A0A087XAA6_POEFO Loading...

Oxytocin receptor a

AlphaFold DB , UniProt , Accession A0A087XAA6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 390 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M27.8Very low29.8Very low216 Ų216141.8 Ų141.8100%1.06473%0.729SS**  096.30-73.7138.3173.800105.6
2E27.3Very low29.6Very low176 Ų176143.5 Ų143.582%0.82273%0.732SS**  106.6132.178.2-91.1162.8178.900106.4
3T28Very low29.8Very low130 Ų130141.5 Ų141.580%0.79872%0.723SS**  cis-129.9151.41223.80000112.8
4I34.5Very low30.1Very low174 Ų174139.7 Ų139.789%0.89272%0.716SS**  trans-107.1114.3169-65.1166.4000107.2
5S27.2Very low30.3Very low93 Ų93138.7 Ų138.765%0.6571%0.707SS**  trans-175.2148.5160.454.20000111.2
6N27.7Very low30.3Very low101 Ų101135.4 Ų135.454%0.5470%0.7SS.*  trans109.537.1166.8-65.147.7000119.8D9N6-D9 PolarHBondContact ND2-OD2 3.42Å
7E31.8Very low30.3Very low178 Ų178139.1 Ų139.183%0.83270%0.703SS**SBendtrans-104.2-7.5148.1-79.7-169.5118.800113.2
8S29.5Very low30.3Very low80 Ų80140.4 Ų140.456%0.55970%0.698SS**SBendtrans-74.4-26.7-179.844.80000114.8I10S8-I10 VanDerWaalsContact C-N 3.34Å; S8-I10 PolarHBondContact O-N 3.07Å
9D30.8Very low30.3Very low83 Ų83140.1 Ų140.144%0.44470%0.699SS.*THydrogen-bonded Turntrans-80-17.7-167.3-61-7.3000113.2N6 W11N6-D9 PolarHBondContact ND2-OD2 3.42Å; D9-W11 VanDerWaalsContact C-N 3.26Å; D9-W11 PolarHBondContact O-N 3Å
10I32.9Very low30.4Very low131 Ų131137.2 Ų137.267%0.67269%0.693SS**THydrogen-bonded Turntrans-69-26.1-179.9-61.3177.4000111.4S8S8-I10 VanDerWaalsContact C-N 3.34Å; S8-I10 PolarHBondContact O-N 3.07Å
11W30Very low30.6Very low198 Ų198135.3 Ų135.375%0.7569%0.692SS**THydrogen-bonded Turntrans-89.1-18.6-178-80.997.3000114.9D9D9-W11 VanDerWaalsContact C-N 3.26Å; D9-W11 PolarHBondContact O-N 3Å
12Q27.9Very low31.2Very low162 Ų162132 Ų13276%0.75768%0.679SS**THydrogen-bonded Turntrans-80.3-22177.5-72.5-152.6-9.400114.2N14 E15Q12-N14 PolarHBondContact O-N 3.38Å; Q12-N14 VanDerWaalsContact O-N 3.15Å; Q12-E15 PolarHBondContact O-N 3.41Å
13L31.7Very low31.5Very low117 Ų117130.8 Ų130.861%0.61368%0.677SS**Hα-helixtrans-61.7-20.9173.1-9699.8000113W17L13-W17 VanDerWaalsContact O-CD1 3.3Å
14N33.8Very low31.6Very low117 Ų117131.8 Ų131.863%0.62668%0.677SS**Hα-helixtrans-79-14.9-177-111.7-6.8000115.1Q12Q12-N14 PolarHBondContact O-N 3.38Å; Q12-N14 VanDerWaalsContact O-N 3.15Å
15E33.4Very low31.9Very low125 Ų125127.1 Ų127.158%0.58467%0.672SS**Hα-helixtrans-95.4-30.9178.4-69.3-133.6110.200113.6Q12 W17 R18Q12-E15 PolarHBondContact O-N 3.41Å; E15-W17 VanDerWaalsContact C-N 3.3Å; E15-W17 PolarHBondContact O-N 3.04Å; E15-R18 PolarHBondContact O-N 3.22Å; E15-R18 IonicContact OE1-CZ 3.86Å; E15-R18 IonicContact OE1-NH1 3.44Å; E15-R18 PolarHBondContact OE1-NH1 2.92Å
16S30.1Very low32.5Very low86 Ų86129.8 Ų129.860%0.60169%0.685SS**Hα-helixtrans-62-36178.5-174.20000113.1R18 S20S16-R18 VanDerWaalsContact C-N 3.29Å; S16-R18 PolarHBondContact O-N 2.77Å; S16-S20 PolarHBondContact O-OG 3.31Å; S16-S20 VanDerWaalsContact O-OG 3.06Å
17W30.6Very low32.6Very low197 Ų197128.8 Ų128.875%0.74670%0.698SS**Hα-helixtrans-75.1-10.9179.3-75.686.4000114.5L13 E15L13-W17 VanDerWaalsContact O-CD1 3.3Å; E15-W17 VanDerWaalsContact C-N 3.3Å; E15-W17 PolarHBondContact O-N 3.04Å
18R30.5Very low33.1Very low163 Ų163124.2 Ų124.262%0.61570%0.699SS**Hα-helixtrans-86.8-24.3-179.5-146.5169.383.9-124.33.9113.3E15 S16 S21E15-R18 PolarHBondContact O-N 3.22Å; E15-R18 IonicContact OE1-CZ 3.86Å; E15-R18 IonicContact OE1-NH1 3.44Å; E15-R18 PolarHBondContact OE1-NH1 2.92Å; S16-R18 VanDerWaalsContact C-N 3.29Å; S16-R18 PolarHBondContact O-N 2.77Å; R18-S21 PolarHBondContact O-OG 3.17Å
19N31Very low33.4Very low134 Ų134128.2 Ų128.272%0.71771%0.713SS**Hα-helixtrans-95.7-12.4-178.5-70.9-14.9000113.9S21N19-S21 VanDerWaalsContact C-N 3.34Å
20S31Very low33.8Very low83 Ų83132.2 Ų132.258%0.5873%0.734SS**THydrogen-bonded Turntrans-84.5-4.4179.528.60000113.8S16 L22S16-S20 PolarHBondContact O-OG 3.31Å; S16-S20 VanDerWaalsContact O-OG 3.06Å; S20-L22 VanDerWaalsContact C-N 3.27Å; S20-L22 PolarHBondContact O-N 3.47Å
21S34.3Very low33.9Very low97 Ų97134.1 Ų134.168%0.67874%0.74SS**THydrogen-bonded Turntrans-83.69.4177.862.50000114.8R18 N19R18-S21 PolarHBondContact O-OG 3.17Å; N19-S21 VanDerWaalsContact C-N 3.34Å
22L40.8Very low34.5Very low148 Ų148130.8 Ų130.878%0.77574%0.742SS**SBendtrans-130.543.1-171.4-102.7170.4000113.7S20S20-L22 VanDerWaalsContact C-N 3.27Å; S20-L22 PolarHBondContact O-N 3.47Å
23L33.1Very low34.9Very low150 Ų150129.2 Ų129.279%0.78574%0.739SS**SBendtrans-156.4122.8162.1-109.8142.5000114
24N31Very low35.3Very low150 Ų150130 Ų13080%0.80275%0.751SS**  trans46.2105.2160.8-65.8-5.1000119.6
25G41.7Very low35.8Very low77 Ų77132.3 Ų132.379%0.79476%0.763SS**  trans-82133.7157.300000112.1
26T38.9Very low36.3Very low149 Ų149132.9 Ų132.991%0.91476%0.763SS**  trans-171.2120.3143.432.60000107.4
27G30.8Very low37.4Very low79 Ų79133.7 Ų133.781%0.81475%0.753SS**  trans145104.9176.900000112.2
28G42Very low39.1Very low82 Ų82129.4 Ų129.485%0.84575%0.745SS**  trans-76.1124.1178.900000112.2
29L35.4Very low41.1Very low165 Ų165126 Ų12686%0.86474%0.736SS**  trans-140.5132.9159.2-102.9134.7000107.8Q31L29-Q31 VanDerWaalsContact C-N 3.26Å; L29-Q31 PolarHBondContact O-N 3.44Å
30N38.5Very low43.2Very low166 Ų166125.4 Ų125.489%0.88873%0.729SS**  trans-68.284178.1-80.5-26.2000110T32N30-T32 PolarHBondContact O-N 3.49Å
31Q35.9Very low45.3Very low171 Ų171122.8 Ų122.880%0.79971%0.709SS**  trans-77.592.8176.1-156.4168.63100108.8L29 N33L29-Q31 VanDerWaalsContact C-N 3.26Å; L29-Q31 PolarHBondContact O-N 3.44Å; Q31-N33 PolarHBondContact O-N 2.83Å
32T41.8Very low47.2Very low128 Ų128118.9 Ų118.979%0.78568%0.683SS**  trans-58.7105.5170.341.50000109.4N30 P34N30-T32 PolarHBondContact O-N 3.49Å; T32-P34 WeakPolarHBondContact O-CD 3.48Å
33N35.8Very low49.2Very low129 Ų129116.2 Ų116.269%0.6967%0.665SS**  trans-55116.7-179.8-76.4-69.1000111.1Q31 L35 K36Q31-N33 PolarHBondContact O-N 2.83Å; N33-L35 PolarHBondContact O-N 2.99Å; N33-K36 PolarHBondContact O-N 3.26Å
34P41.8Very low51.6Low134 Ų134113.4 Ų113.487%0.8765%0.654SS**THydrogen-bonded Turntrans-72.3-0.1-175.829.5-35.6000114.2T32T32-P34 WeakPolarHBondContact O-CD 3.48Å
35L42.4Very low54Low166 Ų166106.6 Ų106.687%0.86962%0.617SS**THydrogen-bonded Turntrans-102.7-1.6-179.5-85.5163.5000114.6N33 R37N33-L35 PolarHBondContact O-N 2.99Å; L35-R37 PolarHBondContact O-N 3.45Å
36K44.6Very low56.1Low136 Ų136104.5 Ų104.559%0.59159%0.589SS**  trans-81.486.3173.4-162.7175.8-175.6-172.50109.7N33 N38 E39N33-K36 PolarHBondContact O-N 3.26Å; K36-N38 PolarHBondContact O-N 2.79Å; K36-N38 VanDerWaalsContact O-N 3.08Å; K36-E39 VanDerWaalsContact CE-OE2 3.26Å; K36-E39 WeakPolarHBondContact CE-OE2 3.37Å; K36-E39 IonicContact NZ-OE2 3Å; K36-E39 PolarHBondContact NZ-OE2 2.96Å
37R54.3Low58.5Low104 Ų104102 Ų10239%0.39257%0.573SS.*  trans-43119.8165.3177.416382.8146.3-1.2107.7L35 E39L35-R37 PolarHBondContact O-N 3.45Å; R37-E39 PolarHBondContact O-N 3.26Å
38N65Low61.2Low107 Ų107100.6 Ų100.657%0.57255%0.549SS*.  trans-52.2111.1-168-75.7-32.1000110.4K36 E40 V41 A42K36-N38 PolarHBondContact O-N 2.79Å; K36-N38 VanDerWaalsContact O-N 3.08Å; N38-E40 PolarHBondContact O-N 3.3Å; N38-V41 HydrophobicContact CB-CB 4.01Å; N38-V41 HydrophobicContact CB-CG2 3.49Å; N38-V41 VanDerWaalsContact CB-CG2 3.49Å; N38-V41 WeakPolarHBondContact O-CA 3.26Å; N38-V41 WeakPolarHBondContact O-CB 3.15Å; N38-V41 PolarHBondContact O-N 2.91Å; N38-A42 PolarHBondContact O-N 3.48Å
39E72.9Confident63.4Low92 Ų9296.7 Ų96.743%0.4351%0.509SS..Hα-helixtrans-60.3-36.5-168.9-158.7-171.8120.200111.7K36 R37 V41 A42 K43K36-E39 VanDerWaalsContact CE-OE2 3.26Å; K36-E39 WeakPolarHBondContact CE-OE2 3.37Å; K36-E39 IonicContact NZ-OE2 3Å; K36-E39 PolarHBondContact NZ-OE2 2.96Å; R37-E39 PolarHBondContact O-N 3.26Å; E39-V41 VanDerWaalsContact C-N 3.33Å; E39-V41 PolarHBondContact O-N 2.92Å; E39-A42 PolarHBondContact O-N 3.41Å; E39-K43 VanDerWaalsContact O-CG 3.32Å; E39-K43 WeakPolarHBondContact O-CG 3.36Å; E39-K43 PolarHBondContact O-N 3.37Å; E39-K43 WeakPolarHBondContact OE1-CE 3.23Å; E39-K43 IonicContact OE1-NZ 3.61Å; E39-K43 PolarHBondContact OE1-NZ 3.28Å
40E75.7Confident66.1Low121 Ų12190.8 Ų90.857%0.56548%0.484SS*.Hα-helixtrans-64.5-33.5174-57.5-50.2111.600113N38 K43 V44N38-E40 PolarHBondContact O-N 3.3Å; E40-K43 PolarHBondContact O-N 3.11Å; E40-K43 IonicContact OE1-NZ 2.6Å; E40-K43 PolarHBondContact OE1-NZ 3.29Å; E40-V44 VanDerWaalsContact O-CG2 3.28Å; E40-V44 WeakPolarHBondContact O-CG2 3.43Å; E40-V44 PolarHBondContact O-N 3.49Å
41V73.7Confident68.6Low28 Ų2887.7 Ų87.717%0.1747%0.467CS..Hα-helixtrans-71.2-43.3177.9-178.50000110.3N38 E39 K43 V44 E45 M308 I311N38-V41 HydrophobicContact CB-CB 4.01Å; N38-V41 HydrophobicContact CB-CG2 3.49Å; N38-V41 VanDerWaalsContact CB-CG2 3.49Å; N38-V41 WeakPolarHBondContact O-CA 3.26Å; N38-V41 WeakPolarHBondContact O-CB 3.15Å; N38-V41 PolarHBondContact O-N 2.91Å; E39-V41 VanDerWaalsContact C-N 3.33Å; E39-V41 PolarHBondContact O-N 2.92Å; V41-K43 PolarHBondContact O-N 2.94Å; V41-V44 PolarHBondContact O-N 2.81Å; V41-E45 WeakPolarHBondContact O-CB 3.47Å; V41-E45 PolarHBondContact O-N 2.87Å; V41-M308 HydrophobicContact CB-SD 4.48Å; V41-M308 HydrophobicContact CG1-CE 4.5Å; V41-M308 HydrophobicContact CG1-SD 3.79Å; V41-M308 HydrophobicContact CG2-CE 3.36Å; V41-M308 HydrophobicContact CG2-SD 3.77Å; V41-I311 HydrophobicContact CG1-CD1 3.66Å
42A74.2Confident71.2Confident15 Ų1579.8 Ų79.812%0.12443%0.43CS..Hα-helixtrans-63-40.7174.700000111.7N38 E39 V44 E45 V46N38-A42 PolarHBondContact O-N 3.48Å; E39-A42 PolarHBondContact O-N 3.41Å; A42-V44 PolarHBondContact O-N 3.48Å; A42-E45 PolarHBondContact O-N 3.25Å; A42-V46 WeakPolarHBondContact O-CB 3.22Å; A42-V46 VanDerWaalsContact O-CG2 3.32Å; A42-V46 WeakPolarHBondContact O-CG2 3.22Å; A42-V46 PolarHBondContact O-N 3.36Å
43K83.2Confident73.6Confident92 Ų9274.6 Ų74.640%0.440%0.397SS..Hα-helixtrans-59.5-45.1173.1-72.1167.1-169.3161.70111.9E39 E40 V41 T47E39-K43 VanDerWaalsContact O-CG 3.32Å; E39-K43 WeakPolarHBondContact O-CG 3.36Å; E39-K43 PolarHBondContact O-N 3.37Å; E39-K43 WeakPolarHBondContact OE1-CE 3.23Å; E39-K43 IonicContact OE1-NZ 3.61Å; E39-K43 PolarHBondContact OE1-NZ 3.28Å; E40-K43 PolarHBondContact O-N 3.11Å; E40-K43 IonicContact OE1-NZ 2.6Å; E40-K43 PolarHBondContact OE1-NZ 3.29Å; V41-K43 PolarHBondContact O-N 2.94Å; K43-T47 VanDerWaalsContact O-CB 3.32Å; K43-T47 WeakPolarHBondContact O-CB 3.35Å; K43-T47 PolarHBondContact O-N 2.89Å; K43-T47 PolarHBondContact O-OG1 2.7Å
44V83.6Confident76.4Confident90 Ų9074.9 Ų74.955%0.54539%0.393SS..Hα-helixtrans-65.4-46.5177.6169.60000111.2E40 V41 A42 T47 V48E40-V44 VanDerWaalsContact O-CG2 3.28Å; E40-V44 WeakPolarHBondContact O-CG2 3.43Å; E40-V44 PolarHBondContact O-N 3.49Å; V41-V44 PolarHBondContact O-N 2.81Å; A42-V44 PolarHBondContact O-N 3.48Å; V44-T47 PolarHBondContact O-N 2.93Å; V44-V48 HydrophobicContact CG1-CG2 4.29Å; V44-V48 VanDerWaalsContact O-CG2 3.3Å; V44-V48 WeakPolarHBondContact O-CG2 3.39Å; V44-V48 PolarHBondContact O-N 3.43Å
45E81.4Confident78.9Confident7 Ų770.9 Ų70.93%0.03336%0.364CS..Hα-helixtrans-57-53177.8177167.1-141.500112V41 A42 T47 V48 L49 I311V41-E45 WeakPolarHBondContact O-CB 3.47Å; V41-E45 PolarHBondContact O-N 2.87Å; A42-E45 PolarHBondContact O-N 3.25Å; E45-T47 VanDerWaalsContact C-N 3.32Å; E45-T47 PolarHBondContact O-N 3.33Å; E45-V48 PolarHBondContact O-N 3.32Å; E45-L49 HydrophobicContact CG-CD1 3.92Å; E45-L49 WeakPolarHBondContact O-CB 3.43Å; E45-L49 WeakPolarHBondContact O-CG 3.31Å; E45-L49 PolarHBondContact O-N 2.89Å; E45-I311 HydrophobicContact CB-CG2 4.19Å; E45-I311 HydrophobicContact CG-CG2 4.07Å; E45-I311 WeakPolarHBondContact OE1-CG2 3.31Å
46V86.8Confident81.2Confident33 Ų3363 Ų6320%0.232%0.323CS..Hα-helixtrans-58.7-42.6176.7168.30000111.4A42 L49 A50 L100 D103 I104A42-V46 WeakPolarHBondContact O-CB 3.22Å; A42-V46 VanDerWaalsContact O-CG2 3.32Å; A42-V46 WeakPolarHBondContact O-CG2 3.22Å; A42-V46 PolarHBondContact O-N 3.36Å; V46-L49 PolarHBondContact O-N 3.44Å; V46-A50 VanDerWaalsContact O-CB 3.3Å; V46-A50 WeakPolarHBondContact O-CB 3.45Å; V46-A50 PolarHBondContact O-N 3.25Å; V46-L100 HydrophobicContact CB-CD1 4.42Å; V46-L100 HydrophobicContact CG1-CD1 3.89Å; V46-L100 WeakPolarHBondContact O-CD1 3.4Å; V46-D103 HydrophobicContact CG2-CB 3.9Å; V46-I104 HydrophobicContact CG1-CD1 4.03Å; V46-I104 HydrophobicContact CG1-CG1 3.68Å; V46-I104 HydrophobicContact CG2-CG1 4Å
47T88.8Confident83.6Confident96 Ų9659.4 Ų59.459%0.58931%0.31SS*.Hα-helixtrans-64.9-43.7179.1-57.90000111.7K43 V44 E45 L51K43-T47 VanDerWaalsContact O-CB 3.32Å; K43-T47 WeakPolarHBondContact O-CB 3.35Å; K43-T47 PolarHBondContact O-N 2.89Å; K43-T47 PolarHBondContact O-OG1 2.7Å; V44-T47 PolarHBondContact O-N 2.93Å; E45-T47 VanDerWaalsContact C-N 3.32Å; E45-T47 PolarHBondContact O-N 3.33Å; T47-L51 WeakPolarHBondContact O-CB 3.36Å; T47-L51 PolarHBondContact O-N 3.06Å
48V87.9Confident85.5Confident50 Ų5056.5 Ų56.530%0.30331%0.308SS..Hα-helixtrans-67.7-44.2178.1175.50000110.7V44 E45 A50 L51 V52 L315V44-V48 HydrophobicContact CG1-CG2 4.29Å; V44-V48 VanDerWaalsContact O-CG2 3.3Å; V44-V48 WeakPolarHBondContact O-CG2 3.39Å; V44-V48 PolarHBondContact O-N 3.43Å; E45-V48 PolarHBondContact O-N 3.32Å; V48-A50 PolarHBondContact O-N 2.93Å; V48-L51 PolarHBondContact O-N 3.16Å; V48-V52 HydrophobicContact CG1-CG2 4.22Å; V48-V52 WeakPolarHBondContact O-CB 3.33Å; V48-V52 VanDerWaalsContact O-CG2 3.29Å; V48-V52 WeakPolarHBondContact O-CG2 3.25Å; V48-V52 PolarHBondContact O-N 2.86Å; V48-L315 HydrophobicContact CB-CD2 4.25Å; V48-L315 HydrophobicContact CG1-CD1 4.32Å; V48-L315 HydrophobicContact CG1-CD2 3.93Å
49L87.4Confident86.8Confident0 Ų052.1 Ų52.10%029%0.288CS..Hα-helixtrans-61.6-42.3176.6-75.9168.5000112.3E45 V46 L51 V52 L53 V96 Q99 L100 D103 L315E45-L49 HydrophobicContact CG-CD1 3.92Å; E45-L49 WeakPolarHBondContact O-CB 3.43Å; E45-L49 WeakPolarHBondContact O-CG 3.31Å; E45-L49 PolarHBondContact O-N 2.89Å; V46-L49 PolarHBondContact O-N 3.44Å; L49-L51 PolarHBondContact O-N 2.99Å; L49-V52 PolarHBondContact O-N 3.39Å; L49-L53 VanDerWaalsContact O-CB 3.25Å; L49-L53 WeakPolarHBondContact O-CB 3.48Å; L49-L53 PolarHBondContact O-N 3.33Å; L49-V96 HydrophobicContact CD2-CG1 4.21Å; L49-Q99 HydrophobicContact CD1-CG 4.06Å; L49-L100 HydrophobicContact CB-CB 4.4Å; L49-L100 HydrophobicContact CB-CD1 3.9Å; L49-D103 WeakPolarHBondContact CD1-OD2 3.26Å; L49-L315 HydrophobicContact CD1-CD2 4.42Å; L49-L315 HydrophobicContact CD2-CD2 3.76Å; L49-L315 HydrophobicContact CG-CD2 3.64Å
