolarHBondContact O-N 3.23Å; K151-T155 PolarHBondContact O-N 3.45Å; K151-T155 PolarHBondContact O-OG1 3.01Å; K151-T155 VanDerWaalsContact O-OG1 3.07Å
152M91.4Very high86.7Confident114 Ų11476 Ų7656%0.56240%0.397SS*.Hα-helixtrans-60.7-45.9175.8-172.6-177.275.900111.6K148 H149 V150 L154 T155 M156K148-M152 WeakPolarHBondContact O-CB 3.48Å; K148-M152 PolarHBondContact O-N 3.22Å; H149-M152 WeakPolarHBondContact O-CB 3.49Å; H149-M152 PolarHBondContact O-N 3.41Å; V150-M152 VanDerWaalsContact C-N 3.33Å; V150-M152 PolarHBondContact O-N 3.49Å; M152-L154 PolarHBondContact O-N 3.35Å; M152-T155 PolarHBondContact O-N 3.34Å; M152-M156 HydrophobicContact CG-CG 4.47Å; M152-M156 WeakPolarHBondContact O-CB 3.28Å; M152-M156 VanDerWaalsContact O-CG 3.26Å; M152-M156 WeakPolarHBondContact O-CG 3.47Å; M152-M156 PolarHBondContact O-N 3Å
153M91.6Very high88.2Confident73 Ų7375.7 Ų75.736%0.3639%0.387SS..Hα-helixtrans-60.3-45.8175.9-71.8-174.378.400112V126 M145 H149 V150 T155 M156 V157V126-M153 HydrophobicContact CG1-CE 3.6Å; V126-M153 HydrophobicContact CG1-SD 4.47Å; V126-M153 HydrophobicContact CG2-CE 4.23Å; M145-M153 HydrophobicContact CE-SD 4.39Å; H149-M153 WeakPolarHBondContact O-CG 2.84Å; H149-M153 PolarHBondContact O-N 2.94Å; V150-M153 PolarHBondContact O-N 3.34Å; M153-T155 PolarHBondContact O-N 3.26Å; M153-M156 PolarHBondContact O-N 2.77Å; M153-V157 WeakPolarHBondContact O-CB 3.41Å; M153-V157 WeakPolarHBondContact O-CG2 3.39Å; M153-V157 PolarHBondContact O-N 3.48Å
154L93.6Very high89.8Confident37 Ų3771.5 Ų71.519%0.19436%0.361CS..Hα-helixtrans-57.3-49.1175.917661000110.9L123 V150 K151 M152 M156 V157 C158L123-L154 HydrophobicContact CD1-CD1 4.18Å; L123-L154 HydrophobicContact CD2-CD1 3.52Å; V150-L154 WeakPolarHBondContact O-CB 3.47Å; V150-L154 PolarHBondContact O-N 3.29Å; K151-L154 PolarHBondContact O-N 3.23Å; M152-L154 PolarHBondContact O-N 3.35Å; L154-M156 PolarHBondContact O-N 2.79Å; L154-V157 PolarHBondContact O-N 3.16Å; L154-C158 PolarHBondContact O-N 2.89Å; L154-C158 PolarHBondContact O-SG 3.11Å
155T95Very high91.2Very high77 Ų7765.5 Ų65.547%0.47234%0.335SS..Hα-helixtrans-60.5-46.1177.2-60.30000111.8K151 M152 M153 V157 C158 L159K151-T155 PolarHBondContact O-N 3.45Å; K151-T155 PolarHBondContact O-OG1 3.01Å; K151-T155 VanDerWaalsContact O-OG1 3.07Å; M152-T155 PolarHBondContact O-N 3.34Å; M153-T155 PolarHBondContact O-N 3.26Å; T155-V157 PolarHBondContact O-N 3.37Å; T155-C158 PolarHBondContact O-N 2.88Å; T155-L159 HydrophobicContact CG2-CD1 3.83Å; T155-L159 HydrophobicContact CG2-CG 4.19Å; T155-L159 WeakPolarHBondContact O-CB 3.43Å; T155-L159 VanDerWaalsContact O-CG 3.26Å; T155-L159 WeakPolarHBondContact O-CG 3.28Å; T155-L159 PolarHBondContact O-N 2.99Å
156M95.9Very high92.5Very high117 Ų11766.5 Ų66.558%0.57634%0.341SS*.Hα-helixtrans-62.6-41.2179.3-71-60-67.100112.4M152 M153 L154 L159 F160M152-M156 HydrophobicContact CG-CG 4.47Å; M152-M156 WeakPolarHBondContact O-CB 3.28Å; M152-M156 VanDerWaalsContact O-CG 3.26Å; M152-M156 WeakPolarHBondContact O-CG 3.47Å; M152-M156 PolarHBondContact O-N 3Å; M153-M156 PolarHBondContact O-N 2.77Å; L154-M156 PolarHBondContact O-N 2.79Å; M156-L159 PolarHBondContact O-N 2.95Å; M156-F160 VanDerWaalsContact O-CB 3.27Å; M156-F160 WeakPolarHBondContact O-CB 3.35Å; M156-F160 PolarHBondContact O-N 3.01Å
157V97.2Very high93.3Very high20 Ų2065.8 Ų65.812%0.12133%0.334CS..Hα-helixtrans-62.7-47.3175.7167.40000110.9F122 L123 V126 M153 L154 T155 F160 A161F122-V157 HydrophobicContact CB-CG1 3.45Å; F122-V157 VanDerWaalsContact CB-CG1 3.45Å; F122-V157 HydrophobicContact CD2-CG1 4.33Å; F122-V157 HydrophobicContact CG-CG1 4.38Å; L123-V157 HydrophobicContact CD2-CB 4.23Å; L123-V157 HydrophobicContact CD2-CG1 3.82Å; L123-V157 HydrophobicContact CG-CG1 3.98Å; V126-V157 HydrophobicContact CG2-CG2 4.05Å; M153-V157 WeakPolarHBondContact O-CB 3.41Å; M153-V157 WeakPolarHBondContact O-CG2 3.39Å; M153-V157 PolarHBondContact O-N 3.48Å; L154-V157 PolarHBondContact O-N 3.16Å; T155-V157 PolarHBondContact O-N 3.37Å; V157-F160 PolarHBondContact O-N 2.99Å; V157-A161 WeakPolarHBondContact O-CB 3.21Å; V157-A161 PolarHBondContact O-N 3.38Å
158C96.8Very high93.8Very high33 Ų3363.4 Ų63.422%0.22332%0.318CS..Hα-helixtrans-61.6-46.1177.6-67.40000111.5L154 T155 F160 A161 V162L154-C158 PolarHBondContact O-N 2.89Å; L154-C158 PolarHBondContact O-SG 3.11Å; T155-C158 PolarHBondContact O-N 2.88Å; C158-F160 VanDerWaalsContact C-N 3.35Å; C158-F160 PolarHBondContact O-N 2.91Å; C158-A161 PolarHBondContact O-N 3.45Å; C158-V162 WeakPolarHBondContact O-CG2 3.25Å; C158-V162 PolarHBondContact O-N 3.41Å
159L97.5Very high94.1Very high104 Ų10458.1 Ų58.155%0.54530%0.297SS..Hα-helixtrans-62.3-41.6178.1-72.4176.3000111.9T155 M156 V162 L163T155-L159 HydrophobicContact CG2-CD1 3.83Å; T155-L159 HydrophobicContact CG2-CG 4.19Å; T155-L159 WeakPolarHBondContact O-CB 3.43Å; T155-L159 VanDerWaalsContact O-CG 3.26Å; T155-L159 WeakPolarHBondContact O-CG 3.28Å; T155-L159 PolarHBondContact O-N 2.99Å; M156-L159 PolarHBondContact O-N 2.95Å; L159-V162 PolarHBondContact O-N 3.39Å; L159-L163 WeakPolarHBondContact O-CB 3.31Å; L159-L163 PolarHBondContact O-N 2.71Å
160F97.8Very high94.3Very high88 Ų8859.2 Ų59.239%0.38631%0.305SS..Hα-helixtrans-63.1-45.3176-176.9-115.5000111.3F122 M156 V157 C158 V162 L163 I164 L206F122-F160 HydrophobicContact CD2-CD1 4.11Å; F122-F160 HydrophobicContact CE1-CE1 4.44Å; F122-F160 AromaticContact CE2-CD1 3.53Å; F122-F160 HydrophobicContact CE2-CD1 3.53Å; F122-F160 AromaticContact CE2-CE1 3.73Å; F122-F160 HydrophobicContact CE2-CE1 3.73Å; F122-F160 AromaticContact CZ-CD1 3.94Å; F122-F160 HydrophobicContact CZ-CD1 3.94Å; F122-F160 AromaticContact CZ-CE1 3.63Å; F122-F160 HydrophobicContact CZ-CE1 3.63Å; M156-F160 VanDerWaalsContact O-CB 3.27Å; M156-F160 WeakPolarHBondContact O-CB 3.35Å; M156-F160 PolarHBondContact O-N 3.01Å; V157-F160 PolarHBondContact O-N 2.99Å; C158-F160 VanDerWaalsContact C-N 3.35Å; C158-F160 PolarHBondContact O-N 2.91Å; F160-V162 VanDerWaalsContact C-N 3.35Å; F160-V162 PolarHBondContact O-N 3.45Å; F160-L163 WeakPolarHBondContact O-CB 3.25Å; F160-L163 PolarHBondContact O-N 2.68Å; F160-I164 HydrophobicContact CE1-CG1 4.39Å; F160-I164 HydrophobicContact CE2-CD1 4.13Å; F160-I164 HydrophobicContact CE2-CG1 4.3Å; F160-I164 HydrophobicContact CZ-CD1 4.1Å; F160-I164 HydrophobicContact CZ-CG1 4.18Å; F160-I164 WeakPolarHBondContact O-CG1 3.43Å; F160-I164 PolarHBondContact O-N 3.12Å; F160-I164 VanDerWaalsContact O-N 3.07Å; F160-L206 HydrophobicContact CE1-CD1 4.26Å; F160-L206 HydrophobicContact CE1-CD2 4.32Å; F160-L206 HydrophobicContact CZ-CD1 4.19Å; F160-L206 HydrophobicContact CZ-CD2 4.27Å
161A97.8Very high94.4Very high0 Ų065.8 Ų65.80%033%0.33CS..Hα-helixtrans-61.9-40.6175.600000112.5F115 C119 F122 V157 C158 I164 A165F115-A161 HydrophobicContact CD2-CB 3.79Å; F115-A161 HydrophobicContact CE2-CB 4.03Å; C119-A161 HydrophobicContact CB-CB 3.84Å; F122-A161 HydrophobicContact CD2-CB 4.39Å; F122-A161 HydrophobicContact CE2-CB 4.46Å; V157-A161 WeakPolarHBondContact O-CB 3.21Å; V157-A161 PolarHBondContact O-N 3.38Å; C158-A161 PolarHBondContact O-N 3.45Å; A161-I164 PolarHBondContact O-N 2.86Å; A161-A165 WeakPolarHBondContact O-CB 3.27Å; A161-A165 PolarHBondContact O-N 2.63Å
162V97.7Very high94.2Very high57 Ų5769.4 Ų69.435%0.34535%0.346SS..Hα-helixtrans-62.5-44174.5168.60000111F115 C158 L159 F160 I164 A165 L166F115-V162 HydrophobicContact CD2-CG2 3.68Å; F115-V162 HydrophobicContact CE2-CG2 3.62Å; C158-V162 WeakPolarHBondContact O-CG2 3.25Å; C158-V162 PolarHBondContact O-N 3.41Å; L159-V162 PolarHBondContact O-N 3.39Å; F160-V162 VanDerWaalsContact C-N 3.35Å; F160-V162 PolarHBondContact O-N 3.45Å; V162-I164 VanDerWaalsContact C-N 3.34Å; V162-I164 PolarHBondContact O-N 2.94Å; V162-A165 PolarHBondContact O-N 3.05Å; V162-L166 HydrophobicContact CG1-CD1 3.63Å; V162-L166 HydrophobicContact CG1-CG 4.19Å; V162-L166 WeakPolarHBondContact O-CB 3.28Å; V162-L166 WeakPolarHBondContact O-CG 3.19Å; V162-L166 PolarHBondContact O-N 3.07Å
163L97.1Very high94Very high94 Ų9468.2 Ų68.249%0.49234%0.335SS..Hα-helixtrans-57.8-47.1177.8177.263.9000111.3L159 F160 A165 L166 L167L159-L163 WeakPolarHBondContact O-CB 3.31Å; L159-L163 PolarHBondContact O-N 2.71Å; F160-L163 WeakPolarHBondContact O-CB 3.25Å; F160-L163 PolarHBondContact O-N 2.68Å; L163-A165 VanDerWaalsContact C-N 3.34Å; L163-A165 PolarHBondContact O-N 3.28Å; L163-L166 PolarHBondContact O-N 3.32Å; L163-L167 WeakPolarHBondContact O-CB 3.07Å; L163-L167 PolarHBondContact O-N 2.93Å
164I97Very high93.8Very high11 Ų1166.9 Ų66.96%0.05634%0.336CS..Hα-helixtrans-64.3-39.4178-58.5-63.4000111.4L118 F160 A161 V162 L166 L202 L206L118-I164 HydrophobicContact CD1-CB 4.17Å; L118-I164 HydrophobicContact CD1-CG2 3.62Å; F160-I164 HydrophobicContact CE1-CG1 4.39Å; F160-I164 HydrophobicContact CE2-CD1 4.13Å; F160-I164 HydrophobicContact CE2-CG1 4.3Å; F160-I164 HydrophobicContact CZ-CD1 4.1Å; F160-I164 HydrophobicContact CZ-CG1 4.18Å; F160-I164 WeakPolarHBondContact O-CG1 3.43Å; F160-I164 PolarHBondContact O-N 3.12Å; F160-I164 VanDerWaalsContact O-N 3.07Å; A161-I164 PolarHBondContact O-N 2.86Å; V162-I164 VanDerWaalsContact C-N 3.34Å; V162-I164 PolarHBondContact O-N 2.94Å; I164-L166 VanDerWaalsContact C-N 3.34Å; I164-L166 PolarHBondContact O-N 3.47Å; I164-L202 HydrophobicContact CD1-CD2 3.97Å; I164-L202 HydrophobicContact CD1-CG 4.37Å; I164-L202 HydrophobicContact CG2-CD2 4.24Å; I164-L202 HydrophobicContact CG2-CG 4.45Å; I164-L206 HydrophobicContact CD1-CD1 3.92Å; I164-L206 HydrophobicContact CG1-CD1 4.04Å; I164-L206 HydrophobicContact CG2-CD1 4.42Å
165A96.8Very high93.8Very high0 Ų065.2 Ų65.20%033%0.327CS..Hα-helixtrans-69.7-26.8177.600000113.6I111 V114 F115 A161 V162 L163 Y175I111-A165 HydrophobicContact CG2-CB 3.91Å; V114-A165 HydrophobicContact CB-CB 4.03Å; V114-A165 HydrophobicContact CG1-CB 3.81Å; F115-A165 HydrophobicContact CB-CB 4.13Å; A161-A165 WeakPolarHBondContact O-CB 3.27Å; A161-A165 PolarHBondContact O-N 2.63Å; V162-A165 PolarHBondContact O-N 3.05Å; L163-A165 VanDerWaalsContact C-N 3.34Å; L163-A165 PolarHBondContact O-N 3.28Å; A165-Y175 PolarHBondContact O-OH 3.4Å
166L96.1Very high93.6Very high64 Ų6465.8 Ų65.834%0.33532%0.324SS..Hα-helixtrans-91.7-19.1178.1-67.9177.1000113.5I111 V162 L163 I164 I169 L170I111-L166 HydrophobicContact CD1-CD2 3.98Å; I111-L166 HydrophobicContact CG1-CD2 4.33Å; I111-L166 HydrophobicContact CG2-CD2 4.12Å; V162-L166 HydrophobicContact CG1-CD1 3.63Å; V162-L166 HydrophobicContact CG1-CG 4.19Å; V162-L166 WeakPolarHBondContact O-CB 3.28Å; V162-L166 WeakPolarHBondContact O-CG 3.19Å; V162-L166 PolarHBondContact O-N 3.07Å; L163-L166 PolarHBondContact O-N 3.32Å; I164-L166 VanDerWaalsContact C-N 3.34Å; I164-L166 PolarHBondContact O-N 3.47Å; L166-I169 PolarHBondContact O-N 2.99Å; L166-L170 HydrophobicContact CB-CD1 4.48Å; L166-L170 WeakPolarHBondContact O-CG 3.2Å; L166-L170 PolarHBondContact O-N 3.23Å; L166-L170 VanDerWaalsContact O-N 3.1Å
167L94.4Very high93.3Very high47 Ų4763 Ų6325%0.24631%0.311CS..Hα-helixtrans-49.5-42.9-175.1-165.866.5000114.9L163 I169 L170 R171 F198 Y199 L202L163-L167 WeakPolarHBondContact O-CB 3.07Å; L163-L167 PolarHBondContact O-N 2.93Å; L167-I169 PolarHBondContact O-N 3.09Å; L167-L170 PolarHBondContact O-N 2.87Å; L167-R171 PolarHBondContact O-N 2.98Å; L167-F198 HydrophobicContact CD2-CE1 4.19Å; L167-Y199 HydrophobicContact CB-CE1 4.29Å; L167-Y199 HydrophobicContact CD2-CD1 4.31Å; L167-Y199 HydrophobicContact CD2-CE1 3.82Å; L167-Y199 HydrophobicContact CG-CE1 3.85Å; L167-L202 HydrophobicContact CD2-CD2 3.8Å
168P91.5Very high93Very high3 Ų362.4 Ų62.42%0.01931%0.307CS..Hα-helixtrans-63.6-41.7179.1-16.328.2000112.2R171 F172 R173 Y175 Y186 Y199P168-R171 CarbonylContact O-C 3.56Å; P168-R171 WeakPolarHBondContact O-CA 3.34Å; P168-R171 PolarHBondContact O-N 3.29Å; P168-R171 VanDerWaalsContact O-N 3.09Å; P168-F172 PolarHBondContact O-N 2.64Å; P168-R173 CarbonylContact C-O 3.29Å; P168-R173 HydrophobicContact CB-CB 4.12Å; P168-R173 WeakPolarHBondContact O-CA 3.26Å; P168-R173 WeakPolarHBondContact O-CB 3.28Å; P168-R173 PolarHBondContact O-N 2.62Å; P168-Y175 HydrophobicContact CG-CE2 4.2Å; P168-Y186 HydrophobicContact CG-CD1 4.33Å; P168-Y186 HydrophobicContact CG-CE1 3.55Å; P168-Y199 HydrophobicContact CB-CD2 4.42Å; P168-Y199 HydrophobicContact CB-CE2 4.24Å; P168-Y199 HydrophobicContact CG-CD1 4.17Å; P168-Y199 HydrophobicContact CG-CE1 4.31Å; P168-Y199 HydrophobicContact CG-CG 4.3Å
169I89.8Confident92.3Very high63 Ų6361.7 Ų61.732%0.32330%0.303SS..Hα-helixtrans-70.7-38.1-176.2-60.9174.4000110.4I111 L166 L167 R171 F172 Y175I111-I169 HydrophobicContact CD1-CD1 3.2Å; I111-I169 HydrophobicContact CG1-CD1 3.54Å; L166-I169 PolarHBondContact O-N 2.99Å; L167-I169 PolarHBondContact O-N 3.09Å; I169-R171 PolarHBondContact O-N 3.07Å; I169-R171 VanDerWaalsContact O-N 3.17Å; I169-F172 PolarHBondContact O-N 3.3Å; I169-Y175 HydrophobicContact CD1-CD2 4.2Å; I169-Y175 HydrophobicContact CD1-CE2 4.05Å; I169-Y175 HydrophobicContact CG1-CD2 4.29Å; I169-Y175 HydrophobicContact CG1-CE2 4.14Å
170L89.8Confident91.6Very high115 Ų11557 Ų5760%0.60228%0.28SS*.Hα-helixtrans-60.7-22.7173.1-65.2176000112.7L166 L167L166-L170 HydrophobicContact CB-CD1 4.48Å; L166-L170 WeakPolarHBondContact O-CG 3.2Å; L166-L170 PolarHBondContact O-N 3.23Å; L166-L170 VanDerWaalsContact O-N 3.1Å; L167-L170 PolarHBondContact O-N 2.87Å
171R87.6Confident91.1Very high141 Ų14156.9 Ų56.953%0.53228%0.276SS..THydrogen-bonded Turntrans-102.818.1176.6-67.7-73.8-64.3177.11.2112.6L167 P168 I169 R173 E195 Y199L167-R171 PolarHBondContact O-N 2.98Å; P168-R171 CarbonylContact O-C 3.56Å; P168-R171 WeakPolarHBondContact O-CA 3.34Å; P168-R171 PolarHBondContact O-N 3.29Å; P168-R171 VanDerWaalsContact O-N 3.09Å; I169-R171 PolarHBondContact O-N 3.07Å; I169-R171 VanDerWaalsContact O-N 3.17Å; R171-R173 PolarHBondContact O-N 3.07Å; R171-E195 IonicContact CZ-OE1 3.84Å; R171-E195 IonicContact NE-OE1 3.78Å; R171-E195 IonicContact NH2-OE1 2.9Å; R171-E195 PolarHBondContact NH2-OE1 2.88Å; R171-Y199 WeakPolarHBondContact CB-OH 3.37Å; R171-Y199 WeakPolarHBondContact CG-OH 3.4Å
172F86Confident90.5Very high200 Ų20057.3 Ų57.388%0.87728%0.279SS*.THydrogen-bonded Turntrans5827.4-179.5-56-79.2000114.6P168 I169P168-F172 PolarHBondContact O-N 2.64Å; I169-F172 PolarHBondContact O-N 3.3Å