50A91.9Very high87.8Confident42 Ų4247.8 Ų47.835%0.34727%0.268SS..Hα-helixtrans-61.9-42.1175.200000112.1V46 V48 F54 L100V46-A50 VanDerWaalsContact O-CB 3.3Å; V46-A50 WeakPolarHBondContact O-CB 3.45Å; V46-A50 PolarHBondContact O-N 3.25Å; V48-A50 PolarHBondContact O-N 2.93Å; A50-F54 WeakPolarHBondContact O-CB 3.27Å; A50-F54 PolarHBondContact O-N 3.37Å; A50-L100 HydrophobicContact CB-CD1 4.24Å; A50-L100 HydrophobicContact CB-CD2 4.09Å
51L91.9Very high88.6Confident100 Ų10046.3 Ų46.352%0.52426%0.264SS..Hα-helixtrans-65.3-45.6175.1-179.562.6000111.9T47 V48 L49 L53 F54 L55T47-L51 WeakPolarHBondContact O-CB 3.36Å; T47-L51 PolarHBondContact O-N 3.06Å; V48-L51 PolarHBondContact O-N 3.16Å; L49-L51 PolarHBondContact O-N 2.99Å; L51-L53 VanDerWaalsContact C-N 3.35Å; L51-L53 PolarHBondContact O-N 3.42Å; L51-F54 PolarHBondContact O-N 2.75Å; L51-L55 HydrophobicContact CD1-CD1 4.09Å; L51-L55 HydrophobicContact CD1-CG 4.16Å; L51-L55 HydrophobicContact CG-CD1 3.99Å; L51-L55 HydrophobicContact CG-CG 4.44Å; L51-L55 WeakPolarHBondContact O-CB 3.39Å; L51-L55 VanDerWaalsContact O-CG 3.26Å; L51-L55 WeakPolarHBondContact O-CG 3.34Å; L51-L55 PolarHBondContact O-N 2.97Å
52V90.6Very high89.4Confident6 Ų647.1 Ų47.14%0.03627%0.27CS..Hα-helixtrans-62.4-42.4177.71710000111V48 L49 L55 A56 L319 C322V48-V52 HydrophobicContact CG1-CG2 4.22Å; V48-V52 WeakPolarHBondContact O-CB 3.33Å; V48-V52 VanDerWaalsContact O-CG2 3.29Å; V48-V52 WeakPolarHBondContact O-CG2 3.25Å; V48-V52 PolarHBondContact O-N 2.86Å; L49-V52 PolarHBondContact O-N 3.39Å; V52-L55 PolarHBondContact O-N 3.02Å; V52-A56 WeakPolarHBondContact O-CB 3.16Å; V52-A56 PolarHBondContact O-N 3.46Å; V52-L319 HydrophobicContact CG2-CD2 3.61Å; V52-L319 HydrophobicContact CG2-CG 4.46Å; V52-C322 HydrophobicContact CG1-CB 4.47Å
53L92.8Very high90.2Very high18 Ų1846.4 Ų46.49%0.09426%0.264CS..Hα-helixtrans-59.1-51.1174.5178.462.1000111.2L49 L51 L55 A56 L57 A92 V96 L97 L100L49-L53 VanDerWaalsContact O-CB 3.25Å; L49-L53 WeakPolarHBondContact O-CB 3.48Å; L49-L53 PolarHBondContact O-N 3.33Å; L51-L53 VanDerWaalsContact C-N 3.35Å; L51-L53 PolarHBondContact O-N 3.42Å; L53-L55 PolarHBondContact O-N 2.88Å; L53-A56 PolarHBondContact O-N 3.03Å; L53-L57 HydrophobicContact CD1-CD1 3.76Å; L53-L57 HydrophobicContact CD1-CG 4.02Å; L53-L57 HydrophobicContact CG-CD1 3.96Å; L53-L57 WeakPolarHBondContact O-CB 3.46Å; L53-L57 VanDerWaalsContact O-CG 3.28Å; L53-L57 WeakPolarHBondContact O-CG 3.32Å; L53-L57 PolarHBondContact O-N 3.28Å; L53-A92 HydrophobicContact CD1-CB 4.19Å; L53-A92 WeakPolarHBondContact CD1-O 3.29Å; L53-V96 HydrophobicContact CB-CG1 3.93Å; L53-V96 HydrophobicContact CD1-CB 4.28Å; L53-V96 HydrophobicContact CD1-CG1 4.36Å; L53-L97 HydrophobicContact CD1-CB 4.05Å; L53-L97 HydrophobicContact CD2-CB 4.05Å; L53-L97 HydrophobicContact CD2-CD1 3.93Å; L53-L100 HydrophobicContact CD2-CD2 3.74Å
54F94.4Very high90.6Very high135 Ų13543 Ų4359%0.59225%0.25SS*.Hα-helixtrans-58.2-48.3178175-100.6000111.8A50 L51 L57 A58A50-F54 WeakPolarHBondContact O-CB 3.27Å; A50-F54 PolarHBondContact O-N 3.37Å; L51-F54 PolarHBondContact O-N 2.75Å; F54-L57 PolarHBondContact O-N 2.94Å; F54-A58 WeakPolarHBondContact O-CB 3.46Å; F54-A58 PolarHBondContact O-N 3.29Å
55L92.8Very high90.9Very high51 Ų5142.7 Ų42.727%0.26725%0.245SC..Hα-helixtrans-65.2-40.2179.5-69.7177.3000112.7L51 V52 L53 G59 C322 W326L51-L55 HydrophobicContact CD1-CD1 4.09Å; L51-L55 HydrophobicContact CD1-CG 4.16Å; L51-L55 HydrophobicContact CG-CD1 3.99Å; L51-L55 HydrophobicContact CG-CG 4.44Å; L51-L55 WeakPolarHBondContact O-CB 3.39Å; L51-L55 VanDerWaalsContact O-CG 3.26Å; L51-L55 WeakPolarHBondContact O-CG 3.34Å; L51-L55 PolarHBondContact O-N 2.97Å; V52-L55 PolarHBondContact O-N 3.02Å; L53-L55 PolarHBondContact O-N 2.88Å; L55-G59 WeakPolarHBondContact O-CA 3.34Å; L55-G59 PolarHBondContact O-N 2.87Å; L55-C322 HydrophobicContact CB-CB 4.27Å; L55-W326 HydrophobicContact CD2-CZ2 4.11Å
56A92.1Very high91.1Very high1 Ų142.3 Ų42.31%0.00824%0.243CC..Hα-helixtrans-66.7-44.5177.800000111.8V52 L53 N60 A92 C322V52-A56 WeakPolarHBondContact O-CB 3.16Å; V52-A56 PolarHBondContact O-N 3.46Å; L53-A56 PolarHBondContact O-N 3.03Å; A56-N60 VanDerWaalsContact O-CB 3.3Å; A56-N60 WeakPolarHBondContact O-CB 3.31Å; A56-N60 PolarHBondContact O-N 3.47Å; A56-N60 VanDerWaalsContact O-N 3.11Å; A56-N60 PolarHBondContact O-ND2 2.77Å; A56-A92 HydrophobicContact CB-CB 3.97Å; A56-C322 HydrophobicContact CB-CB 4.1Å
57L94.9Very high91.1Very high59 Ų5941.3 Ų41.331%0.30924%0.236SC..Hα-helixtrans-65.8-56.4176.9-69.7175.1000111.5L53 F54 G59 L61 L89 A92 I93L53-L57 HydrophobicContact CD1-CD1 3.76Å; L53-L57 HydrophobicContact CD1-CG 4.02Å; L53-L57 HydrophobicContact CG-CD1 3.96Å; L53-L57 WeakPolarHBondContact O-CB 3.46Å; L53-L57 VanDerWaalsContact O-CG 3.28Å; L53-L57 WeakPolarHBondContact O-CG 3.32Å; L53-L57 PolarHBondContact O-N 3.28Å; F54-L57 PolarHBondContact O-N 2.94Å; L57-G59 PolarHBondContact O-N 3.44Å; L57-L61 WeakPolarHBondContact O-CB 3.32Å; L57-L61 PolarHBondContact O-N 2.86Å; L57-L89 HydrophobicContact CD2-CD2 3.87Å; L57-A92 HydrophobicContact CD2-CB 3.71Å; L57-A92 HydrophobicContact CG-CB 4.07Å; L57-I93 HydrophobicContact CD2-CD1 4.36Å; L57-I93 HydrophobicContact CD2-CG1 3.83Å
58A93.9Very high90.9Very high44 Ų4442.7 Ų42.736%0.36424%0.236SC..Hα-helixtrans-63.6-43.2-17700000111.8F54 C62F54-A58 WeakPolarHBondContact O-CB 3.46Å; F54-A58 PolarHBondContact O-N 3.29Å; A58-C62 WeakPolarHBondContact O-CB 3.24Å; A58-C62 PolarHBondContact O-N 3.49Å
59G92.1Very high90.6Very high15 Ų1543.3 Ų43.316%0.15524%0.24CC..Hα-helixtrans-63.8-52.2179.300000112.7L55 L57 C62 V63L55-G59 WeakPolarHBondContact O-CA 3.34Å; L55-G59 PolarHBondContact O-N 2.87Å; L57-G59 PolarHBondContact O-N 3.44Å; G59-C62 WeakPolarHBondContact O-CB 3.24Å; G59-C62 PolarHBondContact O-N 2.85Å; G59-V63 WeakPolarHBondContact O-CG2 3.31Å; G59-V63 PolarHBondContact O-N 3Å
60N93.7Very high90Very high0 Ų043.6 Ų43.60%024%0.241CC..Hα-helixtrans-71.1-33.9-178.1-74.5-68.9000112.5A56 V63 L64 S85 L89 S321 P325A56-N60 VanDerWaalsContact O-CB 3.3Å; A56-N60 WeakPolarHBondContact O-CB 3.31Å; A56-N60 PolarHBondContact O-N 3.47Å; A56-N60 VanDerWaalsContact O-N 3.11Å; A56-N60 PolarHBondContact O-ND2 2.77Å; N60-V63 PolarHBondContact O-N 3.3Å; N60-L64 WeakPolarHBondContact O-CG 3.44Å; N60-L64 PolarHBondContact O-N 3.35Å; N60-S85 WeakPolarHBondContact OD1-CA 3.09Å; N60-S85 WeakPolarHBondContact OD1-CB 3.3Å; N60-S85 PolarHBondContact OD1-OG 3.22Å; N60-L89 HydrophobicContact CB-CD1 4.43Å; N60-L89 HydrophobicContact CB-CD2 3.93Å; N60-L89 HydrophobicContact CB-CG 3.81Å; N60-S321 PolarHBondContact ND2-O 3.48Å; N60-S321 VanDerWaalsContact ND2-O 3.1Å; N60-P325 HydrophobicContact CB-CG 4.4Å
61L93.5Very high88.7Confident91 Ų9151.3 Ų51.348%0.47627%0.267SS..Hα-helixtrans-63.9-42.4171.1-176.260.6000111.4L57 V63 L64 L65L57-L61 WeakPolarHBondContact O-CB 3.32Å; L57-L61 PolarHBondContact O-N 2.86Å; L61-V63 PolarHBondContact O-N 2.86Å; L61-L64 PolarHBondContact O-N 3.41Å; L61-L65 HydrophobicContact CD1-CG 4.45Å; L61-L65 HydrophobicContact CG-CD1 4.15Å; L61-L65 HydrophobicContact CG-CG 4.48Å; L61-L65 VanDerWaalsContact O-CG 3.32Å; L61-L65 WeakPolarHBondContact O-CG 3.39Å; L61-L65 PolarHBondContact O-N 3.32Å
62C90.6Very high87.2Confident44 Ų4453.6 Ų53.630%0.29728%0.275SS..Hα-helixtrans-60.6-43.7175.3-173.70000111.9A58 G59 L64 L65 A66A58-C62 WeakPolarHBondContact O-CB 3.24Å; A58-C62 PolarHBondContact O-N 3.49Å; G59-C62 WeakPolarHBondContact O-CB 3.24Å; G59-C62 PolarHBondContact O-N 2.85Å; C62-L64 PolarHBondContact O-N 3.02Å; C62-L65 PolarHBondContact O-N 2.76Å; C62-A66 WeakPolarHBondContact O-CB 3.32Å; C62-A66 PolarHBondContact O-N 3.3Å
63V90.3Very high85.7Confident0 Ų054.9 Ų54.90%028%0.284CS..Hα-helixtrans-58.2-46.3173.9172.10000111.3G59 N60 L61 A66 I67 S85 P325 Y328 F336G59-V63 WeakPolarHBondContact O-CG2 3.31Å; G59-V63 PolarHBondContact O-N 3Å; N60-V63 PolarHBondContact O-N 3.3Å; L61-V63 PolarHBondContact O-N 2.86Å; V63-A66 PolarHBondContact O-N 3.44Å; V63-I67 HydrophobicContact CG1-CD1 3.81Å; V63-I67 VanDerWaalsContact O-CG1 3.31Å; V63-I67 WeakPolarHBondContact O-CG1 3.3Å; V63-I67 PolarHBondContact O-N 3.48Å; V63-S85 WeakPolarHBondContact CG1-OG 3.44Å; V63-P325 HydrophobicContact CG2-CB 3.82Å; V63-P325 HydrophobicContact CG2-CG 4.17Å; V63-Y328 HydrophobicContact CG1-CD2 3.83Å; V63-Y328 HydrophobicContact CG1-CE2 4.19Å; V63-Y328 HydrophobicContact CG2-CD2 3.83Å; V63-F336 HydrophobicContact CG2-CZ 4.01Å
64L91.1Very high84.2Confident22 Ų2260.2 Ų60.212%0.11531%0.309CS..Hα-helixtrans-62.1-47.2177.2-70.3176.7000111.6N60 L61 C62 A66 I67 H68 K82 I86 L89N60-L64 WeakPolarHBondContact O-CG 3.44Å; N60-L64 PolarHBondContact O-N 3.35Å; L61-L64 PolarHBondContact O-N 3.41Å; C62-L64 PolarHBondContact O-N 3.02Å; L64-A66 VanDerWaalsContact C-N 3.31Å; L64-A66 PolarHBondContact O-N 3.29Å; L64-I67 PolarHBondContact O-N 3.41Å; L64-H68 WeakPolarHBondContact O-CB 3.45Å; L64-H68 PolarHBondContact O-CD2 3.24Å; L64-H68 VanDerWaalsContact O-CD2 3.24Å; L64-H68 PolarHBondContact O-N 2.93Å; L64-K82 HydrophobicContact CD2-CB 4.27Å; L64-K82 HydrophobicContact CD2-CG 3.79Å; L64-I86 HydrophobicContact CD1-CG1 4.33Å; L64-I86 HydrophobicContact CD2-CG1 4.32Å; L64-L89 HydrophobicContact CD1-CD1 3.59Å
65L89.3Confident83.2Confident82 Ų8256.7 Ų56.743%0.42930%0.301SS..Hα-helixtrans-60.4-40177.1-70171.8000111.9L61 C62 H68 T69 L339L61-L65 HydrophobicContact CD1-CG 4.45Å; L61-L65 HydrophobicContact CG-CD1 4.15Å; L61-L65 HydrophobicContact CG-CG 4.48Å; L61-L65 VanDerWaalsContact O-CG 3.32Å; L61-L65 WeakPolarHBondContact O-CG 3.39Å; L61-L65 PolarHBondContact O-N 3.32Å; C62-L65 PolarHBondContact O-N 2.76Å; L65-H68 PolarHBondContact O-N 3.31Å; L65-T69 WeakPolarHBondContact O-CB 3.08Å; L65-T69 WeakPolarHBondContact O-CG2 3.16Å; L65-T69 PolarHBondContact O-N 2.96Å; L65-T69 PolarHBondContact O-OG1 2.89Å; L65-L339 HydrophobicContact CB-CD1 4.01Å
66A86.3Confident82.6Confident0 Ų057.9 Ų57.90%030%0.302CS..Hα-helixtrans-67.5-43.6178.700000111.6C62 V63 L64 H68 T69 T70 L335 L339C62-A66 WeakPolarHBondContact O-CB 3.32Å; C62-A66 PolarHBondContact O-N 3.3Å; V63-A66 PolarHBondContact O-N 3.44Å; L64-A66 VanDerWaalsContact C-N 3.31Å; L64-A66 PolarHBondContact O-N 3.29Å; A66-H68 VanDerWaalsContact C-N 3.31Å; A66-H68 PolarHBondContact O-N 2.87Å; A66-T69 PolarHBondContact O-N 2.91Å; A66-T69 PolarHBondContact O-OG1 3.49Å; A66-T70 PolarHBondContact O-N 2.91Å; A66-L335 HydrophobicContact CB-CD1 4.13Å; A66-L335 HydrophobicContact CB-CD2 4.06Å; A66-L335 HydrophobicContact CB-CG 3.68Å; A66-L335 WeakPolarHBondContact O-CD1 3.45Å; A66-L339 HydrophobicContact CB-CB 4.17Å; A66-L339 HydrophobicContact CB-CD1 3.77Å
67I87.1Confident82Confident11 Ų1158.4 Ų58.46%0.05630%0.304CS..Hα-helixtrans-62.5-38.3173.5-67.9169.2000111.2V63 L64 S73 Y78 M81 K82 L335V63-I67 HydrophobicContact CG1-CD1 3.81Å; V63-I67 VanDerWaalsContact O-CG1 3.31Å; V63-I67 WeakPolarHBondContact O-CG1 3.3Å; V63-I67 PolarHBondContact O-N 3.48Å; L64-I67 PolarHBondContact O-N 3.41Å; I67-S73 WeakPolarHBondContact O-CB 3.16Å; I67-Y78 HydrophobicContact CG1-CD1 4.32Å; I67-M81 HydrophobicContact CD1-CB 3.78Å; I67-K82 HydrophobicContact CD1-CB 4.48Å; I67-L335 HydrophobicContact CG1-CD2 4.07Å
68H84.4Confident81.5Confident126 Ų12656.8 Ų56.858%0.58329%0.294SS*.Hα-helixtrans-73.3-27.5178.9-89.7-84.7000113.9L64 L65 A66 K82L64-H68 WeakPolarHBondContact O-CB 3.45Å; L64-H68 PolarHBondContact O-CD2 3.24Å; L64-H68 VanDerWaalsContact O-CD2 3.24Å; L64-H68 PolarHBondContact O-N 2.93Å; L65-H68 PolarHBondContact O-N 3.31Å; A66-H68 VanDerWaalsContact C-N 3.31Å; A66-H68 PolarHBondContact O-N 2.87Å; H68-K82 PolarHBondContact CE1-NZ 2.89Å; H68-K82 PolarHBondContact NE2-NZ 3.33Å
69T81.4Confident81.2Confident62 Ų6258.1 Ų58.138%0.3829%0.29SS..Hα-helixtrans-93.5-25-17849.70000114.4L65 A66L65-T69 WeakPolarHBondContact O-CB 3.08Å; L65-T69 WeakPolarHBondContact O-CG2 3.16Å; L65-T69 PolarHBondContact O-N 2.96Å; L65-T69 PolarHBondContact O-OG1 2.89Å; A66-T69 PolarHBondContact O-N 2.91Å; A66-T69 PolarHBondContact O-OG1 3.49Å
70T76Confident81Confident6 Ų657.6 Ų57.64%0.03728%0.284CS..  trans-75.4133.4176.3-172.50000112.6A66 H72 S73 L335 D338A66-T70 PolarHBondContact O-N 2.91Å; T70-H72 PolarHBondContact O-N 3.01Å; T70-H72 PolarHBondContact OG1-N 3.4Å; T70-S73 WeakPolarHBondContact O-CB 3.16Å; T70-S73 PolarHBondContact O-N 3.24Å; T70-S73 PolarHBondContact O-OG 3.28Å; T70-L335 HydrophobicContact CG2-CD1 3.36Å; T70-D338 WeakPolarHBondContact CB-OD2 3.28Å; T70-D338 PolarHBondContact OG1-OD2 3.2Å
71K64.4Low80.8Confident205 Ų20557.8 Ų57.889%0.89129%0.285SS*.THydrogen-bonded Turntrans-67.1-19.4170.8-78.2-175.9174.6179.60112.8S73K71-S73 VanDerWaalsContact C-N 3.27Å; K71-S73 PolarHBondContact O-N 3.29Å
72H58.9Low80.7Confident147 Ų14756.6 Ų56.668%0.68128%0.276SS*.THydrogen-bonded Turntrans-846.2178.6-86.4-74000114.4T70 Q74 Y78T70-H72 PolarHBondContact O-N 3.01Å; T70-H72 PolarHBondContact OG1-N 3.4Å; H72-Q74 PolarHBondContact O-N 3.03Å; H72-Y78 VanDerWaalsContact O-CE2 3.25Å; H72-Y78 WeakPolarHBondContact O-CE2 3.49Å
73S59.6Low80.8Confident34 Ų3456.2 Ų56.224%0.23827%0.27CS..THydrogen-bonded Turntrans-60.5-7.4-175.554.20000116.2I67 T70 K71 S75I67-S73 WeakPolarHBondContact O-CB 3.16Å; T70-S73 WeakPolarHBondContact O-CB 3.16Å; T70-S73 PolarHBondContact O-N 3.24Å; T70-S73 PolarHBondContact O-OG 3.28Å; K71-S73 VanDerWaalsContact C-N 3.27Å; K71-S73 PolarHBondContact O-N 3.29Å; S73-S75 PolarHBondContact O-N 3.14Å; S73-S75 VanDerWaalsContact O-N 3.16Å
74Q61.3Low80.9Confident130 Ų13056.3 Ų56.361%0.60727%0.27SS*.THydrogen-bonded Turntrans-73.1-1.7-177.3-65-59.1-32.200115.7H72 R153H72-Q74 PolarHBondContact O-N 3.03Å; Q74-R153 PolarHBondContact O-NH1 3.26Å
75S74.3Confident81Confident60 Ų6055.2 Ų55.242%0.4226%0.264SS..SBendtrans-69.5138.5174-177.30000112.2S73 M77 Y78S73-S75 PolarHBondContact O-N 3.14Å; S73-S75 VanDerWaalsContact O-N 3.16Å; S75-M77 PolarHBondContact O-N 3.39Å; S75-M77 PolarHBondContact OG-N 3.32Å; S75-Y78 PolarHBondContact O-N 2.98Å
76R79Confident81.3Confident76 Ų7654 Ų5429%0.28726%0.258SS..Hα-helixtrans-54.3-23.7173.4-168.2174.2-178-126.4-5.8113.1F80 D139 D156R76-F80 HydrophobicContact CG-CE2 4.08Å; R76-F80 VanDerWaalsContact O-CD2 3.24Å; R76-F80 WeakPolarHBondContact O-CD2 3.38Å; R76-D139 IonicContact CZ-OD1 3.67Å; R76-D139 IonicContact CZ-OD2 3.81Å; R76-D139 IonicContact NE-OD1 3.29Å; R76-D139 IonicContact NH1-OD1 2.67Å; R76-D139 PolarHBondContact NH1-OD1 2.96Å; R76-D139 IonicContact NH1-OD2 2.74Å; R76-D139 IonicContact NH2-OD1 3.64Å; R76-D139 PolarHBondContact NH2-OD1 2.95Å; R76-D156 WeakPolarHBondContact CD-OD2 3.26Å; R76-D156 IonicContact CZ-OD1 3.29Å; R76-D156 VanDerWaalsContact CZ-OD1 3.29Å; R76-D156 IonicContact CZ-OD2 3.71Å; R76-D156 IonicContact NE-OD1 2.9Å; R76-D156 PolarHBondContact NE-OD1 2.91Å; R76-D156 VanDerWaalsContact NE-OD1 3.12Å; R76-D156 IonicContact NE-OD2 3.27Å; R76-D156 PolarHBondContact NE-OD2 3.04Å; R76-D156 IonicContact NH2-OD1 3.5Å; R76-D156 PolarHBondContact NH2-OD1 3.09Å; R76-D156 IonicContact NH2-OD2 2.71Å
77M79.8Confident81.7Confident12 Ų1254 Ų546%0.05926%0.258CS..Hα-helixtrans-67.1-46.6174.1-173.370.8-90.800112.6S75 Y79 F80 M81 M136 R140 T272 M275S75-M77 PolarHBondContact O-N 3.39Å; S75-M77 PolarHBondContact OG-N 3.32Å; M77-Y79 PolarHBondContact O-N 2.93Å; M77-F80 HydrophobicContact CE-CB 3.91Å; M77-F80 PolarHBondContact O-N 3.43Å; M77-F80 VanDerWaalsContact O-N 3.14Å; M77-M81 HydrophobicContact CE-CG 4.18Å; M77-M81 HydrophobicContact CG-CE 3.68Å; M77-M81 HydrophobicContact CG-CG 4.35Å; M77-M81 HydrophobicContact CG-SD 3.91Å; M77-M81 WeakPolarHBondContact O-CG 3.3Å; M77-M81 PolarHBondContact O-N 2.74Å; M77-M81 HydrophobicContact SD-CE 4.42Å; M77-M136 HydrophobicContact CE-CG 3.86Å; M77-M136 HydrophobicContact CE-SD 3.62Å; M77-R140 PolarHBondContact SD-NH1 3.44Å; M77-T272 HydrophobicContact CG-CG2 4Å; M77-T272 HydrophobicContact SD-CG2 3.22Å; M77-T272 WeakPolarHBondContact SD-CG2 3.43Å; M77-M275 HydrophobicContact SD-CE 4.16Å
78Y84.4Confident82Confident26 Ų2653.5 Ų53.510%0.10226%0.255CS..Hα-helixtrans-66.6-26.4-177.3-56.5-56.2000112.1I67 H72 S75 M81 K82 H334 L335I67-Y78 HydrophobicContact CG1-CD1 4.32Å; H72-Y78 VanDerWaalsContact O-CE2 3.25Å; H72-Y78 WeakPolarHBondContact O-CE2 3.49Å; S75-Y78 PolarHBondContact O-N 2.98Å; Y78-M81 HydrophobicContact CD1-SD 3.63Å; Y78-M81 HydrophobicContact CE1-SD 4.2Å; Y78-K82 VanDerWaalsContact O-CB 3.3Å; Y78-K82 WeakPolarHBondContact O-CB 3.25Å; Y78-K82 PolarHBondContact O-N 3.45Å; Y78-H334 PolarHBondContact OH-NE2 3.18Å; Y78-L335 HydrophobicContact CE1-CD1 4.49Å; Y78-L335 HydrophobicContact CE1-CD2 4.42Å
79Y87.7Confident82.5Confident71 Ų7148.9 Ų48.928%0.27824%0.235SC..Hα-helixtrans-61.5-47.8171-178.6-111.2000112.4M77 K82 H83 D156 V160M77-Y79 PolarHBondContact O-N 2.93Å; Y79-K82 PolarHBondContact O-N 2.87Å; Y79-H83 AromaticContact CE2-CD2 3.59Å; Y79-H83 AromaticContact CE2-NE2 3.32Å; Y79-H83 VanDerWaalsContact CE2-NE2 3.32Å; Y79-H83 WeakPolarHBondContact CE2-NE2 3.48Å; Y79-H83 AromaticContact CZ-CD2 3.62Å; Y79-H83 AromaticContact CZ-NE2 3.43Å; Y79-H83 PolarHBondContact O-CD2 3.19Å; Y79-H83 PolarHBondContact O-N 3.29Å; Y79-H83 PolarHBondContact OH-NE2 3.47Å; Y79-D156 HydrophobicContact CD1-CB 4.5Å; Y79-D156 HydrophobicContact CE1-CB 4.26Å; Y79-V160 HydrophobicContact CE1-CB 4.4Å; Y79-V160 HydrophobicContact CE1-CG2 3.7Å
80F88.3Confident83.1Confident4 Ų447.3 Ų47.32%0.01822%0.224CC..Hα-helixtrans-69.6-41.2176.2-67.4-63000112.4R76 M77 K82 H83 L84 L135 D139 D156 V160R76-F80 HydrophobicContact CG-CE2 4.08Å; R76-F80 VanDerWaalsContact O-CD2 3.24Å; R76-F80 WeakPolarHBondContact O-CD2 3.38Å; M77-F80 HydrophobicContact CE-CB 3.91Å; M77-F80 PolarHBondContact O-N 3.43Å; M77-F80 VanDerWaalsContact O-N 3.14Å; F80-K82 VanDerWaalsContact C-N 3.29Å; F80-K82 PolarHBondContact O-N 3.21Å; F80-H83 PolarHBondContact O-N 3.37Å; F80-L84 WeakPolarHBondContact O-CB 3.43Å; F80-L84 PolarHBondContact O-N 2.84Å; F80-L135 HydrophobicContact CD1-CD2 4.46Å; F80-L135 HydrophobicContact CD1-CG 4.41Å; F80-L135 HydrophobicContact CE1-CD2 3.85Å; F80-L135 HydrophobicContact CE1-CG 3.78Å; F80-L135 HydrophobicContact CZ-CG 4.49Å; F80-D139 HydrophobicContact CE2-CB 4Å; F80-D139 WeakPolarHBondContact CE2-OD2 3.3Å; F80-D139 HydrophobicContact CZ-CB 4.22Å; F80-D156 HydrophobicContact CZ-CB 4.33Å; F80-V160 HydrophobicContact CD1-CG2 4.18Å; F80-V160 HydrophobicContact CE1-CG2 3.89Å
81M88.9Confident83.9Confident4 Ų447.1 Ų47.12%0.0222%0.224CC..Hα-helixtrans-56.1-43.8173.6-69.8166.7161.200111.5I67 M77 Y78 H83 L84 S85 M275 Y328I67-M81 HydrophobicContact CD1-CB 3.78Å; M77-M81 HydrophobicContact CE-CG 4.18Å; M77-M81 HydrophobicContact CG-CE 3.68Å; M77-M81 HydrophobicContact CG-CG 4.35Å; M77-M81 HydrophobicContact CG-SD 3.91Å; M77-M81 WeakPolarHBondContact O-CG 3.3Å; M77-M81 PolarHBondContact O-N 2.74Å; M77-M81 HydrophobicContact SD-CE 4.42Å; Y78-M81 HydrophobicContact CD1-SD 3.63Å; Y78-M81 HydrophobicContact CE1-SD 4.2Å; M81-H83 PolarHBondContact O-N 2.67Å; M81-L84 PolarHBondContact O-N 3.12Å; M81-S85 PolarHBondContact O-N 2.6Å; M81-S85 PolarHBondContact O-OG 3.02Å; M81-M275 HydrophobicContact CE-CE 3.59Å; M81-M275 HydrophobicContact CE-SD 3.45Å; M81-M275 WeakPolarHBondContact CE-SD 3.47Å; M81-Y328 HydrophobicContact CB-CE2 4.38Å; M81-Y328 HydrophobicContact CE-CD1 3.78Å; M81-Y328 HydrophobicContact CE-CE1 4.08Å; M81-Y328 HydrophobicContact CE-CG 4.34Å; M81-Y328 HydrophobicContact CG-CD1 4.41Å; M81-Y328 HydrophobicContact CG-CE1 3.97Å; M81-Y328 HydrophobicContact CG-CE2 4.33Å
82K91.3Very high85.2Confident66 Ų6637.4 Ų37.429%0.28718%0.181SC..Hα-helixtrans-59.1-48176.6173.2167.5179.9165.40112.2L64 I67 H68 Y78 Y79 F80 I86L64-K82 HydrophobicContact CD2-CB 4.27Å; L64-K82 HydrophobicContact CD2-CG 3.79Å; I67-K82 HydrophobicContact CD1-CB 4.48Å; H68-K82 PolarHBondContact CE1-NZ 2.89Å; H68-K82 PolarHBondContact NE2-NZ 3.33Å; Y78-K82 VanDerWaalsContact O-CB 3.3Å; Y78-K82 WeakPolarHBondContact O-CB 3.25Å; Y78-K82 PolarHBondContact O-N 3.45Å; Y79-K82 PolarHBondContact O-N 2.87Å; F80-K82 VanDerWaalsContact C-N 3.29Å; F80-K82 PolarHBondContact O-N 3.21Å; K82-I86 HydrophobicContact CG-CD1 3.93Å; K82-I86 WeakPolarHBondContact O-CD1 3.41Å; K82-I86 VanDerWaalsContact O-CG1 3.25Å; K82-I86 WeakPolarHBondContact O-CG1 3.22Å; K82-I86 PolarHBondContact O-N 3.44Å
83H93.5Very high86.8Confident37 Ų3733.9 Ų33.917%0.17117%0.167CC..Hα-helixtrans-69.9-32.8179.9-80.5-76.3000113.1Y79 F80 M81 I86 A87 M132 V160 W164Y79-H83 AromaticContact CE2-CD2 3.59Å; Y79-H83 AromaticContact CE2-NE2 3.32Å; Y79-H83 VanDerWaalsContact CE2-NE2 3.32Å; Y79-H83 WeakPolarHBondContact CE2-NE2 3.48Å; Y79-H83 AromaticContact CZ-CD2 3.62Å; Y79-H83 AromaticContact CZ-NE2 3.43Å; Y79-H83 PolarHBondContact O-CD2 3.19Å; Y79-H83 PolarHBondContact O-N 3.29Å; Y79-H83 PolarHBondContact OH-NE2 3.47Å; F80-H83 PolarHBondContact O-N 3.37Å; M81-H83 PolarHBondContact O-N 2.67Å; H83-I86 PolarHBondContact O-N 2.96Å; H83-A87 PolarHBondContact O-N 2.96Å; H83-M132 HydrophobicContact CB-CG 4.37Å; H83-M132 HydrophobicContact CB-SD 3.64Å; H83-V160 HydrophobicContact CB-CG1 4.44Å; H83-W164 AromaticContact ND1-NE1 3.64Å
84L91.8Very high88.3Confident1 Ų135.6 Ų35.61%0.00517%0.17CC..Hα-helixtrans-67.9-47174-176.143.6000111.2F80 M81 I86 A87 D88 S129 M132 M136 Y328F80-L84 WeakPolarHBondContact O-CB 3.43Å; F80-L84 PolarHBondContact O-N 2.84Å; M81-L84 PolarHBondContact O-N 3.12Å; L84-I86 VanDerWaalsContact C-N 3.29Å; L84-I86 PolarHBondContact O-N 3.19Å; L84-A87 WeakPolarHBondContact O-CB 3.45Å; L84-A87 PolarHBondContact O-N 2.76Å; L84-D88 PolarHBondContact O-N 3.48Å; L84-S129 WeakPolarHBondContact CD1-OG 3.42Å; L84-M132 HydrophobicContact CB-CB 4.26Å; L84-M132 HydrophobicContact CD1-CB 4.1Å; L84-M136 HydrophobicContact CD2-CE 3.93Å; L84-M136 HydrophobicContact CD2-SD 4.4Å; L84-Y328 VanDerWaalsContact CD2-OH 3.25Å; L84-Y328 WeakPolarHBondContact CD2-OH 3.47Å
85S93.9Very high89.6Confident0 Ų029.7 Ų29.70%014%0.143CC..Hα-helixtrans-63.2-30.2173.6-71.60000113.8N60 V63 M81 L89N60-S85 WeakPolarHBondContact OD1-CA 3.09Å; N60-S85 WeakPolarHBondContact OD1-CB 3.3Å; N60-S85 PolarHBondContact OD1-OG 3.22Å; V63-S85 WeakPolarHBondContact CG1-OG 3.44Å; M81-S85 PolarHBondContact O-N 2.6Å; M81-S85 PolarHBondContact O-OG 3.02Å; S85-L89 WeakPolarHBondContact O-CB 2.78Å; S85-L89 VanDerWaalsContact O-CG 3.26Å; S85-L89 WeakPolarHBondContact O-CG 3.5Å; S85-L89 PolarHBondContact O-N 3.45Å
86I94.9Very high90.4Very high56 Ų5627 Ų2729%0.28712%0.123SC..Hα-helixtrans-66.6-44170.4-70.2163.9000110.7L64 K82 H83 L84 L89 V90 W164L64-I86 HydrophobicContact CD1-CG1 4.33Å; L64-I86 HydrophobicContact CD2-CG1 4.32Å; K82-I86 HydrophobicContact CG-CD1 3.93Å; K82-I86 WeakPolarHBondContact O-CD1 3.41Å; K82-I86 VanDerWaalsContact O-CG1 3.25Å; K82-I86 WeakPolarHBondContact O-CG1 3.22Å; K82-I86 PolarHBondContact O-N 3.44Å; H83-I86 PolarHBondContact O-N 2.96Å; L84-I86 VanDerWaalsContact C-N 3.29Å; L84-I86 PolarHBondContact O-N 3.19Å; I86-L89 PolarHBondContact O-N 3.29Å; I86-V90 WeakPolarHBondContact O-CG2 3.3Å; I86-V90 PolarHBondContact O-N 3.14Å; I86-W164 HydrophobicContact CG2-CH2 4.02Å; I86-W164 HydrophobicContact CG2-CZ2 4.09Å
87A94.6Very high90.9Very high0 Ų026.4 Ų26.40%013%0.125CC..Hα-helixtrans-65.3-39.417700000112.5H83 L84 L89 V90 V91 A128 W164H83-A87 PolarHBondContact O-N 2.96Å; L84-A87 WeakPolarHBondContact O-CB 3.45Å; L84-A87 PolarHBondContact O-N 2.76Å; A87-L89 VanDerWaalsContact C-N 3.33Å; A87-L89 PolarHBondContact O-N 2.93Å; A87-V90 WeakPolarHBondContact O-CB 3.2Å; A87-V90 PolarHBondContact O-N 3.12Å; A87-V90 VanDerWaalsContact O-N 3.15Å; A87-V91 PolarHBondContact O-N 3.05Å; A87-A128 HydrophobicContact CB-CB 3.82Å; A87-W164 HydrophobicContact CB-CH2 4.13Å; A87-W164 HydrophobicContact CB-CZ2 4.13Å
88D94.2Very high91.4Very high0 Ų027.1 Ų27.10%013%0.131CC..Hα-helixtrans-68.7-29.6176.1-70.6-29.2000112.6L84 V91 A92 S129 S321 N324L84-D88 PolarHBondContact O-N 3.48Å; D88-V91 PolarHBondContact O-N 2.98Å; D88-A92 WeakPolarHBondContact O-CB 3.24Å; D88-A92 PolarHBondContact O-N 2.78Å; D88-S129 WeakPolarHBondContact OD1-CB 3.46Å; D88-S129 PolarHBondContact OD1-OG 2.98Å; D88-S321 WeakPolarHBondContact OD1-CB 3.34Å; D88-S321 PolarHBondContact OD1-OG 3.49Å; D88-N324 PolarHBondContact OD2-ND2 3.41Å
89L94.8Very high91.4Very high30 Ų3026.6 Ų26.616%0.15713%0.13CC..Hα-helixtrans-69.7-36.4168.1-74.3171.9000112.4L57 N60 L64 S85 I86 A87 V91 A92 I93L57-L89 HydrophobicContact CD2-CD2 3.87Å; N60-L89 HydrophobicContact CB-CD1 4.43Å; N60-L89 HydrophobicContact CB-CD2 3.93Å; N60-L89 HydrophobicContact CB-CG 3.81Å; L64-L89 HydrophobicContact CD1-CD1 3.59Å; S85-L89 WeakPolarHBondContact O-CB 2.78Å; S85-L89 VanDerWaalsContact O-CG 3.26Å; S85-L89 WeakPolarHBondContact O-CG 3.5Å; S85-L89 PolarHBondContact O-N 3.45Å; I86-L89 PolarHBondContact O-N 3.29Å; A87-L89 VanDerWaalsContact C-N 3.33Å; A87-L89 PolarHBondContact O-N 2.93Å; L89-V91 VanDerWaalsContact C-N 3.33Å; L89-A92 PolarHBondContact O-N 3.24Å; L89-I93 WeakPolarHBondContact O-CB 3.37Å; L89-I93 VanDerWaalsContact O-CG1 3.31Å; L89-I93 WeakPolarHBondContact O-CG1 3.33Å; L89-I93 PolarHBondContact O-N 3.31Å
90V93.5Very high91.4Very high28 Ų2824 Ų2417%0.1712%0.12CC..Hα-helixtrans-62.3-42.2171.7171.70000110.1I86 A87 I93 F94I86-V90 WeakPolarHBondContact O-CG2 3.3Å; I86-V90 PolarHBondContact O-N 3.14Å; A87-V90 WeakPolarHBondContact O-CB 3.2Å; A87-V90 PolarHBondContact O-N 3.12Å; A87-V90 VanDerWaalsContact O-N 3.15Å; V90-I93 PolarHBondContact O-N 3.02Å; V90-F94 HydrophobicContact CB-CD2 4.41Å; V90-F94 HydrophobicContact CG1-CD2 3.88Å; V90-F94 WeakPolarHBondContact O-CB 3.33Å; V90-F94 WeakPolarHBondContact O-CD2 3.27Å; V90-F94 PolarHBondContact O-N 3.46Å
91V92.7Very high91.4Very high3 Ų327.9 Ų27.92%0.01814%0.141CC..Hα-helixtrans-60-49.6171.5170.80000111.2A87 D88 L89 I93 Q95 V96 G125A87-V91 PolarHBondContact O-N 3.05Å; D88-V91 PolarHBondContact O-N 2.98Å; L89-V91 VanDerWaalsContact C-N 3.33Å; V91-I93 PolarHBondContact O-N 3.37Å; V91-Q95 HydrophobicContact CG1-CB 4.23Å; V91-Q95 WeakPolarHBondContact O-CA 3.38Å; V91-Q95 VanDerWaalsContact O-CB 3.22Å; V91-Q95 WeakPolarHBondContact O-CB 3.33Å; V91-Q95 PolarHBondContact O-N 3.47Å; V91-V96 HydrophobicContact CG1-CG2 4.28Å; V91-V96 PolarHBondContact O-N 3.02Å; V91-G125 WeakPolarHBondContact CG2-O 3.47Å
92A92.7Very high91.2Very high0 Ų030.7 Ų30.70%015%0.151CC..Iπ-helixtrans-57.9-45.8179.500000112.6L53 A56 L57 D88 L89 L97L53-A92 HydrophobicContact CD1-CB 4.19Å; L53-A92 WeakPolarHBondContact CD1-O 3.29Å; A56-A92 HydrophobicContact CB-CB 3.97Å; L57-A92 HydrophobicContact CD2-CB 3.71Å; L57-A92 HydrophobicContact CG-CB 4.07Å; D88-A92 WeakPolarHBondContact O-CB 3.24Å; D88-A92 PolarHBondContact O-N 2.78Å; L89-A92 PolarHBondContact O-N 3.24Å; A92-L97 PolarHBondContact O-N 3.47Å
93I92.7Very high90.7Very high73 Ų7328.4 Ų28.437%0.37414%0.142SC..Iπ-helixtrans-80.6-35-173.8-64.2169.9000113.2L57 L89 V90 V91 P98L57-I93 HydrophobicContact CD2-CD1 4.36Å; L57-I93 HydrophobicContact CD2-CG1 3.83Å; L89-I93 WeakPolarHBondContact O-CB 3.37Å; L89-I93 VanDerWaalsContact O-CG1 3.31Å; L89-I93 WeakPolarHBondContact O-CG1 3.33Å; L89-I93 PolarHBondContact O-N 3.31Å; V90-I93 PolarHBondContact O-N 3.02Å; V91-I93 PolarHBondContact O-N 3.37Å; I93-P98 WeakPolarHBondContact O-CD 3.48Å
94F90.6Very high90.3Very high70 Ų7031 Ų3131%0.30716%0.156SC..Iπ-helixtrans-112.1-13.9-172.2-60.8-73.7000114.9V90 P98 L121 Q122V90-F94 HydrophobicContact CB-CD2 4.41Å; V90-F94 HydrophobicContact CG1-CD2 3.88Å; V90-F94 WeakPolarHBondContact O-CB 3.33Å; V90-F94 WeakPolarHBondContact O-CD2 3.27Å; V90-F94 PolarHBondContact O-N 3.46Å; F94-P98 WeakPolarHBondContact O-CG 3.37Å; F94-L121 HydrophobicContact CB-CB 3.69Å; F94-L121 HydrophobicContact CD1-CB 3.89Å; F94-L121 HydrophobicContact CD1-CD1 3.54Å; F94-L121 HydrophobicContact CD1-CG 4.37Å; F94-L121 HydrophobicContact CD2-CB 4.33Å; F94-L121 HydrophobicContact CD2-CD1 4.46Å; F94-L121 HydrophobicContact CE1-CD1 3.48Å; F94-L121 VanDerWaalsContact CE1-CD1 3.48Å; F94-L121 HydrophobicContact CE2-CD1 4.41Å; F94-L121 HydrophobicContact CG-CB 3.71Å; F94-L121 HydrophobicContact CG-CD1 4.05Å; F94-L121 HydrophobicContact CZ-CD1 3.94Å; F94-Q122 WeakPolarHBondContact O-CB 3.43Å
95Q88.8Confident90Very high7 Ų733.2 Ų33.23%0.03317%0.17CC..Iπ-helixtrans-105.4-59.9170.2172.3-178.5-23.800110.9V91 Q99 Q122 M126V91-Q95 HydrophobicContact CG1-CB 4.23Å; V91-Q95 WeakPolarHBondContact O-CA 3.38Å; V91-Q95 VanDerWaalsContact O-CB 3.22Å; V91-Q95 WeakPolarHBondContact O-CB 3.33Å; V91-Q95 PolarHBondContact O-N 3.47Å; Q95-Q99 VanDerWaalsContact O-CB 3.26Å; Q95-Q99 WeakPolarHBondContact O-CB 3.37Å; Q95-Q99 PolarHBondContact O-N 3.26Å; Q95-Q122 HydrophobicContact CB-CB 4.39Å; Q95-Q122 HydrophobicContact CB-CG 3.87Å; Q95-Q122 HydrophobicContact CG-CG 4Å; Q95-M126 VanDerWaalsContact CD-CE 3.48Å; Q95-M126 HydrophobicContact CG-CE 4.16Å; Q95-M126 VanDerWaalsContact OE1-CE 3.24Å
96V89.9Confident89.4Confident2 Ų239 Ų391%0.01220%0.195CC..Iπ-helixtrans-73.6-44.2-169-172.60000112L49 L53 V91 Q99 L100L49-V96 HydrophobicContact CD2-CG1 4.21Å; L53-V96 HydrophobicContact CB-CG1 3.93Å; L53-V96 HydrophobicContact CD1-CB 4.28Å; L53-V96 HydrophobicContact CD1-CG1 4.36Å; V91-V96 HydrophobicContact CG1-CG2 4.28Å; V91-V96 PolarHBondContact O-N 3.02Å; V96-Q99 PolarHBondContact O-N 3.31Å; V96-L100 WeakPolarHBondContact O-CB 3.21Å; V96-L100 PolarHBondContact O-N 2.88Å
97L90.9Very high88.7Confident64 Ų6441 Ų4134%0.33520%0.199SC..Hα-helixtrans-63.7-47.6178.1169.767.6000113.2L53 A92 Q99 L100 I101L53-L97 HydrophobicContact CD1-CB 4.05Å; L53-L97 HydrophobicContact CD2-CB 4.05Å; L53-L97 HydrophobicContact CD2-CD1 3.93Å; A92-L97 PolarHBondContact O-N 3.47Å; L97-Q99 VanDerWaalsContact C-N 3.31Å; L97-Q99 PolarHBondContact O-N 2.92Å; L97-L100 PolarHBondContact O-N 3.35Å; L97-I101 HydrophobicContact CD1-CD1 3.89Å; L97-I101 HydrophobicContact CD1-CG1 4.17Å; L97-I101 HydrophobicContact CG-CD1 4.03Å; L97-I101 WeakPolarHBondContact O-CG1 3.33Å; L97-I101 PolarHBondContact O-N 3.49Å