173R87.9Confident90.2Very high89 Ų8954.9 Ų54.934%0.33626%0.264SS..PPolyproline II helixtrans-99.7129.8171.8-64.2-63.3-174.3-176.65.1110.3P168 R171 E195 Y199P168-R173 CarbonylContact C-O 3.29Å; P168-R173 HydrophobicContact CB-CB 4.12Å; P168-R173 WeakPolarHBondContact O-CA 3.26Å; P168-R173 WeakPolarHBondContact O-CB 3.28Å; P168-R173 PolarHBondContact O-N 2.62Å; R171-R173 PolarHBondContact O-N 3.07Å; R173-E195 IonicContact CZ-OE2 3.91Å; R173-E195 VanDerWaalsContact CZ-OE2 3.26Å; R173-E195 IonicContact NE-OE2 2.86Å; R173-E195 PolarHBondContact NE-OE2 3.12Å; R173-E195 IonicContact NH2-OE2 3.45Å; R173-E195 PolarHBondContact NH2-OE2 2.88Å; R173-Y199 HydrophobicContact CB-CE2 4.43Å; R173-Y199 HydrophobicContact CG-CE2 4.24Å
174A86.7Confident90.1Very high45 Ų4550.4 Ų50.437%0.37224%0.24SC..PPolyproline II helixtrans-91.4144.1178.800000111.5N103N103-A174 VanDerWaalsContact ND2-CB 3.35Å; N103-A174 WeakPolarHBondContact ND2-CB 3.37Å
175Y92.9Very high89.9Confident1 Ų150 Ų500%0.00424%0.238CC..PPolyproline II helixtrans-63.7146.8163.4-73.8-89.3000110.3G110 I111 V114 A165 P168 I169 Y186G110-Y175 VanDerWaalsContact C-CE1 3.48Å; G110-Y175 VanDerWaalsContact CA-CD1 3.46Å; I111-Y175 HydrophobicContact CG1-CD2 4.3Å; I111-Y175 HydrophobicContact CG1-CE2 3.69Å; V114-Y175 HydrophobicContact CG2-CE1 3.81Å; A165-Y175 PolarHBondContact O-OH 3.4Å; P168-Y175 HydrophobicContact CG-CE2 4.2Å; I169-Y175 HydrophobicContact CD1-CD2 4.2Å; I169-Y175 HydrophobicContact CD1-CE2 4.05Å; I169-Y175 HydrophobicContact CG1-CD2 4.29Å; I169-Y175 HydrophobicContact CG1-CE2 4.14Å; Y175-Y186 HydrophobicContact CD1-CD1 4.41Å; Y175-Y186 AromaticContact CE1-CD1 3.88Å; Y175-Y186 HydrophobicContact CE1-CD1 3.88Å; Y175-Y186 AromaticContact CE1-CE1 3.71Å; Y175-Y186 HydrophobicContact CE1-CE1 3.71Å; Y175-Y186 AromaticContact CZ-CE1 3.97Å
176Q90.8Very high89.8Confident90 Ų9050.4 Ų50.442%0.42124%0.24SC..EExtended strand (participates in β ladder)trans-115.6144.9-174.6-66.6-67.3-6.700111.8Q178 C184 F185 K187Q176-Q178 PolarHBondContact O-NE2 2.92Å; Q176-Q178 VanDerWaalsContact O-NE2 3.12Å; Q176-C184 WeakPolarHBondContact O-CA 3.42Å; Q176-F185 PolarHBondContact N-O 3.21Å; Q176-F185 PolarHBondContact O-N 3.01Å; Q176-F185 VanDerWaalsContact O-N 3.12Å; Q176-K187 HydrophobicContact CG-CB 4.09Å; Q176-K187 HydrophobicContact CG-CG 4.34Å
177I90.8Very high89.4Confident57 Ų5750.2 Ų50.229%0.29224%0.236SC..EExtended strand (participates in β ladder)trans-70.1128.5172.4-57.7160.6000107.8W96 C106 R181W96-I177 HydrophobicContact CB-CD1 3.62Å; W96-I177 HydrophobicContact CD2-CD1 3.59Å; W96-I177 HydrophobicContact CD2-CG1 3.84Å; W96-I177 HydrophobicContact CD2-CG2 4.27Å; W96-I177 HydrophobicContact CE3-CD1 3.79Å; W96-I177 HydrophobicContact CE3-CG1 3.94Å; W96-I177 HydrophobicContact CG-CD1 3.51Å; W96-I177 HydrophobicContact CG-CG1 4.2Å; W96-I177 HydrophobicContact CG-CG2 4.32Å; W96-I177 HydrophobicContact CZ2-CG2 4.45Å; W96-I177 HydrophobicContact CZ3-CG1 4.39Å; C106-I177 HydrophobicContact CB-CG1 4.44Å; I177-R181 HydrophobicContact CG2-CB 4.21Å; I177-R181 HydrophobicContact CG2-CG 4.28Å
178Q90.4Very high89Confident9 Ų948.7 Ų48.74%0.04223%0.229CC..  trans-82.5163.7-177-55.9-67.2-52.300111.4Q176 S180 R181 W183 F185 Y186 T188Q176-Q178 PolarHBondContact O-NE2 2.92Å; Q176-Q178 VanDerWaalsContact O-NE2 3.12Å; Q178-S180 PolarHBondContact O-N 3.45Å; Q178-R181 WeakPolarHBondContact O-CA 3.19Å; Q178-R181 PolarHBondContact O-N 3.44Å; Q178-W183 HydrophobicContact CB-CD2 4.21Å; Q178-W183 HydrophobicContact CB-CG 4.42Å; Q178-W183 HydrophobicContact CB-CZ2 3.91Å; Q178-W183 HydrophobicContact CG-CD2 3.71Å; Q178-W183 VanDerWaalsContact CG-CE2 3.48Å; Q178-W183 HydrophobicContact CG-CE3 4.05Å; Q178-W183 HydrophobicContact CG-CG 4.24Å; Q178-W183 HydrophobicContact CG-CH2 3.95Å; Q178-W183 HydrophobicContact CG-CZ2 3.58Å; Q178-W183 HydrophobicContact CG-CZ3 4.2Å; Q178-W183 PolarHBondContact N-O 3.45Å; Q178-F185 HydrophobicContact CG-CB 4.24Å; Q178-F185 PolarHBondContact NE2-O 2.89Å; Q178-Y186 PolarHBondContact NE2-O 3.45Å; Q178-T188 PolarHBondContact OE1-OG1 3.47Å
179A83.1Confident88.4Confident17 Ų1752.3 Ų52.314%0.1425%0.246CC..THydrogen-bonded Turntrans-49.3-35.4-176.200000115.1R181 E189 C280A179-R181 PolarHBondContact O-N 3.44Å; A179-E189 WeakPolarHBondContact CB-OE1 3.2Å; A179-C280 HydrophobicContact CB-CB 3.99Å
180S82.1Confident87.7Confident7 Ų756.6 Ų56.65%0.04926%0.264CS..THydrogen-bonded Turntrans-71.1-16.8178.968.60000113.7K94 Q178 T182 W183K94-S180 PolarHBondContact NZ-O 2.97Å; Q178-S180 PolarHBondContact O-N 3.45Å; S180-T182 WeakPolarHBondContact O-CG2 3.48Å; S180-T182 PolarHBondContact O-N 2.98Å; S180-T182 PolarHBondContact OG-N 3.33Å; S180-T182 PolarHBondContact OG-OG1 2.91Å; S180-W183 PolarHBondContact OG-NE1 2.79Å
181R86.8Confident87.3Confident85 Ų8551.8 Ų51.832%0.32124%0.239SC..SBendtrans56.324.3-171.8-51.5-177.281.5-164.84.2113.6V89 K94 W96 I177 Q178 A179V89-R181 WeakPolarHBondContact CG1-O 3.33Å; K94-R181 HydrophobicContact CB-CB 4.07Å; K94-R181 HydrophobicContact CD-CB 4.29Å; W96-R181 PolarHBondContact NE1-O 2.77Å; I177-R181 HydrophobicContact CG2-CB 4.21Å; I177-R181 HydrophobicContact CG2-CG 4.28Å; Q178-R181 WeakPolarHBondContact O-CA 3.19Å; Q178-R181 PolarHBondContact O-N 3.44Å; A179-R181 PolarHBondContact O-N 3.44Å
182T86.4Confident86.7Confident9 Ų952.2 Ų52.26%0.05525%0.247CC..SBendtrans-107.1-10.2-177.857.50000114Y90 K94 S180Y90-T182 HydrophobicContact CD1-CG2 4.36Å; Y90-T182 HydrophobicContact CE1-CG2 3.43Å; Y90-T182 VanDerWaalsContact CE1-CG2 3.43Å; Y90-T182 HydrophobicContact CE2-CG2 4.42Å; Y90-T182 VanDerWaalsContact CZ-CG2 3.46Å; Y90-T182 VanDerWaalsContact OH-CG2 3.29Å; Y90-T182 WeakPolarHBondContact OH-CG2 3.32Å; K94-T182 HydrophobicContact CD-CG2 3.93Å; K94-T182 VanDerWaalsContact CE-CG2 3.44Å; S180-T182 WeakPolarHBondContact O-CG2 3.48Å; S180-T182 PolarHBondContact O-N 2.98Å; S180-T182 PolarHBondContact OG-N 3.33Å; S180-T182 PolarHBondContact OG-OG1 2.91Å
183W91.1Very high86.7Confident6 Ų646 Ų462%0.02322%0.223CC..  trans-155.8159.4-17562.7-59.9000110.8F109 M113 Q178 S180 F185 F262 M266 I283 L287F109-W183 HydrophobicContact CE1-CB 4.14Å; F109-W183 HydrophobicContact CZ-CB 4.16Å; M113-W183 HydrophobicContact CE-CB 4.41Å; M113-W183 HydrophobicContact CE-CD2 4.46Å; M113-W183 HydrophobicContact CE-CE3 3.74Å; M113-W183 HydrophobicContact CE-CZ3 4.48Å; Q178-W183 HydrophobicContact CB-CD2 4.21Å; Q178-W183 HydrophobicContact CB-CG 4.42Å; Q178-W183 HydrophobicContact CB-CZ2 3.91Å; Q178-W183 HydrophobicContact CG-CD2 3.71Å; Q178-W183 VanDerWaalsContact CG-CE2 3.48Å; Q178-W183 HydrophobicContact CG-CE3 4.05Å; Q178-W183 HydrophobicContact CG-CG 4.24Å; Q178-W183 HydrophobicContact CG-CH2 3.95Å; Q178-W183 HydrophobicContact CG-CZ2 3.58Å; Q178-W183 HydrophobicContact CG-CZ3 4.2Å; Q178-W183 PolarHBondContact N-O 3.45Å; S180-W183 PolarHBondContact OG-NE1 2.79Å; W183-F185 HydrophobicContact CE3-CB 3.62Å; W183-F185 HydrophobicContact CE3-CG 4.22Å; W183-F185 HydrophobicContact CH2-CB 4Å; W183-F185 HydrophobicContact CH2-CD1 4.27Å; W183-F185 HydrophobicContact CH2-CG 4.25Å; W183-F185 HydrophobicContact CZ3-CB 3.23Å; W183-F185 AromaticContact CZ3-CD1 3.91Å; W183-F185 HydrophobicContact CZ3-CD1 3.91Å; W183-F185 HydrophobicContact CZ3-CD2 4.05Å; W183-F185 AromaticContact CZ3-CG 3.48Å; W183-F185 HydrophobicContact CZ3-CG 3.48Å; W183-F185 VanDerWaalsContact CZ3-CG 3.48Å; W183-F262 HydrophobicContact CH2-CE2 4.31Å; W183-F262 HydrophobicContact CH2-CZ 4.5Å; W183-F262 HydrophobicContact CZ3-CE2 4.5Å; W183-F262 HydrophobicContact CZ3-CZ 4.32Å; W183-M266 HydrophobicContact CH2-CE 3.98Å; W183-I283 HydrophobicContact CH2-CG2 3.87Å; W183-I283 HydrophobicContact CZ2-CG2 3.54Å; W183-L287 HydrophobicContact CD2-CD2 3.83Å; W183-L287 HydrophobicContact CE3-CD2 4.07Å; W183-L287 HydrophobicContact CG-CD2 4.16Å; W183-L287 HydrophobicContact CZ3-CD2 4.49Å
184C93.8Very high86.7Confident0 Ų050 Ų500%024%0.238CC..EExtended strand (participates in β ladder)trans-117.6139.4176.1-74.80000110.1W96 C106 F109 G110 Q176W96-C184 WeakPolarHBondContact CH2-SG 3.41Å; C106-C184 WeakPolarHBondContact CA-SG 3.45Å; C106-C184 HydrophobicContact CB-CB 4.09Å; C106-C184 WeakPolarHBondContact CB-SG 3.35Å; C106-C184 VanDerWaalsContact O-CB 3.24Å; C106-C184 WeakPolarHBondContact O-CB 3.36Å; C106-C184 WeakPolarHBondContact SG-CB 3.45Å; C106-C184 CovalentContact SG-SG 2.04Å; C106-C184 PolarHBondContact SG-SG 2.71Å; F109-C184 HydrophobicContact CB-CB 4.19Å; F109-C184 HydrophobicContact CD1-CB 4.25Å; F109-C184 HydrophobicContact CG-CB 4.42Å; G110-C184 WeakPolarHBondContact CA-O 3.3Å; Q176-C184 WeakPolarHBondContact O-CA 3.42Å
185F94.6Very high86.8Confident2 Ų248.7 Ų48.71%0.00922%0.224CC..EExtended strand (participates in β ladder)trans-159.7-174.4-178.8-161-116000110.2M113 V114 Q176 Q178 W183 L200 F203 F262 M266M113-F185 HydrophobicContact CB-CD2 4.22Å; V114-F185 HydrophobicContact CG2-CD2 4.02Å; V114-F185 HydrophobicContact CG2-CE2 3.52Å; V114-F185 HydrophobicContact CG2-CZ 4.31Å; Q176-F185 PolarHBondContact N-O 3.21Å; Q176-F185 PolarHBondContact O-N 3.01Å; Q176-F185 VanDerWaalsContact O-N 3.12Å; Q178-F185 HydrophobicContact CG-CB 4.24Å; Q178-F185 PolarHBondContact NE2-O 2.89Å; W183-F185 HydrophobicContact CE3-CB 3.62Å; W183-F185 HydrophobicContact CE3-CG 4.22Å; W183-F185 HydrophobicContact CH2-CB 4Å; W183-F185 HydrophobicContact CH2-CD1 4.27Å; W183-F185 HydrophobicContact CH2-CG 4.25Å; W183-F185 HydrophobicContact CZ3-CB 3.23Å; W183-F185 AromaticContact CZ3-CD1 3.91Å; W183-F185 HydrophobicContact CZ3-CD1 3.91Å; W183-F185 HydrophobicContact CZ3-CD2 4.05Å; W183-F185 AromaticContact CZ3-CG 3.48Å; W183-F185 HydrophobicContact CZ3-CG 3.48Å; W183-F185 VanDerWaalsContact CZ3-CG 3.48Å; F185-L200 HydrophobicContact CE1-CD2 4.23Å; F185-F203 HydrophobicContact CE2-CE2 4.3Å; F185-F203 HydrophobicContact CE2-CZ 4.34Å; F185-F203 AromaticContact CZ-CD1 3.84Å; F185-F203 HydrophobicContact CZ-CD1 3.84Å; F185-F203 HydrophobicContact CZ-CD2 4.16Å; F185-F203 AromaticContact CZ-CE1 3.78Å; F185-F203 HydrophobicContact CZ-CE1 3.78Å; F185-F203 HydrophobicContact CZ-CE2 4.09Å; F185-F203 HydrophobicContact CZ-CG 4.05Å; F185-F203 AromaticContact CZ-CZ 3.92Å; F185-F203 HydrophobicContact CZ-CZ 3.92Å; F185-F262 HydrophobicContact CE1-CZ 4.43Å; F185-F262 HydrophobicContact CZ-CE1 4.4Å; F185-F262 HydrophobicContact CZ-CZ 4.34Å; F185-M266 HydrophobicContact CD1-CE 4.39Å; F185-M266 HydrophobicContact CD1-SD 4.23Å; F185-M266 HydrophobicContact CE1-CE 4.26Å; F185-M266 HydrophobicContact CE1-CG 4.22Å; F185-M266 HydrophobicContact CE1-SD 3.79Å
186Y93.1Very high86.6Confident9 Ų949.5 Ų49.54%0.03523%0.229CC..SBendtrans-53.6153169.4-59-54.4000111V114 P168 Y175 Q178 T188 Y199 L200 F203V114-Y186 WeakPolarHBondContact CG1-OH 3.39Å; V114-Y186 HydrophobicContact CG2-CD2 4.41Å; V114-Y186 HydrophobicContact CG2-CE1 4.29Å; V114-Y186 HydrophobicContact CG2-CE2 3.6Å; P168-Y186 HydrophobicContact CG-CD1 4.33Å; P168-Y186 HydrophobicContact CG-CE1 3.55Å; Y175-Y186 HydrophobicContact CD1-CD1 4.41Å; Y175-Y186 AromaticContact CE1-CD1 3.88Å; Y175-Y186 HydrophobicContact CE1-CD1 3.88Å; Y175-Y186 AromaticContact CE1-CE1 3.71Å; Y175-Y186 HydrophobicContact CE1-CE1 3.71Å; Y175-Y186 AromaticContact CZ-CE1 3.97Å; Q178-Y186 PolarHBondContact NE2-O 3.45Å; Y186-T188 PolarHBondContact O-N 3.29Å; Y186-T188 VanDerWaalsContact O-N 3.13Å; Y186-Y199 HydrophobicContact CE1-CG 4.31Å; Y186-L200 HydrophobicContact CD2-CD2 4.21Å; Y186-L200 HydrophobicContact CG-CD2 4.38Å; Y186-F203 HydrophobicContact CD2-CB 4.39Å; Y186-F203 HydrophobicContact CE2-CB 3.7Å; Y186-F203 HydrophobicContact CE2-CD2 4.27Å; Y186-F203 HydrophobicContact CE2-CG 4.08Å
187K89.2Confident86.6Confident59 Ų5947.2 Ų47.226%0.25722%0.216SC..  trans-62.7116.2177-172-172.9177.8-172.80109.3Q176 E189 H190 V191 D196 L200Q176-K187 HydrophobicContact CG-CB 4.09Å; Q176-K187 HydrophobicContact CG-CG 4.34Å; K187-E189 VanDerWaalsContact CE-O 3.24Å; K187-E189 WeakPolarHBondContact CE-O 3.41Å; K187-E189 WeakPolarHBondContact CG-O 3.32Å; K187-H190 VanDerWaalsContact CE-O 3.28Å; K187-H190 WeakPolarHBondContact CE-O 3.35Å; K187-H190 PolarHBondContact NZ-O 2.98Å; K187-V191 WeakPolarHBondContact O-CG2 3.3Å; K187-D196 WeakPolarHBondContact CD-OD2 3.32Å; K187-D196 IonicContact NZ-OD2 2.96Å; K187-L200 WeakPolarHBondContact O-CD1 3.42Å
188T85.2Confident86.7Confident15 Ų1548.9 Ų48.99%0.09222%0.221CC..  trans-105.8-18.4-179.956.10000113.1Q178 Y186 L200 M266 I269Q178-T188 PolarHBondContact OE1-OG1 3.47Å; Y186-T188 PolarHBondContact O-N 3.29Å; Y186-T188 VanDerWaalsContact O-N 3.13Å; T188-L200 HydrophobicContact CG2-CD2 4.21Å; T188-M266 HydrophobicContact CG2-CE 4.33Å; T188-M266 HydrophobicContact CG2-SD 3.97Å; T188-I269 HydrophobicContact CG2-CD1 4.37Å; T188-I269 VanDerWaalsContact O-CG2 3.31Å; T188-I269 WeakPolarHBondContact O-CG2 3.21Å
189E79.8Confident86.9Confident80 Ų8048.8 Ų48.837%0.37422%0.221SC..SBendtrans-101.3137.9179.3-64-174.8177.200110.9A179 K187 V191A179-E189 WeakPolarHBondContact CB-OE1 3.2Å; K187-E189 VanDerWaalsContact CE-O 3.24Å; K187-E189 WeakPolarHBondContact CE-O 3.41Å; K187-E189 WeakPolarHBondContact CG-O 3.32Å; E189-V191 PolarHBondContact O-N 3.1Å
190H74.8Confident87.4Confident152 Ų15248 Ų4870%0.70421%0.214SC*.SBendtrans49.356.4176.7-5487.3000112.1K187 E192K187-H190 VanDerWaalsContact CE-O 3.28Å; K187-H190 WeakPolarHBondContact CE-O 3.35Å; K187-H190 PolarHBondContact NZ-O 2.98Å; H190-E192 VanDerWaalsContact C-N 3.32Å; H190-E192 PolarHBondContact O-N 3.24Å
191V79.8Confident88.1Confident14 Ų1450.1 Ų50.19%0.08523%0.225CC..  trans-80.278-176.9-167.70000110.1K187 E189 D196 R197 L200 I269K187-V191 WeakPolarHBondContact O-CG2 3.3Å; E189-V191 PolarHBondContact O-N 3.1Å; V191-D196 HydrophobicContact CG1-CB 3.71Å; V191-R197 HydrophobicContact CG1-CB 4.45Å; V191-R197 HydrophobicContact CG1-CG 3.47Å; V191-R197 VanDerWaalsContact CG1-CG 3.47Å; V191-R197 PolarHBondContact O-NE 3.31Å; V191-R197 VanDerWaalsContact O-NE 3.11Å; V191-R197 PolarHBondContact O-NH2 3.02Å; V191-L200 HydrophobicContact CG2-CD1 4.22Å; V191-I269 HydrophobicContact CG2-CG2 4.1Å
192E76.2Confident88.5Confident151 Ų15147.8 Ų47.871%0.70622%0.219SC*.  trans-83.4-35.7178.6-64.1-178.2170.700112.1H190 R197H190-E192 VanDerWaalsContact C-N 3.32Å; H190-E192 PolarHBondContact O-N 3.24Å; E192-R197 PolarHBondContact O-NH2 2.82Å
193D85.8Confident89.1Confident68 Ų6847.4 Ų47.436%0.36422%0.216SC..SBendtrans-78.8137.5-176.3-70.1-36.9000112.8E195 D196 R197D193-E195 VanDerWaalsContact C-N 3.3Å; D193-E195 PolarHBondContact O-N 3.05Å; D193-D196 HydrophobicContact CB-CB 4.5Å; D193-D196 PolarHBondContact O-N 3.38Å; D193-R197 PolarHBondContact O-N 3.2Å
194W87.4Confident89.4Confident174 Ų17447.1 Ų47.166%0.65922%0.215SC*.Hα-helixtrans-64.5-32.1178.876.2-91.7000113.1R197 F198W194-R197 PolarHBondContact O-N 3.05Å; W194-F198 HydrophobicContact CE3-CB 4.33Å; W194-F198 HydrophobicContact CZ3-CB 4.36Å; W194-F198 WeakPolarHBondContact O-CB 3.41Å; W194-F198 PolarHBondContact O-N 2.78Å