98P88.5Confident88.3Confident28 Ų2842.5 Ų42.518%0.18221%0.206CC..Hα-helixtrans-67.6-30.9177.8-24.738.1000113.1I93 F94 W102 V118I93-P98 WeakPolarHBondContact O-CD 3.48Å; F94-P98 WeakPolarHBondContact O-CG 3.37Å; P98-W102 WeakPolarHBondContact O-CB 3.42Å; P98-W102 PolarHBondContact O-N 3.2Å; P98-V118 HydrophobicContact CB-CG1 3.6Å; P98-V118 HydrophobicContact CG-CG1 3.95Å
99Q86.3Confident87.8Confident14 Ų1450.7 Ų50.77%0.06524%0.238CC..Hα-helixtrans-63.1-51.8169.9178.7-178.6-14.400111L49 Q95 V96 L97 I101 W102 D103 M314L49-Q99 HydrophobicContact CD1-CG 4.06Å; Q95-Q99 VanDerWaalsContact O-CB 3.26Å; Q95-Q99 WeakPolarHBondContact O-CB 3.37Å; Q95-Q99 PolarHBondContact O-N 3.26Å; V96-Q99 PolarHBondContact O-N 3.31Å; L97-Q99 VanDerWaalsContact C-N 3.31Å; L97-Q99 PolarHBondContact O-N 2.92Å; Q99-I101 VanDerWaalsContact C-N 3.29Å; Q99-I101 PolarHBondContact O-N 2.91Å; Q99-W102 WeakPolarHBondContact O-CA 3.38Å; Q99-W102 VanDerWaalsContact O-CB 3.3Å; Q99-W102 WeakPolarHBondContact O-CB 3.31Å; Q99-W102 PolarHBondContact O-N 2.92Å; Q99-D103 WeakPolarHBondContact CG-OD2 3.48Å; Q99-D103 PolarHBondContact O-N 3.22Å; Q99-M314 VanDerWaalsContact CD-CE 3.46Å; Q99-M314 HydrophobicContact CG-CE 4.08Å; Q99-M314 PolarHBondContact NE2-SD 3.48Å
100L87.7Confident87.4Confident17 Ų1750.7 Ų50.79%0.08925%0.245CC..Hα-helixtrans-56.2-42.4177.5175.964.5000112.3V46 L49 A50 L53 V96 L97 D103 I104V46-L100 HydrophobicContact CB-CD1 4.42Å; V46-L100 HydrophobicContact CG1-CD1 3.89Å; V46-L100 WeakPolarHBondContact O-CD1 3.4Å; L49-L100 HydrophobicContact CB-CB 4.4Å; L49-L100 HydrophobicContact CB-CD1 3.9Å; A50-L100 HydrophobicContact CB-CD1 4.24Å; A50-L100 HydrophobicContact CB-CD2 4.09Å; L53-L100 HydrophobicContact CD2-CD2 3.74Å; V96-L100 WeakPolarHBondContact O-CB 3.21Å; V96-L100 PolarHBondContact O-N 2.88Å; L97-L100 PolarHBondContact O-N 3.35Å; L100-D103 PolarHBondContact O-N 3.16Å; L100-I104 HydrophobicContact CD1-CD1 3.93Å; L100-I104 HydrophobicContact CD1-CG1 4.43Å; L100-I104 HydrophobicContact CG-CD1 4Å; L100-I104 WeakPolarHBondContact O-CD1 3.49Å; L100-I104 VanDerWaalsContact O-CG1 3.26Å; L100-I104 WeakPolarHBondContact O-CG1 3.3Å; L100-I104 PolarHBondContact O-N 2.99Å; L100-I104 VanDerWaalsContact O-N 3.15Å
101I88.1Confident87.3Confident86 Ų8653.3 Ų53.344%0.44126%0.263SS..Hα-helixtrans-60.1-48.4174.3-68.6165.8000109.7L97 Q99 D103 I104 T105L97-I101 HydrophobicContact CD1-CD1 3.89Å; L97-I101 HydrophobicContact CD1-CG1 4.17Å; L97-I101 HydrophobicContact CG-CD1 4.03Å; L97-I101 WeakPolarHBondContact O-CG1 3.33Å; L97-I101 PolarHBondContact O-N 3.49Å; Q99-I101 VanDerWaalsContact C-N 3.29Å; Q99-I101 PolarHBondContact O-N 2.91Å; I101-D103 VanDerWaalsContact C-N 3.35Å; I101-D103 PolarHBondContact O-N 3.12Å; I101-I104 PolarHBondContact O-N 3.1Å; I101-T105 HydrophobicContact CG2-CG2 4.15Å; I101-T105 WeakPolarHBondContact O-CB 3.45Å; I101-T105 WeakPolarHBondContact O-CG2 3.42Å; I101-T105 PolarHBondContact O-N 3.01Å; I101-T105 PolarHBondContact O-OG1 3.38Å
102W83.9Confident87.3Confident63 Ų6355.5 Ų55.524%0.23927%0.274CS..Hα-helixtrans-59-42.6178.9-161.9-65.7000113.2P98 Q99 I104 T105 F106 F108 D189 C190P98-W102 WeakPolarHBondContact O-CB 3.42Å; P98-W102 PolarHBondContact O-N 3.2Å; Q99-W102 WeakPolarHBondContact O-CA 3.38Å; Q99-W102 VanDerWaalsContact O-CB 3.3Å; Q99-W102 WeakPolarHBondContact O-CB 3.31Å; Q99-W102 PolarHBondContact O-N 2.92Å; W102-I104 VanDerWaalsContact C-N 3.29Å; W102-I104 PolarHBondContact O-N 3.18Å; W102-T105 PolarHBondContact O-N 3.21Å; W102-F106 VanDerWaalsContact O-CA 3.25Å; W102-F106 WeakPolarHBondContact O-CA 3.36Å; W102-F106 PolarHBondContact O-N 3.44Å; W102-F108 HydrophobicContact CE3-CB 4.25Å; W102-F108 HydrophobicContact CE3-CD2 4.18Å; W102-F108 HydrophobicContact CH2-CB 3.84Å; W102-F108 HydrophobicContact CZ3-CB 3.62Å; W102-F108 AromaticContact CZ3-CD2 3.77Å; W102-F108 HydrophobicContact CZ3-CD2 3.77Å; W102-F108 HydrophobicContact CZ3-CG 4.09Å; W102-D189 WeakPolarHBondContact CH2-OD1 3.42Å; W102-D189 WeakPolarHBondContact CZ2-OD1 3.5Å; W102-C190 HydrophobicContact CH2-CB 3.69Å; W102-C190 HydrophobicContact CZ3-CB 3.74Å
103D81.3Confident87.3Confident18 Ų1862 Ų6210%0.09631%0.308CS..Hα-helixtrans-69.8-28.8-178.6-67.4-38.5000112.3V46 L49 Q99 L100 I101V46-D103 HydrophobicContact CG2-CB 3.9Å; L49-D103 WeakPolarHBondContact CD1-OD2 3.26Å; Q99-D103 WeakPolarHBondContact CG-OD2 3.48Å; Q99-D103 PolarHBondContact O-N 3.22Å; L100-D103 PolarHBondContact O-N 3.16Å; I101-D103 VanDerWaalsContact C-N 3.35Å; I101-D103 PolarHBondContact O-N 3.12Å
104I84.9Confident87.3Confident92 Ų9262 Ų6247%0.47231%0.308SS..Hα-helixtrans-77-44.7172.1-67.4166.5000111.7V46 L100 I101 W102 F106V46-I104 HydrophobicContact CG1-CD1 4.03Å; V46-I104 HydrophobicContact CG1-CG1 3.68Å; V46-I104 HydrophobicContact CG2-CG1 4Å; L100-I104 HydrophobicContact CD1-CD1 3.93Å; L100-I104 HydrophobicContact CD1-CG1 4.43Å; L100-I104 HydrophobicContact CG-CD1 4Å; L100-I104 WeakPolarHBondContact O-CD1 3.49Å; L100-I104 VanDerWaalsContact O-CG1 3.26Å; L100-I104 WeakPolarHBondContact O-CG1 3.3Å; L100-I104 PolarHBondContact O-N 2.99Å; L100-I104 VanDerWaalsContact O-N 3.15Å; I101-I104 PolarHBondContact O-N 3.1Å; W102-I104 VanDerWaalsContact C-N 3.29Å; W102-I104 PolarHBondContact O-N 3.18Å; I104-F106 VanDerWaalsContact O-CD2 3.3Å; I104-F106 WeakPolarHBondContact O-CD2 3.34Å; I104-F106 WeakPolarHBondContact O-CE2 3.43Å
105T84.9Confident87.3Confident47 Ų4758.7 Ų58.729%0.28829%0.294SS..Hα-helixtrans-94.1-8.1-170.265.60000113.8I101 W102 R107 Y109I101-T105 HydrophobicContact CG2-CG2 4.15Å; I101-T105 WeakPolarHBondContact O-CB 3.45Å; I101-T105 WeakPolarHBondContact O-CG2 3.42Å; I101-T105 PolarHBondContact O-N 3.01Å; I101-T105 PolarHBondContact O-OG1 3.38Å; W102-T105 PolarHBondContact O-N 3.21Å; T105-R107 PolarHBondContact O-N 2.91Å; T105-R107 PolarHBondContact OG1-O 2.98Å; T105-Y109 HydrophobicContact CG2-CD2 4.49Å
106F80.8Confident87.5Confident122 Ų12261.4 Ų61.454%0.53530%0.304SS..SBendtrans57.81.7-178.4-59.7-103.7000115.7W102 I104W102-F106 VanDerWaalsContact O-CA 3.25Å; W102-F106 WeakPolarHBondContact O-CA 3.36Å; W102-F106 PolarHBondContact O-N 3.44Å; I104-F106 VanDerWaalsContact O-CD2 3.3Å; I104-F106 WeakPolarHBondContact O-CD2 3.34Å; I104-F106 WeakPolarHBondContact O-CE2 3.43Å
107R80.9Confident87.7Confident98 Ų9865.1 Ų65.137%0.3732%0.323SS..SBendtrans-153.7152-170.8-64.7-64-177.5-175-0.1110.8T105 Y109 D189T105-R107 PolarHBondContact O-N 2.91Å; T105-R107 PolarHBondContact OG1-O 2.98Å; R107-Y109 HydrophobicContact CB-CD2 4.28Å; R107-Y109 HydrophobicContact CB-CE2 3.66Å; R107-Y109 VanDerWaalsContact O-CD2 3.32Å; R107-Y109 WeakPolarHBondContact O-CD2 3.4Å; R107-D189 IonicContact NH1-OD2 3.98Å; R107-D189 PolarHBondContact NH1-OD2 3.37Å
108F86.1Confident87.7Confident31 Ų3163.1 Ų63.114%0.13631%0.313CS..  trans-73.5126.1165-169.3-105.9000112.7W102 G110 L114 C115 L180 D189 C190W102-F108 HydrophobicContact CE3-CB 4.25Å; W102-F108 HydrophobicContact CE3-CD2 4.18Å; W102-F108 HydrophobicContact CH2-CB 3.84Å; W102-F108 HydrophobicContact CZ3-CB 3.62Å; W102-F108 AromaticContact CZ3-CD2 3.77Å; W102-F108 HydrophobicContact CZ3-CD2 3.77Å; W102-F108 HydrophobicContact CZ3-CG 4.09Å; F108-G110 WeakPolarHBondContact CE1-O 3.48Å; F108-L114 HydrophobicContact CZ-CB 4.11Å; F108-L114 HydrophobicContact CZ-CD2 4.22Å; F108-L114 HydrophobicContact CZ-CG 4.01Å; F108-C115 HydrophobicContact CD1-CB 4.21Å; F108-C115 HydrophobicContact CE1-CB 3.65Å; F108-C115 HydrophobicContact CE2-CB 4.44Å; F108-C115 VanDerWaalsContact CZ-CA 3.49Å; F108-C115 HydrophobicContact CZ-CB 3.8Å; F108-C115 VanDerWaalsContact CZ-N 3.34Å; F108-L180 HydrophobicContact CD1-CD1 3.97Å; F108-D189 WeakPolarHBondContact CB-OD1 3.43Å; F108-D189 PolarHBondContact N-OD1 3.5Å; F108-C190 HydrophobicContact CB-CB 3.81Å; F108-C190 HydrophobicContact CD1-CB 4.02Å; F108-C190 HydrophobicContact CD2-CB 4Å; F108-C190 HydrophobicContact CG-CB 3.65Å
109Y83.6Confident87.8Confident171 Ų17163.6 Ų63.667%0.67131%0.313SS*.  trans-112.6102171.4-68.4-89.8000110T105 R107T105-Y109 HydrophobicContact CG2-CD2 4.49Å; R107-Y109 HydrophobicContact CB-CD2 4.28Å; R107-Y109 HydrophobicContact CB-CE2 3.66Å; R107-Y109 VanDerWaalsContact O-CD2 3.32Å; R107-Y109 WeakPolarHBondContact O-CD2 3.4Å
110G87.3Confident88.2Confident31 Ų3164.7 Ų64.732%0.3232%0.316SS..SBendtrans163.5173.6176.600000114.1F108F108-G110 WeakPolarHBondContact CE1-O 3.48Å
111P91.5Very high88.5Confident83 Ų8365.6 Ų65.654%0.53932%0.321SS..  trans-73.8160.4176.131.3-35.6000112.4I113 L114 C115P111-I113 VanDerWaalsContact C-N 3.26Å; P111-I113 PolarHBondContact O-N 3.26Å; P111-L114 HydrophobicContact CG-CB 3.94Å; P111-L114 WeakPolarHBondContact O-CA 3.24Å; P111-L114 WeakPolarHBondContact O-CB 3.38Å; P111-L114 PolarHBondContact O-N 3.2Å; P111-C115 PolarHBondContact O-N 3.38Å; P111-C115 VanDerWaalsContact O-N 3.16Å
112D91.9Very high88.6Confident48 Ų4862.8 Ų62.826%0.25731%0.306SS..Hα-helixtrans-51.3-41.417818061.2000113.5L114 C115 R116 S179 L180D112-L114 VanDerWaalsContact C-N 3.27Å; D112-L114 PolarHBondContact O-N 2.91Å; D112-C115 WeakPolarHBondContact O-CB 3.22Å; D112-C115 PolarHBondContact O-N 3.34Å; D112-R116 WeakPolarHBondContact O-CG 3.25Å; D112-R116 PolarHBondContact O-N 3.01Å; D112-R116 IonicContact OD1-CZ 3.77Å; D112-R116 IonicContact OD1-NE 3.3Å; D112-R116 PolarHBondContact OD1-NE 3.43Å; D112-R116 IonicContact OD1-NH2 2.75Å; D112-R116 PolarHBondContact OD1-NH2 2.9Å; D112-R116 IonicContact OD2-CZ 2.74Å; D112-R116 VanDerWaalsContact OD2-CZ 3.29Å; D112-R116 IonicContact OD2-NE 2.74Å; D112-R116 PolarHBondContact OD2-NE 2.98Å; D112-R116 IonicContact OD2-NH2 2.71Å; D112-R116 PolarHBondContact OD2-NH2 2.71Å; D112-S179 WeakPolarHBondContact OD1-CA 3.47Å; D112-S179 WeakPolarHBondContact OD1-CB 3.3Å; D112-L180 HydrophobicContact CB-CB 3.92Å; D112-L180 PolarHBondContact OD1-N 3.29Å
113I93.2Very high89Confident136 Ų13660.1 Ų60.170%0.69730%0.297SS*.Hα-helixtrans-59.3-38.8177.4-60.3173.4000111.3P111 L117P111-I113 VanDerWaalsContact C-N 3.26Å; P111-I113 PolarHBondContact O-N 3.26Å; I113-L117 VanDerWaalsContact O-CB 3.26Å; I113-L117 WeakPolarHBondContact O-CB 3.2Å; I113-L117 PolarHBondContact O-N 3.41Å
114L91.7Very high89.7Confident75 Ų7559.4 Ų59.439%0.39329%0.293SS..Hα-helixtrans-71.4-40.3178.1-174.563.6000111.1F108 P111 D112 L117 V118F108-L114 HydrophobicContact CZ-CB 4.11Å; F108-L114 HydrophobicContact CZ-CD2 4.22Å; F108-L114 HydrophobicContact CZ-CG 4.01Å; P111-L114 HydrophobicContact CG-CB 3.94Å; P111-L114 WeakPolarHBondContact O-CA 3.24Å; P111-L114 WeakPolarHBondContact O-CB 3.38Å; P111-L114 PolarHBondContact O-N 3.2Å; D112-L114 VanDerWaalsContact C-N 3.27Å; D112-L114 PolarHBondContact O-N 2.91Å; L114-L117 PolarHBondContact O-N 3.31Å; L114-V118 HydrophobicContact CD1-CG2 4.19Å; L114-V118 HydrophobicContact CG-CG2 4.33Å; L114-V118 WeakPolarHBondContact O-CB 3.49Å; L114-V118 VanDerWaalsContact O-CG2 3.27Å; L114-V118 WeakPolarHBondContact O-CG2 3.5Å; L114-V118 PolarHBondContact O-N 3.3Å
115C91.3Very high90Very high0 Ų055 Ų550%027%0.271CS..Hα-helixtrans-55.3-53173.3159.50000111.1F108 P111 D112 L117 V118 K119 C190F108-C115 HydrophobicContact CD1-CB 4.21Å; F108-C115 HydrophobicContact CE1-CB 3.65Å; F108-C115 HydrophobicContact CE2-CB 4.44Å; F108-C115 VanDerWaalsContact CZ-CA 3.49Å; F108-C115 HydrophobicContact CZ-CB 3.8Å; F108-C115 VanDerWaalsContact CZ-N 3.34Å; P111-C115 PolarHBondContact O-N 3.38Å; P111-C115 VanDerWaalsContact O-N 3.16Å; D112-C115 WeakPolarHBondContact O-CB 3.22Å; D112-C115 PolarHBondContact O-N 3.34Å; C115-L117 PolarHBondContact O-N 2.99Å; C115-V118 PolarHBondContact O-N 3.03Å; C115-K119 WeakPolarHBondContact O-CG 3.34Å; C115-K119 PolarHBondContact O-N 3.34Å; C115-C190 VanDerWaalsContact CA-SG 3.55Å; C115-C190 HydrophobicContact CB-CB 3.68Å; C115-C190 WeakPolarHBondContact CB-SG 3.44Å; C115-C190 VanDerWaalsContact SG-CA 3.56Å; C115-C190 WeakPolarHBondContact SG-CB 3.07Å; C115-C190 CovalentContact SG-SG 2.03Å; C115-C190 PolarHBondContact SG-SG 3.45Å
116R94Very high90.4Very high63 Ų6353.4 Ų53.424%0.23826%0.26CS..Hα-helixtrans-58.8-47.9177.7-67.8-178.5-162.1-85.7-7.4112.1D112 V118 K119 Y120 M175 F178 S179D112-R116 WeakPolarHBondContact O-CG 3.25Å; D112-R116 PolarHBondContact O-N 3.01Å; D112-R116 IonicContact OD1-CZ 3.77Å; D112-R116 IonicContact OD1-NE 3.3Å; D112-R116 PolarHBondContact OD1-NE 3.43Å; D112-R116 IonicContact OD1-NH2 2.75Å; D112-R116 PolarHBondContact OD1-NH2 2.9Å; D112-R116 IonicContact OD2-CZ 2.74Å; D112-R116 VanDerWaalsContact OD2-CZ 3.29Å; D112-R116 IonicContact OD2-NE 2.74Å; D112-R116 PolarHBondContact OD2-NE 2.98Å; D112-R116 IonicContact OD2-NH2 2.71Å; D112-R116 PolarHBondContact OD2-NH2 2.71Å; R116-V118 PolarHBondContact O-N 3.32Å; R116-K119 PolarHBondContact O-N 3.37Å; R116-Y120 VanDerWaalsContact O-CB 3.28Å; R116-Y120 WeakPolarHBondContact O-CB 3.23Å; R116-Y120 PolarHBondContact O-N 3.11Å; R116-M175 HydrophobicContact CB-CE 3.82Å; R116-M175 HydrophobicContact CB-SD 3.89Å; R116-M175 PolarHBondContact NH1-O 3.47Å; R116-F178 WeakPolarHBondContact CG-O 3.28Å; R116-F178 PolarHBondContact NH1-O 2.99Å; R116-S179 VanDerWaalsContact NH2-CB 3.29Å
117L93.3Very high91Very high80 Ų8047.6 Ų47.642%0.41923%0.234SC..Hα-helixtrans-63.8-41.8-178.2-175.963.3000112I113 L114 C115 Y120 L121I113-L117 VanDerWaalsContact O-CB 3.26Å; I113-L117 WeakPolarHBondContact O-CB 3.2Å; I113-L117 PolarHBondContact O-N 3.41Å; L114-L117 PolarHBondContact O-N 3.31Å; C115-L117 PolarHBondContact O-N 2.99Å; L117-Y120 PolarHBondContact O-N 2.99Å; L117-L121 HydrophobicContact CD1-CD1 3.77Å; L117-L121 HydrophobicContact CD1-CG 3.97Å; L117-L121 HydrophobicContact CG-CD1 3.83Å; L117-L121 HydrophobicContact CG-CG 4.35Å; L117-L121 WeakPolarHBondContact O-CB 3.46Å; L117-L121 VanDerWaalsContact O-CG 3.3Å; L117-L121 WeakPolarHBondContact O-CG 3.43Å; L117-L121 PolarHBondContact O-N 3.44Å
118V91.1Very high91.7Very high22 Ų2242.9 Ų42.913%0.13322%0.217CC..Hα-helixtrans-61.8-52.2175.8166.30000110.6P98 L114 C115 R116 Y120 L121 Q122P98-V118 HydrophobicContact CB-CG1 3.6Å; P98-V118 HydrophobicContact CG-CG1 3.95Å; L114-V118 HydrophobicContact CD1-CG2 4.19Å; L114-V118 HydrophobicContact CG-CG2 4.33Å; L114-V118 WeakPolarHBondContact O-CB 3.49Å; L114-V118 VanDerWaalsContact O-CG2 3.27Å; L114-V118 WeakPolarHBondContact O-CG2 3.5Å; L114-V118 PolarHBondContact O-N 3.3Å; C115-V118 PolarHBondContact O-N 3.03Å; R116-V118 PolarHBondContact O-N 3.32Å; V118-Y120 VanDerWaalsContact C-N 3.31Å; V118-Y120 PolarHBondContact O-N 3.45Å; V118-L121 PolarHBondContact O-N 3.11Å; V118-Q122 WeakPolarHBondContact O-CB 3.33Å; V118-Q122 PolarHBondContact O-N 3.47Å