195E89.4Confident89.6Confident17 Ų1750.6 Ų50.68%0.07924%0.238CC..Hα-helixtrans-67.4-40179.1-68.4-171152.100111.3R171 R173 D193 R197 F198 Y199R171-E195 IonicContact CZ-OE1 3.84Å; R171-E195 IonicContact NE-OE1 3.78Å; R171-E195 IonicContact NH2-OE1 2.9Å; R171-E195 PolarHBondContact NH2-OE1 2.88Å; R173-E195 IonicContact CZ-OE2 3.91Å; R173-E195 VanDerWaalsContact CZ-OE2 3.26Å; R173-E195 IonicContact NE-OE2 2.86Å; R173-E195 PolarHBondContact NE-OE2 3.12Å; R173-E195 IonicContact NH2-OE2 3.45Å; R173-E195 PolarHBondContact NH2-OE2 2.88Å; D193-E195 VanDerWaalsContact C-N 3.3Å; D193-E195 PolarHBondContact O-N 3.05Å; E195-R197 VanDerWaalsContact C-N 3.32Å; E195-R197 PolarHBondContact O-N 3.28Å; E195-F198 WeakPolarHBondContact O-CB 3.29Å; E195-F198 PolarHBondContact O-N 3.45Å; E195-Y199 HydrophobicContact CB-CE2 4.22Å; E195-Y199 WeakPolarHBondContact O-CD2 3.3Å; E195-Y199 WeakPolarHBondContact O-CE2 3.37Å; E195-Y199 PolarHBondContact O-N 3.3Å
196D88.8Confident89.7Confident18 Ų1852 Ų5210%0.09625%0.246CC..Hα-helixtrans-64.6-39.8177.2-70-25.1000110.9K187 V191 D193 L200K187-D196 WeakPolarHBondContact CD-OD2 3.32Å; K187-D196 IonicContact NZ-OD2 2.96Å; V191-D196 HydrophobicContact CG1-CB 3.71Å; D193-D196 HydrophobicContact CB-CB 4.5Å; D193-D196 PolarHBondContact O-N 3.38Å; D196-L200 PolarHBondContact O-N 3.25Å
197R90.8Very high90Very high43 Ų4351.6 Ų51.616%0.16224%0.244CC..Hα-helixtrans-62.4-45.3171.7-61.6-178.9-169.81679.4111.2V191 E192 D193 W194 E195 Y199 L200 L201 E273V191-R197 HydrophobicContact CG1-CB 4.45Å; V191-R197 HydrophobicContact CG1-CG 3.47Å; V191-R197 VanDerWaalsContact CG1-CG 3.47Å; V191-R197 PolarHBondContact O-NE 3.31Å; V191-R197 VanDerWaalsContact O-NE 3.11Å; V191-R197 PolarHBondContact O-NH2 3.02Å; E192-R197 PolarHBondContact O-NH2 2.82Å; D193-R197 PolarHBondContact O-N 3.2Å; W194-R197 PolarHBondContact O-N 3.05Å; E195-R197 VanDerWaalsContact C-N 3.32Å; E195-R197 PolarHBondContact O-N 3.28Å; R197-Y199 VanDerWaalsContact C-N 3.32Å; R197-Y199 PolarHBondContact O-N 2.87Å; R197-L200 PolarHBondContact O-N 3.4Å; R197-L201 WeakPolarHBondContact O-CB 3.24Å; R197-L201 VanDerWaalsContact O-CG 3.23Å; R197-L201 WeakPolarHBondContact O-CG 3.38Å; R197-L201 PolarHBondContact O-N 2.91Å; R197-E273 IonicContact CZ-OE1 2.78Å; R197-E273 VanDerWaalsContact CZ-OE1 3.28Å; R197-E273 IonicContact NH1-OE1 2.71Å; R197-E273 PolarHBondContact NH1-OE1 2.91Å; R197-E273 IonicContact NH1-OE2 3.28Å; R197-E273 IonicContact NH2-OE1 3.26Å; R197-E273 PolarHBondContact NH2-OE1 3Å
198F93.3Very high90.4Very high91 Ų9151.4 Ų51.440%0.39925%0.246SC..Hα-helixtrans-56.6-45.6-179.7172.5-99.3000111.6L167 W194 E195 L201 L202L167-F198 HydrophobicContact CD2-CE1 4.19Å; W194-F198 HydrophobicContact CE3-CB 4.33Å; W194-F198 HydrophobicContact CZ3-CB 4.36Å; W194-F198 WeakPolarHBondContact O-CB 3.41Å; W194-F198 PolarHBondContact O-N 2.78Å; E195-F198 WeakPolarHBondContact O-CB 3.29Å; E195-F198 PolarHBondContact O-N 3.45Å; F198-L201 PolarHBondContact O-N 3.44Å; F198-L202 HydrophobicContact CE1-CD2 3.93Å; F198-L202 HydrophobicContact CZ-CD2 4.08Å; F198-L202 WeakPolarHBondContact O-CB 3.28Å; F198-L202 PolarHBondContact O-N 3.48Å
199Y94.1Very high91Very high8 Ų855.5 Ų55.53%0.03127%0.266CS..Hα-helixtrans-68.2-40.2179.6-62-56.8000113.4L167 P168 R171 R173 Y186 E195 R197 L202 F203L167-Y199 HydrophobicContact CB-CE1 4.29Å; L167-Y199 HydrophobicContact CD2-CD1 4.31Å; L167-Y199 HydrophobicContact CD2-CE1 3.82Å; L167-Y199 HydrophobicContact CG-CE1 3.85Å; P168-Y199 HydrophobicContact CB-CD2 4.42Å; P168-Y199 HydrophobicContact CB-CE2 4.24Å; P168-Y199 HydrophobicContact CG-CD1 4.17Å; P168-Y199 HydrophobicContact CG-CE1 4.31Å; P168-Y199 HydrophobicContact CG-CG 4.3Å; R171-Y199 WeakPolarHBondContact CB-OH 3.37Å; R171-Y199 WeakPolarHBondContact CG-OH 3.4Å; R173-Y199 HydrophobicContact CB-CE2 4.43Å; R173-Y199 HydrophobicContact CG-CE2 4.24Å; Y186-Y199 HydrophobicContact CE1-CG 4.31Å; E195-Y199 HydrophobicContact CB-CE2 4.22Å; E195-Y199 WeakPolarHBondContact O-CD2 3.3Å; E195-Y199 WeakPolarHBondContact O-CE2 3.37Å; E195-Y199 PolarHBondContact O-N 3.3Å; R197-Y199 VanDerWaalsContact C-N 3.32Å; R197-Y199 PolarHBondContact O-N 2.87Å; Y199-L202 PolarHBondContact O-N 3.06Å; Y199-F203 WeakPolarHBondContact O-CB 3.34Å; Y199-F203 PolarHBondContact O-N 3.46Å
200L94Very high91.9Very high0 Ų051.9 Ų51.90%025%0.25CS..Hα-helixtrans-61.4-45.3174-78172.9000112F185 Y186 K187 T188 V191 D196 R197 S204 M266 I269F185-L200 HydrophobicContact CE1-CD2 4.23Å; Y186-L200 HydrophobicContact CD2-CD2 4.21Å; Y186-L200 HydrophobicContact CG-CD2 4.38Å; K187-L200 WeakPolarHBondContact O-CD1 3.42Å; T188-L200 HydrophobicContact CG2-CD2 4.21Å; V191-L200 HydrophobicContact CG2-CD1 4.22Å; D196-L200 PolarHBondContact O-N 3.25Å; R197-L200 PolarHBondContact O-N 3.4Å; L200-S204 WeakPolarHBondContact O-CB 3.28Å; L200-S204 PolarHBondContact O-N 3.45Å; L200-S204 PolarHBondContact O-OG 2.72Å; L200-M266 HydrophobicContact CD2-SD 3.87Å; L200-I269 HydrophobicContact CD1-CG2 3.8Å
201L95.2Very high92.9Very high51 Ų5145.2 Ų45.227%0.26722%0.22SC..Hα-helixtrans-67.6-42.5177.7-68176000111.3R197 F198 F203 S204 C205 I271R197-L201 WeakPolarHBondContact O-CB 3.24Å; R197-L201 VanDerWaalsContact O-CG 3.23Å; R197-L201 WeakPolarHBondContact O-CG 3.38Å; R197-L201 PolarHBondContact O-N 2.91Å; F198-L201 PolarHBondContact O-N 3.44Å; L201-F203 PolarHBondContact O-N 2.96Å; L201-S204 WeakPolarHBondContact CA-OG 3.16Å; L201-S204 PolarHBondContact O-N 2.99Å; L201-S204 PolarHBondContact O-OG 3.29Å; L201-C205 WeakPolarHBondContact O-CB 3.36Å; L201-C205 PolarHBondContact O-N 2.94Å; L201-C205 PolarHBondContact O-SG 3.44Å; L201-I271 HydrophobicContact CD2-CG1 3.78Å
202L96.8Very high93.8Very high37 Ų3746.8 Ų46.819%0.19423%0.234CC..Hα-helixtrans-58.1-50176.9-178.363.3000110.9I164 L167 F198 Y199 L206I164-L202 HydrophobicContact CD1-CD2 3.97Å; I164-L202 HydrophobicContact CD1-CG 4.37Å; I164-L202 HydrophobicContact CG2-CD2 4.24Å; I164-L202 HydrophobicContact CG2-CG 4.45Å; L167-L202 HydrophobicContact CD2-CD2 3.8Å; F198-L202 HydrophobicContact CE1-CD2 3.93Å; F198-L202 HydrophobicContact CZ-CD2 4.08Å; F198-L202 WeakPolarHBondContact O-CB 3.28Å; F198-L202 PolarHBondContact O-N 3.48Å; Y199-L202 PolarHBondContact O-N 3.06Å; L202-L206 HydrophobicContact CD1-CD1 3.74Å; L202-L206 HydrophobicContact CD1-CG 4.15Å; L202-L206 HydrophobicContact CG-CD1 3.98Å; L202-L206 VanDerWaalsContact O-CB 3.22Å; L202-L206 WeakPolarHBondContact O-CB 3.49Å; L202-L206 WeakPolarHBondContact O-CD1 3.22Å; L202-L206 WeakPolarHBondContact O-CG 3.27Å; L202-L206 PolarHBondContact O-N 2.85Å
203F97.3Very high94.7Very high1 Ų142.6 Ų42.60%0.00422%0.216CC..Hα-helixtrans-60.1-51176.7173.2-91.8000112.3V114 L118 F185 Y186 Y199 L201 G207 F262 L263V114-F203 HydrophobicContact CG1-CD2 4.08Å; V114-F203 HydrophobicContact CG1-CE2 4.46Å; L118-F203 HydrophobicContact CD1-CD2 3.78Å; L118-F203 HydrophobicContact CD1-CE2 4.32Å; L118-F203 HydrophobicContact CD2-CD2 3.78Å; L118-F203 HydrophobicContact CD2-CE2 3.88Å; L118-F203 HydrophobicContact CD2-CG 4.44Å; L118-F203 HydrophobicContact CG-CD2 3.61Å; L118-F203 HydrophobicContact CG-CE2 3.66Å; F185-F203 HydrophobicContact CE2-CE2 4.3Å; F185-F203 HydrophobicContact CE2-CZ 4.34Å; F185-F203 AromaticContact CZ-CD1 3.84Å; F185-F203 HydrophobicContact CZ-CD1 3.84Å; F185-F203 HydrophobicContact CZ-CD2 4.16Å; F185-F203 AromaticContact CZ-CE1 3.78Å; F185-F203 HydrophobicContact CZ-CE1 3.78Å; F185-F203 HydrophobicContact CZ-CE2 4.09Å; F185-F203 HydrophobicContact CZ-CG 4.05Å; F185-F203 AromaticContact CZ-CZ 3.92Å; F185-F203 HydrophobicContact CZ-CZ 3.92Å; Y186-F203 HydrophobicContact CD2-CB 4.39Å; Y186-F203 HydrophobicContact CE2-CB 3.7Å; Y186-F203 HydrophobicContact CE2-CD2 4.27Å; Y186-F203 HydrophobicContact CE2-CG 4.08Å; Y199-F203 WeakPolarHBondContact O-CB 3.34Å; Y199-F203 PolarHBondContact O-N 3.46Å; L201-F203 PolarHBondContact O-N 2.96Å; F203-G207 PolarHBondContact O-N 2.85Å; F203-F262 HydrophobicContact CE1-CD1 4.03Å; F203-F262 AromaticContact CE1-CE1 3.6Å; F203-F262 HydrophobicContact CE1-CE1 3.6Å; F203-F262 HydrophobicContact CZ-CD1 4.31Å; F203-F262 AromaticContact CZ-CE1 3.75Å; F203-F262 HydrophobicContact CZ-CE1 3.75Å; F203-L263 HydrophobicContact CD1-CD2 4.22Å; F203-L263 HydrophobicContact CE1-CD2 3.73Å; F203-L263 HydrophobicContact CZ-CD2 4.32Å
204S97.4Very high95.2Very high0 Ų039.8 Ų39.80%020%0.201CC..Hα-helixtrans-68.8-43.5-175.755.20000112.7L200 L201 G207 L208 L263 A267L200-S204 WeakPolarHBondContact O-CB 3.28Å; L200-S204 PolarHBondContact O-N 3.45Å; L200-S204 PolarHBondContact O-OG 2.72Å; L201-S204 WeakPolarHBondContact CA-OG 3.16Å; L201-S204 PolarHBondContact O-N 2.99Å; L201-S204 PolarHBondContact O-OG 3.29Å; S204-G207 PolarHBondContact O-N 2.91Å; S204-L208 WeakPolarHBondContact O-CB 3.38Å; S204-L208 WeakPolarHBondContact O-CG 3.07Å; S204-L208 PolarHBondContact O-N 3.39Å; S204-L263 VanDerWaalsContact CB-O 3.28Å; S204-L263 WeakPolarHBondContact CB-O 3.48Å; S204-A267 WeakPolarHBondContact OG-CA 3.41Å
205C97.9Very high95.5Very high72 Ų7235.9 Ų35.949%0.48619%0.189SC..Hα-helixtrans-64.5-44176.9-69.60000111.9L201 L208 L209L201-C205 WeakPolarHBondContact O-CB 3.36Å; L201-C205 PolarHBondContact O-N 2.94Å; L201-C205 PolarHBondContact O-SG 3.44Å; C205-L208 PolarHBondContact O-N 2.76Å; C205-L209 WeakPolarHBondContact O-CB 3.31Å; C205-L209 PolarHBondContact O-N 3.24Å
206L98.4Very high95.9Very high32 Ų3240.3 Ų40.317%0.16821%0.213CC..Hα-helixtrans-63-43176.4-73.8174.9000111.6L118 F122 F160 I164 L202 L209 A210L118-L206 HydrophobicContact CD2-CB 4.38Å; F122-L206 HydrophobicContact CE1-CB 4.13Å; F122-L206 HydrophobicContact CZ-CB 3.93Å; F122-L206 HydrophobicContact CZ-CD1 4.29Å; F122-L206 HydrophobicContact CZ-CG 4.5Å; F160-L206 HydrophobicContact CE1-CD1 4.26Å; F160-L206 HydrophobicContact CE1-CD2 4.32Å; F160-L206 HydrophobicContact CZ-CD1 4.19Å; F160-L206 HydrophobicContact CZ-CD2 4.27Å; I164-L206 HydrophobicContact CD1-CD1 3.92Å; I164-L206 HydrophobicContact CG1-CD1 4.04Å; I164-L206 HydrophobicContact CG2-CD1 4.42Å; L202-L206 HydrophobicContact CD1-CD1 3.74Å; L202-L206 HydrophobicContact CD1-CG 4.15Å; L202-L206 HydrophobicContact CG-CD1 3.98Å; L202-L206 VanDerWaalsContact O-CB 3.22Å; L202-L206 WeakPolarHBondContact O-CB 3.49Å; L202-L206 WeakPolarHBondContact O-CD1 3.22Å; L202-L206 WeakPolarHBondContact O-CG 3.27Å; L202-L206 PolarHBondContact O-N 2.85Å; L206-L209 PolarHBondContact O-N 3.2Å; L206-A210 WeakPolarHBondContact O-CB 3.37Å; L206-A210 PolarHBondContact O-N 3.13Å
207G97.9Very high96.1Very high0 Ų040.5 Ų40.50%022%0.215CC..Hα-helixtrans-64.3-45.1176.100000112.8F203 S204 L209 A210 L211F203-G207 PolarHBondContact O-N 2.85Å; S204-G207 PolarHBondContact O-N 2.91Å; G207-L209 PolarHBondContact O-N 3.49Å; G207-A210 PolarHBondContact O-N 3Å; G207-L211 WeakPolarHBondContact O-CG 3.39Å; G207-L211 PolarHBondContact O-N 3.09Å
208L98.1Very high96.1Very high56 Ų5638.5 Ų38.529%0.29321%0.208SC..Hα-helixtrans-64.4-40177.4-73.8169.3000111.6S204 C205 L211 A212 L263 V264S204-L208 WeakPolarHBondContact O-CB 3.38Å; S204-L208 WeakPolarHBondContact O-CG 3.07Å; S204-L208 PolarHBondContact O-N 3.39Å; C205-L208 PolarHBondContact O-N 2.76Å; L208-L211 PolarHBondContact O-N 3.15Å; L208-A212 VanDerWaalsContact O-CB 3.31Å; L208-A212 WeakPolarHBondContact O-CB 3.32Å; L208-A212 PolarHBondContact O-N 3Å; L208-L263 HydrophobicContact CD2-CB 3.87Å; L208-L263 HydrophobicContact CD2-CD1 4.27Å; L208-L263 HydrophobicContact CG-CB 3.89Å; L208-L263 HydrophobicContact CG-CD1 4.38Å; L208-V264 HydrophobicContact CD2-CG2 4.25Å
209L98.2Very high96.1Very high100 Ų10035.3 Ų35.352%0.52420%0.199SC..Hα-helixtrans-62.9-45.4175.3179.962.1000111C205 L206 G207 L211 A212 I213C205-L209 WeakPolarHBondContact O-CB 3.31Å; C205-L209 PolarHBondContact O-N 3.24Å; L206-L209 PolarHBondContact O-N 3.2Å; G207-L209 PolarHBondContact O-N 3.49Å; L209-L211 PolarHBondContact O-N 3.19Å; L209-A212 PolarHBondContact O-N 3.41Å; L209-I213 HydrophobicContact CD1-CD1 4.05Å; L209-I213 HydrophobicContact CD1-CG1 4.29Å; L209-I213 HydrophobicContact CG-CD1 3.92Å; L209-I213 WeakPolarHBondContact O-CB 3.31Å; L209-I213 VanDerWaalsContact O-CG1 3.27Å; L209-I213 WeakPolarHBondContact O-CG1 3.22Å; L209-I213 PolarHBondContact O-N 2.8Å
210A97.9Very high96Very high4 Ų438.1 Ų38.13%0.03322%0.217CC..Hα-helixtrans-60.9-43.5176.600000111.9L121 F122 S125 L206 G207 S214L121-A210 HydrophobicContact CB-CB 4.18Å; F122-A210 HydrophobicContact CD1-CB 3.79Å; F122-A210 HydrophobicContact CE1-CB 4.14Å; S125-A210 WeakPolarHBondContact CB-O 3.47Å; L206-A210 WeakPolarHBondContact O-CB 3.37Å; L206-A210 PolarHBondContact O-N 3.13Å; G207-A210 PolarHBondContact O-N 3Å; A210-S214 WeakPolarHBondContact O-CB 3.33Å; A210-S214 PolarHBondContact O-N 3.2Å
211L96.7Very high95.7Very high13 Ų1338.3 Ų38.37%0.06822%0.217CC..Hα-helixtrans-61.7-45.5173.5-76.4-180000112.3L121 G207 L208 L209 S214 F215 W259 L263L121-L211 HydrophobicContact CD2-CD2 3.56Å; L121-L211 HydrophobicContact CD2-CG 3.81Å; G207-L211 WeakPolarHBondContact O-CG 3.39Å; G207-L211 PolarHBondContact O-N 3.09Å; L208-L211 PolarHBondContact O-N 3.15Å; L209-L211 PolarHBondContact O-N 3.19Å; L211-S214 WeakPolarHBondContact O-CB 3.4Å; L211-S214 PolarHBondContact O-N 2.75Å; L211-F215 WeakPolarHBondContact O-CB 3.46Å; L211-F215 PolarHBondContact O-N 3.32Å; L211-W259 HydrophobicContact CD1-CB 3.67Å; L211-W259 HydrophobicContact CD2-CB 4.09Å; L211-W259 HydrophobicContact CD2-CG 4.42Å; L211-W259 HydrophobicContact CG-CB 4.35Å; L211-L263 HydrophobicContact CD1-CD1 3.44Å; L211-L263 VanDerWaalsContact CD1-CD1 3.44Å; L211-L263 HydrophobicContact CG-CD1 4.19Å
212A97.6Very high95.3Very high46 Ų4636.3 Ų36.338%0.3821%0.21SC..Hα-helixtrans-62.9-45.3-179.900000111.2L208 L209 S214 F215 L216L208-A212 VanDerWaalsContact O-CB 3.31Å; L208-A212 WeakPolarHBondContact O-CB 3.32Å; L208-A212 PolarHBondContact O-N 3Å; L209-A212 PolarHBondContact O-N 3.41Å; A212-S214 VanDerWaalsContact C-N 3.33Å; A212-S214 PolarHBondContact O-N 3.05Å; A212-F215 PolarHBondContact O-N 2.76Å; A212-L216 WeakPolarHBondContact O-CB 3.12Å; A212-L216 VanDerWaalsContact O-CG 3.25Å; A212-L216 WeakPolarHBondContact O-CG 3.31Å; A212-L216 PolarHBondContact O-N 3.03Å