119K90.6Very high92.1Very high39 Ų3941.5 Ų41.517%0.1721%0.211CC..Hα-helixtrans-62.9-37180-63.5-67.2-177.3-173.80112.2C115 R116 V123 F178C115-K119 WeakPolarHBondContact O-CG 3.34Å; C115-K119 PolarHBondContact O-N 3.34Å; R116-K119 PolarHBondContact O-N 3.37Å; K119-V123 PolarHBondContact O-N 3.02Å; K119-F178 HydrophobicContact CB-CB 4.02Å; K119-F178 HydrophobicContact CB-CD2 4.16Å; K119-F178 HydrophobicContact CB-CG 4.05Å; K119-F178 HydrophobicContact CD-CD1 4.14Å; K119-F178 HydrophobicContact CD-CE1 4.46Å; K119-F178 HydrophobicContact CD-CG 4.3Å; K119-F178 HydrophobicContact CG-CB 3.84Å; K119-F178 HydrophobicContact CG-CD1 4.07Å; K119-F178 HydrophobicContact CG-CD2 4.37Å; K119-F178 HydrophobicContact CG-CG 3.82Å
120Y94.3Very high92.6Very high37 Ų3733.4 Ų33.415%0.14518%0.179CC..Hα-helixtrans-63.7-54.7173.2178.9-106.1000112.2R116 L117 V118 Q122 V123 V124 L168 S171 Q174 M175R116-Y120 VanDerWaalsContact O-CB 3.28Å; R116-Y120 WeakPolarHBondContact O-CB 3.23Å; R116-Y120 PolarHBondContact O-N 3.11Å; L117-Y120 PolarHBondContact O-N 2.99Å; V118-Y120 VanDerWaalsContact C-N 3.31Å; V118-Y120 PolarHBondContact O-N 3.45Å; Y120-Q122 VanDerWaalsContact C-N 3.34Å; Y120-Q122 PolarHBondContact O-N 2.92Å; Y120-V123 PolarHBondContact O-N 3.44Å; Y120-V123 VanDerWaalsContact O-N 3.15Å; Y120-V124 HydrophobicContact CD1-CG2 4.03Å; Y120-V124 HydrophobicContact CD2-CG2 4.34Å; Y120-V124 HydrophobicContact CE1-CG2 3.64Å; Y120-V124 HydrophobicContact CE2-CG2 3.98Å; Y120-V124 HydrophobicContact CG-CG2 4.36Å; Y120-V124 WeakPolarHBondContact O-CG2 3.43Å; Y120-V124 PolarHBondContact O-N 3.1Å; Y120-L168 HydrophobicContact CE1-CD2 4.39Å; Y120-L168 WeakPolarHBondContact OH-CA 3.34Å; Y120-L168 WeakPolarHBondContact OH-CD2 3.29Å; Y120-L168 PolarHBondContact OH-O 2.7Å; Y120-S171 VanDerWaalsContact CD2-O 3.31Å; Y120-S171 WeakPolarHBondContact CD2-O 3.34Å; Y120-Q174 HydrophobicContact CD2-CB 4.33Å; Y120-M175 VanDerWaalsContact CB-SD 3.59Å; Y120-M175 HydrophobicContact CD2-CG 3.82Å; Y120-M175 HydrophobicContact CD2-SD 4.37Å; Y120-M175 HydrophobicContact CG-CG 4.01Å; Y120-M175 HydrophobicContact CG-SD 3.94Å
121L93.3Very high93Very high35 Ų3533.1 Ų33.118%0.18317%0.169CC..Hα-helixtrans-67-33-177-68.5176.8000113F94 L117 V118 V123 V124 G125F94-L121 HydrophobicContact CB-CB 3.69Å; F94-L121 HydrophobicContact CD1-CB 3.89Å; F94-L121 HydrophobicContact CD1-CD1 3.54Å; F94-L121 HydrophobicContact CD1-CG 4.37Å; F94-L121 HydrophobicContact CD2-CB 4.33Å; F94-L121 HydrophobicContact CD2-CD1 4.46Å; F94-L121 HydrophobicContact CE1-CD1 3.48Å; F94-L121 VanDerWaalsContact CE1-CD1 3.48Å; F94-L121 HydrophobicContact CE2-CD1 4.41Å; F94-L121 HydrophobicContact CG-CB 3.71Å; F94-L121 HydrophobicContact CG-CD1 4.05Å; F94-L121 HydrophobicContact CZ-CD1 3.94Å; L117-L121 HydrophobicContact CD1-CD1 3.77Å; L117-L121 HydrophobicContact CD1-CG 3.97Å; L117-L121 HydrophobicContact CG-CD1 3.83Å; L117-L121 HydrophobicContact CG-CG 4.35Å; L117-L121 WeakPolarHBondContact O-CB 3.46Å; L117-L121 VanDerWaalsContact O-CG 3.3Å; L117-L121 WeakPolarHBondContact O-CG 3.43Å; L117-L121 PolarHBondContact O-N 3.44Å; V118-L121 PolarHBondContact O-N 3.11Å; L121-V123 VanDerWaalsContact C-N 3.31Å; L121-V123 PolarHBondContact O-N 3.36Å; L121-V124 PolarHBondContact O-N 2.91Å; L121-G125 PolarHBondContact O-N 2.82Å
122Q91.3Very high93.1Very high28 Ų2829.3 Ų29.313%0.13114%0.143CC..Hα-helixtrans-50.6-51.1169171.9166.519.800110.9F94 Q95 V118 Y120 G125 M126F94-Q122 WeakPolarHBondContact O-CB 3.43Å; Q95-Q122 HydrophobicContact CB-CB 4.39Å; Q95-Q122 HydrophobicContact CB-CG 3.87Å; Q95-Q122 HydrophobicContact CG-CG 4Å; V118-Q122 WeakPolarHBondContact O-CB 3.33Å; V118-Q122 PolarHBondContact O-N 3.47Å; Y120-Q122 VanDerWaalsContact C-N 3.34Å; Y120-Q122 PolarHBondContact O-N 2.92Å; Q122-G125 PolarHBondContact O-N 3.17Å; Q122-M126 HydrophobicContact CG-CE 3.71Å; Q122-M126 WeakPolarHBondContact O-CG 3.39Å; Q122-M126 PolarHBondContact O-N 2.87Å
123V91.9Very high93.2Very high6 Ų627 Ų274%0.03613%0.132CC..Hα-helixtrans-78.9-32.7-177.5175.10000112.6K119 Y120 L121 G125 M126 F127 Q174 I207K119-V123 PolarHBondContact O-N 3.02Å; Y120-V123 PolarHBondContact O-N 3.44Å; Y120-V123 VanDerWaalsContact O-N 3.15Å; L121-V123 VanDerWaalsContact C-N 3.31Å; L121-V123 PolarHBondContact O-N 3.36Å; V123-G125 VanDerWaalsContact C-N 3.27Å; V123-G125 PolarHBondContact O-N 3.19Å; V123-M126 PolarHBondContact O-N 2.8Å; V123-F127 HydrophobicContact CG1-CD2 3.59Å; V123-F127 HydrophobicContact CG1-CE2 3.48Å; V123-F127 VanDerWaalsContact CG1-CE2 3.48Å; V123-F127 WeakPolarHBondContact O-CD2 3.49Å; V123-F127 PolarHBondContact O-N 3.21Å; V123-Q174 HydrophobicContact CB-CG 3.84Å; V123-Q174 HydrophobicContact CG1-CG 4.26Å; V123-Q174 HydrophobicContact CG2-CG 3.89Å; V123-I207 HydrophobicContact CG1-CD1 4.32Å
124V95.3Very high93.2Very high4 Ų421.4 Ų21.42%0.02410%0.103CC..Hα-helixtrans-57-42.9169.9172.30000110.7Y120 L121 F127 A128 L168 S171Y120-V124 HydrophobicContact CD1-CG2 4.03Å; Y120-V124 HydrophobicContact CD2-CG2 4.34Å; Y120-V124 HydrophobicContact CE1-CG2 3.64Å; Y120-V124 HydrophobicContact CE2-CG2 3.98Å; Y120-V124 HydrophobicContact CG-CG2 4.36Å; Y120-V124 WeakPolarHBondContact O-CG2 3.43Å; Y120-V124 PolarHBondContact O-N 3.1Å; L121-V124 PolarHBondContact O-N 2.91Å; V124-F127 PolarHBondContact O-N 2.89Å; V124-A128 WeakPolarHBondContact O-CB 3.41Å; V124-A128 PolarHBondContact O-N 2.92Å; V124-L168 HydrophobicContact CG1-CD2 3.89Å; V124-L168 HydrophobicContact CG2-CD2 4.09Å; V124-S171 VanDerWaalsContact CA-OG 3.27Å; V124-S171 WeakPolarHBondContact CA-OG 3.4Å; V124-S171 VanDerWaalsContact CG2-CB 3.43Å; V124-S171 WeakPolarHBondContact CG2-OG 3.49Å; V124-S171 PolarHBondContact N-OG 3.05Å
125G92.3Very high93.3Very high0 Ų018.8 Ų18.80%09%0.09CC..Hα-helixtrans-58.5-49.7176.200000112.8V91 L121 Q122 V123 F127 A128 S129V91-G125 WeakPolarHBondContact CG2-O 3.47Å; L121-G125 PolarHBondContact O-N 2.82Å; Q122-G125 PolarHBondContact O-N 3.17Å; V123-G125 VanDerWaalsContact C-N 3.27Å; V123-G125 PolarHBondContact O-N 3.19Å; G125-F127 PolarHBondContact O-N 3.38Å; G125-A128 PolarHBondContact O-N 3.27Å; G125-S129 PolarHBondContact O-N 3.47Å
126M92Very high93.3Very high12 Ų1218.8 Ų18.86%0.0599%0.09CC..Hα-helixtrans-58.4-49.8178-58.2176.5-168.800111.8Q95 Q122 V123 A128 T130 I211 W287Q95-M126 VanDerWaalsContact CD-CE 3.48Å; Q95-M126 HydrophobicContact CG-CE 4.16Å; Q95-M126 VanDerWaalsContact OE1-CE 3.24Å; Q122-M126 HydrophobicContact CG-CE 3.71Å; Q122-M126 WeakPolarHBondContact O-CG 3.39Å; Q122-M126 PolarHBondContact O-N 2.87Å; V123-M126 PolarHBondContact O-N 2.8Å; M126-A128 PolarHBondContact O-N 3.09Å; M126-T130 VanDerWaalsContact O-CB 3.26Å; M126-T130 WeakPolarHBondContact O-CB 3.29Å; M126-T130 PolarHBondContact O-N 3.47Å; M126-T130 VanDerWaalsContact O-N 3.08Å; M126-T130 PolarHBondContact O-OG1 3.06Å; M126-I211 HydrophobicContact CB-CD1 3.82Å; M126-I211 HydrophobicContact SD-CD1 4.32Å; M126-W287 HydrophobicContact CB-CH2 4.18Å; M126-W287 HydrophobicContact CG-CH2 3.85Å; M126-W287 HydrophobicContact SD-CH2 4.01Å; M126-W287 HydrophobicContact SD-CZ3 4.47Å
127F95Very high93.1Very high0 Ų015.8 Ų15.80%08%0.078CC..Hα-helixtrans-63.3-40.3178-83.2-64.8000112.1V123 V124 G125 Y131 S167 F170 S171 I207 T210 I211V123-F127 HydrophobicContact CG1-CD2 3.59Å; V123-F127 HydrophobicContact CG1-CE2 3.48Å; V123-F127 VanDerWaalsContact CG1-CE2 3.48Å; V123-F127 WeakPolarHBondContact O-CD2 3.49Å; V123-F127 PolarHBondContact O-N 3.21Å; V124-F127 PolarHBondContact O-N 2.89Å; G125-F127 PolarHBondContact O-N 3.38Å; F127-Y131 HydrophobicContact CB-CE2 4.41Å; F127-Y131 HydrophobicContact CD1-CE1 4.26Å; F127-Y131 AromaticContact CD1-CE2 3.78Å; F127-Y131 HydrophobicContact CD1-CE2 3.78Å; F127-Y131 AromaticContact CD1-CZ 3.57Å; F127-Y131 WeakPolarHBondContact CD1-OH 3.44Å; F127-Y131 WeakPolarHBondContact CE1-OH 3.42Å; F127-Y131 HydrophobicContact CG-CE2 4.47Å; F127-Y131 WeakPolarHBondContact O-CB 3.42Å; F127-Y131 VanDerWaalsContact O-CG 3.28Å; F127-Y131 PolarHBondContact O-N 3.39Å; F127-S167 VanDerWaalsContact C-OG 3.25Å; F127-S167 PolarHBondContact O-OG 2.89Å; F127-F170 HydrophobicContact CD2-CB 4.41Å; F127-F170 HydrophobicContact CE1-CB 4.11Å; F127-F170 HydrophobicContact CE1-CD2 4.22Å; F127-F170 HydrophobicContact CE2-CB 3.99Å; F127-F170 HydrophobicContact CZ-CB 3.84Å; F127-S171 WeakPolarHBondContact CD2-OG 3.23Å; F127-I207 HydrophobicContact CE2-CD1 4.08Å; F127-I207 HydrophobicContact CZ-CD1 4.06Å; F127-T210 WeakPolarHBondContact CE1-OG1 3.22Å; F127-T210 WeakPolarHBondContact CZ-OG1 3.32Å; F127-I211 HydrophobicContact CD1-CD1 4.15Å; F127-I211 HydrophobicContact CD1-CG1 3.67Å; F127-I211 HydrophobicContact CD2-CD1 4.22Å; F127-I211 HydrophobicContact CE1-CD1 4.03Å; F127-I211 HydrophobicContact CE1-CG1 3.38Å; F127-I211 HydrophobicContact CE2-CD1 4.12Å; F127-I211 HydrophobicContact CE2-CG1 4.35Å; F127-I211 HydrophobicContact CG-CD1 4.24Å; F127-I211 HydrophobicContact CG-CG1 4.26Å; F127-I211 HydrophobicContact CZ-CD1 4.02Å; F127-I211 HydrophobicContact CZ-CG1 3.76Å
128A95.3Very high93Very high0 Ų014.2 Ų14.20%07%0.072CC..Hα-helixtrans-65.5-48.2-17900000111.4A87 V124 G125 M126 T130 Y131 M132 W164 S167A87-A128 HydrophobicContact CB-CB 3.82Å; V124-A128 WeakPolarHBondContact O-CB 3.41Å; V124-A128 PolarHBondContact O-N 2.92Å; G125-A128 PolarHBondContact O-N 3.27Å; M126-A128 PolarHBondContact O-N 3.09Å; A128-T130 PolarHBondContact O-N 2.93Å; A128-Y131 PolarHBondContact O-N 2.88Å; A128-M132 WeakPolarHBondContact O-CB 3.45Å; A128-M132 VanDerWaalsContact O-CG 3.24Å; A128-M132 WeakPolarHBondContact O-CG 3.28Å; A128-M132 PolarHBondContact O-N 2.97Å; A128-W164 HydrophobicContact CB-CE3 4.18Å; A128-W164 HydrophobicContact CB-CH2 3.98Å; A128-W164 HydrophobicContact CB-CZ2 4.38Å; A128-W164 HydrophobicContact CB-CZ3 3.87Å; A128-S167 WeakPolarHBondContact CA-OG 3.47Å; A128-S167 PolarHBondContact N-OG 3.29Å
129S93.8Very high92.9Very high2 Ų213.4 Ų13.41%0.0147%0.067CC..Hα-helixtrans-61.8-46.7178.7-177.20000110.6L84 D88 G125 Y131 M132 L133L84-S129 WeakPolarHBondContact CD1-OG 3.42Å; D88-S129 WeakPolarHBondContact OD1-CB 3.46Å; D88-S129 PolarHBondContact OD1-OG 2.98Å; G125-S129 PolarHBondContact O-N 3.47Å; S129-Y131 PolarHBondContact O-N 2.89Å; S129-M132 PolarHBondContact O-N 3.34Å; S129-L133 WeakPolarHBondContact O-CB 3.3Å; S129-L133 PolarHBondContact O-N 2.98Å
130T94.6Very high92.7Very high1 Ų112.9 Ų12.91%0.0066%0.064CC..Hα-helixtrans-59-48.6177.1-59.90000112.9M126 A128 L133 V134 I211 P215 Y283M126-T130 VanDerWaalsContact O-CB 3.26Å; M126-T130 WeakPolarHBondContact O-CB 3.29Å; M126-T130 PolarHBondContact O-N 3.47Å; M126-T130 VanDerWaalsContact O-N 3.08Å; M126-T130 PolarHBondContact O-OG1 3.06Å; A128-T130 PolarHBondContact O-N 2.93Å; T130-L133 WeakPolarHBondContact O-CB 3.41Å; T130-L133 PolarHBondContact O-N 2.9Å; T130-V134 WeakPolarHBondContact O-CG2 3.42Å; T130-V134 PolarHBondContact O-N 3.39Å; T130-I211 HydrophobicContact CG2-CG2 4.36Å; T130-I211 WeakPolarHBondContact CG2-O 3.48Å; T130-P215 HydrophobicContact CG2-CB 3.78Å; T130-P215 HydrophobicContact CG2-CG 3.53Å; T130-Y283 HydrophobicContact CG2-CE2 4.34Å; T130-Y283 VanDerWaalsContact CG2-OH 3.23Å; T130-Y283 WeakPolarHBondContact CG2-OH 3.42Å; T130-Y283 PolarHBondContact OG1-OH 3.11Å; T130-Y283 VanDerWaalsContact OG1-OH 3.12Å
131Y95.5Very high92.4Very high25 Ų2511.7 Ų11.710%0.0986%0.061CC..Hα-helixtrans-73.9-29.3-178.6-65.3-15.1000112.8F127 A128 S129 L133 L135 L166 S167 F170 T210 P215F127-Y131 HydrophobicContact CB-CE2 4.41Å; F127-Y131 HydrophobicContact CD1-CE1 4.26Å; F127-Y131 AromaticContact CD1-CE2 3.78Å; F127-Y131 HydrophobicContact CD1-CE2 3.78Å; F127-Y131 AromaticContact CD1-CZ 3.57Å; F127-Y131 WeakPolarHBondContact CD1-OH 3.44Å; F127-Y131 WeakPolarHBondContact CE1-OH 3.42Å; F127-Y131 HydrophobicContact CG-CE2 4.47Å; F127-Y131 WeakPolarHBondContact O-CB 3.42Å; F127-Y131 VanDerWaalsContact O-CG 3.28Å; F127-Y131 PolarHBondContact O-N 3.39Å; A128-Y131 PolarHBondContact O-N 2.88Å; S129-Y131 PolarHBondContact O-N 2.89Å; Y131-L133 VanDerWaalsContact C-N 3.35Å; Y131-L135 WeakPolarHBondContact O-CB 3.49Å; Y131-L135 PolarHBondContact O-N 2.94Å; Y131-L166 HydrophobicContact CD2-CB 4.37Å; Y131-L166 HydrophobicContact CD2-CD2 4.11Å; Y131-L166 HydrophobicContact CD2-CG 4.36Å; Y131-L166 HydrophobicContact CE2-CB 4.29Å; Y131-L166 HydrophobicContact CE2-CD2 3.73Å; Y131-L166 HydrophobicContact CE2-CG 3.85Å; Y131-S167 WeakPolarHBondContact CD2-OG 3.46Å; Y131-F170 HydrophobicContact CE2-CD2 4.39Å; Y131-F170 VanDerWaalsContact OH-CD2 3.32Å; Y131-F170 WeakPolarHBondContact OH-CD2 3.36Å; Y131-T210 WeakPolarHBondContact CE1-O 3.4Å; Y131-T210 PolarHBondContact OH-O 3.1Å; Y131-P215 HydrophobicContact CE1-CG 4.37Å
132M94.1Very high92.1Very high2 Ų213 Ų131%0.017%0.068CC..Hα-helixtrans-63.4-40.2167.7-73.4-56.3100.900111.8H83 L84 A128 S129 L135 M136 V160H83-M132 HydrophobicContact CB-CG 4.37Å; H83-M132 HydrophobicContact CB-SD 3.64Å; L84-M132 HydrophobicContact CB-CB 4.26Å; L84-M132 HydrophobicContact CD1-CB 4.1Å; A128-M132 WeakPolarHBondContact O-CB 3.45Å; A128-M132 VanDerWaalsContact O-CG 3.24Å; A128-M132 WeakPolarHBondContact O-CG 3.28Å; A128-M132 PolarHBondContact O-N 2.97Å; S129-M132 PolarHBondContact O-N 3.34Å; M132-L135 HydrophobicContact CE-CD2 4.23Å; M132-L135 PolarHBondContact O-N 2.97Å; M132-M136 VanDerWaalsContact O-CB 3.22Å; M132-M136 WeakPolarHBondContact O-CB 3.41Å; M132-M136 PolarHBondContact O-N 3.48Å; M132-V160 HydrophobicContact CE-CG1 4.28Å; M132-V160 HydrophobicContact SD-CG1 4.25Å; M132-V160 HydrophobicContact SD-CG2 4.34Å
133L92.4Very high91.7Very high1 Ų112.9 Ų12.91%0.0057%0.071CC..Hα-helixtrans-68.3-42178.4-172.5166.9000112.3S129 T130 Y131 S137 L219 I279 V280 Y283S129-L133 WeakPolarHBondContact O-CB 3.3Å; S129-L133 PolarHBondContact O-N 2.98Å; T130-L133 WeakPolarHBondContact O-CB 3.41Å; T130-L133 PolarHBondContact O-N 2.9Å; Y131-L133 VanDerWaalsContact C-N 3.35Å; L133-S137 WeakPolarHBondContact O-CB 3.34Å; L133-S137 PolarHBondContact O-N 3.15Å; L133-S137 PolarHBondContact O-OG 3.28Å; L133-L219 HydrophobicContact CD2-CD1 3.57Å; L133-L219 HydrophobicContact CD2-CD2 3.59Å; L133-L219 HydrophobicContact CD2-CG 4.21Å; L133-I279 HydrophobicContact CD1-CG2 3.66Å; L133-I279 HydrophobicContact CG-CG2 3.93Å; L133-V280 HydrophobicContact CD2-CG2 3.88Å; L133-Y283 HydrophobicContact CD1-CD2 3.53Å; L133-Y283 HydrophobicContact CD1-CE2 4.36Å; L133-Y283 HydrophobicContact CD1-CG 3.8Å