213I96.9Very high94.9Very high64 Ų6438.4 Ų38.433%0.32822%0.22SC..Hα-helixtrans-58.8-47.1174.7-69.1166.9000110.3V129 L209 L216 C217V129-I213 HydrophobicContact CG2-CG2 3.82Å; L209-I213 HydrophobicContact CD1-CD1 4.05Å; L209-I213 HydrophobicContact CD1-CG1 4.29Å; L209-I213 HydrophobicContact CG-CD1 3.92Å; L209-I213 WeakPolarHBondContact O-CB 3.31Å; L209-I213 VanDerWaalsContact O-CG1 3.27Å; L209-I213 WeakPolarHBondContact O-CG1 3.22Å; L209-I213 PolarHBondContact O-N 2.8Å; I213-L216 PolarHBondContact O-N 3.19Å; I213-C217 VanDerWaalsContact O-CB 3.3Å; I213-C217 WeakPolarHBondContact O-CB 3.42Å; I213-C217 PolarHBondContact O-N 3.27Å; I213-C217 PolarHBondContact O-SG 2.81Å
214S94.8Very high94.3Very high8 Ų840.2 Ų40.26%0.05623%0.231CC..Hα-helixtrans-59.6-47.6177.7-175.60000111.9A210 L211 A212 C217 N218A210-S214 WeakPolarHBondContact O-CB 3.33Å; A210-S214 PolarHBondContact O-N 3.2Å; L211-S214 WeakPolarHBondContact O-CB 3.4Å; L211-S214 PolarHBondContact O-N 2.75Å; A212-S214 VanDerWaalsContact C-N 3.33Å; A212-S214 PolarHBondContact O-N 3.05Å; S214-C217 PolarHBondContact O-N 2.81Å; S214-N218 VanDerWaalsContact O-CB 3.3Å; S214-N218 WeakPolarHBondContact O-CB 3.48Å; S214-N218 VanDerWaalsContact O-CG 3.26Å; S214-N218 PolarHBondContact O-N 3.41Å; S214-N218 PolarHBondContact O-ND2 3.33Å; S214-N218 PolarHBondContact OG-ND2 2.77Å
215F94.9Very high93.6Very high93 Ų9340.9 Ų40.941%0.40824%0.235SC..Hα-helixtrans-59.6-51.2178.5179.3-90000111.7L211 A212 C217 N218 A219 M252L211-F215 WeakPolarHBondContact O-CB 3.46Å; L211-F215 PolarHBondContact O-N 3.32Å; A212-F215 PolarHBondContact O-N 2.76Å; F215-C217 PolarHBondContact O-N 3.29Å; F215-N218 PolarHBondContact O-N 3.14Å; F215-A219 VanDerWaalsContact O-CB 3.26Å; F215-A219 WeakPolarHBondContact O-CB 3.29Å; F215-A219 PolarHBondContact O-N 3.41Å; F215-M252 HydrophobicContact CD2-CB 4.31Å; F215-M252 HydrophobicContact CD2-CE 3.55Å; F215-M252 HydrophobicContact CD2-CG 4.38Å; F215-M252 HydrophobicContact CE1-CE 4.44Å; F215-M252 HydrophobicContact CE2-CE 3.3Å; F215-M252 HydrophobicContact CG-CE 4.23Å; F215-M252 HydrophobicContact CZ-CE 3.79Å
216L96.2Very high93Very high109 Ų10940.4 Ų40.457%0.57123%0.227SC*.Hα-helixtrans-61.5-45179.8-69.2172.7000111.4A212 I213 A219 V220A212-L216 WeakPolarHBondContact O-CB 3.12Å; A212-L216 VanDerWaalsContact O-CG 3.25Å; A212-L216 WeakPolarHBondContact O-CG 3.31Å; A212-L216 PolarHBondContact O-N 3.03Å; I213-L216 PolarHBondContact O-N 3.19Å; L216-A219 PolarHBondContact O-N 3.18Å; L216-V220 VanDerWaalsContact O-CG2 3.31Å; L216-V220 WeakPolarHBondContact O-CG2 3.42Å; L216-V220 PolarHBondContact O-N 2.96Å
217C93.5Very high92.3Very high22 Ų2247.4 Ų47.415%0.14925%0.251CS..Hα-helixtrans-64.7-44179-71.20000112.2A128 C132 I213 S214 F215 A219 V220 T221A128-C217 HydrophobicContact CB-CB 3.88Å; C132-C217 HydrophobicContact CB-CB 3.99Å; I213-C217 VanDerWaalsContact O-CB 3.3Å; I213-C217 WeakPolarHBondContact O-CB 3.42Å; I213-C217 PolarHBondContact O-N 3.27Å; I213-C217 PolarHBondContact O-SG 2.81Å; S214-C217 PolarHBondContact O-N 2.81Å; F215-C217 PolarHBondContact O-N 3.29Å; C217-A219 VanDerWaalsContact C-N 3.35Å; C217-V220 PolarHBondContact O-N 3.14Å; C217-T221 WeakPolarHBondContact O-CB 3.49Å; C217-T221 PolarHBondContact O-N 3.02Å; C217-T221 PolarHBondContact O-OG1 2.87Å
218N91.6Very high91.4Very high1 Ų151.2 Ų51.21%0.00527%0.274CS..Hα-helixtrans-66.8-37.1177.1-72.2-36.8000111.4S214 F215 T221 G222 L248 M252S214-N218 VanDerWaalsContact O-CB 3.3Å; S214-N218 WeakPolarHBondContact O-CB 3.48Å; S214-N218 VanDerWaalsContact O-CG 3.26Å; S214-N218 PolarHBondContact O-N 3.41Å; S214-N218 PolarHBondContact O-ND2 3.33Å; S214-N218 PolarHBondContact OG-ND2 2.77Å; F215-N218 PolarHBondContact O-N 3.14Å; N218-T221 PolarHBondContact O-N 3.15Å; N218-G222 PolarHBondContact O-N 3.39Å; N218-L248 HydrophobicContact CB-CD2 4.41Å; N218-L248 WeakPolarHBondContact OD1-CD2 3.16Å; N218-M252 HydrophobicContact CB-CG 3.46Å; N218-M252 VanDerWaalsContact CB-CG 3.46Å; N218-M252 HydrophobicContact CB-SD 3.51Å; N218-M252 VanDerWaalsContact CB-SD 3.51Å
219A92.1Very high90.2Very high25 Ų2551.5 Ų51.521%0.20727%0.273CS..Hα-helixtrans-64.7-47.817500000112F215 L216 C217 T221 G222 I223 M252F215-A219 VanDerWaalsContact O-CB 3.26Å; F215-A219 WeakPolarHBondContact O-CB 3.29Å; F215-A219 PolarHBondContact O-N 3.41Å; L216-A219 PolarHBondContact O-N 3.18Å; C217-A219 VanDerWaalsContact C-N 3.35Å; A219-T221 VanDerWaalsContact C-N 3.3Å; A219-T221 PolarHBondContact O-N 3.46Å; A219-G222 PolarHBondContact O-N 3Å; A219-I223 WeakPolarHBondContact O-CB 3.4Å; A219-I223 VanDerWaalsContact O-CG1 3.26Å; A219-I223 WeakPolarHBondContact O-CG1 3.48Å; A219-I223 PolarHBondContact O-N 3.25Å; A219-M252 HydrophobicContact CB-CE 4.06Å
220V92.1Very high89.1Confident67 Ų6753.4 Ų53.441%0.40628%0.278SS..Hα-helixtrans-59-43.7175.3169.60000110.9T136 L216 C217 I223 T224T136-V220 HydrophobicContact CG2-CG1 4.24Å; L216-V220 VanDerWaalsContact O-CG2 3.31Å; L216-V220 WeakPolarHBondContact O-CG2 3.42Å; L216-V220 PolarHBondContact O-N 2.96Å; C217-V220 PolarHBondContact O-N 3.14Å; V220-I223 PolarHBondContact O-N 2.93Å; V220-T224 WeakPolarHBondContact O-CB 3.11Å; V220-T224 PolarHBondContact O-N 2.78Å; V220-T224 PolarHBondContact O-OG1 3.23Å
221T87.8Confident87.9Confident3 Ų362.5 Ų62.52%0.01832%0.316CS..Hα-helixtrans-61.2-47.5176.5-54.90000110.8C132 V135 C217 N218 A219 T224 L225 L248C132-T221 VanDerWaalsContact CA-OG1 3.28Å; C132-T221 WeakPolarHBondContact CA-OG1 3.4Å; V135-T221 HydrophobicContact CB-CG2 4.2Å; V135-T221 HydrophobicContact CG1-CG2 4.49Å; V135-T221 HydrophobicContact CG2-CG2 3.8Å; C217-T221 WeakPolarHBondContact O-CB 3.49Å; C217-T221 PolarHBondContact O-N 3.02Å; C217-T221 PolarHBondContact O-OG1 2.87Å; N218-T221 PolarHBondContact O-N 3.15Å; A219-T221 VanDerWaalsContact C-N 3.3Å; A219-T221 PolarHBondContact O-N 3.46Å; T221-T224 PolarHBondContact O-N 2.92Å; T221-L225 HydrophobicContact CG2-CD1 4.17Å; T221-L225 WeakPolarHBondContact O-CB 3.4Å; T221-L225 VanDerWaalsContact O-CG 3.29Å; T221-L225 WeakPolarHBondContact O-CG 3.36Å; T221-L225 PolarHBondContact O-N 3.3Å; T221-L248 HydrophobicContact CG2-CD1 3.56Å
222G87Confident86.4Confident10 Ų1065.1 Ų65.110%0.10334%0.335CS..Hα-helixtrans-61.1-47.517800000113N218 A219 T224 L225 L226N218-G222 PolarHBondContact O-N 3.39Å; A219-G222 PolarHBondContact O-N 3Å; G222-T224 PolarHBondContact O-N 3.26Å; G222-L225 PolarHBondContact O-N 2.95Å; G222-L226 WeakPolarHBondContact O-CB 2.9Å; G222-L226 VanDerWaalsContact O-CG 3.3Å; G222-L226 WeakPolarHBondContact O-CG 3.09Å; G222-L226 PolarHBondContact O-N 3.43Å
223I88.1Confident84.4Confident81 Ų8171 Ų7142%0.41536%0.355SS..Hα-helixtrans-62.4-42.6177.6-67.3165.5000110.8A219 V220 L226 R227A219-I223 WeakPolarHBondContact O-CB 3.4Å; A219-I223 VanDerWaalsContact O-CG1 3.26Å; A219-I223 WeakPolarHBondContact O-CG1 3.48Å; A219-I223 PolarHBondContact O-N 3.25Å; V220-I223 PolarHBondContact O-N 2.93Å; I223-L226 PolarHBondContact O-N 2.91Å; I223-R227 HydrophobicContact CG2-CG 4.4Å; I223-R227 WeakPolarHBondContact O-CG 3.32Å; I223-R227 PolarHBondContact O-N 3.07Å
224T86.3Confident82.2Confident38 Ų3876.9 Ų76.923%0.23338%0.381CS..Hα-helixtrans-63.3-45.3178.6-57.20000111V135 V220 T221 G222 L226 R227 V228V135-T224 HydrophobicContact CG1-CG2 3.78Å; V220-T224 WeakPolarHBondContact O-CB 3.11Å; V220-T224 PolarHBondContact O-N 2.78Å; V220-T224 PolarHBondContact O-OG1 3.23Å; T221-T224 PolarHBondContact O-N 2.92Å; G222-T224 PolarHBondContact O-N 3.26Å; T224-L226 VanDerWaalsContact C-N 3.33Å; T224-L226 PolarHBondContact O-N 2.84Å; T224-R227 PolarHBondContact O-N 3.42Å; T224-V228 WeakPolarHBondContact O-CG2 3.38Å; T224-V228 PolarHBondContact O-N 3.47Å
225L82.9Confident80.1Confident14 Ų1487.2 Ų87.27%0.07342%0.419CS..Hα-helixtrans-62.7-39175.6-70.7173000112.2V135 T221 G222 K229 M244 I245 L248V135-L225 HydrophobicContact CG1-CD2 4.32Å; V135-L225 HydrophobicContact CG1-CG 4.42Å; T221-L225 HydrophobicContact CG2-CD1 4.17Å; T221-L225 WeakPolarHBondContact O-CB 3.4Å; T221-L225 VanDerWaalsContact O-CG 3.29Å; T221-L225 WeakPolarHBondContact O-CG 3.36Å; T221-L225 PolarHBondContact O-N 3.3Å; G222-L225 PolarHBondContact O-N 2.95Å; L225-K229 WeakPolarHBondContact O-CB 3.35Å; L225-K229 PolarHBondContact O-N 3.35Å; L225-K229 VanDerWaalsContact O-N 3.09Å; L225-M244 HydrophobicContact CD1-CB 4.29Å; L225-M244 HydrophobicContact CD1-CE 4.36Å; L225-I245 HydrophobicContact CB-CD1 4.15Å; L225-I245 HydrophobicContact CB-CG1 3.98Å; L225-I245 HydrophobicContact CD1-CG1 4.37Å; L225-L248 HydrophobicContact CD1-CD1 4Å
226L83.6Confident77.7Confident63 Ų6392.8 Ų92.833%0.3345%0.446SS..Hα-helixtrans-63-47.5174.4-76.3167.4000111.6G222 I223 T224 V228 K229 F230 I245G222-L226 WeakPolarHBondContact O-CB 2.9Å; G222-L226 VanDerWaalsContact O-CG 3.3Å; G222-L226 WeakPolarHBondContact O-CG 3.09Å; G222-L226 PolarHBondContact O-N 3.43Å; I223-L226 PolarHBondContact O-N 2.91Å; T224-L226 VanDerWaalsContact C-N 3.33Å; T224-L226 PolarHBondContact O-N 2.84Å; L226-V228 PolarHBondContact O-N 3.33Å; L226-K229 WeakPolarHBondContact O-CB 3.43Å; L226-K229 PolarHBondContact O-N 3.2Å; L226-F230 WeakPolarHBondContact O-CD2 3.47Å; L226-F230 PolarHBondContact O-N 3.31Å; L226-I245 HydrophobicContact CD2-CD1 3.64Å; L226-I245 HydrophobicContact CG-CD1 3.81Å; L226-I245 HydrophobicContact CG-CG1 4.48Å
227R84.3Confident75.7Confident179 Ų17989.8 Ų89.868%0.67544%0.442SS*.Hα-helixtrans-60.5-45.8178.9-74.3178-178.6176.91112.3I223 T224 K229 F230 K231I223-R227 HydrophobicContact CG2-CG 4.4Å; I223-R227 WeakPolarHBondContact O-CG 3.32Å; I223-R227 PolarHBondContact O-N 3.07Å; T224-R227 PolarHBondContact O-N 3.42Å; R227-K229 VanDerWaalsContact C-N 3.27Å; R227-K229 PolarHBondContact O-N 3.38Å; R227-F230 PolarHBondContact O-N 2.87Å; R227-K231 PolarHBondContact O-N 3Å
228V79.1Confident73.6Confident80 Ų8099.4 Ų99.449%0.48548%0.475SS..Hα-helixtrans-59.9-41.3176.6171.80000110.6T224 L226 K231 S232T224-V228 WeakPolarHBondContact O-CG2 3.38Å; T224-V228 PolarHBondContact O-N 3.47Å; L226-V228 PolarHBondContact O-N 3.33Å; V228-K231 PolarHBondContact O-N 2.86Å; V228-S232 WeakPolarHBondContact O-CB 3.18Å; V228-S232 PolarHBondContact O-N 3.46Å
229K73.7Confident71.9Confident61 Ų61102 Ų10227%0.26549%0.494SS..Hα-helixtrans-63.5-45.4176.6179.2-168.9164.5-154.70112.5L225 L226 R227 K231 S232 F242L225-K229 WeakPolarHBondContact O-CB 3.35Å; L225-K229 PolarHBondContact O-N 3.35Å; L225-K229 VanDerWaalsContact O-N 3.09Å; L226-K229 WeakPolarHBondContact O-CB 3.43Å; L226-K229 PolarHBondContact O-N 3.2Å; R227-K229 VanDerWaalsContact C-N 3.27Å; R227-K229 PolarHBondContact O-N 3.38Å; K229-K231 VanDerWaalsContact C-N 3.29Å; K229-K231 PolarHBondContact O-N 3.38Å; K229-S232 PolarHBondContact O-N 2.91Å; K229-F242 HydrophobicContact CD-CE2 4.42Å
230F75.1Confident70.3Confident141 Ų141106.3 Ų106.362%0.61851%0.509SS*.Hα-helixtrans-63.8-35.9177.9-81.4-72.2000112.1L226 R227 S232L226-F230 WeakPolarHBondContact O-CD2 3.47Å; L226-F230 PolarHBondContact O-N 3.31Å; R227-F230 PolarHBondContact O-N 2.87Å; F230-S232 VanDerWaalsContact C-N 3.35Å
231K72.6Confident69Low195 Ų195106.8 Ų106.885%0.84851%0.507SS*.Hα-helixtrans-73.8-23.9176.3-160.6175-178.4179.70113.4R227 V228 K229R227-K231 PolarHBondContact O-N 3Å; V228-K231 PolarHBondContact O-N 2.86Å; K229-K231 VanDerWaalsContact C-N 3.29Å; K229-K231 PolarHBondContact O-N 3.38Å
232S64.3Low68Low67 Ų67111.1 Ų111.147%0.46953%0.526SS..THydrogen-bonded Turntrans-98.826.6-175-172.90000114.1V228 K229 F230 Q234V228-S232 WeakPolarHBondContact O-CB 3.18Å; V228-S232 PolarHBondContact O-N 3.46Å; K229-S232 PolarHBondContact O-N 2.91Å; F230-S232 VanDerWaalsContact C-N 3.35Å; S232-Q234 PolarHBondContact O-N 3.36Å
233Q56.1Low67.1Low169 Ų169112.1 Ų112.179%0.7953%0.527SS*.THydrogen-bonded Turntrans-59.7-5.5179.6-84-143.3-13.800115.4
234Q50.8Low66.3Low189 Ų189112.4 Ų112.488%0.88353%0.528SS*.THydrogen-bonded Turntrans-98.4-8.2-176.8-97.3163.2-31.100117.3S232S232-Q234 PolarHBondContact O-N 3.36Å
235R50.3Low65.9Low225 Ų225111.8 Ų111.885%0.84952%0.523SS*.SBendtrans-140.6121.7179.2-78.8-175170.1153.3-4.1114.9G237R235-G237 PolarHBondContact O-N 2.92Å
236Q45.2Very low65.7Low209 Ų209115.7 Ų115.798%0.97754%0.543SS*.SBendtrans-15.398.1166.5-146.393.9-22.100116.1
237G53.2Low65.6Low47 Ų47113.4 Ų113.449%0.48553%0.531SS..  trans-168.735.2176.500000114.2R235 S239R235-G237 PolarHBondContact O-N 2.92Å; G237-S239 PolarHBondContact O-N 2.81Å
238R50.1Low65.5Low224 Ų224105.3 Ų105.385%0.84550%0.501SS*.THydrogen-bonded Turntrans-77.4-14.7-154.7-168.5163.1151.4159.7-7.9116.8F242R238-F242 WeakPolarHBondContact O-CD2 3.15Å
239S56.4Low65.8Low56 Ų56106.7 Ų106.739%0.39251%0.505SS..THydrogen-bonded Turntrans-105.3-30.2-168176.40000116G237 K306G237-S239 PolarHBondContact O-N 2.81Å; S239-K306 PolarHBondContact OG-NZ 3.23Å
240H57.5Low66.4Low114 Ų114105.1 Ų105.153%0.52850%0.503SS..Hα-helixtrans-81-33.1-172.4-75.1-73.9000113.6M244H240-M244 WeakPolarHBondContact O-CG 3.26Å; H240-M244 PolarHBondContact O-N 3.49Å
241H64.4Low66.9Low77 Ų7798.5 Ų98.536%0.35647%0.474SS..Hα-helixtrans-71.7-36.1-178.9-71.7-84.9000113.3M244 I245H241-M244 PolarHBondContact O-N 3.34Å; H241-I245 WeakPolarHBondContact O-CD1 3.21Å; H241-I245 VanDerWaalsContact O-CG1 3.31Å; H241-I245 WeakPolarHBondContact O-CG1 3.47Å; H241-I245 PolarHBondContact O-N 3.29Å; H241-I245 VanDerWaalsContact O-N 3.15Å
242F66.4Low67.6Low95 Ų9590.6 Ų90.642%0.41744%0.44SS..Hα-helixtrans-64.9-42.2176.2-86.9-84.1000112.1K229 R238 M244 I245 I246K229-F242 HydrophobicContact CD-CE2 4.42Å; R238-F242 WeakPolarHBondContact O-CD2 3.15Å; F242-M244 VanDerWaalsContact C-N 3.33Å; F242-M244 PolarHBondContact O-N 3.26Å; F242-I245 PolarHBondContact O-N 3.07Å; F242-I246 VanDerWaalsContact O-CG1 3.29Å; F242-I246 WeakPolarHBondContact O-CG1 3.21Å; F242-I246 PolarHBondContact O-N 3.12Å
243E67.9Low68.8Low30 Ų3090.2 Ų90.214%0.1444%0.437CS..Hα-helixtrans-60.1-44.1179.1-169-178.4179.400111.3I245 I246 Q247 L304 R305 K306E243-I245 PolarHBondContact O-N 3.21Å; E243-I246 PolarHBondContact O-N 3Å; E243-Q247 WeakPolarHBondContact O-CB 3.46Å; E243-Q247 PolarHBondContact O-N 3.21Å; E243-L304 VanDerWaalsContact CG-O 3.28Å; E243-L304 WeakPolarHBondContact CG-O 3.3Å; E243-R305 VanDerWaalsContact OE1-C 3.23Å; E243-R305 WeakPolarHBondContact OE1-CA 3.47Å; E243-K306 VanDerWaalsContact OE1-CA 3.28Å; E243-K306 WeakPolarHBondContact OE1-CA 3.33Å; E243-K306 PolarHBondContact OE1-N 3.34Å; E243-K306 WeakPolarHBondContact OE2-CB 3.33Å
244M72.5Confident70.6Confident87 Ų8783.8 Ų83.843%0.42941%0.409SS..Hα-helixtrans-64.7-38.7175.9-67.2176.76800112.9L225 H240 H241 F242 Q247 L248L225-M244 HydrophobicContact CD1-CB 4.29Å; L225-M244 HydrophobicContact CD1-CE 4.36Å; H240-M244 WeakPolarHBondContact O-CG 3.26Å; H240-M244 PolarHBondContact O-N 3.49Å; H241-M244 PolarHBondContact O-N 3.34Å; F242-M244 VanDerWaalsContact C-N 3.33Å; F242-M244 PolarHBondContact O-N 3.26Å; M244-Q247 WeakPolarHBondContact O-CB 3.07Å; M244-Q247 PolarHBondContact O-N 2.9Å; M244-L248 VanDerWaalsContact O-CG 3.3Å; M244-L248 WeakPolarHBondContact O-CG 3.2Å; M244-L248 PolarHBondContact O-N 2.96Å