134V95.1Very high91.2Very high18 Ų1813.4 Ų13.411%0.1097%0.074CC..Hα-helixtrans-61.1-50.5171.2171.90000110.8T130 M136 S137 V138 P215 I218 L219T130-V134 WeakPolarHBondContact O-CG2 3.42Å; T130-V134 PolarHBondContact O-N 3.39Å; V134-M136 VanDerWaalsContact C-N 3.34Å; V134-M136 PolarHBondContact O-N 3.5Å; V134-S137 PolarHBondContact O-N 3.04Å; V134-S137 VanDerWaalsContact O-N 3.09Å; V134-V138 HydrophobicContact CG1-CG2 4.25Å; V134-V138 WeakPolarHBondContact O-CG2 3.2Å; V134-V138 PolarHBondContact O-N 3.25Å; V134-P215 HydrophobicContact CG2-CB 3.67Å; V134-P215 HydrophobicContact CG2-CG 4.23Å; V134-I218 HydrophobicContact CG1-CB 4.38Å; V134-I218 HydrophobicContact CG1-CD1 4.28Å; V134-I218 HydrophobicContact CG1-CG2 3.77Å; V134-L219 HydrophobicContact CG2-CD2 4.35Å; V134-L219 HydrophobicContact CG2-CG 4.43Å
135L93.3Very high90.6Very high19 Ų1915 Ų1510%0.0998%0.084CC..Hα-helixtrans-60.1-42.8179.8177.156000112F80 Y131 M132 S137 D139 Y159 V160F80-L135 HydrophobicContact CD1-CD2 4.46Å; F80-L135 HydrophobicContact CD1-CG 4.41Å; F80-L135 HydrophobicContact CE1-CD2 3.85Å; F80-L135 HydrophobicContact CE1-CG 3.78Å; F80-L135 HydrophobicContact CZ-CG 4.49Å; Y131-L135 WeakPolarHBondContact O-CB 3.49Å; Y131-L135 PolarHBondContact O-N 2.94Å; M132-L135 HydrophobicContact CE-CD2 4.23Å; M132-L135 PolarHBondContact O-N 2.97Å; L135-S137 VanDerWaalsContact C-N 3.32Å; L135-S137 PolarHBondContact O-N 3.44Å; L135-D139 VanDerWaalsContact O-CB 3.3Å; L135-D139 WeakPolarHBondContact O-CB 3.4Å; L135-D139 PolarHBondContact O-N 3.2Å; L135-Y159 HydrophobicContact CD1-CG 4.23Å; L135-V160 HydrophobicContact CD2-CB 4.41Å; L135-V160 HydrophobicContact CD2-CG2 3.67Å
136M90.4Very high89.8Confident1 Ų119.1 Ų19.11%0.00510%0.104CC..Hα-helixtrans-58.7-42.4173.8177.6174.766.400111.8M77 L84 M132 V134 D139 R140 T276 I279M77-M136 HydrophobicContact CE-CG 3.86Å; M77-M136 HydrophobicContact CE-SD 3.62Å; L84-M136 HydrophobicContact CD2-CE 3.93Å; L84-M136 HydrophobicContact CD2-SD 4.4Å; M132-M136 VanDerWaalsContact O-CB 3.22Å; M132-M136 WeakPolarHBondContact O-CB 3.41Å; M132-M136 PolarHBondContact O-N 3.48Å; V134-M136 VanDerWaalsContact C-N 3.34Å; V134-M136 PolarHBondContact O-N 3.5Å; M136-D139 WeakPolarHBondContact O-CB 3.46Å; M136-D139 PolarHBondContact O-N 3.08Å; M136-R140 WeakPolarHBondContact O-CG 3.22Å; M136-R140 PolarHBondContact O-N 3.04Å; M136-T276 HydrophobicContact CE-CG2 3.94Å; M136-T276 HydrophobicContact CG-CG2 3.91Å; M136-T276 HydrophobicContact SD-CG2 3.75Å; M136-I279 HydrophobicContact CE-CB 4.49Å; M136-I279 HydrophobicContact CE-CD1 3.85Å; M136-I279 HydrophobicContact CE-CG2 4.09Å
137S91.1Very high88.6Confident0 Ų021 Ų210%012%0.117CC..Hα-helixtrans-73.8-41-178.5-63.30000113L133 V134 L135 D139 R140 C141 L219 Y223L133-S137 WeakPolarHBondContact O-CB 3.34Å; L133-S137 PolarHBondContact O-N 3.15Å; L133-S137 PolarHBondContact O-OG 3.28Å; V134-S137 PolarHBondContact O-N 3.04Å; V134-S137 VanDerWaalsContact O-N 3.09Å; L135-S137 VanDerWaalsContact C-N 3.32Å; L135-S137 PolarHBondContact O-N 3.44Å; S137-D139 VanDerWaalsContact C-N 3.27Å; S137-D139 PolarHBondContact O-N 3.3Å; S137-R140 PolarHBondContact O-N 3.05Å; S137-C141 WeakPolarHBondContact O-CB 3.5Å; S137-C141 PolarHBondContact O-N 3.42Å; S137-L219 VanDerWaalsContact OG-CD2 3.29Å; S137-L219 WeakPolarHBondContact OG-CD2 3.27Å; S137-Y223 WeakPolarHBondContact OG-CE2 3.37Å; S137-Y223 PolarHBondContact OG-OH 3.47Å
138V91.5Very high86.9Confident47 Ų4728.4 Ų28.429%0.28516%0.156SC..Hα-helixtrans-58.6-42.6169.9170.60000110V134 C141 L142 I218V134-V138 HydrophobicContact CG1-CG2 4.25Å; V134-V138 WeakPolarHBondContact O-CG2 3.2Å; V134-V138 PolarHBondContact O-N 3.25Å; V138-C141 WeakPolarHBondContact O-CB 3.47Å; V138-C141 PolarHBondContact O-N 3.37Å; V138-L142 HydrophobicContact CG1-CD1 4.04Å; V138-L142 HydrophobicContact CG1-CG 4.41Å; V138-L142 WeakPolarHBondContact O-CG 3.46Å; V138-L142 PolarHBondContact O-N 3.48Å; V138-I218 HydrophobicContact CG2-CG2 3.96Å
139D88Confident85.3Confident5 Ų535.4 Ų35.43%0.02718%0.182CC..Hα-helixtrans-62-46.7176.417950.8000112.9R76 F80 L135 M136 S137 C141 L142 A143R76-D139 IonicContact CZ-OD1 3.67Å; R76-D139 IonicContact CZ-OD2 3.81Å; R76-D139 IonicContact NE-OD1 3.29Å; R76-D139 IonicContact NH1-OD1 2.67Å; R76-D139 PolarHBondContact NH1-OD1 2.96Å; R76-D139 IonicContact NH1-OD2 2.74Å; R76-D139 IonicContact NH2-OD1 3.64Å; R76-D139 PolarHBondContact NH2-OD1 2.95Å; F80-D139 HydrophobicContact CE2-CB 4Å; F80-D139 WeakPolarHBondContact CE2-OD2 3.3Å; F80-D139 HydrophobicContact CZ-CB 4.22Å; L135-D139 VanDerWaalsContact O-CB 3.3Å; L135-D139 WeakPolarHBondContact O-CB 3.4Å; L135-D139 PolarHBondContact O-N 3.2Å; M136-D139 WeakPolarHBondContact O-CB 3.46Å; M136-D139 PolarHBondContact O-N 3.08Å; S137-D139 VanDerWaalsContact C-N 3.27Å; S137-D139 PolarHBondContact O-N 3.3Å; D139-C141 VanDerWaalsContact C-N 3.29Å; D139-C141 PolarHBondContact O-N 3.34Å; D139-L142 PolarHBondContact O-N 3.03Å; D139-A143 WeakPolarHBondContact O-CB 3.38Å; D139-A143 PolarHBondContact O-N 2.84Å
140R87.4Confident83.4Confident28 Ų2839.2 Ų39.211%0.10621%0.209CC..Hα-helixtrans-58-44.1174.4-68.4-49.593.6151.410.6111.2M77 M136 S137 A143 I144 I226 T272 T276M77-R140 PolarHBondContact SD-NH1 3.44Å; M136-R140 WeakPolarHBondContact O-CG 3.22Å; M136-R140 PolarHBondContact O-N 3.04Å; S137-R140 PolarHBondContact O-N 3.05Å; R140-A143 PolarHBondContact O-N 2.77Å; R140-I144 VanDerWaalsContact O-CD1 3.24Å; R140-I144 WeakPolarHBondContact O-CD1 3.46Å; R140-I144 VanDerWaalsContact O-CG1 3.29Å; R140-I144 WeakPolarHBondContact O-CG1 3.47Å; R140-I144 PolarHBondContact O-N 3Å; R140-I226 HydrophobicContact CB-CD1 4.31Å; R140-T272 VanDerWaalsContact NH1-CG2 3.31Å; R140-T276 HydrophobicContact CG-CG2 3.87Å
141C87.9Confident81.5Confident11 Ų1146.9 Ų46.97%0.07425%0.249CC..Hα-helixtrans-57.7-52.4176.5-1750000111.1S137 V138 D139 A143 I144 C145 C222 I226S137-C141 WeakPolarHBondContact O-CB 3.5Å; S137-C141 PolarHBondContact O-N 3.42Å; V138-C141 WeakPolarHBondContact O-CB 3.47Å; V138-C141 PolarHBondContact O-N 3.37Å; D139-C141 VanDerWaalsContact C-N 3.29Å; D139-C141 PolarHBondContact O-N 3.34Å; C141-A143 PolarHBondContact O-N 2.78Å; C141-I144 PolarHBondContact O-N 3.33Å; C141-C145 VanDerWaalsContact O-CB 3.27Å; C141-C145 WeakPolarHBondContact O-CB 3.44Å; C141-C145 PolarHBondContact O-N 2.99Å; C141-C145 PolarHBondContact O-SG 2.98Å; C141-C145 VanDerWaalsContact SG-SG 3.68Å; C141-C222 HydrophobicContact CB-CB 4.03Å; C141-I226 HydrophobicContact CB-CD1 4.05Å; C141-I226 HydrophobicContact CB-CG1 4.09Å
142L86.6Confident79.8Confident63 Ų6350.8 Ų50.833%0.3327%0.268SS..Hα-helixtrans-60.6-41.1178-68.6174.1000112.9V138 D139 I144 Q146V138-L142 HydrophobicContact CG1-CD1 4.04Å; V138-L142 HydrophobicContact CG1-CG 4.41Å; V138-L142 WeakPolarHBondContact O-CG 3.46Å; V138-L142 PolarHBondContact O-N 3.48Å; D139-L142 PolarHBondContact O-N 3.03Å; L142-I144 PolarHBondContact O-N 3.36Å; L142-I144 VanDerWaalsContact O-N 3.17Å; L142-Q146 CarbonylContact O-C 3.34Å; L142-Q146 WeakPolarHBondContact O-CA 3.37Å; L142-Q146 PolarHBondContact O-N 2.92Å
143A82.8Confident78.2Confident25 Ų2558 Ų5821%0.20730%0.295CS..Hα-helixtrans-67.4-12.8-179.900000114.8D139 R140 C141 K269D139-A143 WeakPolarHBondContact O-CB 3.38Å; D139-A143 PolarHBondContact O-N 2.84Å; R140-A143 PolarHBondContact O-N 2.77Å; C141-A143 PolarHBondContact O-N 2.78Å; A143-K269 PolarHBondContact O-NZ 3.38Å
144I81.3Confident76.8Confident18 Ų1869.1 Ų69.19%0.09234%0.337CS..Hα-helixtrans-109.8-48.4-179.4-65.3162.4000110.7R140 C141 L142 I226 K229 I265 V273R140-I144 VanDerWaalsContact O-CD1 3.24Å; R140-I144 WeakPolarHBondContact O-CD1 3.46Å; R140-I144 VanDerWaalsContact O-CG1 3.29Å; R140-I144 WeakPolarHBondContact O-CG1 3.47Å; R140-I144 PolarHBondContact O-N 3Å; C141-I144 PolarHBondContact O-N 3.33Å; L142-I144 PolarHBondContact O-N 3.36Å; L142-I144 VanDerWaalsContact O-N 3.17Å; I144-I226 HydrophobicContact CD1-CD1 4.38Å; I144-I226 HydrophobicContact CD1-CG1 4.14Å; I144-I226 HydrophobicContact CD1-CG2 3.99Å; I144-K229 HydrophobicContact CG2-CB 4.38Å; I144-I265 HydrophobicContact CG2-CD1 4.26Å; I144-V273 HydrophobicContact CD1-CG2 3.17Å; I144-V273 HydrophobicContact CG1-CG2 4.46Å
145C81.8Confident76Confident36 Ų3672.6 Ų72.624%0.24335%0.351CS..Hα-helixtrans-72.9-29.9-179.6-60.10000112.6C141 K229C141-C145 VanDerWaalsContact O-CB 3.27Å; C141-C145 WeakPolarHBondContact O-CB 3.44Å; C141-C145 PolarHBondContact O-N 2.99Å; C141-C145 PolarHBondContact O-SG 2.98Å; C141-C145 VanDerWaalsContact SG-SG 3.68Å; C145-K229 HydrophobicContact CB-CG 4.42Å
146Q76.4Confident75.4Confident88 Ų8872 Ų7241%0.41135%0.348SS..  trans-127.267-178.9-64.2-173.4-14.600112L142 L148 R149L142-Q146 CarbonylContact O-C 3.34Å; L142-Q146 WeakPolarHBondContact O-CA 3.37Å; L142-Q146 PolarHBondContact O-N 2.92Å; Q146-L148 PolarHBondContact O-N 2.86Å; Q146-R149 HydrophobicContact CB-CB 4.27Å; Q146-R149 PolarHBondContact O-N 3.13Å; Q146-R149 VanDerWaalsContact OE1-CD 3.25Å
147P65.6Low75.3Confident52 Ų5280.2 Ų80.234%0.33838%0.378SS..THydrogen-bonded Turntrans-65.3-7.8-173.228.1-36.6000115.3R263P147-R263 PolarHBondContact O-NH1 3.15Å
148L60.4Low75.2Confident155 Ų15586.4 Ų86.481%0.81241%0.406SS*.THydrogen-bonded Turntrans-88.9-13.9175.4-64.1174.2000113.4Q146 S150Q146-L148 PolarHBondContact O-N 2.86Å; L148-S150 VanDerWaalsContact C-N 3.35Å; L148-S150 PolarHBondContact O-N 2.83Å
149R61.6Low75.2Confident146 Ų14688.9 Ų88.955%0.55141%0.41SS*.  trans-89.86.9-175-154.7174.1-178.4-166.9-0.5114.4Q146 L151Q146-R149 HydrophobicContact CB-CB 4.27Å; Q146-R149 PolarHBondContact O-N 3.13Å; Q146-R149 VanDerWaalsContact OE1-CD 3.25Å; R149-L151 PolarHBondContact O-N 2.99Å
150S54.5Low75.4Confident82 Ų8288.7 Ų88.757%0.57341%0.41SS*.THydrogen-bonded Turntrans-67.911.3-162.7-167.30000117.7L148L148-S150 VanDerWaalsContact C-N 3.35Å; L148-S150 PolarHBondContact O-N 2.83Å
151L54.8Low75.8Confident163 Ų16391.2 Ų91.285%0.85342%0.424SS*.THydrogen-bonded Turntrans-110.80.5-166.6-75.4168000115.9R149 R153R149-L151 PolarHBondContact O-N 2.99Å; L151-R153 PolarHBondContact O-N 3.39Å
152H59.7Low76.1Confident107 Ų10795.9 Ų95.950%0.49544%0.443SS..  trans-100.355.8-167.3-111.590.2000116R154 K155H152-R154 PolarHBondContact O-N 3.3Å; H152-K155 HydrophobicContact CB-CD 4.29Å; H152-K155 PolarHBondContact O-N 2.95Å
153R60Low76.5Confident154 Ų15493.5 Ų93.558%0.58143%0.432SS*.Hα-helixtrans-49.2-31.1175.9-85.2174.179124.9-8.7114.4Q74 L151 K155 D156Q74-R153 PolarHBondContact O-NH1 3.26Å; L151-R153 PolarHBondContact O-N 3.39Å; R153-K155 VanDerWaalsContact C-N 3.29Å; R153-K155 PolarHBondContact O-N 3.33Å; R153-D156 PolarHBondContact O-N 3.49Å
154R63.4Low77.2Confident233 Ų23394.8 Ų94.888%0.87943%0.432SS*.Hα-helixtrans-64.7-27.4178.4-75.2-172.8178.2178.2-0.1113.7H152H152-R154 PolarHBondContact O-N 3.3Å
155K77.8Confident78Confident92 Ų9298.9 Ų98.940%0.445%0.454SS..Hα-helixtrans-78.9-26.6-179.4-72.9176.7-178.9-178.50112.6H152 R153 R157 F158 Y159H152-K155 HydrophobicContact CB-CD 4.29Å; H152-K155 PolarHBondContact O-N 2.95Å; R153-K155 VanDerWaalsContact C-N 3.29Å; R153-K155 PolarHBondContact O-N 3.33Å; K155-R157 PolarHBondContact O-N 3.4Å; K155-F158 WeakPolarHBondContact O-CB 3.36Å; K155-F158 PolarHBondContact O-N 2.86Å; K155-Y159 HydrophobicContact CB-CD2 4.32Å; K155-Y159 HydrophobicContact CB-CE2 3.83Å; K155-Y159 WeakPolarHBondContact O-CD2 3.41Å; K155-Y159 PolarHBondContact O-N 2.96Å
156D81Confident78.6Confident7 Ų799 Ų994%0.03745%0.452CS..Hα-helixtrans-60.9-45.1178.7-56.8-32.2000112.3R76 Y79 F80 R153 F158 Y159 V160R76-D156 WeakPolarHBondContact CD-OD2 3.26Å; R76-D156 IonicContact CZ-OD1 3.29Å; R76-D156 VanDerWaalsContact CZ-OD1 3.29Å; R76-D156 IonicContact CZ-OD2 3.71Å; R76-D156 IonicContact NE-OD1 2.9Å; R76-D156 PolarHBondContact NE-OD1 2.91Å; R76-D156 VanDerWaalsContact NE-OD1 3.12Å; R76-D156 IonicContact NE-OD2 3.27Å; R76-D156 PolarHBondContact NE-OD2 3.04Å; R76-D156 IonicContact NH2-OD1 3.5Å; R76-D156 PolarHBondContact NH2-OD1 3.09Å; R76-D156 IonicContact NH2-OD2 2.71Å; Y79-D156 HydrophobicContact CD1-CB 4.5Å; Y79-D156 HydrophobicContact CE1-CB 4.26Å; F80-D156 HydrophobicContact CZ-CB 4.33Å; R153-D156 PolarHBondContact O-N 3.49Å; D156-F158 VanDerWaalsContact C-N 3.3Å; D156-F158 PolarHBondContact O-N 3.44Å; D156-Y159 PolarHBondContact O-N 2.92Å; D156-V160 WeakPolarHBondContact O-CG2 3.32Å; D156-V160 PolarHBondContact O-N 3.24Å
157R87Confident79.6Confident172 Ų17294.9 Ų94.965%0.64943%0.432SS*.Hα-helixtrans-62.5-39.1177-174.1177.8179.3-173.6-0.3111.5K155 I161K155-R157 PolarHBondContact O-N 3.4Å; R157-I161 HydrophobicContact CG-CD1 3.85Å; R157-I161 HydrophobicContact CG-CG1 4.49Å; R157-I161 WeakPolarHBondContact O-CB 3.46Å; R157-I161 VanDerWaalsContact O-CG1 3.24Å; R157-I161 WeakPolarHBondContact O-CG1 3.26Å; R157-I161 PolarHBondContact O-N 3.27Å
158F89.8Confident81.1Confident131 Ų13195.6 Ų95.658%0.57543%0.433SS*.Hα-helixtrans-63.5-48.4175.1176.6-92.8000111.3K155 D156 V160 I161 F162K155-F158 WeakPolarHBondContact O-CB 3.36Å; K155-F158 PolarHBondContact O-N 2.86Å; D156-F158 VanDerWaalsContact C-N 3.3Å; D156-F158 PolarHBondContact O-N 3.44Å; F158-V160 PolarHBondContact O-N 3.47Å; F158-I161 PolarHBondContact O-N 3.44Å; F158-F162 VanDerWaalsContact O-CB 3.3Å; F158-F162 WeakPolarHBondContact O-CB 3.28Å; F158-F162 PolarHBondContact O-N 2.86Å
159Y91.2Very high82.7Confident98 Ų9893.1 Ų93.138%0.38442%0.42SS..Hα-helixtrans-62.7-40178.4-64.9-53.9000112.6L135 K155 D156 F162 S163L135-Y159 HydrophobicContact CD1-CG 4.23Å; K155-Y159 HydrophobicContact CB-CD2 4.32Å; K155-Y159 HydrophobicContact CB-CE2 3.83Å; K155-Y159 WeakPolarHBondContact O-CD2 3.41Å; K155-Y159 PolarHBondContact O-N 2.96Å; D156-Y159 PolarHBondContact O-N 2.92Å; Y159-F162 PolarHBondContact O-N 3.42Å; Y159-S163 PolarHBondContact O-N 3.4Å; Y159-S163 PolarHBondContact O-OG 2.97Å
160V93.3Very high84.3Confident2 Ų288.8 Ų88.81%0.01241%0.405CS..Hα-helixtrans-62.3-50.9174.71690000110.8Y79 F80 H83 M132 L135 D156 F158 F162 S163 W164Y79-V160 HydrophobicContact CE1-CB 4.4Å; Y79-V160 HydrophobicContact CE1-CG2 3.7Å; F80-V160 HydrophobicContact CD1-CG2 4.18Å; F80-V160 HydrophobicContact CE1-CG2 3.89Å; H83-V160 HydrophobicContact CB-CG1 4.44Å; M132-V160 HydrophobicContact CE-CG1 4.28Å; M132-V160 HydrophobicContact SD-CG1 4.25Å; M132-V160 HydrophobicContact SD-CG2 4.34Å; L135-V160 HydrophobicContact CD2-CB 4.41Å; L135-V160 HydrophobicContact CD2-CG2 3.67Å; D156-V160 WeakPolarHBondContact O-CG2 3.32Å; D156-V160 PolarHBondContact O-N 3.24Å; F158-V160 PolarHBondContact O-N 3.47Å; V160-F162 VanDerWaalsContact C-N 3.3Å; V160-F162 PolarHBondContact O-N 3Å; V160-S163 PolarHBondContact O-N 2.93Å; V160-W164 VanDerWaalsContact O-CD1 3.25Å; V160-W164 PolarHBondContact O-N 3.48Å
161I94.3Very high86.2Confident81 Ų8184.9 Ų84.942%0.41538%0.378SS..Hα-helixtrans-58.1-44.8178-69.8167.8000110.7R157 F158 S163 W164 L165R157-I161 HydrophobicContact CG-CD1 3.85Å; R157-I161 HydrophobicContact CG-CG1 4.49Å; R157-I161 WeakPolarHBondContact O-CB 3.46Å; R157-I161 VanDerWaalsContact O-CG1 3.24Å; R157-I161 WeakPolarHBondContact O-CG1 3.26Å; R157-I161 PolarHBondContact O-N 3.27Å; F158-I161 PolarHBondContact O-N 3.44Å; I161-S163 PolarHBondContact O-N 3.22Å; I161-W164 PolarHBondContact O-N 2.93Å; I161-L165 HydrophobicContact CG2-CD1 3.83Å; I161-L165 HydrophobicContact CG2-CG 4.25Å; I161-L165 WeakPolarHBondContact O-CG 3.37Å; I161-L165 PolarHBondContact O-N 2.99Å
162F94.8Very high88.1Confident108 Ų10879.8 Ų79.847%0.47435%0.354SS..Hα-helixtrans-58.5-46.4176.6176.5-99.3000112F158 Y159 V160 W164 L165 L166F158-F162 VanDerWaalsContact O-CB 3.3Å; F158-F162 WeakPolarHBondContact O-CB 3.28Å; F158-F162 PolarHBondContact O-N 2.86Å; Y159-F162 PolarHBondContact O-N 3.42Å; V160-F162 VanDerWaalsContact C-N 3.3Å; V160-F162 PolarHBondContact O-N 3Å; F162-W164 PolarHBondContact O-N 3.35Å; F162-L165 PolarHBondContact O-N 3.23Å; F162-L166 HydrophobicContact CE1-CD2 4.24Å; F162-L166 WeakPolarHBondContact O-CB 3.4Å; F162-L166 PolarHBondContact O-N 2.92Å
163S95.4Very high89.6Confident14 Ų1476.8 Ų76.810%0.09834%0.344CS..Hα-helixtrans-60.8-44175.5-69.50000112.5Y159 V160 I161 L166 S167Y159-S163 PolarHBondContact O-N 3.4Å; Y159-S163 PolarHBondContact O-OG 2.97Å; V160-S163 PolarHBondContact O-N 2.93Å; I161-S163 PolarHBondContact O-N 3.22Å; S163-L166 PolarHBondContact O-N 3.43Å; S163-S167 PolarHBondContact O-N 2.92Å; S163-S167 PolarHBondContact O-OG 3.15Å
164W97.1Very high91.1Very high51 Ų5169.6 Ų69.619%0.19332%0.317CS..Hα-helixtrans-63.4-43176.4-82.393.2000112.4H83 I86 A87 A128 V160 I161 F162 L166 S167 L168H83-W164 AromaticContact ND1-NE1 3.64Å; I86-W164 HydrophobicContact CG2-CH2 4.02Å; I86-W164 HydrophobicContact CG2-CZ2 4.09Å; A87-W164 HydrophobicContact CB-CH2 4.13Å; A87-W164 HydrophobicContact CB-CZ2 4.13Å; A128-W164 HydrophobicContact CB-CE3 4.18Å; A128-W164 HydrophobicContact CB-CH2 3.98Å; A128-W164 HydrophobicContact CB-CZ2 4.38Å; A128-W164 HydrophobicContact CB-CZ3 3.87Å; V160-W164 VanDerWaalsContact O-CD1 3.25Å; V160-W164 PolarHBondContact O-N 3.48Å; I161-W164 PolarHBondContact O-N 2.93Å; F162-W164 PolarHBondContact O-N 3.35Å; W164-L166 VanDerWaalsContact C-N 3.33Å; W164-L166 PolarHBondContact O-N 3.05Å; W164-S167 PolarHBondContact O-N 3.22Å; W164-L168 WeakPolarHBondContact O-CG 3.31Å; W164-L168 PolarHBondContact O-N 2.95Å
165L97.1Very high92.3Very high105 Ų10561.8 Ų61.855%0.5529%0.291SS..Hα-helixtrans-63.1-39.4174.8-69.6173.7000111.7I161 F162 L168 L169I161-L165 HydrophobicContact CG2-CD1 3.83Å; I161-L165 HydrophobicContact CG2-CG 4.25Å; I161-L165 WeakPolarHBondContact O-CG 3.37Å; I161-L165 PolarHBondContact O-N 2.99Å; F162-L165 PolarHBondContact O-N 3.23Å; L165-L168 PolarHBondContact O-N 3.49Å; L165-L169 VanDerWaalsContact O-CB 3.3Å; L165-L169 WeakPolarHBondContact O-CB 3.41Å; L165-L169 PolarHBondContact O-N 3.23Å
166L96Very high92.9Very high39 Ų3965.4 Ų65.420%0.20431%0.307CS..Hα-helixtrans-65.6-40.9176.3-167.166.7000111.6Y131 F162 S163 W164 L169 F170Y131-L166 HydrophobicContact CD2-CB 4.37Å; Y131-L166 HydrophobicContact CD2-CD2 4.11Å; Y131-L166 HydrophobicContact CD2-CG 4.36Å; Y131-L166 HydrophobicContact CE2-CB 4.29Å; Y131-L166 HydrophobicContact CE2-CD2 3.73Å; Y131-L166 HydrophobicContact CE2-CG 3.85Å; F162-L166 HydrophobicContact CE1-CD2 4.24Å; F162-L166 WeakPolarHBondContact O-CB 3.4Å; F162-L166 PolarHBondContact O-N 2.92Å; S163-L166 PolarHBondContact O-N 3.43Å; W164-L166 VanDerWaalsContact C-N 3.33Å; W164-L166 PolarHBondContact O-N 3.05Å; L166-L169 PolarHBondContact O-N 2.97Å; L166-F170 HydrophobicContact CD1-CD1 4.03Å; L166-F170 HydrophobicContact CD1-CD2 4.46Å; L166-F170 HydrophobicContact CD1-CE1 3.57Å; L166-F170 HydrophobicContact CD1-CE2 4.04Å; L166-F170 HydrophobicContact CD1-CG 4.47Å; L166-F170 HydrophobicContact CD1-CZ 3.58Å; L166-F170 HydrophobicContact CD2-CE2 4.45Å; L166-F170 HydrophobicContact CG-CD2 4.32Å; L166-F170 HydrophobicContact CG-CE1 4.4Å; L166-F170 HydrophobicContact CG-CE2 4.16Å; L166-F170 HydrophobicContact CG-CZ 4.21Å; L166-F170 WeakPolarHBondContact O-CB 3.49Å; L166-F170 PolarHBondContact O-N 3.36Å
167S96.8Very high93.3Very high0 Ų066.4 Ų66.40%031%0.312CS..Hα-helixtrans-61.9-44173.8-55.90000112.3F127 A128 Y131 S163 W164 S171F127-S167 VanDerWaalsContact C-OG 3.25Å; F127-S167 PolarHBondContact O-OG 2.89Å; A128-S167 WeakPolarHBondContact CA-OG 3.47Å; A128-S167 PolarHBondContact N-OG 3.29Å; Y131-S167 WeakPolarHBondContact CD2-OG 3.46Å; S163-S167 PolarHBondContact O-N 2.92Å; S163-S167 PolarHBondContact O-OG 3.15Å; W164-S167 PolarHBondContact O-N 3.22Å; S167-S171 WeakPolarHBondContact O-CB 3.37Å; S167-S171 PolarHBondContact O-N 2.92Å; S167-S171 PolarHBondContact O-OG 3.41Å
168L96.1Very high93.5Very high67 Ų6759.6 Ų59.635%0.35129%0.287SS..Hα-helixtrans-63.1-42.5175.7-71.4166.2000111.9Y120 V124 W164 L165Y120-L168 HydrophobicContact CE1-CD2 4.39Å; Y120-L168 WeakPolarHBondContact OH-CA 3.34Å; Y120-L168 WeakPolarHBondContact OH-CD2 3.29Å; Y120-L168 PolarHBondContact OH-O 2.7Å; V124-L168 HydrophobicContact CG1-CD2 3.89Å; V124-L168 HydrophobicContact CG2-CD2 4.09Å; W164-L168 WeakPolarHBondContact O-CG 3.31Å; W164-L168 PolarHBondContact O-N 2.95Å; L165-L168 PolarHBondContact O-N 3.49Å
169L96Very high93.6Very high104 Ų10453.7 Ų53.755%0.54526%0.262SS..Hα-helixtrans-67.2-49.7179.818062.7000112.2L165 L166 S171 T172L165-L169 VanDerWaalsContact O-CB 3.3Å; L165-L169 WeakPolarHBondContact O-CB 3.41Å; L165-L169 PolarHBondContact O-N 3.23Å; L166-L169 PolarHBondContact O-N 2.97Å; L169-S171 PolarHBondContact O-N 3.44Å; L169-T172 WeakPolarHBondContact O-CB 3.38Å; L169-T172 VanDerWaalsContact O-CG2 3.26Å; L169-T172 WeakPolarHBondContact O-CG2 3.16Å; L169-T172 PolarHBondContact O-N 2.88Å; L169-T172 VanDerWaalsContact O-N 3.11Å; L169-T172 PolarHBondContact O-OG1 3.07Å
170F95.1Very high93.6Very high54 Ų5451.4 Ų51.424%0.23726%0.256CS..Hα-helixtrans-71.9-16.4-177-75.28.2000113.4F127 Y131 L166 P173 W206 T210F127-F170 HydrophobicContact CD2-CB 4.41Å; F127-F170 HydrophobicContact CE1-CB 4.11Å; F127-F170 HydrophobicContact CE1-CD2 4.22Å; F127-F170 HydrophobicContact CE2-CB 3.99Å; F127-F170 HydrophobicContact CZ-CB 3.84Å; Y131-F170 HydrophobicContact CE2-CD2 4.39Å; Y131-F170 VanDerWaalsContact OH-CD2 3.32Å; Y131-F170 WeakPolarHBondContact OH-CD2 3.36Å; L166-F170 HydrophobicContact CD1-CD1 4.03Å; L166-F170 HydrophobicContact CD1-CD2 4.46Å; L166-F170 HydrophobicContact CD1-CE1 3.57Å; L166-F170 HydrophobicContact CD1-CE2 4.04Å; L166-F170 HydrophobicContact CD1-CG 4.47Å; L166-F170 HydrophobicContact CD1-CZ 3.58Å; L166-F170 HydrophobicContact CD2-CE2 4.45Å; L166-F170 HydrophobicContact CG-CD2 4.32Å; L166-F170 HydrophobicContact CG-CE1 4.4Å; L166-F170 HydrophobicContact CG-CE2 4.16Å; L166-F170 HydrophobicContact CG-CZ 4.21Å; L166-F170 WeakPolarHBondContact O-CB 3.49Å; L166-F170 PolarHBondContact O-N 3.36Å; F170-P173 WeakPolarHBondContact O-CD 3.48Å; F170-W206 HydrophobicContact CD1-CZ2 4.26Å; F170-W206 HydrophobicContact CD2-CZ2 4.02Å; F170-W206 HydrophobicContact CE1-CZ2 4.43Å; F170-W206 HydrophobicContact CE2-CH2 4.29Å; F170-W206 HydrophobicContact CE2-CZ2 4.21Å; F170-W206 HydrophobicContact CG-CZ2 4.05Å; F170-W206 HydrophobicContact CZ-CH2 4.28Å; F170-W206 HydrophobicContact CZ-CZ2 4.4Å; F170-T210 HydrophobicContact CD2-CG2 4.48Å; F170-T210 HydrophobicContact CE2-CG2 4.43Å
171S94.5Very high93.3Very high0 Ų056.9 Ų56.90%028%0.277CS..THydrogen-bonded Turntrans-81.1-12.6171.7-550000113.7Y120 V124 F127 S167 L169 P173 Q174Y120-S171 VanDerWaalsContact CD2-O 3.31Å; Y120-S171 WeakPolarHBondContact CD2-O 3.34Å; V124-S171 VanDerWaalsContact CA-OG 3.27Å; V124-S171 WeakPolarHBondContact CA-OG 3.4Å; V124-S171 VanDerWaalsContact CG2-CB 3.43Å; V124-S171 WeakPolarHBondContact CG2-OG 3.49Å; V124-S171 PolarHBondContact N-OG 3.05Å; F127-S171 WeakPolarHBondContact CD2-OG 3.23Å; S167-S171 WeakPolarHBondContact O-CB 3.37Å; S167-S171 PolarHBondContact O-N 2.92Å; S167-S171 PolarHBondContact O-OG 3.41Å; L169-S171 PolarHBondContact O-N 3.44Å; S171-P173 VanDerWaalsContact C-N 3.31Å; S171-P173 WeakPolarHBondContact O-CD 3.37Å; S171-P173 VanDerWaalsContact O-N 3.13Å; S171-Q174 WeakPolarHBondContact O-CB 3.27Å; S171-Q174 VanDerWaalsContact O-CG 3.29Å; S171-Q174 WeakPolarHBondContact O-CG 3.36Å; S171-Q174 PolarHBondContact O-N 2.88Å; S171-Q174 VanDerWaalsContact O-N 3.09Å
172T93.2Very high93Very high57 Ų5757.9 Ų57.935%0.3528%0.28SS..THydrogen-bonded Turntrans-53.1-32.1-175.853.60000115.9L169 Q174 M175 F176L169-T172 WeakPolarHBondContact O-CB 3.38Å; L169-T172 VanDerWaalsContact O-CG2 3.26Å; L169-T172 WeakPolarHBondContact O-CG2 3.16Å; L169-T172 PolarHBondContact O-N 2.88Å; L169-T172 VanDerWaalsContact O-N 3.11Å; L169-T172 PolarHBondContact O-OG1 3.07Å; T172-Q174 PolarHBondContact O-N 3.29Å; T172-Q174 VanDerWaalsContact O-N 3.11Å; T172-M175 PolarHBondContact O-N 3.37Å; T172-F176 WeakPolarHBondContact O-CD2 3.45Å
173P91.7Very high92.4Very high44 Ų4456.1 Ų56.129%0.28628%0.277SS..THydrogen-bonded Turntrans-57.9-26.8177.1-26.637000114.3F170 S171 M175 F176 I177F170-P173 WeakPolarHBondContact O-CD 3.48Å; S171-P173 VanDerWaalsContact C-N 3.31Å; S171-P173 WeakPolarHBondContact O-CD 3.37Å; S171-P173 VanDerWaalsContact O-N 3.13Å; P173-M175 VanDerWaalsContact C-N 3.29Å; P173-M175 PolarHBondContact O-N 2.83Å; P173-F176 PolarHBondContact O-N 3.44Å; P173-F176 VanDerWaalsContact O-N 3.17Å; P173-I177 HydrophobicContact CB-CD1 3.85Å; P173-I177 WeakPolarHBondContact O-CG1 3.24Å; P173-I177 PolarHBondContact O-N 2.91Å
174Q90.6Very high91.7Very high3 Ų357 Ų571%0.01429%0.289CS..Hα-helixtrans-56.6-41.6179.7-63.1-56.9-49.100112.9Y120 V123 S171 T172 F176 I177 F178 Y203Y120-Q174 HydrophobicContact CD2-CB 4.33Å; V123-Q174 HydrophobicContact CB-CG 3.84Å; V123-Q174 HydrophobicContact CG1-CG 4.26Å; V123-Q174 HydrophobicContact CG2-CG 3.89Å; S171-Q174 WeakPolarHBondContact O-CB 3.27Å; S171-Q174 VanDerWaalsContact O-CG 3.29Å; S171-Q174 WeakPolarHBondContact O-CG 3.36Å; S171-Q174 PolarHBondContact O-N 2.88Å; S171-Q174 VanDerWaalsContact O-N 3.09Å; T172-Q174 PolarHBondContact O-N 3.29Å; T172-Q174 VanDerWaalsContact O-N 3.11Å; Q174-F176 PolarHBondContact O-N 2.9Å; Q174-I177 PolarHBondContact O-N 3.25Å; Q174-F178 PolarHBondContact O-N 3.49Å; Q174-F178 VanDerWaalsContact O-N 3.08Å; Q174-Y203 VanDerWaalsContact NE2-CE2 3.26Å; Q174-Y203 PolarHBondContact NE2-OH 2.94Å
175M89.8Confident90.9Very high68 Ų6860.3 Ų60.334%0.33532%0.32SS..Hα-helixtrans-64.6-23.9-176.5-68.5-62.7-62.700112.9R116 Y120 T172 P173R116-M175 HydrophobicContact CB-CE 3.82Å; R116-M175 HydrophobicContact CB-SD 3.89Å; R116-M175 PolarHBondContact NH1-O 3.47Å; Y120-M175 VanDerWaalsContact CB-SD 3.59Å; Y120-M175 HydrophobicContact CD2-CG 3.82Å; Y120-M175 HydrophobicContact CD2-SD 4.37Å; Y120-M175 HydrophobicContact CG-CG 4.01Å; Y120-M175 HydrophobicContact CG-SD 3.94Å; T172-M175 PolarHBondContact O-N 3.37Å; P173-M175 VanDerWaalsContact C-N 3.29Å; P173-M175 PolarHBondContact O-N 2.83Å
176F90.4Very high90.1Very high169 Ų16958.1 Ų58.174%0.74132%0.323SS*.Hα-helixtrans-99.7-33.8-178.3-56.5-74.3000112.7T172 P173 Q174T172-F176 WeakPolarHBondContact O-CD2 3.45Å; P173-F176 PolarHBondContact O-N 3.44Å; P173-F176 VanDerWaalsContact O-N 3.17Å; Q174-F176 PolarHBondContact O-N 2.9Å
177I90.1Very high89.6Confident27 Ų2758.6 Ų58.614%0.13833%0.327CS..Hα-helixtrans-78.5-42.8-178.4-65.5165.1000111.6P173 Q174 G192 D193 F194 Y203P173-I177 HydrophobicContact CB-CD1 3.85Å; P173-I177 WeakPolarHBondContact O-CG1 3.24Å; P173-I177 PolarHBondContact O-N 2.91Å; Q174-I177 PolarHBondContact O-N 3.25Å; I177-G192 WeakPolarHBondContact O-CA 3.46Å; I177-D193 PolarHBondContact O-N 3.33Å; I177-F194 HydrophobicContact CD1-CE1 4.12Å; I177-F194 HydrophobicContact CG1-CE1 4.33Å; I177-F194 HydrophobicContact CG2-CD1 4.33Å; I177-F194 HydrophobicContact CG2-CE1 3.72Å; I177-F194 HydrophobicContact CG2-CE2 4.25Å; I177-F194 HydrophobicContact CG2-CZ 3.67Å; I177-Y203 HydrophobicContact CD1-CD2 3.82Å; I177-Y203 HydrophobicContact CD1-CE2 4.31Å; I177-Y203 HydrophobicContact CD1-CG 4.26Å
178F89.9Confident89.1Confident30 Ų3064.5 Ų64.513%0.13235%0.35CS..EExtended strand (participates in β ladder)trans-96.8140.5-175-68.5-86.9000112R116 K119 Q174 W191R116-F178 WeakPolarHBondContact CG-O 3.28Å; R116-F178 PolarHBondContact NH1-O 2.99Å; K119-F178 HydrophobicContact CB-CB 4.02Å; K119-F178 HydrophobicContact CB-CD2 4.16Å; K119-F178 HydrophobicContact CB-CG 4.05Å; K119-F178 HydrophobicContact CD-CD1 4.14Å; K119-F178 HydrophobicContact CD-CE1 4.46Å; K119-F178 HydrophobicContact CD-CG 4.3Å; K119-F178 HydrophobicContact CG-CB 3.84Å; K119-F178 HydrophobicContact CG-CD1 4.07Å; K119-F178 HydrophobicContact CG-CD2 4.37Å; K119-F178 HydrophobicContact CG-CG 3.82Å; Q174-F178 PolarHBondContact O-N 3.49Å; Q174-F178 VanDerWaalsContact O-N 3.08Å; F178-W191 WeakPolarHBondContact CA-O 3.34Å
179S92.1Very high88.6Confident7 Ų761.8 Ų61.85%0.04934%0.336CS..EExtended strand (participates in β ladder)trans-159.3160.3177.952.30000111.3D112 R116 R181 C190 W191D112-S179 WeakPolarHBondContact OD1-CA 3.47Å; D112-S179 WeakPolarHBondContact OD1-CB 3.3Å; R116-S179 VanDerWaalsContact NH2-CB 3.29Å; S179-R181 PolarHBondContact O-N 3.36Å; S179-R181 WeakPolarHBondContact OG-CG 3.36Å; S179-R181 PolarHBondContact OG-NE 2.92Å; S179-C190 CarbonylContact O-C 3.52Å; S179-W191 PolarHBondContact N-O 3.38Å; S179-W191 PolarHBondContact O-N 2.89Å
180L90.4Very high88.3Confident49 Ų4957.1 Ų57.126%0.25731%0.312SS..EExtended strand (participates in β ladder)trans-71.1117.3169-173.268.6000108.7F108 D112 D189F108-L180 HydrophobicContact CD1-CD1 3.97Å; D112-L180 HydrophobicContact CB-CB 3.92Å; D112-L180 PolarHBondContact OD1-N 3.29Å; L180-D189 WeakPolarHBondContact CA-O 3.38Å
181R87.4Confident87.8Confident118 Ų11861.8 Ų61.845%0.44533%0.328SS..EExtended strand (participates in β ladder)trans-131.1154.1-176.4-66.6-58.8-153.3166.411.7110.7S179 Y188 D189 W191 D193S179-R181 PolarHBondContact O-N 3.36Å; S179-R181 WeakPolarHBondContact OG-CG 3.36Å; S179-R181 PolarHBondContact OG-NE 2.92Å; R181-Y188 CarbonylContact O-C 3.56Å; R181-Y188 VanDerWaalsContact O-CA 3.31Å; R181-Y188 WeakPolarHBondContact O-CA 3.32Å; R181-D189 PolarHBondContact N-O 3.5Å; R181-D189 PolarHBondContact O-N 2.88Å; R181-W191 HydrophobicContact CB-CB 4.25Å; R181-D193 IonicContact CZ-OD2 3.12Å; R181-D193 IonicContact NE-OD2 3.9Å; R181-D193 IonicContact NH2-OD2 2.86Å; R181-D193 PolarHBondContact NH2-OD2 2.99Å
182E87.5Confident87.4Confident102 Ų10262.4 Ų62.448%0.47733%0.334SS..EExtended strand (participates in β ladder)trans-79119.1169.7-166.8166.8163.500108.9G184 G186 V187 Y188E182-G184 WeakPolarHBondContact CG-O 3.26Å; E182-G186 PolarHBondContact OE1-N 3.1Å; E182-V187 CarbonylContact C-O 3.53Å; E182-V187 WeakPolarHBondContact CA-O 3.34Å; E182-Y188 HydrophobicContact CB-CD1 4.07Å; E182-Y188 HydrophobicContact CB-CE1 3.72Å; E182-Y188 HydrophobicContact CG-CE1 4.21Å; E182-Y188 PolarHBondContact OE2-OH 3.11Å