245I76.9Confident72.5Confident26 Ų2675.2 Ų75.213%0.13337%0.371CS..Hα-helixtrans-68.6-44.1178.1-67.5159.6000110.7L225 L226 H241 F242 E243 Q247 L248 L249L225-I245 HydrophobicContact CB-CD1 4.15Å; L225-I245 HydrophobicContact CB-CG1 3.98Å; L225-I245 HydrophobicContact CD1-CG1 4.37Å; L226-I245 HydrophobicContact CD2-CD1 3.64Å; L226-I245 HydrophobicContact CG-CD1 3.81Å; L226-I245 HydrophobicContact CG-CG1 4.48Å; H241-I245 WeakPolarHBondContact O-CD1 3.21Å; H241-I245 VanDerWaalsContact O-CG1 3.31Å; H241-I245 WeakPolarHBondContact O-CG1 3.47Å; H241-I245 PolarHBondContact O-N 3.29Å; H241-I245 VanDerWaalsContact O-N 3.15Å; F242-I245 PolarHBondContact O-N 3.07Å; E243-I245 PolarHBondContact O-N 3.21Å; I245-Q247 VanDerWaalsContact C-N 3.26Å; I245-Q247 PolarHBondContact O-N 3.46Å; I245-L248 PolarHBondContact O-N 3.49Å; I245-L249 WeakPolarHBondContact O-CB 3.37Å; I245-L249 PolarHBondContact O-N 3.36Å
246I78.6Confident74.5Confident95 Ų9566.2 Ų66.249%0.48734%0.342SS..Hα-helixtrans-60.8-40.5175.1-68166.1000110F242 E243 L249 A250 L304F242-I246 VanDerWaalsContact O-CG1 3.29Å; F242-I246 WeakPolarHBondContact O-CG1 3.21Å; F242-I246 PolarHBondContact O-N 3.12Å; E243-I246 PolarHBondContact O-N 3Å; I246-L249 PolarHBondContact O-N 2.61Å; I246-A250 WeakPolarHBondContact O-CB 3.1Å; I246-A250 PolarHBondContact O-N 3.12Å; I246-L304 HydrophobicContact CG2-CD2 4.08Å
247Q82.2Confident76.9Confident15 Ų1561.3 Ų61.37%0.0732%0.321CS..Hα-helixtrans-58.9-50.8174.6-172.6170.714.800112.9E243 M244 I245 L249 A250 I251 V300 Y301 L304E243-Q247 WeakPolarHBondContact O-CB 3.46Å; E243-Q247 PolarHBondContact O-N 3.21Å; M244-Q247 WeakPolarHBondContact O-CB 3.07Å; M244-Q247 PolarHBondContact O-N 2.9Å; I245-Q247 VanDerWaalsContact C-N 3.26Å; I245-Q247 PolarHBondContact O-N 3.46Å; Q247-L249 VanDerWaalsContact C-N 3.31Å; Q247-L249 PolarHBondContact O-N 3.42Å; Q247-A250 PolarHBondContact O-N 2.91Å; Q247-I251 HydrophobicContact CG-CD1 3.95Å; Q247-I251 VanDerWaalsContact O-CG1 3.25Å; Q247-I251 WeakPolarHBondContact O-CG1 3.29Å; Q247-I251 PolarHBondContact O-N 3.19Å; Q247-V300 WeakPolarHBondContact CG-O 3.31Å; Q247-V300 PolarHBondContact NE2-O 3.45Å; Q247-Y301 PolarHBondContact NE2-O 3.25Å; Q247-L304 HydrophobicContact CB-CB 3.66Å; Q247-L304 HydrophobicContact CB-CD1 3.95Å; Q247-L304 HydrophobicContact CB-CG 4.31Å; Q247-L304 HydrophobicContact CG-CB 3.7Å; Q247-L304 HydrophobicContact CG-CD1 4Å; Q247-L304 HydrophobicContact CG-CG 4.46Å; Q247-L304 PolarHBondContact OE1-O 3.27Å
248L82.1Confident78.9Confident10 Ų1059.4 Ų59.45%0.05230%0.3CS..Hα-helixtrans-61.9-41.8179.4-67.8169.4000111.4N218 T221 L225 M244 I245 I251 M252N218-L248 HydrophobicContact CB-CD2 4.41Å; N218-L248 WeakPolarHBondContact OD1-CD2 3.16Å; T221-L248 HydrophobicContact CG2-CD1 3.56Å; L225-L248 HydrophobicContact CD1-CD1 4Å; M244-L248 VanDerWaalsContact O-CG 3.3Å; M244-L248 WeakPolarHBondContact O-CG 3.2Å; M244-L248 PolarHBondContact O-N 2.96Å; I245-L248 PolarHBondContact O-N 3.49Å; L248-I251 PolarHBondContact O-N 2.98Å; L248-M252 WeakPolarHBondContact O-CB 3.19Å; L248-M252 VanDerWaalsContact O-CG 3.22Å; L248-M252 WeakPolarHBondContact O-CG 3.45Å; L248-M252 PolarHBondContact O-N 2.71Å
249L84.9Confident81.1Confident109 Ų10949 Ų4957%0.57126%0.261SS*.Hα-helixtrans-63.4-43.1176.3-173132.4000111.7I245 I246 Q247 M252 C253I245-L249 WeakPolarHBondContact O-CB 3.37Å; I245-L249 PolarHBondContact O-N 3.36Å; I246-L249 PolarHBondContact O-N 2.61Å; Q247-L249 VanDerWaalsContact C-N 3.31Å; Q247-L249 PolarHBondContact O-N 3.42Å; L249-M252 PolarHBondContact O-N 3.08Å; L249-C253 WeakPolarHBondContact O-CB 3.33Å; L249-C253 PolarHBondContact O-N 3.2Å; L249-C253 PolarHBondContact O-SG 2.99Å
250A86.3Confident83Confident27 Ų2748 Ų4822%0.22325%0.254CS..Hα-helixtrans-61.9-44175.700000111.7I246 Q247 M252 C253 V254 V300 L304I246-A250 WeakPolarHBondContact O-CB 3.1Å; I246-A250 PolarHBondContact O-N 3.12Å; Q247-A250 PolarHBondContact O-N 2.91Å; A250-M252 PolarHBondContact O-N 3.27Å; A250-C253 PolarHBondContact O-N 3.28Å; A250-V254 WeakPolarHBondContact O-CB 3.39Å; A250-V254 VanDerWaalsContact O-CG2 3.26Å; A250-V254 WeakPolarHBondContact O-CG2 3.27Å; A250-V254 PolarHBondContact O-N 2.91Å; A250-V300 HydrophobicContact CB-CG1 3.67Å; A250-L304 HydrophobicContact CB-CD1 4.13Å
251I86.1Confident84.8Confident2 Ų244.7 Ų44.71%0.0124%0.242CC..Hα-helixtrans-61-47.4177.6-65.7164.3000110.1Q247 L248 S255 V300 Y301Q247-I251 HydrophobicContact CG-CD1 3.95Å; Q247-I251 VanDerWaalsContact O-CG1 3.25Å; Q247-I251 WeakPolarHBondContact O-CG1 3.29Å; Q247-I251 PolarHBondContact O-N 3.19Å; L248-I251 PolarHBondContact O-N 2.98Å; I251-S255 WeakPolarHBondContact O-CB 3.45Å; I251-S255 PolarHBondContact O-N 3.36Å; I251-S255 PolarHBondContact O-OG 2.75Å; I251-V300 HydrophobicContact CB-CG1 4.2Å; I251-V300 HydrophobicContact CD1-CG1 4.46Å; I251-V300 HydrophobicContact CG1-CB 3.95Å; I251-V300 HydrophobicContact CG1-CG1 3.33Å; I251-Y301 HydrophobicContact CD1-CD1 3.68Å; I251-Y301 HydrophobicContact CD1-CE1 3.54Å; I251-Y301 HydrophobicContact CG1-CD1 4.34Å; I251-Y301 HydrophobicContact CG1-CE1 4.09Å; I251-Y301 HydrophobicContact CG2-CE1 4.28Å
252M87Confident86.3Confident29 Ų2941.3 Ų41.314%0.14323%0.227CC..Hα-helixtrans-58.9-52.9178.1-71.4166.258.400111.3F215 N218 A219 L248 L249 A250 C256F215-M252 HydrophobicContact CD2-CB 4.31Å; F215-M252 HydrophobicContact CD2-CE 3.55Å; F215-M252 HydrophobicContact CD2-CG 4.38Å; F215-M252 HydrophobicContact CE1-CE 4.44Å; F215-M252 HydrophobicContact CE2-CE 3.3Å; F215-M252 HydrophobicContact CG-CE 4.23Å; F215-M252 HydrophobicContact CZ-CE 3.79Å; N218-M252 HydrophobicContact CB-CG 3.46Å; N218-M252 VanDerWaalsContact CB-CG 3.46Å; N218-M252 HydrophobicContact CB-SD 3.51Å; N218-M252 VanDerWaalsContact CB-SD 3.51Å; A219-M252 HydrophobicContact CB-CE 4.06Å; L248-M252 WeakPolarHBondContact O-CB 3.19Å; L248-M252 VanDerWaalsContact O-CG 3.22Å; L248-M252 WeakPolarHBondContact O-CG 3.45Å; L248-M252 PolarHBondContact O-N 2.71Å; L249-M252 PolarHBondContact O-N 3.08Å; A250-M252 PolarHBondContact O-N 3.27Å; M252-C256 WeakPolarHBondContact O-CB 3.37Å; M252-C256 PolarHBondContact O-N 3.48Å; M252-C256 PolarHBondContact O-SG 3.46Å
253C90.8Very high87.7Confident60 Ų6036.8 Ų36.841%0.40521%0.207SC..Hα-helixtrans-62.2-49.6-177.5-68.70000112L249 A250 C256 I257L249-C253 WeakPolarHBondContact O-CB 3.33Å; L249-C253 PolarHBondContact O-N 3.2Å; L249-C253 PolarHBondContact O-SG 2.99Å; A250-C253 PolarHBondContact O-N 3.28Å; C253-C256 PolarHBondContact O-N 3.1Å; C253-I257 HydrophobicContact CB-CD1 4.48Å; C253-I257 WeakPolarHBondContact O-CB 3.47Å; C253-I257 WeakPolarHBondContact O-CD1 3.33Å; C253-I257 WeakPolarHBondContact O-CG1 3.45Å; C253-I257 PolarHBondContact O-N 3.26Å
254V92.1Very high89Confident33 Ų3337.9 Ų37.920%0.222%0.216CC..Hα-helixtrans-62.4-47-179.21730000110.6A250 C256 I257 C258 L296 V300A250-V254 WeakPolarHBondContact O-CB 3.39Å; A250-V254 VanDerWaalsContact O-CG2 3.26Å; A250-V254 WeakPolarHBondContact O-CG2 3.27Å; A250-V254 PolarHBondContact O-N 2.91Å; V254-C256 PolarHBondContact O-N 2.91Å; V254-I257 PolarHBondContact O-N 2.92Å; V254-C258 WeakPolarHBondContact O-CB 3.49Å; V254-C258 PolarHBondContact O-N 3.32Å; V254-C258 PolarHBondContact O-SG 2.73Å; V254-C258 VanDerWaalsContact O-SG 3.33Å; V254-L296 HydrophobicContact CG1-CB 4.06Å; V254-L296 HydrophobicContact CG1-CD1 3.83Å; V254-V300 HydrophobicContact CB-CG2 4.49Å; V254-V300 HydrophobicContact CG1-CG2 4.42Å; V254-V300 HydrophobicContact CG2-CG2 4.36Å
255S91.6Very high90Very high10 Ų1034.2 Ų34.27%0.0720%0.198CC..Hα-helixtrans-60.9-46.4-179.7-55.20000111.6I251 W259I251-S255 WeakPolarHBondContact O-CB 3.45Å; I251-S255 PolarHBondContact O-N 3.36Å; I251-S255 PolarHBondContact O-OG 2.75Å; S255-W259 WeakPolarHBondContact O-CB 3.33Å; S255-W259 PolarHBondContact O-N 3.44Å
256C93.2Very high90.8Very high36 Ų3633 Ų3324%0.24319%0.192CC..Hα-helixtrans-66-46.6179.8-70.70000112M252 C253 V254 C258 S260M252-C256 WeakPolarHBondContact O-CB 3.37Å; M252-C256 PolarHBondContact O-N 3.48Å; M252-C256 PolarHBondContact O-SG 3.46Å; C253-C256 PolarHBondContact O-N 3.1Å; V254-C256 PolarHBondContact O-N 2.91Å; C256-C258 VanDerWaalsContact C-N 3.32Å; C256-C258 PolarHBondContact O-N 3.23Å; C256-S260 WeakPolarHBondContact O-CB 3.35Å; C256-S260 PolarHBondContact O-N 3.48Å; C256-S260 VanDerWaalsContact O-N 3.07Å; C256-S260 PolarHBondContact O-OG 2.86Å
257I94.8Very high91.5Very high106 Ų10629.1 Ų29.154%0.54417%0.174SC..Hα-helixtrans-66-37.3-177.7-68.7166.6000111.3C253 V254 P261 M289C253-I257 HydrophobicContact CB-CD1 4.48Å; C253-I257 WeakPolarHBondContact O-CB 3.47Å; C253-I257 WeakPolarHBondContact O-CD1 3.33Å; C253-I257 WeakPolarHBondContact O-CG1 3.45Å; C253-I257 PolarHBondContact O-N 3.26Å; V254-I257 PolarHBondContact O-N 2.92Å; I257-P261 WeakPolarHBondContact O-CD 3.38Å; I257-P261 VanDerWaalsContact O-CG 3.32Å; I257-P261 WeakPolarHBondContact O-CG 3.49Å; I257-M289 HydrophobicContact CG2-CE 3.81Å
258C95.1Very high92Very high6 Ų634.5 Ų34.54%0.04119%0.194CC..Hα-helixtrans-79-46.5-177.5-73.30000113.3V254 C256 M289 A290 N293V254-C258 WeakPolarHBondContact O-CB 3.49Å; V254-C258 PolarHBondContact O-N 3.32Å; V254-C258 PolarHBondContact O-SG 2.73Å; V254-C258 VanDerWaalsContact O-SG 3.33Å; C256-C258 VanDerWaalsContact C-N 3.32Å; C256-C258 PolarHBondContact O-N 3.23Å; C258-M289 WeakPolarHBondContact CA-O 3.29Å; C258-M289 WeakPolarHBondContact CB-O 3.31Å; C258-M289 CarbonylContact O-C 3.57Å; C258-M289 VanDerWaalsContact O-C 3.24Å; C258-M289 PolarHBondContact SG-O 3.49Å; C258-M289 VanDerWaalsContact SG-O 3.39Å; C258-A290 WeakPolarHBondContact O-CA 3.33Å; C258-A290 PolarHBondContact O-N 3.07Å; C258-A290 VanDerWaalsContact O-N 3.15Å; C258-N293 HydrophobicContact CB-CB 3.55Å
259W96.4Very high92.3Very high5 Ų534.4 Ų34.42%0.01919%0.193CC..Hα-helixtrans-90.3-33.5-173-77.7107.1000114.8G117 L121 L211 S255 P261 F262 L263 A290 N293 Q294G117-W259 WeakPolarHBondContact O-CH2 3.49Å; L121-W259 HydrophobicContact CD1-CD2 4.03Å; L121-W259 HydrophobicContact CD1-CE3 3.85Å; L121-W259 HydrophobicContact CD1-CZ3 4.14Å; L121-W259 HydrophobicContact CD2-CB 4.23Å; L121-W259 HydrophobicContact CD2-CD2 3.68Å; L121-W259 HydrophobicContact CD2-CE3 4.36Å; L121-W259 HydrophobicContact CD2-CG 3.6Å; L121-W259 HydrophobicContact CG-CD2 3.96Å; L121-W259 HydrophobicContact CG-CE3 4.26Å; L121-W259 HydrophobicContact CG-CG 4.41Å; L121-W259 HydrophobicContact CG-CZ2 4.22Å; L211-W259 HydrophobicContact CD1-CB 3.67Å; L211-W259 HydrophobicContact CD2-CB 4.09Å; L211-W259 HydrophobicContact CD2-CG 4.42Å; L211-W259 HydrophobicContact CG-CB 4.35Å; S255-W259 WeakPolarHBondContact O-CB 3.33Å; S255-W259 PolarHBondContact O-N 3.44Å; W259-P261 VanDerWaalsContact C-CD 3.49Å; W259-F262 PolarHBondContact O-N 3.32Å; W259-L263 HydrophobicContact CB-CD1 4.13Å; W259-L263 WeakPolarHBondContact O-CG 3.25Å; W259-L263 PolarHBondContact O-N 3.36Å; W259-L263 VanDerWaalsContact O-N 3.07Å; W259-A290 HydrophobicContact CD2-CB 4.25Å; W259-A290 HydrophobicContact CE3-CB 3.79Å; W259-A290 HydrophobicContact CH2-CB 4.24Å; W259-A290 HydrophobicContact CZ3-CB 3.8Å; W259-N293 PolarHBondContact NE1-OD1 3.22Å; W259-Q294 HydrophobicContact CZ2-CG 4.42Å
260S95.9Very high92.5Very high36 Ų3629.3 Ų29.325%0.25217%0.167SC..Hα-helixtrans-59.1-42.5-174.6-50.40000113.1C256 F262 L263 V264C256-S260 WeakPolarHBondContact O-CB 3.35Å; C256-S260 PolarHBondContact O-N 3.48Å; C256-S260 VanDerWaalsContact O-N 3.07Å; C256-S260 PolarHBondContact O-OG 2.86Å; S260-F262 VanDerWaalsContact C-N 3.28Å; S260-F262 PolarHBondContact O-N 3.42Å; S260-L263 PolarHBondContact O-N 2.86Å; S260-V264 VanDerWaalsContact O-CB 3.25Å; S260-V264 WeakPolarHBondContact O-CB 3.28Å; S260-V264 WeakPolarHBondContact O-CG2 2.93Å; S260-V264 PolarHBondContact O-N 2.85Å
261P95.4Very high92.7Very high44 Ų4433.5 Ų33.529%0.28619%0.185SC..Hα-helixtrans-55.7-44.3178.1-26.135.4000112.3I257 W259 T265 A286I257-P261 WeakPolarHBondContact O-CD 3.38Å; I257-P261 VanDerWaalsContact O-CG 3.32Å; I257-P261 WeakPolarHBondContact O-CG 3.49Å; W259-P261 VanDerWaalsContact C-CD 3.49Å; P261-T265 VanDerWaalsContact O-CB 3.28Å; P261-T265 WeakPolarHBondContact O-CB 3.43Å; P261-T265 PolarHBondContact O-N 2.92Å; P261-T265 VanDerWaalsContact O-N 3.07Å; P261-T265 PolarHBondContact O-OG1 3.4Å; P261-A286 HydrophobicContact CB-CB 4.01Å
262F95.1Very high92.5Very high6 Ų637 Ų373%0.02620%0.203CC..Hα-helixtrans-69.1-49.1-178.4-171.2-112.3000111.8W183 F185 F203 W259 S260 T265 M266 A286 L287 A290W183-F262 HydrophobicContact CH2-CE2 4.31Å; W183-F262 HydrophobicContact CH2-CZ 4.5Å; W183-F262 HydrophobicContact CZ3-CE2 4.5Å; W183-F262 HydrophobicContact CZ3-CZ 4.32Å; F185-F262 HydrophobicContact CE1-CZ 4.43Å; F185-F262 HydrophobicContact CZ-CE1 4.4Å; F185-F262 HydrophobicContact CZ-CZ 4.34Å; F203-F262 HydrophobicContact CE1-CD1 4.03Å; F203-F262 AromaticContact CE1-CE1 3.6Å; F203-F262 HydrophobicContact CE1-CE1 3.6Å; F203-F262 HydrophobicContact CZ-CD1 4.31Å; F203-F262 AromaticContact CZ-CE1 3.75Å; F203-F262 HydrophobicContact CZ-CE1 3.75Å; W259-F262 PolarHBondContact O-N 3.32Å; S260-F262 VanDerWaalsContact C-N 3.28Å; S260-F262 PolarHBondContact O-N 3.42Å; F262-T265 PolarHBondContact O-N 2.89Å; F262-M266 HydrophobicContact CD2-CE 4.04Å; F262-M266 HydrophobicContact CE1-CG 4.36Å; F262-M266 HydrophobicContact CE2-CE 3.34Å; F262-M266 HydrophobicContact CZ-CE 3.65Å; F262-M266 HydrophobicContact CZ-CG 4.32Å; F262-M266 WeakPolarHBondContact O-CG 3.47Å; F262-M266 PolarHBondContact O-N 3.13Å; F262-A286 HydrophobicContact CB-CB 4.2Å; F262-A286 HydrophobicContact CD2-CB 4.24Å; F262-L287 HydrophobicContact CD2-CB 4.1Å; F262-L287 HydrophobicContact CD2-CD1 4.29Å; F262-L287 HydrophobicContact CE2-CB 3.95Å; F262-L287 HydrophobicContact CE2-CD1 3.67Å; F262-L287 HydrophobicContact CE2-CG 4.41Å; F262-L287 HydrophobicContact CZ-CD1 3.81Å; F262-A290 HydrophobicContact CB-CB 4.23Å; F262-A290 HydrophobicContact CG-CB 4.47Å
263L96.8Very high91.2Very high0 Ų041.5 Ų41.50%022%0.224CC..Hα-helixtrans-67-40.1-177.5-64.5167.7000112.5L121 F203 S204 L208 L211 W259 S260 T265 M266 A267L121-L263 HydrophobicContact CD1-CD1 4.11Å; L121-L263 HydrophobicContact CD1-CD2 4.38Å; F203-L263 HydrophobicContact CD1-CD2 4.22Å; F203-L263 HydrophobicContact CE1-CD2 3.73Å; F203-L263 HydrophobicContact CZ-CD2 4.32Å; S204-L263 VanDerWaalsContact CB-O 3.28Å; S204-L263 WeakPolarHBondContact CB-O 3.48Å; L208-L263 HydrophobicContact CD2-CB 3.87Å; L208-L263 HydrophobicContact CD2-CD1 4.27Å; L208-L263 HydrophobicContact CG-CB 3.89Å; L208-L263 HydrophobicContact CG-CD1 4.38Å; L211-L263 HydrophobicContact CD1-CD1 3.44Å; L211-L263 VanDerWaalsContact CD1-CD1 3.44Å; L211-L263 HydrophobicContact CG-CD1 4.19Å; W259-L263 HydrophobicContact CB-CD1 4.13Å; W259-L263 WeakPolarHBondContact O-CG 3.25Å; W259-L263 PolarHBondContact O-N 3.36Å; W259-L263 VanDerWaalsContact O-N 3.07Å; S260-L263 PolarHBondContact O-N 2.86Å; L263-T265 VanDerWaalsContact C-N 3.35Å; L263-M266 PolarHBondContact O-N 3.38Å; L263-A267 WeakPolarHBondContact O-CB 3.25Å; L263-A267 PolarHBondContact O-N 3.32Å
264V95.1Very high89.5Confident54 Ų5446 Ų4633%0.32724%0.244SC..Hα-helixtrans-66.2-39.3175.9172.60000110.7L208 S260 A267 R268L208-V264 HydrophobicContact CD2-CG2 4.25Å; S260-V264 VanDerWaalsContact O-CB 3.25Å; S260-V264 WeakPolarHBondContact O-CB 3.28Å; S260-V264 WeakPolarHBondContact O-CG2 2.93Å; S260-V264 PolarHBondContact O-N 2.85Å; V264-A267 PolarHBondContact O-N 2.87Å; V264-R268 HydrophobicContact CG1-CG 4.36Å; V264-R268 WeakPolarHBondContact O-CB 3.44Å; V264-R268 VanDerWaalsContact O-CG 3.27Å; V264-R268 WeakPolarHBondContact O-CG 3.35Å; V264-R268 PolarHBondContact O-N 3.46Å
265T93Very high87.6Confident10 Ų1055.1 Ų55.16%0.06128%0.275CS..Hα-helixtrans-62.3-46.7175.8-58.40000110.9P261 F262 L263 A267 R268 I269 E278 I283P261-T265 VanDerWaalsContact O-CB 3.28Å; P261-T265 WeakPolarHBondContact O-CB 3.43Å; P261-T265 PolarHBondContact O-N 2.92Å; P261-T265 VanDerWaalsContact O-N 3.07Å; P261-T265 PolarHBondContact O-OG1 3.4Å; F262-T265 PolarHBondContact O-N 2.89Å; L263-T265 VanDerWaalsContact C-N 3.35Å; T265-A267 PolarHBondContact O-N 2.87Å; T265-R268 PolarHBondContact O-N 3.18Å; T265-I269 HydrophobicContact CG2-CD1 3.98Å; T265-I269 VanDerWaalsContact O-CG1 3.31Å; T265-I269 WeakPolarHBondContact O-CG1 3.36Å; T265-I269 PolarHBondContact O-N 3.47Å; T265-E278 HydrophobicContact CG2-CB 4.38Å; T265-E278 HydrophobicContact CG2-CG 4.2Å; T265-I283 HydrophobicContact CG2-CG1 3.97Å
266M93.7Very high85.9Confident0 Ų056.7 Ų56.70%029%0.286CS..Hα-helixtrans-63.8-39.3177.1-65.7-55.7155.500112.6W183 F185 T188 L200 F262 L263 I269 G270 I283W183-M266 HydrophobicContact CH2-CE 3.98Å; F185-M266 HydrophobicContact CD1-CE 4.39Å; F185-M266 HydrophobicContact CD1-SD 4.23Å; F185-M266 HydrophobicContact CE1-CE 4.26Å; F185-M266 HydrophobicContact CE1-CG 4.22Å; F185-M266 HydrophobicContact CE1-SD 3.79Å; T188-M266 HydrophobicContact CG2-CE 4.33Å; T188-M266 HydrophobicContact CG2-SD 3.97Å; L200-M266 HydrophobicContact CD2-SD 3.87Å; F262-M266 HydrophobicContact CD2-CE 4.04Å; F262-M266 HydrophobicContact CE1-CG 4.36Å; F262-M266 HydrophobicContact CE2-CE 3.34Å; F262-M266 HydrophobicContact CZ-CE 3.65Å; F262-M266 HydrophobicContact CZ-CG 4.32Å; F262-M266 WeakPolarHBondContact O-CG 3.47Å; F262-M266 PolarHBondContact O-N 3.13Å; L263-M266 PolarHBondContact O-N 3.38Å; M266-I269 PolarHBondContact O-N 3.16Å; M266-I269 HydrophobicContact SD-CD1 4.42Å; M266-G270 PolarHBondContact O-N 3.22Å; M266-I283 HydrophobicContact CE-CG2 3.83Å
267A93.7Very high84.3Confident13 Ų1364.4 Ų64.411%0.10732%0.315CS..Hα-helixtrans-62.8-44.4173.800000111.6S204 L263 V264 T265 I269 G270 I271S204-A267 WeakPolarHBondContact OG-CA 3.41Å; L263-A267 WeakPolarHBondContact O-CB 3.25Å; L263-A267 PolarHBondContact O-N 3.32Å; V264-A267 PolarHBondContact O-N 2.87Å; T265-A267 PolarHBondContact O-N 2.87Å; A267-I269 VanDerWaalsContact C-N 3.35Å; A267-I269 PolarHBondContact O-N 3.06Å; A267-G270 PolarHBondContact O-N 3Å; A267-I271 VanDerWaalsContact O-CG1 3.25Å; A267-I271 WeakPolarHBondContact O-CG1 3.44Å; A267-I271 PolarHBondContact O-N 3.16Å
268R92Very high83.2Confident129 Ų12961.8 Ų61.849%0.48730%0.301SS..Hα-helixtrans-61.3-42.3178-77.4176.7179.7-167.10.8112.3V264 T265 G270 I271 N272 E278V264-R268 HydrophobicContact CG1-CG 4.36Å; V264-R268 WeakPolarHBondContact O-CB 3.44Å; V264-R268 VanDerWaalsContact O-CG 3.27Å; V264-R268 WeakPolarHBondContact O-CG 3.35Å; V264-R268 PolarHBondContact O-N 3.46Å; T265-R268 PolarHBondContact O-N 3.18Å; R268-G270 VanDerWaalsContact C-N 3.34Å; R268-I271 PolarHBondContact O-N 3.45Å; R268-N272 WeakPolarHBondContact O-CB 3.12Å; R268-N272 PolarHBondContact O-N 3.44Å; R268-E278 IonicContact NH1-OE1 3.55Å; R268-E278 PolarHBondContact NH1-OE1 2.88Å
269I89.6Confident82.4Confident7 Ų765.5 Ų65.54%0.03632%0.323CS..Hα-helixtrans-64.4-41.3176.1-65.7166.7000110.1T188 V191 L200 T265 M266 A267 I271 I283T188-I269 HydrophobicContact CG2-CD1 4.37Å; T188-I269 VanDerWaalsContact O-CG2 3.31Å; T188-I269 WeakPolarHBondContact O-CG2 3.21Å; V191-I269 HydrophobicContact CG2-CG2 4.1Å; L200-I269 HydrophobicContact CD1-CG2 3.8Å; T265-I269 HydrophobicContact CG2-CD1 3.98Å; T265-I269 VanDerWaalsContact O-CG1 3.31Å; T265-I269 WeakPolarHBondContact O-CG1 3.36Å; T265-I269 PolarHBondContact O-N 3.47Å; M266-I269 PolarHBondContact O-N 3.16Å; M266-I269 HydrophobicContact SD-CD1 4.42Å; A267-I269 VanDerWaalsContact C-N 3.35Å; A267-I269 PolarHBondContact O-N 3.06Å; I269-I271 PolarHBondContact O-N 2.04Å; I269-I283 HydrophobicContact CD1-CD1 3.95Å; I269-I283 HydrophobicContact CD1-CG1 4.5Å
270G89.4Confident81.6Confident3 Ų366.4 Ų66.43%0.03133%0.33CS..Hα-helixtrans-67.4-31177.100000114.7M266 A267 R268M266-G270 PolarHBondContact O-N 3.22Å; A267-G270 PolarHBondContact O-N 3Å; R268-G270 VanDerWaalsContact C-N 3.34Å
271I89.7Confident81Confident115 Ų11568 Ų6859%0.5933%0.334SS*.Hα-helixtrans-84.9-42.6-179.7-65.1168.6000112L201 A267 R268 I269 E273L201-I271 HydrophobicContact CD2-CG1 3.78Å; A267-I271 VanDerWaalsContact O-CG1 3.25Å; A267-I271 WeakPolarHBondContact O-CG1 3.44Å; A267-I271 PolarHBondContact O-N 3.16Å; R268-I271 PolarHBondContact O-N 3.45Å; I269-I271 PolarHBondContact O-N 2.04Å; I271-E273 PolarHBondContact O-N 3.04Å
272N82.6Confident80.6Confident75 Ų7568.6 Ų68.640%0.40134%0.336SS..  trans-95.394.5-168.5-71-36.6000112.5R268 N274R268-N272 WeakPolarHBondContact O-CB 3.12Å; R268-N272 PolarHBondContact O-N 3.44Å; N272-N274 PolarHBondContact O-N 3.06Å; N272-N274 VanDerWaalsContact O-N 3.09Å
273E59.6Low80.2Confident124 Ų12469 Ų6958%0.57934%0.339SS*.THydrogen-bonded Turntrans-54.2-24.3-179.5173.9157-13000116.2R197 I271R197-E273 IonicContact CZ-OE1 2.78Å; R197-E273 VanDerWaalsContact CZ-OE1 3.28Å; R197-E273 IonicContact NH1-OE1 2.71Å; R197-E273 PolarHBondContact NH1-OE1 2.91Å; R197-E273 IonicContact NH1-OE2 3.28Å; R197-E273 IonicContact NH2-OE1 3.26Å; R197-E273 PolarHBondContact NH2-OE1 3Å; I271-E273 PolarHBondContact O-N 3.04Å
274N54.3Low79.8Confident155 Ų15569.5 Ų69.583%0.82934%0.341SS*.THydrogen-bonded Turntrans-149.88.4-169.4-113.6-19.1000116.4N272N272-N274 PolarHBondContact O-N 3.06Å; N272-N274 VanDerWaalsContact O-N 3.09Å
275R52.1Low79.5Confident223 Ų22372.7 Ų72.784%0.84235%0.351SS*.THydrogen-bonded Turntrans-134.3-11.7-165.5-68.5-89.1-150.6-152.80.3115.7K277R275-K277 VanDerWaalsContact C-N 3.34Å; R275-K277 PolarHBondContact O-N 3.41Å
276S55.5Low79.4Confident43 Ų4372.3 Ų72.330%0.30135%0.349SS..  trans-7689.6-18065.50000110.1E278S276-E278 PolarHBondContact O-N 3.4Å
277K61.5Low79.3Confident199 Ų19973.6 Ų73.687%0.86536%0.356SS*.  trans-72.944.3163.3-65.1-176.4178.3-178.40110.4R275 T279R275-K277 VanDerWaalsContact C-N 3.34Å; R275-K277 PolarHBondContact O-N 3.41Å; K277-T279 PolarHBondContact O-N 3.49Å
278E71.1Confident79.2Confident50 Ų5075.8 Ų75.823%0.23436%0.361CS..  trans-71.3107.6174.1-69.2-66.5171.300106.8T265 R268 S276 T282T265-E278 HydrophobicContact CG2-CB 4.38Å; T265-E278 HydrophobicContact CG2-CG 4.2Å; R268-E278 IonicContact NH1-OE1 3.55Å; R268-E278 PolarHBondContact NH1-OE1 2.88Å; S276-E278 PolarHBondContact O-N 3.4Å; E278-T282 WeakPolarHBondContact OE2-CG2 2.99Å
279T77.5Confident79.2Confident84 Ų8471.5 Ų71.552%0.51535%0.347SS..  trans-63.7145.3-178.8-51.40000109.3K277 E281 T282 I283K277-T279 PolarHBondContact O-N 3.49Å; T279-E281 HydrophobicContact CG2-CB 4.14Å; T279-E281 HydrophobicContact CG2-CG 4.27Å; T279-E281 PolarHBondContact O-N 2.82Å; T279-T282 WeakPolarHBondContact O-CB 3.35Å; T279-T282 PolarHBondContact O-N 3.2Å; T279-I283 PolarHBondContact O-N 2.96Å
280C80.2Confident79.3Confident25 Ų2571.3 Ų71.317%0.16935%0.347CS..Hα-helixtrans-47.9-37.4172.5177.80000112.6C20 A179 T282 I283 L284C20-C280 HydrophobicContact CB-CB 3.86Å; C20-C280 WeakPolarHBondContact CB-SG 3.45Å; C20-C280 PolarHBondContact SG-SG 2.89Å; A179-C280 HydrophobicContact CB-CB 3.99Å; C280-T282 PolarHBondContact O-N 3.35Å; C280-I283 PolarHBondContact O-N 2.89Å; C280-L284 WeakPolarHBondContact O-CB 3.4Å; C280-L284 WeakPolarHBondContact O-CG 3.39Å; C280-L284 PolarHBondContact O-N 3.32Å
281E82.9Confident79.4Confident69 Ų6973 Ų7332%0.32236%0.356SS..Hα-helixtrans-59.7-41.7175-66.2-62.7158.500113C20 T22 T279 L284 F285C20-E281 PolarHBondContact SG-OE1 3.37Å; T22-E281 WeakPolarHBondContact CB-OE1 3.26Å; T22-E281 WeakPolarHBondContact CG2-OE1 3.39Å; T22-E281 PolarHBondContact OG1-OE1 2.69Å; T279-E281 HydrophobicContact CG2-CB 4.14Å; T279-E281 HydrophobicContact CG2-CG 4.27Å; T279-E281 PolarHBondContact O-N 2.82Å; E281-L284 PolarHBondContact O-N 2.89Å; E281-F285 VanDerWaalsContact O-CB 3.29Å; E281-F285 WeakPolarHBondContact O-CB 3.29Å; E281-F285 PolarHBondContact O-N 3.46Å
282T86.4Confident79.5Confident56 Ų5672.5 Ų72.534%0.34435%0.347SS..Hα-helixtrans-65.1-43.4177.2-51.20000110.9E278 T279 C280 F285 A286E278-T282 WeakPolarHBondContact OE2-CG2 2.99Å; T279-T282 WeakPolarHBondContact O-CB 3.35Å; T279-T282 PolarHBondContact O-N 3.2Å; C280-T282 PolarHBondContact O-N 3.35Å; T282-F285 PolarHBondContact O-N 2.9Å; T282-A286 VanDerWaalsContact O-CB 3.29Å; T282-A286 WeakPolarHBondContact O-CB 3.35Å; T282-A286 PolarHBondContact O-N 3.39Å
283I88.6Confident79.9Confident16 Ų1669 Ų698%0.08233%0.329CS..Hα-helixtrans-64.7-44.2178.5-60.1173.6000110.3W183 T265 M266 I269 T279 C280 A286 L287W183-I283 HydrophobicContact CH2-CG2 3.87Å; W183-I283 HydrophobicContact CZ2-CG2 3.54Å; T265-I283 HydrophobicContact CG2-CG1 3.97Å; M266-I283 HydrophobicContact CE-CG2 3.83Å; I269-I283 HydrophobicContact CD1-CD1 3.95Å; I269-I283 HydrophobicContact CD1-CG1 4.5Å; T279-I283 PolarHBondContact O-N 2.96Å; C280-I283 PolarHBondContact O-N 2.89Å; I283-A286 PolarHBondContact O-N 2.99Å; I283-L287 WeakPolarHBondContact O-CB 3.45Å; I283-L287 PolarHBondContact O-N 3.01Å
284L87.5Confident81.4Confident9 Ų963.8 Ų63.85%0.04730%0.304CS..Hα-helixtrans-64.1-41.9176.6-75.2176.6000112.2C280 E281 L287 R288C280-L284 WeakPolarHBondContact O-CB 3.4Å; C280-L284 WeakPolarHBondContact O-CG 3.39Å; C280-L284 PolarHBondContact O-N 3.32Å; E281-L284 PolarHBondContact O-N 2.89Å; L284-L287 PolarHBondContact O-N 3.34Å; L284-R288 WeakPolarHBondContact O-CB 3.36Å; L284-R288 VanDerWaalsContact O-CG 3.25Å; L284-R288 WeakPolarHBondContact O-CG 3.5Å; L284-R288 PolarHBondContact O-N 2.97Å
285F88.5Confident83Confident122 Ų12256.6 Ų56.654%0.53527%0.266SS..Hα-helixtrans-61.1-48.4174.7176.2-97.8000110.9E281 T282 L287 R288 M289E281-F285 VanDerWaalsContact O-CB 3.29Å; E281-F285 WeakPolarHBondContact O-CB 3.29Å; E281-F285 PolarHBondContact O-N 3.46Å; T282-F285 PolarHBondContact O-N 2.9Å; F285-L287 VanDerWaalsContact C-N 3.32Å; F285-L287 PolarHBondContact O-N 2.78Å; F285-R288 WeakPolarHBondContact O-CB 3.24Å; F285-R288 PolarHBondContact O-N 3.32Å; F285-R288 VanDerWaalsContact O-N 3.16Å; F285-M289 HydrophobicContact CD1-CG 4.13Å; F285-M289 HydrophobicContact CE1-CG 3.68Å; F285-M289 HydrophobicContact CE1-SD 4.33Å; F285-M289 HydrophobicContact CE2-CG 4.28Å; F285-M289 HydrophobicContact CE2-SD 4.22Å; F285-M289 HydrophobicContact CZ-CG 3.76Å; F285-M289 HydrophobicContact CZ-SD 3.81Å; F285-M289 WeakPolarHBondContact O-CG 3.04Å; F285-M289 PolarHBondContact O-N 2.87Å
286A92.1Very high84.7Confident2 Ų248.6 Ų48.62%0.01724%0.239CC..Hα-helixtrans-61.3-40.4178.100000112.3P261 F262 T282 I283 M289 A290P261-A286 HydrophobicContact CB-CB 4.01Å; F262-A286 HydrophobicContact CB-CB 4.2Å; F262-A286 HydrophobicContact CD2-CB 4.24Å; T282-A286 VanDerWaalsContact O-CB 3.29Å; T282-A286 WeakPolarHBondContact O-CB 3.35Å; T282-A286 PolarHBondContact O-N 3.39Å; I283-A286 PolarHBondContact O-N 2.99Å; A286-M289 WeakPolarHBondContact O-CB 3.31Å; A286-M289 PolarHBondContact O-N 2.83Å; A286-A290 PolarHBondContact O-N 3.41Å
287L91.3Very high86Confident27 Ų2746.8 Ų46.814%0.14123%0.226CC..Hα-helixtrans-62.1-43.8174.1-178.468.3000111.7M113 W183 F262 I283 L284 F285 M289 A290 T291M113-L287 HydrophobicContact CE-CD1 3.69Å; M113-L287 HydrophobicContact CE-CD2 4.06Å; M113-L287 HydrophobicContact CE-CG 4.45Å; W183-L287 HydrophobicContact CD2-CD2 3.83Å; W183-L287 HydrophobicContact CE3-CD2 4.07Å; W183-L287 HydrophobicContact CG-CD2 4.16Å; W183-L287 HydrophobicContact CZ3-CD2 4.49Å; F262-L287 HydrophobicContact CD2-CB 4.1Å; F262-L287 HydrophobicContact CD2-CD1 4.29Å; F262-L287 HydrophobicContact CE2-CB 3.95Å; F262-L287 HydrophobicContact CE2-CD1 3.67Å; F262-L287 HydrophobicContact CE2-CG 4.41Å; F262-L287 HydrophobicContact CZ-CD1 3.81Å; I283-L287 WeakPolarHBondContact O-CB 3.45Å; I283-L287 PolarHBondContact O-N 3.01Å; L284-L287 PolarHBondContact O-N 3.34Å; F285-L287 VanDerWaalsContact C-N 3.32Å; F285-L287 PolarHBondContact O-N 2.78Å; L287-M289 VanDerWaalsContact C-N 3.33Å; L287-M289 PolarHBondContact O-N 3.27Å; L287-A290 WeakPolarHBondContact O-CB 3.2Å; L287-A290 PolarHBondContact O-N 2.75Å; L287-T291 PolarHBondContact O-N 2.89Å; L287-T291 VanDerWaalsContact O-N 3.08Å; L287-T291 PolarHBondContact O-OG1 3.11Å
288R90.8Very high86.8Confident58 Ų5837.4 Ų37.422%0.21919%0.185CC..Hα-helixtrans-62.2-40.6175.7-75170.6-177160.73.5111.5S27 F34 L284 F285 A290 T291 W292S27-R288 PolarHBondContact OG-NH2 3.03Å; S27-R288 VanDerWaalsContact OG-NH2 3.11Å; F34-R288 HydrophobicContact CE2-CB 4.11Å; F34-R288 HydrophobicContact CE2-CG 4.27Å; L284-R288 WeakPolarHBondContact O-CB 3.36Å; L284-R288 VanDerWaalsContact O-CG 3.25Å; L284-R288 WeakPolarHBondContact O-CG 3.5Å; L284-R288 PolarHBondContact O-N 2.97Å; F285-R288 WeakPolarHBondContact O-CB 3.24Å; F285-R288 PolarHBondContact O-N 3.32Å; F285-R288 VanDerWaalsContact O-N 3.16Å; R288-A290 VanDerWaalsContact C-N 3.31Å; R288-A290 PolarHBondContact O-N 3.43Å; R288-T291 WeakPolarHBondContact CA-OG1 3.13Å; R288-T291 PolarHBondContact O-N 2.83Å; R288-T291 PolarHBondContact O-OG1 2.82Å; R288-W292 VanDerWaalsContact O-CD1 3.23Å; R288-W292 PolarHBondContact O-N 3.44Å; R288-W292 VanDerWaalsContact O-N 3.13Å
289M91.6Very high87.2Confident40 Ų4037.6 Ų37.620%0.19718%0.184CC..Hα-helixtrans-61-40.5174.6-69.8-58-66.500111.4I257 C258 F285 A286 L287 W292I257-M289 HydrophobicContact CG2-CE 3.81Å; C258-M289 WeakPolarHBondContact CA-O 3.29Å; C258-M289 WeakPolarHBondContact CB-O 3.31Å; C258-M289 CarbonylContact O-C 3.57Å; C258-M289 VanDerWaalsContact O-C 3.24Å; C258-M289 PolarHBondContact SG-O 3.49Å; C258-M289 VanDerWaalsContact SG-O 3.39Å; F285-M289 HydrophobicContact CD1-CG 4.13Å; F285-M289 HydrophobicContact CE1-CG 3.68Å; F285-M289 HydrophobicContact CE1-SD 4.33Å; F285-M289 HydrophobicContact CE2-CG 4.28Å; F285-M289 HydrophobicContact CE2-SD 4.22Å; F285-M289 HydrophobicContact CZ-CG 3.76Å; F285-M289 HydrophobicContact CZ-SD 3.81Å; F285-M289 WeakPolarHBondContact O-CG 3.04Å; F285-M289 PolarHBondContact O-N 2.87Å; A286-M289 WeakPolarHBondContact O-CB 3.31Å; A286-M289 PolarHBondContact O-N 2.83Å; L287-M289 VanDerWaalsContact C-N 3.33Å; L287-M289 PolarHBondContact O-N 3.27Å; M289-W292 WeakPolarHBondContact O-CB 3.14Å; M289-W292 PolarHBondContact O-N 2.88Å
290A93.1Very high87.2Confident3 Ų334.3 Ų34.33%0.02516%0.164CC..Hα-helixtrans-63.6-41.9175.400000112.2C258 W259 F262 A286 L287 R288 W292 N293C258-A290 WeakPolarHBondContact O-CA 3.33Å; C258-A290 PolarHBondContact O-N 3.07Å; C258-A290 VanDerWaalsContact O-N 3.15Å; W259-A290 HydrophobicContact CD2-CB 4.25Å; W259-A290 HydrophobicContact CE3-CB 3.79Å; W259-A290 HydrophobicContact CH2-CB 4.24Å; W259-A290 HydrophobicContact CZ3-CB 3.8Å; F262-A290 HydrophobicContact CB-CB 4.23Å; F262-A290 HydrophobicContact CG-CB 4.47Å; A286-A290 PolarHBondContact O-N 3.41Å; L287-A290 WeakPolarHBondContact O-CB 3.2Å; L287-A290 PolarHBondContact O-N 2.75Å; R288-A290 VanDerWaalsContact C-N 3.31Å; R288-A290 PolarHBondContact O-N 3.43Å; A290-W292 VanDerWaalsContact C-N 3.27Å; A290-W292 PolarHBondContact O-N 3.01Å; A290-N293 VanDerWaalsContact O-CB 3.32Å; A290-N293 WeakPolarHBondContact O-CB 3.49Å; A290-N293 PolarHBondContact O-N 3.39Å
291T91.3Very high86.7Confident37 Ų3733.6 Ų33.623%0.22716%0.158CC..Hα-helixtrans-65-27.7175.844.40000113.7L287 R288 N293 Q294 I295L287-T291 PolarHBondContact O-N 2.89Å; L287-T291 VanDerWaalsContact O-N 3.08Å; L287-T291 PolarHBondContact O-OG1 3.11Å; R288-T291 WeakPolarHBondContact CA-OG1 3.13Å; R288-T291 PolarHBondContact O-N 2.83Å; R288-T291 PolarHBondContact O-OG1 2.82Å; T291-N293 PolarHBondContact O-N 2.81Å; T291-Q294 PolarHBondContact O-N 3.12Å; T291-I295 WeakPolarHBondContact O-CG1 3.17Å; T291-I295 PolarHBondContact O-N 3.48Å
292W90.9Very high85.8Confident105 Ų10530.9 Ų30.940%0.39815%0.145SC..Hα-helixtrans-61-32.9172.4-86.8101.9000112.1F34 R288 M289 A290 I295 L296F34-W292 HydrophobicContact CE1-CZ2 4.04Å; F34-W292 AromaticContact CE2-CD1 3.92Å; F34-W292 AromaticContact CE2-NE1 3.5Å; F34-W292 AromaticContact CZ-CE2 3.74Å; F34-W292 AromaticContact CZ-CZ2 3.96Å; F34-W292 HydrophobicContact CZ-CZ2 3.96Å; F34-W292 AromaticContact CZ-NE1 3.26Å; F34-W292 VanDerWaalsContact CZ-NE1 3.26Å; R288-W292 VanDerWaalsContact O-CD1 3.23Å; R288-W292 PolarHBondContact O-N 3.44Å; R288-W292 VanDerWaalsContact O-N 3.13Å; M289-W292 WeakPolarHBondContact O-CB 3.14Å; M289-W292 PolarHBondContact O-N 2.88Å; A290-W292 VanDerWaalsContact C-N 3.27Å; A290-W292 PolarHBondContact O-N 3.01Å; W292-I295 PolarHBondContact O-N 3.19Å; W292-L296 HydrophobicContact CE3-CD1 4.21Å; W292-L296 HydrophobicContact CE3-CG 4.28Å; W292-L296 WeakPolarHBondContact O-CB 3.3Å; W292-L296 WeakPolarHBondContact O-CG 3.26Å; W292-L296 PolarHBondContact O-N 3.27Å
293N91.5Very high84.3Confident3 Ų331.3 Ų31.32%0.01615%0.145CC..Hα-helixtrans-61.8-48.7176.2-176.7-110.6000111.4C258 W259 A290 T291 I295 L296 D297C258-N293 HydrophobicContact CB-CB 3.55Å; W259-N293 PolarHBondContact NE1-OD1 3.22Å; A290-N293 VanDerWaalsContact O-CB 3.32Å; A290-N293 WeakPolarHBondContact O-CB 3.49Å; A290-N293 PolarHBondContact O-N 3.39Å; T291-N293 PolarHBondContact O-N 2.81Å; N293-I295 PolarHBondContact O-N 3Å; N293-L296 PolarHBondContact O-N 3.07Å; N293-D297 VanDerWaalsContact CG-OD1 3.22Å; N293-D297 PolarHBondContact ND2-OD1 2.6Å; N293-D297 VanDerWaalsContact O-CB 3.31Å; N293-D297 WeakPolarHBondContact O-CB 3.31Å; N293-D297 PolarHBondContact O-N 3.48Å; N293-D297 PolarHBondContact OD1-OD1 3.26Å
294Q90.2Very high82.4Confident13 Ų1332.5 Ų32.56%0.06115%0.152CC..Hα-helixtrans-60.8-28.4179.5-63.2170.6-0.800112.8N42 D75 F116 W259 T291N42-Q294 PolarHBondContact ND2-O 2.93Å; D75-Q294 HydrophobicContact CB-CB 4.32Å; F116-Q294 PolarHBondContact O-NE2 3.29Å; F116-Q294 VanDerWaalsContact O-NE2 3.09Å; W259-Q294 HydrophobicContact CZ2-CG 4.42Å; T291-Q294 PolarHBondContact O-N 3.12Å
295I89.4Confident81.1Confident5 Ų536.6 Ų36.63%0.02617%0.166CC..Hα-helixtrans-76-41.9174.6-62.3173.7000111F34 V37 S41 T291 W292 N293 W299F34-I295 HydrophobicContact CB-CD1 4.34Å; V37-I295 HydrophobicContact CG1-CG2 3.8Å; S41-I295 PolarHBondContact OG-O 2.95Å; T291-I295 WeakPolarHBondContact O-CG1 3.17Å; T291-I295 PolarHBondContact O-N 3.48Å; W292-I295 PolarHBondContact O-N 3.19Å; N293-I295 PolarHBondContact O-N 3Å; I295-W299 VanDerWaalsContact O-CD1 3.29Å
296L87.4Confident79.1Confident55 Ų5535.3 Ų35.329%0.28816%0.16SC..Hα-helixtrans-84.9-31-172.2-68.3173.8000113.4V254 W292 N293 W299 V300V254-L296 HydrophobicContact CG1-CB 4.06Å; V254-L296 HydrophobicContact CG1-CD1 3.83Å; W292-L296 HydrophobicContact CE3-CD1 4.21Å; W292-L296 HydrophobicContact CE3-CG 4.28Å; W292-L296 WeakPolarHBondContact O-CB 3.3Å; W292-L296 WeakPolarHBondContact O-CG 3.26Å; W292-L296 PolarHBondContact O-N 3.27Å; N293-L296 PolarHBondContact O-N 3.07Å; L296-W299 WeakPolarHBondContact O-CA 3.34Å; L296-W299 WeakPolarHBondContact O-CB 3.43Å; L296-W299 PolarHBondContact O-N 3.42Å; L296-V300 HydrophobicContact CB-CG2 4.35Å; L296-V300 VanDerWaalsContact O-CG2 3.31Å; L296-V300 WeakPolarHBondContact O-CG2 3.37Å; L296-V300 PolarHBondContact O-N 2.94Å
297D82.4Confident77Confident5 Ų538 Ų383%0.02718%0.183CC..Hα-helixtrans-45.4-56.1-175.5-104.830.9000113.1L71 N293 W299 V300 Y301L71-D297 HydrophobicContact CD2-CB 4.17Å; L71-D297 WeakPolarHBondContact CD2-OD2 3.32Å; N293-D297 VanDerWaalsContact CG-OD1 3.22Å; N293-D297 PolarHBondContact ND2-OD1 2.6Å; N293-D297 VanDerWaalsContact O-CB 3.31Å; N293-D297 WeakPolarHBondContact O-CB 3.31Å; N293-D297 PolarHBondContact O-N 3.48Å; N293-D297 PolarHBondContact OD1-OD1 3.26Å; D297-W299 PolarHBondContact O-N 2.94Å; D297-W299 VanDerWaalsContact O-N 3.14Å; D297-V300 PolarHBondContact O-N 3.21Å; D297-Y301 HydrophobicContact CB-CD2 4.48Å; D297-Y301 HydrophobicContact CB-CE2 4.04Å; D297-Y301 WeakPolarHBondContact O-CD2 3.29Å; D297-Y301 WeakPolarHBondContact O-CE2 3.13Å; D297-Y301 PolarHBondContact O-N 3.29Å; D297-Y301 VanDerWaalsContact O-N 3.12Å
298P78.7Confident75Confident1 Ų138.3 Ų38.31%0.00619%0.186CC..Hα-helixtrans-53.1-40176.617.5-31.7000113A45 V72 Y301 I302A45-P298 HydrophobicContact CB-CB 3.33Å; A45-P298 HydrophobicContact CB-CG 4.2Å; V72-P298 HydrophobicContact CG2-CB 3.97Å; P298-Y301 PolarHBondContact O-N 2.85Å; P298-I302 HydrophobicContact CB-CD1 4.2Å; P298-I302 WeakPolarHBondContact O-CB 3.03Å; P298-I302 WeakPolarHBondContact O-CD1 3.37Å; P298-I302 WeakPolarHBondContact O-CG1 3.44Å; P298-I302 PolarHBondContact O-N 3.49Å
299W78.3Confident73Confident55 Ų5539.5 Ų39.521%0.20820%0.196CC..Hα-helixtrans-73.4-39-177.7-60.2112.6000112.9S41 L44 I295 L296 D297 Y301 I302 L303 L312S41-W299 PolarHBondContact OG-NE1 2.82Å; L44-W299 HydrophobicContact CD2-CH2 3.56Å; L44-W299 HydrophobicContact CD2-CZ2 4.09Å; L44-W299 HydrophobicContact CG-CH2 3.94Å; I295-W299 VanDerWaalsContact O-CD1 3.29Å; L296-W299 WeakPolarHBondContact O-CA 3.34Å; L296-W299 WeakPolarHBondContact O-CB 3.43Å; L296-W299 PolarHBondContact O-N 3.42Å; D297-W299 PolarHBondContact O-N 2.94Å; D297-W299 VanDerWaalsContact O-N 3.14Å; W299-Y301 PolarHBondContact O-N 3.11Å; W299-I302 PolarHBondContact O-N 2.94Å; W299-L303 HydrophobicContact CB-CD1 3.71Å; W299-L303 HydrophobicContact CB-CG 3.97Å; W299-L303 HydrophobicContact CD2-CD1 4.37Å; W299-L303 HydrophobicContact CD2-CG 4.39Å; W299-L303 HydrophobicContact CE3-CD1 4.07Å; W299-L303 HydrophobicContact CE3-CD2 3.6Å; W299-L303 HydrophobicContact CE3-CG 3.68Å; W299-L303 HydrophobicContact CG-CD1 4.29Å; W299-L303 HydrophobicContact CZ3-CD2 4Å; W299-L303 VanDerWaalsContact O-CB 3.22Å; W299-L303 WeakPolarHBondContact O-CB 3.49Å; W299-L303 WeakPolarHBondContact O-CG 3.42Å; W299-L303 PolarHBondContact O-N 3.43Å; W299-L312 HydrophobicContact CZ3-CD1 4.47Å
300V78.1Confident71.1Confident14 Ų1444.3 Ų44.39%0.08522%0.216CC..Hα-helixtrans-64.5-28.7175.1-155.20000110.5Q247 A250 I251 V254 L296 D297 L304Q247-V300 WeakPolarHBondContact CG-O 3.31Å; Q247-V300 PolarHBondContact NE2-O 3.45Å; A250-V300 HydrophobicContact CB-CG1 3.67Å; I251-V300 HydrophobicContact CB-CG1 4.2Å; I251-V300 HydrophobicContact CD1-CG1 4.46Å; I251-V300 HydrophobicContact CG1-CB 3.95Å; I251-V300 HydrophobicContact CG1-CG1 3.33Å; V254-V300 HydrophobicContact CB-CG2 4.49Å; V254-V300 HydrophobicContact CG1-CG2 4.42Å; V254-V300 HydrophobicContact CG2-CG2 4.36Å; L296-V300 HydrophobicContact CB-CG2 4.35Å; L296-V300 VanDerWaalsContact O-CG2 3.31Å; L296-V300 WeakPolarHBondContact O-CG2 3.37Å; L296-V300 PolarHBondContact O-N 2.94Å; D297-V300 PolarHBondContact O-N 3.21Å; V300-L304 HydrophobicContact CG1-CD1 4.46Å
301Y69.5Low69.2Low11 Ų1147.8 Ų47.84%0.04323%0.234CC..Hα-helixtrans-81.4-36173.7-62.3-55.1000114.7L71 M127 Q247 I251 D297 P298 W299L71-Y301 HydrophobicContact CD2-CD2 4.02Å; L71-Y301 HydrophobicContact CD2-CE2 3.49Å; L71-Y301 VanDerWaalsContact CD2-CE2 3.49Å; M127-Y301 HydrophobicContact CE-CE1 4.34Å; M127-Y301 HydrophobicContact CE-CE2 3.96Å; M127-Y301 WeakPolarHBondContact CE-OH 3.31Å; Q247-Y301 PolarHBondContact NE2-O 3.25Å; I251-Y301 HydrophobicContact CD1-CD1 3.68Å; I251-Y301 HydrophobicContact CD1-CE1 3.54Å; I251-Y301 HydrophobicContact CG1-CD1 4.34Å; I251-Y301 HydrophobicContact CG1-CE1 4.09Å; I251-Y301 HydrophobicContact CG2-CE1 4.28Å; D297-Y301 HydrophobicContact CB-CD2 4.48Å; D297-Y301 HydrophobicContact CB-CE2 4.04Å; D297-Y301 WeakPolarHBondContact O-CD2 3.29Å; D297-Y301 WeakPolarHBondContact O-CE2 3.13Å; D297-Y301 PolarHBondContact O-N 3.29Å; D297-Y301 VanDerWaalsContact O-N 3.12Å; P298-Y301 PolarHBondContact O-N 2.85Å; W299-Y301 PolarHBondContact O-N 3.11Å
302I65Low67.4Low11 Ų1148 Ų486%0.05623%0.234CC..Hα-helixtrans-95.4-44.6-170.4-67.1168.5000112.7A45 I48 L49 P298 W299 L304 R305 V308A45-I302 HydrophobicContact CB-CD1 3.63Å; I48-I302 HydrophobicContact CD1-CG2 4.28Å; I48-I302 HydrophobicContact CG2-CG2 3.96Å; L49-I302 HydrophobicContact CG-CD1 4.38Å; P298-I302 HydrophobicContact CB-CD1 4.2Å; P298-I302 WeakPolarHBondContact O-CB 3.03Å; P298-I302 WeakPolarHBondContact O-CD1 3.37Å; P298-I302 WeakPolarHBondContact O-CG1 3.44Å; P298-I302 PolarHBondContact O-N 3.49Å; W299-I302 PolarHBondContact O-N 2.94Å; I302-L304 VanDerWaalsContact C-N 3.35Å; I302-L304 PolarHBondContact O-N 3.26Å; I302-R305 PolarHBondContact O-N 3.24Å; I302-V308 HydrophobicContact CG2-CB 4.3Å; I302-V308 HydrophobicContact CG2-CG1 3.59Å; I302-V308 HydrophobicContact CG2-CG2 4.49Å
303L53.5Low65.6Low65 Ų6549.8 Ų49.834%0.3424%0.241SC..THydrogen-bonded Turntrans-65.1-39.1-171.8-67.9179.1000111.6W299 R305 L309 L312W299-L303 HydrophobicContact CB-CD1 3.71Å; W299-L303 HydrophobicContact CB-CG 3.97Å; W299-L303 HydrophobicContact CD2-CD1 4.37Å; W299-L303 HydrophobicContact CD2-CG 4.39Å; W299-L303 HydrophobicContact CE3-CD1 4.07Å; W299-L303 HydrophobicContact CE3-CD2 3.6Å; W299-L303 HydrophobicContact CE3-CG 3.68Å; W299-L303 HydrophobicContact CG-CD1 4.29Å; W299-L303 HydrophobicContact CZ3-CD2 4Å; W299-L303 VanDerWaalsContact O-CB 3.22Å; W299-L303 WeakPolarHBondContact O-CB 3.49Å; W299-L303 WeakPolarHBondContact O-CG 3.42Å; W299-L303 PolarHBondContact O-N 3.43Å; L303-R305 PolarHBondContact O-N 2.99Å; L303-L309 WeakPolarHBondContact O-CD1 3.3Å; L303-L309 WeakPolarHBondContact O-CG 3.01Å; L303-L312 HydrophobicContact CD2-CD1 3.57Å
304L50Low63.8Low42 Ų4255.2 Ų55.222%0.2227%0.265CS..THydrogen-bonded Turntrans-8424.5-175.1-69.2150.9000113.6E243 I246 Q247 A250 V300 I302E243-L304 VanDerWaalsContact CG-O 3.28Å; E243-L304 WeakPolarHBondContact CG-O 3.3Å; I246-L304 HydrophobicContact CG2-CD2 4.08Å; Q247-L304 HydrophobicContact CB-CB 3.66Å; Q247-L304 HydrophobicContact CB-CD1 3.95Å; Q247-L304 HydrophobicContact CB-CG 4.31Å; Q247-L304 HydrophobicContact CG-CB 3.7Å; Q247-L304 HydrophobicContact CG-CD1 4Å; Q247-L304 HydrophobicContact CG-CG 4.46Å; Q247-L304 PolarHBondContact OE1-O 3.27Å; A250-L304 HydrophobicContact CB-CD1 4.13Å; V300-L304 HydrophobicContact CG1-CD1 4.46Å; I302-L304 VanDerWaalsContact C-N 3.35Å; I302-L304 PolarHBondContact O-N 3.26Å
305R59.3Low62.1Low94 Ų9459.7 Ų59.736%0.35529%0.288SS..SBendtrans-108.7115.8162.4-73.5-172.5178.9-166.10.9109.4E243 I302 L303 A307 V308 L309E243-R305 VanDerWaalsContact OE1-C 3.23Å; E243-R305 WeakPolarHBondContact OE1-CA 3.47Å; I302-R305 PolarHBondContact O-N 3.24Å; L303-R305 PolarHBondContact O-N 2.99Å; R305-A307 PolarHBondContact O-N 2.93Å; R305-V308 HydrophobicContact CB-CG2 4.49Å; R305-V308 WeakPolarHBondContact O-CA 3.44Å; R305-V308 PolarHBondContact O-N 2.83Å; R305-L309 PolarHBondContact O-N 2.91Å; R305-L309 VanDerWaalsContact O-N 3.14Å
306K45.9Very low60.3Low95 Ų9563.7 Ų63.741%0.41331%0.313SS..Hα-helixtrans-45.3-36.4-176.3-139.1175.7176.4-178.60114.7S239 E243 V308 K310S239-K306 PolarHBondContact OG-NZ 3.23Å; E243-K306 VanDerWaalsContact OE1-CA 3.28Å; E243-K306 WeakPolarHBondContact OE1-CA 3.33Å; E243-K306 PolarHBondContact OE1-N 3.34Å; E243-K306 WeakPolarHBondContact OE2-CB 3.33Å; K306-V308 VanDerWaalsContact C-N 3.34Å; K306-K310 WeakPolarHBondContact O-CB 3.41Å; K306-K310 PolarHBondContact O-N 2.73Å
307A49.8Very low58.6Low60 Ų6067.9 Ų67.950%0.49633%0.325SS..Hα-helixtrans-67.5-33.4178.900000112.9R305 N311R305-A307 PolarHBondContact O-N 2.93Å; A307-N311 WeakPolarHBondContact O-CB 3.06Å; A307-N311 VanDerWaalsContact O-CG 3.26Å; A307-N311 PolarHBondContact O-N 2.91Å; A307-N311 PolarHBondContact O-ND2 3.39Å; A307-N311 VanDerWaalsContact O-ND2 3.15Å
308V48.5Very low57Low33 Ų3369.8 Ų69.820%0.235%0.346CS..Hα-helixtrans-86.4-42.6179.2-172.70000110.5I48 I302 R305 K306 K310 N311 L312I48-V308 HydrophobicContact CG2-CG1 4.19Å; I302-V308 HydrophobicContact CG2-CB 4.3Å; I302-V308 HydrophobicContact CG2-CG1 3.59Å; I302-V308 HydrophobicContact CG2-CG2 4.49Å; R305-V308 HydrophobicContact CB-CG2 4.49Å; R305-V308 WeakPolarHBondContact O-CA 3.44Å; R305-V308 PolarHBondContact O-N 2.83Å; K306-V308 VanDerWaalsContact C-N 3.34Å; V308-K310 VanDerWaalsContact C-N 3.31Å; V308-K310 PolarHBondContact O-N 2.9Å; V308-N311 CarbonylContact O-C 3.57Å; V308-N311 PolarHBondContact O-N 3.47Å; V308-N311 VanDerWaalsContact O-N 3.1Å; V308-L312 HydrophobicContact CG1-CD1 3.75Å; V308-L312 HydrophobicContact CG1-CG 4.09Å; V308-L312 WeakPolarHBondContact O-CB 3.27Å; V308-L312 WeakPolarHBondContact O-CG 3.43Å; V308-L312 PolarHBondContact O-N 3.25Å
309L48.5Very low55.7Low83 Ų8375 Ų7544%0.43538%0.381SS..Hα-helixtrans-55.4-44.1171.8-114.2162.7000111.9L303 R305 N311 Y313L303-L309 WeakPolarHBondContact O-CD1 3.3Å; L303-L309 WeakPolarHBondContact O-CG 3.01Å; R305-L309 PolarHBondContact O-N 2.91Å; R305-L309 VanDerWaalsContact O-N 3.14Å; L309-N311 VanDerWaalsContact C-N 3.34Å; L309-N311 PolarHBondContact O-N 3.04Å; L309-Y313 WeakPolarHBondContact O-CB 3.29Å; L309-Y313 PolarHBondContact O-N 3.4Å
310K51.8Low54.3Low141 Ų14177.8 Ų77.861%0.61341%0.408SS*.Hα-helixtrans-67.1-32.7177.3-168.9175.3-175.7179.40112.8K306 V308 K314K306-K310 WeakPolarHBondContact O-CB 3.41Å; K306-K310 PolarHBondContact O-N 2.73Å; V308-K310 VanDerWaalsContact C-N 3.31Å; V308-K310 PolarHBondContact O-N 2.9Å; K310-K314 VanDerWaalsContact O-CG 3.28Å; K310-K314 WeakPolarHBondContact O-CG 3.45Å; K310-K314 PolarHBondContact O-N 2.88Å
311N53.3Low52.8Low75 Ų7580 Ų8040%0.40143%0.433SS..Hα-helixtrans-80.6-41.2177.3-76.3-17.8000112.1A307 V308 L309 K314 I315A307-N311 WeakPolarHBondContact O-CB 3.06Å; A307-N311 VanDerWaalsContact O-CG 3.26Å; A307-N311 PolarHBondContact O-N 2.91Å; A307-N311 PolarHBondContact O-ND2 3.39Å; A307-N311 VanDerWaalsContact O-ND2 3.15Å; V308-N311 CarbonylContact O-C 3.57Å; V308-N311 PolarHBondContact O-N 3.47Å; V308-N311 VanDerWaalsContact O-N 3.1Å; L309-N311 VanDerWaalsContact C-N 3.34Å; L309-N311 PolarHBondContact O-N 3.04Å; N311-K314 WeakPolarHBondContact O-CB 3.5Å; N311-K314 PolarHBondContact O-N 3.41Å; N311-I315 VanDerWaalsContact O-CG1 3.25Å; N311-I315 WeakPolarHBondContact O-CG1 3.3Å; N311-I315 PolarHBondContact O-N 3.07Å
312L53.8Low51.4Low43 Ų4386 Ų8623%0.22546%0.463CS..Hα-helixtrans-61.8-46.7173.5-78.4169000110.4W299 L303 V308 K314 I315 T316W299-L312 HydrophobicContact CZ3-CD1 4.47Å; L303-L312 HydrophobicContact CD2-CD1 3.57Å; V308-L312 HydrophobicContact CG1-CD1 3.75Å; V308-L312 HydrophobicContact CG1-CG 4.09Å; V308-L312 WeakPolarHBondContact O-CB 3.27Å; V308-L312 WeakPolarHBondContact O-CG 3.43Å; V308-L312 PolarHBondContact O-N 3.25Å; L312-K314 VanDerWaalsContact C-N 3.27Å; L312-K314 PolarHBondContact O-N 3.27Å; L312-I315 CarbonylContact O-C 3.59Å; L312-I315 WeakPolarHBondContact O-CA 3.25Å; L312-I315 PolarHBondContact O-N 3.41Å; L312-T316 PolarHBondContact O-N 3.25Å; L312-T316 PolarHBondContact O-OG1 3.05Å
313Y52.1Low50.2Low142 Ų14292.9 Ų92.956%0.55750%0.495SS*.Hα-helixtrans-58.1-37.2174.3-176.9-99.7000112.7L309 T316 R317L309-Y313 WeakPolarHBondContact O-CB 3.29Å; L309-Y313 PolarHBondContact O-N 3.4Å; Y313-T316 WeakPolarHBondContact CA-OG1 3.45Å; Y313-T316 PolarHBondContact O-OG1 3.42Å; Y313-R317 WeakPolarHBondContact O-CB 3.17Å; Y313-R317 PolarHBondContact O-N 3.14Å
314K54Low49.5Very low117 Ų11797.4 Ų97.451%0.50952%0.518SS..Hα-helixtrans-68.7-37.3172.8-79.7178.6176.6-167.20112.6K310 N311 L312 G318K310-K314 VanDerWaalsContact O-CG 3.28Å; K310-K314 WeakPolarHBondContact O-CG 3.45Å; K310-K314 PolarHBondContact O-N 2.88Å; N311-K314 WeakPolarHBondContact O-CB 3.5Å; N311-K314 PolarHBondContact O-N 3.41Å; L312-K314 VanDerWaalsContact C-N 3.27Å; L312-K314 PolarHBondContact O-N 3.27Å; K314-G318 PolarHBondContact O-N 3.45Å
315I55.7Low49Very low107 Ų107101.7 Ų101.755%0.54954%0.54SS..Hα-helixtrans-70-47.4177.9-68.2162.9000110.4N311 L312 R317 G318 C319N311-I315 VanDerWaalsContact O-CG1 3.25Å; N311-I315 WeakPolarHBondContact O-CG1 3.3Å; N311-I315 PolarHBondContact O-N 3.07Å; L312-I315 CarbonylContact O-C 3.59Å; L312-I315 WeakPolarHBondContact O-CA 3.25Å; L312-I315 PolarHBondContact O-N 3.41Å; I315-R317 VanDerWaalsContact C-N 3.31Å; I315-R317 PolarHBondContact O-N 3.26Å; I315-G318 CarbonylContact O-C 3.58Å; I315-G318 WeakPolarHBondContact O-CA 3.36Å; I315-G318 PolarHBondContact O-N 3.49Å; I315-C319 PolarHBondContact O-N 3.07Å; I315-C319 PolarHBondContact O-SG 3.3Å
316T50.3Low47.7Very low88 Ų88101.8 Ų101.854%0.5455%0.547SS..Hα-helixtrans-63.2-36.517530.10000112L312 Y313 G318 C319 C320L312-T316 PolarHBondContact O-N 3.25Å; L312-T316 PolarHBondContact O-OG1 3.05Å; Y313-T316 WeakPolarHBondContact CA-OG1 3.45Å; Y313-T316 PolarHBondContact O-OG1 3.42Å; T316-G318 VanDerWaalsContact C-N 3.32Å; T316-C319 PolarHBondContact O-N 3.06Å; T316-C320 PolarHBondContact O-N 3.44Å; T316-C320 VanDerWaalsContact O-N 3.07Å
317R51.3Low47.3Very low143 Ų143104.9 Ų104.954%0.5457%0.567SS.*Hα-helixtrans-70.4-28.3173-160.6172.7178.9174.6-2113Y313 I315Y313-R317 WeakPolarHBondContact O-CB 3.17Å; Y313-R317 PolarHBondContact O-N 3.14Å; I315-R317 VanDerWaalsContact C-N 3.31Å; I315-R317 PolarHBondContact O-N 3.26Å
318G50Low46.7Very low46 Ų46110 Ų11047%0.47458%0.581SS.*Hα-helixtrans-69.8-37.7169.600000112.9K314 I315 T316 C320 G321K314-G318 PolarHBondContact O-N 3.45Å; I315-G318 CarbonylContact O-C 3.58Å; I315-G318 WeakPolarHBondContact O-CA 3.36Å; I315-G318 PolarHBondContact O-N 3.49Å; T316-G318 VanDerWaalsContact C-N 3.32Å; G318-C320 VanDerWaalsContact C-N 3.3Å; G318-C320 PolarHBondContact O-N 2.89Å; G318-G321 PolarHBondContact O-N 3.07Å
319C50.6Low46.1Very low109 Ų109114.9 Ų114.974%0.73660%0.603SS**Hα-helixtrans-69.9-23.9173.4-67.40000113.2I315 T316 G321I315-C319 PolarHBondContact O-N 3.07Å; I315-C319 PolarHBondContact O-SG 3.3Å; T316-C319 PolarHBondContact O-N 3.06Å; C319-G321 VanDerWaalsContact C-N 3.32Å
320C50.1Low45.4Very low115 Ų115121.2 Ų121.278%0.77762%0.621SS**THydrogen-bonded Turntrans-88.315.9171.3-71.80000114.3T316 G318T316-C320 PolarHBondContact O-N 3.44Å; T316-C320 VanDerWaalsContact O-N 3.07Å; G318-C320 VanDerWaalsContact C-N 3.3Å; G318-C320 PolarHBondContact O-N 2.89Å
321G45.3Very low44.7Very low60 Ų60122.3 Ų122.362%0.61963%0.628SS**THydrogen-bonded Turntrans73.155.516700000115.5G318 C319G318-G321 PolarHBondContact O-N 3.07Å; C319-G321 VanDerWaalsContact C-N 3.32Å
322M41.7Very low44.1Very low136 Ų136125.2 Ų125.267%0.6764%0.643SS**  trans-131.299.7155.4-151.78660.800108.9I324M322-I324 PolarHBondContact O-N 3.34Å
323H38.8Very low43.3Very low157 Ų157125.8 Ų125.873%0.72765%0.651SS**  trans-70.2111.4-178.1-163.747.5000110.4
324I38.4Very low42.6Very low159 Ų159122.4 Ų122.482%0.81565%0.648SS**  trans-134.983.6151.3-59.3-178.7000107.3M322M322-I324 PolarHBondContact O-N 3.34Å
325I39.8Very low42.1Very low133 Ų133121.7 Ų121.768%0.68265%0.648SS**  trans-88.6106.9153.7-61.7-178000106.1
326N32.1Very low41.4Very low96 Ų96124.4 Ų124.451%0.51366%0.656SS.*  trans-156.195.5135-140.1-24000110.3
327L36.6Very low40.8Very low160 Ų160125.3 Ų125.384%0.83866%0.658SS**  trans-117.240.3174.5-145.2115.4000111.5
328H37.6Very low40.3Very low168 Ų168122.1 Ų122.178%0.77866%0.658SS**SBendtrans-125.5-2.1165.4-155.1-94.2000113.4
329M36.5Very low39.9Very low135 Ų135125.4 Ų125.467%0.66566%0.664SS**SBendtrans-112.6-2.4-173.8-157.1160.163.300114.9
330W34.4Very low39.4Very low216 Ų216127.1 Ų127.182%0.81866%0.659SS**SBendtrans-106.2-21.7-172.6-146.649000115.8
331E36.4Very low39.1Very low163 Ų163126.9 Ų126.976%0.76265%0.654SS**Hα-helixtrans-78.6-25.3175.9-80.8-165151.900113.3I335E331-I335 WeakPolarHBondContact O-CD1 3.09Å; E331-I335 WeakPolarHBondContact O-CG1 3.37Å
332L39.9Very low38.8Very low137 Ų137127.3 Ų127.372%0.71765%0.651SS**Hα-helixtrans-82.7-29.5179.7-99.991.8000114.6K336L332-K336 VanDerWaalsContact O-CB 3.28Å; L332-K336 WeakPolarHBondContact O-CB 3.44Å; L332-K336 PolarHBondContact O-N 3.35Å
333S38.2Very low38.7Very low55 Ų55124.6 Ų124.639%0.38565%0.65SS.*Hα-helixtrans-80.6-33.5-177.857.90000112.8N337S333-N337 WeakPolarHBondContact O-CB 3.42Å; S333-N337 PolarHBondContact O-N 2.82Å; S333-N337 VanDerWaalsContact O-N 3.16Å
334S36.3Very low38.9Very low70 Ų70122.8 Ų122.849%0.4964%0.644SS.*Hα-helixtrans-71.4-39.8176-167.30000111.8N337 S338S334-N337 PolarHBondContact O-N 2.92Å; S334-S338 WeakPolarHBondContact O-CB 3.41Å; S334-S338 PolarHBondContact O-N 2.99Å; S334-S338 PolarHBondContact O-OG 3.46Å
335I43.7Very low39Very low102 Ų102120.2 Ų120.252%0.52364%0.641SS.*Hα-helixtrans-70.6-37.2179.3-66.7174.5000110.9E331 S338 L339E331-I335 WeakPolarHBondContact O-CD1 3.09Å; E331-I335 WeakPolarHBondContact O-CG1 3.37Å; I335-S338 PolarHBondContact O-N 2.92Å; I335-L339 HydrophobicContact CG2-CD1 3.78Å; I335-L339 WeakPolarHBondContact O-CB 3.17Å; I335-L339 PolarHBondContact O-N 3.36Å
336K41.5Very low38.8Very low164 Ų164122.9 Ų122.971%0.71365%0.651SS**Hα-helixtrans-69-33.3177.2-156.9175-173.7-1770112.7L332 K340L332-K336 VanDerWaalsContact O-CB 3.28Å; L332-K336 WeakPolarHBondContact O-CB 3.44Å; L332-K336 PolarHBondContact O-N 3.35Å; K336-K340 WeakPolarHBondContact O-CB 3.2Å; K336-K340 PolarHBondContact O-N 3.23Å
337N37.8Very low38.7Very low107 Ų107122.6 Ų122.657%0.57266%0.656SS**Hα-helixtrans-78.1-33.7174.9-78.8-14000112.8S333 S334 K340 V341S333-N337 WeakPolarHBondContact O-CB 3.42Å; S333-N337 PolarHBondContact O-N 2.82Å; S333-N337 VanDerWaalsContact O-N 3.16Å; S334-N337 PolarHBondContact O-N 2.92Å; N337-K340 PolarHBondContact O-N 3.48Å; N337-V341 VanDerWaalsContact O-CG2 3.31Å; N337-V341 WeakPolarHBondContact O-CG2 3.45Å; N337-V341 PolarHBondContact O-N 3.03Å; N337-V341 VanDerWaalsContact O-N 3.16Å
338S40.5Very low38.5Very low77 Ų77121.1 Ų121.154%0.53866%0.656SS.*Hα-helixtrans-71.4-35175.1-580000113S334 I335 A342S334-S338 WeakPolarHBondContact O-CB 3.41Å; S334-S338 PolarHBondContact O-N 2.99Å; S334-S338 PolarHBondContact O-OG 3.46Å; I335-S338 PolarHBondContact O-N 2.92Å; S338-A342 WeakPolarHBondContact O-CB 3.08Å; S338-A342 PolarHBondContact O-N 3.13Å; S338-A342 VanDerWaalsContact O-N 3.07Å
339L41.7Very low38.2Very low115 Ų115119.8 Ų119.860%0.60266%0.659SS**Hα-helixtrans-73-30.2174-87.5153.5000113I335 A343I335-L339 HydrophobicContact CG2-CD1 3.78Å; I335-L339 WeakPolarHBondContact O-CB 3.17Å; I335-L339 PolarHBondContact O-N 3.36Å; L339-A343 WeakPolarHBondContact O-CB 3.37Å; L339-A343 PolarHBondContact O-N 3.32Å; L339-A343 VanDerWaalsContact O-N 3.16Å
340K40.3Very low37.9Very low145 Ų145118.8 Ų118.863%0.6367%0.665SS**Hα-helixtrans-74.6-27.7174.9-161.2172.2-177-178.80112.8K336 N337 I344K336-K340 WeakPolarHBondContact O-CB 3.2Å; K336-K340 PolarHBondContact O-N 3.23Å; N337-K340 PolarHBondContact O-N 3.48Å; K340-I344 HydrophobicContact CG-CD1 4.48Å; K340-I344 WeakPolarHBondContact O-CD1 3.24Å; K340-I344 VanDerWaalsContact O-CG1 3.27Å; K340-I344 WeakPolarHBondContact O-CG1 3.19Å
341V44.1Very low37.7Very low110 Ų110113.4 Ų113.467%0.66766%0.661SS**Hα-helixtrans-82.1-33.8175.2174.50000111.7N337N337-V341 VanDerWaalsContact O-CG2 3.31Å; N337-V341 WeakPolarHBondContact O-CG2 3.45Å; N337-V341 PolarHBondContact O-N 3.03Å; N337-V341 VanDerWaalsContact O-N 3.16Å
342A38.3Very low37.5Very low69 Ų69115.1 Ų115.157%0.5767%0.666SS**Hα-helixtrans-72.4-30.5175.300000113.4S338 I344S338-A342 WeakPolarHBondContact O-CB 3.08Å; S338-A342 PolarHBondContact O-N 3.13Å; S338-A342 VanDerWaalsContact O-N 3.07Å; A342-I344 VanDerWaalsContact C-N 3.31Å; A342-I344 PolarHBondContact O-N 3.4Å
343A39.3Very low37.1Very low78 Ų78118.1 Ų118.165%0.64568%0.676SS**THydrogen-bonded Turntrans-81.5-1.4178.700000114.9L339L339-A343 WeakPolarHBondContact O-CB 3.37Å; L339-A343 PolarHBondContact O-N 3.32Å; L339-A343 VanDerWaalsContact O-N 3.16Å
344I44Very low36.7Very low119 Ų119122.6 Ų122.661%0.6169%0.694SS**THydrogen-bonded Turntrans-103.2-9.5178-64171000111.7K340 A342K340-I344 HydrophobicContact CG-CD1 4.48Å; K340-I344 WeakPolarHBondContact O-CD1 3.24Å; K340-I344 VanDerWaalsContact O-CG1 3.27Å; K340-I344 WeakPolarHBondContact O-CG1 3.19Å; A342-I344 VanDerWaalsContact C-N 3.31Å; A342-I344 PolarHBondContact O-N 3.4Å
345S39Very low36.5Very low106 Ų106124.7 Ų124.774%0.74171%0.709SS**SBendtrans-92.7-2.2-178.9-168.90000115.1
346E35.6Very low35.9Very low189 Ų189127.7 Ų127.788%0.88373%0.725SS**  trans-122.575.5170.2-73.6-167.4173.500109.9
347S30Very low35.6Very low89 Ų89128.7 Ų128.762%0.62273%0.732SS**  trans-128.8127.1153.844.40000108.6V349S347-V349 PolarHBondContact O-N 2.93Å
348P33.9Very low35.5Very low129 Ų129129.5 Ų129.584%0.83874%0.743SS**  trans-71.1126.7179.227.5-29.6000109S350P348-S350 PolarHBondContact O-N 3.35Å
349V31.1Very low35.1Very low141 Ų141134 Ų13486%0.85576%0.76SS**  trans-62.4103.3168.3173.30000107.8S347 S351S347-V349 PolarHBondContact O-N 2.93Å; V349-S351 PolarHBondContact O-N 2.87Å
350S29.6Very low34.8Very low113 Ų113133.8 Ų133.879%0.7977%0.769SS**  trans-67.7107.9164.2-1780000108.3P348 K352P348-S350 PolarHBondContact O-N 3.35Å; S350-K352 PolarHBondContact O-N 3.02Å
351S30.7Very low34.6Very low103 Ų103132.7 Ų132.772%0.7277%0.774SS**PPolyproline II helixtrans-56.8128.1170.945.50000111.1V349V349-S351 PolarHBondContact O-N 2.87Å
352K31.7Very low34.4Very low200 Ų200134.2 Ų134.287%0.8778%0.784SS**PPolyproline II helixtrans-59131.1169.3-81.2176.1172.81780110.6S350 I354S350-K352 PolarHBondContact O-N 3.02Å; K352-I354 PolarHBondContact O-N 3.16Å
353Q30.9Very low34.3Very low200 Ų200134.4 Ų134.494%0.93579%0.793SS**PPolyproline II helixtrans-50.9122.2159.9-104.6159.2-37.400110.5
354I31.1Very low34Very low148 Ų148144 Ų14476%0.75982%0.824SS**  trans-118.5113.7153.8-65.7176.2000105.6K352 L356K352-I354 PolarHBondContact O-N 3.16Å; I354-L356 PolarHBondContact O-N 3.31Å
355S31.1Very low33.5Very low115 Ų115145.3 Ų145.380%0.80484%0.835SS**  trans-63.3120.1171.646.70000110.7
356L32Very low33.2Very low164 Ų164147.3 Ų147.386%0.85984%0.84SS**  trans-122.7125.1156.4-112.4110.7000108.3I354I354-L356 PolarHBondContact O-N 3.31Å
357Q34.7Very low33.1Very low186 Ų186145 Ų14587%0.86984%0.838SS**  trans-63154.9173.1-80.6177.7-38.600111.8
358P36.2Very low33.2Very low123 Ų123148.3 Ų148.380%0.79985%0.85SS**  trans-83.8134.8179.932.8-30.5000111.6
359L31.4Very low33.2Very low172 Ų172149.5 Ų149.590%0.90185%0.851SS**  trans-104.298.3161-160.582.1000107.3
360S35.8Very low33.3Very low111 Ų111150.1 Ų150.178%0.77685%0.851SS**  trans-97.7119.1163.654.90000108.7
361T37.1Very low33.6Very low121 Ų121152.7 Ų152.774%0.74286%0.855SS**  trans-62.4133.9173.837.60000112.9
362T38.2Very low33.8Very low142 Ų142156.5 Ų156.587%0.87187%0.865SS**  trans-6.6139146.521.10000119
363G36.7Very low34Very low74 Ų74152.9 Ų152.976%0.76387%0.865SS**  trans163.185.515300000116.6
364Q33Very low34.3Very low279 Ų279148.6 Ų148.6100%1.30486%0.859SS**  trans68.50157.7-68.6-177.2-14.200120.4

Retrieved 364 of 364 residues in 758.2 ms (Link to these results)