183V83.4Confident86.9Confident70 Ų7063 Ų6342%0.42434%0.336SS..EExtended strand (participates in β ladder)trans-103.9-11.7-176-1730000111.4V187 D189 W191V183-V187 PolarHBondContact N-O 3.15Å; V183-D189 HydrophobicContact CG2-CB 3.71Å; V183-W191 HydrophobicContact CG2-CB 4.29Å; V183-W191 HydrophobicContact CG2-CE3 4.44Å; V183-W191 HydrophobicContact CG2-CG 4.49Å
184G81.1Confident86.7Confident34 Ų3464 Ų6435%0.35134%0.336SS..EExtended strand (participates in β ladder)trans-166.6171.6172.300000109.3E182 G186 V187E182-G184 WeakPolarHBondContact CG-O 3.26Å; G184-G186 PolarHBondContact O-N 3.48Å; G184-V187 WeakPolarHBondContact O-CB 3.35Å; G184-V187 PolarHBondContact O-N 3.3Å
185S80.6Confident86.3Confident119 Ų11970.1 Ų70.183%0.83237%0.373SS*.THydrogen-bonded Turntrans-52.1104.3-172.455.20000113.7V187S185-V187 VanDerWaalsContact C-N 3.33Å
186G79.9Confident86.3Confident59 Ų5972.3 Ų72.361%0.60838%0.381SS*.THydrogen-bonded Turntrans75.512-177.200000115.5E182 G184E182-G186 PolarHBondContact OE1-N 3.1Å; G184-G186 PolarHBondContact O-N 3.48Å
187V84.7Confident86Confident49 Ų4970.2 Ų70.230%0.29738%0.384SS..EExtended strand (participates in β ladder)trans-114.2106.8-170.7178.60000110.6E182 V183 G184 S185E182-V187 CarbonylContact C-O 3.53Å; E182-V187 WeakPolarHBondContact CA-O 3.34Å; V183-V187 PolarHBondContact N-O 3.15Å; G184-V187 WeakPolarHBondContact O-CB 3.35Å; G184-V187 PolarHBondContact O-N 3.3Å; S185-V187 VanDerWaalsContact C-N 3.33Å
188Y86.1Confident85.9Confident124 Ų12477 Ų7749%0.48641%0.408SS..EExtended strand (participates in β ladder)trans-93.2142.5-179.9-63.6-80.7000112.9R181 E182R181-Y188 CarbonylContact O-C 3.56Å; R181-Y188 VanDerWaalsContact O-CA 3.31Å; R181-Y188 WeakPolarHBondContact O-CA 3.32Å; E182-Y188 HydrophobicContact CB-CD1 4.07Å; E182-Y188 HydrophobicContact CB-CE1 3.72Å; E182-Y188 HydrophobicContact CG-CE1 4.21Å; E182-Y188 PolarHBondContact OE2-OH 3.11Å
189D87.2Confident85.8Confident11 Ų1176.1 Ų76.16%0.05941%0.407CS..EExtended strand (participates in β ladder)trans-151.4159.6173.9-133.6-25.5000112.7W102 R107 F108 L180 R181 V183 W191W102-D189 WeakPolarHBondContact CH2-OD1 3.42Å; W102-D189 WeakPolarHBondContact CZ2-OD1 3.5Å; R107-D189 IonicContact NH1-OD2 3.98Å; R107-D189 PolarHBondContact NH1-OD2 3.37Å; F108-D189 WeakPolarHBondContact CB-OD1 3.43Å; F108-D189 PolarHBondContact N-OD1 3.5Å; L180-D189 WeakPolarHBondContact CA-O 3.38Å; R181-D189 PolarHBondContact N-O 3.5Å; R181-D189 PolarHBondContact O-N 2.88Å; V183-D189 HydrophobicContact CG2-CB 3.71Å; D189-W191 PolarHBondContact O-N 2.9Å; D189-W191 VanDerWaalsContact O-N 3.13Å
190C88.6Confident85.6Confident5 Ų577.4 Ų77.43%0.03442%0.418CS..EExtended strand (participates in β ladder)trans-83.588179.3178.90000110.9W102 F108 C115 S179W102-C190 HydrophobicContact CH2-CB 3.69Å; W102-C190 HydrophobicContact CZ3-CB 3.74Å; F108-C190 HydrophobicContact CB-CB 3.81Å; F108-C190 HydrophobicContact CD1-CB 4.02Å; F108-C190 HydrophobicContact CD2-CB 4Å; F108-C190 HydrophobicContact CG-CB 3.65Å; C115-C190 VanDerWaalsContact CA-SG 3.55Å; C115-C190 HydrophobicContact CB-CB 3.68Å; C115-C190 WeakPolarHBondContact CB-SG 3.44Å; C115-C190 VanDerWaalsContact SG-CA 3.56Å; C115-C190 WeakPolarHBondContact SG-CB 3.07Å; C115-C190 CovalentContact SG-SG 2.03Å; C115-C190 PolarHBondContact SG-SG 3.45Å; S179-C190 CarbonylContact O-C 3.52Å
191W85.4Confident85.6Confident152 Ų15278.7 Ų78.758%0.57642%0.422SS*.EExtended strand (participates in β ladder)trans-106.2155.2-168.8-163.7-97.7000113.2F178 S179 R181 V183 D189F178-W191 WeakPolarHBondContact CA-O 3.34Å; S179-W191 PolarHBondContact N-O 3.38Å; S179-W191 PolarHBondContact O-N 2.89Å; R181-W191 HydrophobicContact CB-CB 4.25Å; V183-W191 HydrophobicContact CG2-CB 4.29Å; V183-W191 HydrophobicContact CG2-CE3 4.44Å; V183-W191 HydrophobicContact CG2-CG 4.49Å; D189-W191 PolarHBondContact O-N 2.9Å; D189-W191 VanDerWaalsContact O-N 3.13Å
192G86Confident85.8Confident13 Ų1375.3 Ų75.313%0.13442%0.419CS..EExtended strand (participates in β ladder)trans-95.5118.4176.100000111.6I177I177-G192 WeakPolarHBondContact O-CA 3.46Å
193D82.3Confident86Confident71 Ų7172.6 Ų72.638%0.3841%0.405SS..  trans-105.2123.7-178.2-1734.9000110.5I177 R181I177-D193 PolarHBondContact O-N 3.33Å; R181-D193 IonicContact CZ-OD2 3.12Å; R181-D193 IonicContact NE-OD2 3.9Å; R181-D193 IonicContact NH2-OD2 2.86Å; R181-D193 PolarHBondContact NH2-OD2 2.99Å
194F86.3Confident86.3Confident65 Ų6570.4 Ų70.429%0.28539%0.391SS..  trans-117.6101.1-176.9-68.6-77.8000110.5I177 K196 A200 Y203I177-F194 HydrophobicContact CD1-CE1 4.12Å; I177-F194 HydrophobicContact CG1-CE1 4.33Å; I177-F194 HydrophobicContact CG2-CD1 4.33Å; I177-F194 HydrophobicContact CG2-CE1 3.72Å; I177-F194 HydrophobicContact CG2-CE2 4.25Å; I177-F194 HydrophobicContact CG2-CZ 3.67Å; F194-K196 PolarHBondContact O-N 2.9Å; F194-A200 HydrophobicContact CD2-CB 3.94Å; F194-A200 HydrophobicContact CE2-CB 3.88Å; F194-A200 HydrophobicContact CG-CB 4.3Å; F194-A200 HydrophobicContact CZ-CB 4.19Å; F194-Y203 HydrophobicContact CE1-CD1 4.26Å; F194-Y203 HydrophobicContact CE1-CG 4.11Å; F194-Y203 AromaticContact CZ-CD1 3.81Å; F194-Y203 HydrophobicContact CZ-CD1 3.81Å; F194-Y203 HydrophobicContact CZ-CG 4.13Å
195V83.6Confident86.9Confident130 Ų13070.4 Ų70.479%0.78838%0.384SS*.SBendtrans-53.2-21.2179.9-176.10000114.1
196K88.4Confident87.5Confident115 Ų11569.8 Ų69.850%0.536%0.363SS..SBendtrans-128.3143.7177.9-62.2-62.9176.7-168.10110.6F194 W198 G199F194-K196 PolarHBondContact O-N 2.9Å; K196-W198 HydrophobicContact CB-CD2 4.04Å; K196-W198 HydrophobicContact CB-CG 4.32Å; K196-W198 HydrophobicContact CB-CZ2 4Å; K196-W198 HydrophobicContact CG-CZ2 3.92Å; K196-W198 PolarHBondContact O-N 3.02Å; K196-G199 WeakPolarHBondContact O-CA 3.47Å; K196-G199 PolarHBondContact O-N 3.46Å
197P84.8Confident88.1Confident124 Ų12467.6 Ų67.681%0.80534%0.338SS*.THydrogen-bonded Turntrans-64.4-24-176.825.8-35.4000113.6G199P197-G199 VanDerWaalsContact C-N 3.32Å
198W87.3Confident88.6Confident169 Ų16965.4 Ų65.464%0.6432%0.324SS*.THydrogen-bonded Turntrans-81.7-7.3172.354.7-104.7000113.7K196 A200 K201 A202K196-W198 HydrophobicContact CB-CD2 4.04Å; K196-W198 HydrophobicContact CB-CG 4.32Å; K196-W198 HydrophobicContact CB-CZ2 4Å; K196-W198 HydrophobicContact CG-CZ2 3.92Å; K196-W198 PolarHBondContact O-N 3.02Å; W198-A200 PolarHBondContact O-N 3.09Å; W198-K201 PolarHBondContact O-N 3.42Å; W198-A202 HydrophobicContact CE3-CB 3.89Å; W198-A202 HydrophobicContact CZ3-CB 4.15Å; W198-A202 WeakPolarHBondContact O-CB 3.44Å; W198-A202 PolarHBondContact O-N 2.8Å
199G89.1Confident89Confident12 Ų1263 Ų6312%0.12432%0.319CS..Hα-helixtrans-60.1-47.2-173.200000113.2K196 P197 K201 A202 Y203K196-G199 WeakPolarHBondContact O-CA 3.47Å; K196-G199 PolarHBondContact O-N 3.46Å; P197-G199 VanDerWaalsContact C-N 3.32Å; G199-K201 VanDerWaalsContact C-N 3.35Å; G199-K201 PolarHBondContact O-N 3.36Å; G199-A202 PolarHBondContact O-N 2.68Å; G199-Y203 VanDerWaalsContact O-CB 3.27Å; G199-Y203 WeakPolarHBondContact O-CB 3.42Å; G199-Y203 PolarHBondContact O-N 3.33Å
200A87.3Confident89.4Confident34 Ų3462.8 Ų62.828%0.28132%0.318SS..Hα-helixtrans-61.8-41.6176.800000112.1F194 W198 Y203 I204F194-A200 HydrophobicContact CD2-CB 3.94Å; F194-A200 HydrophobicContact CE2-CB 3.88Å; F194-A200 HydrophobicContact CG-CB 4.3Å; F194-A200 HydrophobicContact CZ-CB 4.19Å; W198-A200 PolarHBondContact O-N 3.09Å; A200-Y203 PolarHBondContact O-N 3.47Å; A200-I204 WeakPolarHBondContact O-CB 3.3Å; A200-I204 WeakPolarHBondContact O-CG1 3.49Å; A200-I204 PolarHBondContact O-N 3.44Å
201K90.3Very high89.6Confident77 Ų7762.5 Ų62.534%0.33532%0.317SS..Hα-helixtrans-62.7-48.2176.6-61.3-169.1179.2-170.40111.5W198 G199 T205 A298 W299W198-K201 PolarHBondContact O-N 3.42Å; G199-K201 VanDerWaalsContact C-N 3.35Å; G199-K201 PolarHBondContact O-N 3.36Å; K201-T205 WeakPolarHBondContact O-CB 3.29Å; K201-T205 PolarHBondContact O-N 3.01Å; K201-T205 PolarHBondContact O-OG1 2.91Å; K201-A298 WeakPolarHBondContact CE-O 3.3Å; K201-A298 WeakPolarHBondContact CG-O 3.41Å; K201-W299 HydrophobicContact CD-CE3 4.37Å
202A92.5Very high90Very high47 Ų4757 Ų5739%0.38830%0.296SS..Hα-helixtrans-62.7-44.1177.800000111.8W198 G199 W206W198-A202 HydrophobicContact CE3-CB 3.89Å; W198-A202 HydrophobicContact CZ3-CB 4.15Å; W198-A202 WeakPolarHBondContact O-CB 3.44Å; W198-A202 PolarHBondContact O-N 2.8Å; G199-A202 PolarHBondContact O-N 2.68Å; A202-W206 VanDerWaalsContact O-CB 3.27Å; A202-W206 WeakPolarHBondContact O-CB 3.25Å; A202-W206 PolarHBondContact O-N 3.31Å
203Y91Very high90.5Very high44 Ų4460.4 Ų60.417%0.17331%0.311CS..Hα-helixtrans-61.7-53.1177.8168.2-109.7000112.5Q174 I177 F194 G199 A200 T205 W206 I207Q174-Y203 VanDerWaalsContact NE2-CE2 3.26Å; Q174-Y203 PolarHBondContact NE2-OH 2.94Å; I177-Y203 HydrophobicContact CD1-CD2 3.82Å; I177-Y203 HydrophobicContact CD1-CE2 4.31Å; I177-Y203 HydrophobicContact CD1-CG 4.26Å; F194-Y203 HydrophobicContact CE1-CD1 4.26Å; F194-Y203 HydrophobicContact CE1-CG 4.11Å; F194-Y203 AromaticContact CZ-CD1 3.81Å; F194-Y203 HydrophobicContact CZ-CD1 3.81Å; F194-Y203 HydrophobicContact CZ-CG 4.13Å; G199-Y203 VanDerWaalsContact O-CB 3.27Å; G199-Y203 WeakPolarHBondContact O-CB 3.42Å; G199-Y203 PolarHBondContact O-N 3.33Å; A200-Y203 PolarHBondContact O-N 3.47Å; Y203-T205 VanDerWaalsContact C-N 3.29Å; Y203-T205 PolarHBondContact O-N 3.25Å; Y203-W206 WeakPolarHBondContact O-CB 3.45Å; Y203-W206 PolarHBondContact O-N 2.99Å; Y203-I207 HydrophobicContact CD2-CG1 4Å; Y203-I207 HydrophobicContact CE2-CD1 3.85Å; Y203-I207 HydrophobicContact CE2-CG1 3.48Å; Y203-I207 VanDerWaalsContact CE2-CG1 3.48Å; Y203-I207 WeakPolarHBondContact O-CG1 3.19Å; Y203-I207 PolarHBondContact O-N 3.41Å
204I90.5Very high91.2Very high25 Ų2561.2 Ų61.213%0.12831%0.314CS..Hα-helixtrans-64.1-38.1-179.3-68.2168.3000110.9A200 S208 Q294 A298A200-I204 WeakPolarHBondContact O-CB 3.3Å; A200-I204 WeakPolarHBondContact O-CG1 3.49Å; A200-I204 PolarHBondContact O-N 3.44Å; I204-S208 VanDerWaalsContact O-CB 3.29Å; I204-S208 WeakPolarHBondContact O-CB 3.26Å; I204-S208 PolarHBondContact O-N 3.49Å; I204-S208 PolarHBondContact O-OG 3.42Å; I204-Q294 HydrophobicContact CG2-CB 3.97Å; I204-Q294 WeakPolarHBondContact CG2-O 3.49Å; I204-A298 HydrophobicContact CB-CB 3.96Å; I204-A298 HydrophobicContact CD1-CB 3.71Å; I204-A298 HydrophobicContact CG1-CB 4.43Å; I204-A298 HydrophobicContact CG2-CB 3.88Å
205T93.3Very high91.7Very high33 Ų3358.2 Ų58.220%0.20230%0.301CS..Hα-helixtrans-64.6-44.3175.2-55.30000111.2K201 Y203 S208 L209 W299K201-T205 WeakPolarHBondContact O-CB 3.29Å; K201-T205 PolarHBondContact O-N 3.01Å; K201-T205 PolarHBondContact O-OG1 2.91Å; Y203-T205 VanDerWaalsContact C-N 3.29Å; Y203-T205 PolarHBondContact O-N 3.25Å; T205-S208 PolarHBondContact O-N 3.47Å; T205-L209 HydrophobicContact CG2-CD1 3.95Å; T205-L209 HydrophobicContact CG2-CG 4.35Å; T205-L209 WeakPolarHBondContact O-CB 3.34Å; T205-L209 VanDerWaalsContact O-CG 3.26Å; T205-L209 WeakPolarHBondContact O-CG 3.38Å; T205-L209 PolarHBondContact O-N 2.89Å; T205-W299 PolarHBondContact OG1-NE1 3.47Å
206W94.1Very high92.2Very high106 Ų10653.1 Ų53.140%0.40227%0.27SS..Hα-helixtrans-59.1-49.3176.6170-104.2000112.8F170 A202 Y203 L209 T210F170-W206 HydrophobicContact CD1-CZ2 4.26Å; F170-W206 HydrophobicContact CD2-CZ2 4.02Å; F170-W206 HydrophobicContact CE1-CZ2 4.43Å; F170-W206 HydrophobicContact CE2-CH2 4.29Å; F170-W206 HydrophobicContact CE2-CZ2 4.21Å; F170-W206 HydrophobicContact CG-CZ2 4.05Å; F170-W206 HydrophobicContact CZ-CH2 4.28Å; F170-W206 HydrophobicContact CZ-CZ2 4.4Å; A202-W206 VanDerWaalsContact O-CB 3.27Å; A202-W206 WeakPolarHBondContact O-CB 3.25Å; A202-W206 PolarHBondContact O-N 3.31Å; Y203-W206 WeakPolarHBondContact O-CB 3.45Å; Y203-W206 PolarHBondContact O-N 2.99Å; W206-L209 PolarHBondContact O-N 3.49Å; W206-T210 HydrophobicContact CD2-CG2 3.89Å; W206-T210 HydrophobicContact CE3-CG2 3.85Å; W206-T210 HydrophobicContact CH2-CG2 3.73Å; W206-T210 HydrophobicContact CZ2-CG2 3.76Å; W206-T210 HydrophobicContact CZ3-CG2 3.77Å; W206-T210 WeakPolarHBondContact O-CB 3.49Å; W206-T210 WeakPolarHBondContact O-CG2 3.29Å; W206-T210 PolarHBondContact O-N 3.42Å; W206-T210 PolarHBondContact O-OG1 3.37Å
207I91.9Very high92.7Very high14 Ų1449.9 Ų49.97%0.07227%0.265CS..Hα-helixtrans-64.4-44.2178.7-60.2-63.2000110.2V123 F127 Y203 L209 T210 I211 F291V123-I207 HydrophobicContact CG1-CD1 4.32Å; F127-I207 HydrophobicContact CE2-CD1 4.08Å; F127-I207 HydrophobicContact CZ-CD1 4.06Å; Y203-I207 HydrophobicContact CD2-CG1 4Å; Y203-I207 HydrophobicContact CE2-CD1 3.85Å; Y203-I207 HydrophobicContact CE2-CG1 3.48Å; Y203-I207 VanDerWaalsContact CE2-CG1 3.48Å; Y203-I207 WeakPolarHBondContact O-CG1 3.19Å; Y203-I207 PolarHBondContact O-N 3.41Å; I207-L209 VanDerWaalsContact C-N 3.34Å; I207-L209 PolarHBondContact O-N 2.89Å; I207-T210 PolarHBondContact O-N 3.33Å; I207-I211 HydrophobicContact CG2-CD1 3.63Å; I207-I211 HydrophobicContact CG2-CG1 4.11Å; I207-I211 WeakPolarHBondContact O-CB 3.27Å; I207-I211 PolarHBondContact O-N 3.48Å; I207-F291 HydrophobicContact CG2-CE1 3.94Å; I207-F291 HydrophobicContact CG2-CZ 4.35Å
208S93.9Very high93.2Very high3 Ų346.8 Ų46.82%0.02124%0.241CC..Iπ-helixtrans-60.1-41.4176.4-56.70000112.5I204 T205 Y212 I213 F291 M295I204-S208 VanDerWaalsContact O-CB 3.29Å; I204-S208 WeakPolarHBondContact O-CB 3.26Å; I204-S208 PolarHBondContact O-N 3.49Å; I204-S208 PolarHBondContact O-OG 3.42Å; T205-S208 PolarHBondContact O-N 3.47Å; S208-Y212 WeakPolarHBondContact O-CA 3.05Å; S208-Y212 VanDerWaalsContact O-CB 3.32Å; S208-Y212 WeakPolarHBondContact O-CB 3.38Å; S208-Y212 PolarHBondContact O-N 2.96Å; S208-I213 PolarHBondContact O-N 3.38Å; S208-F291 WeakPolarHBondContact OG-CD1 3.49Å; S208-M295 VanDerWaalsContact CB-CE 3.44Å; S208-M295 WeakPolarHBondContact OG-CE 3.41Å
209L95.6Very high93.6Very high73 Ų7338.8 Ų38.838%0.38221%0.211SC..Iπ-helixtrans-65.6-47.9177.4-76.4170.2000111.9T205 W206 I207 I213 I214T205-L209 HydrophobicContact CG2-CD1 3.95Å; T205-L209 HydrophobicContact CG2-CG 4.35Å; T205-L209 WeakPolarHBondContact O-CB 3.34Å; T205-L209 VanDerWaalsContact O-CG 3.26Å; T205-L209 WeakPolarHBondContact O-CG 3.38Å; T205-L209 PolarHBondContact O-N 2.89Å; W206-L209 PolarHBondContact O-N 3.49Å; I207-L209 VanDerWaalsContact C-N 3.34Å; I207-L209 PolarHBondContact O-N 2.89Å; L209-I213 HydrophobicContact CD2-CB 4.19Å; L209-I213 HydrophobicContact CD2-CG1 4.25Å; L209-I213 HydrophobicContact CD2-CG2 4.33Å; L209-I213 PolarHBondContact O-N 2.87Å; L209-I214 WeakPolarHBondContact O-CB 3.48Å; L209-I214 WeakPolarHBondContact O-CG1 3.43Å; L209-I214 PolarHBondContact O-N 3.42Å
210T94.8Very high93.8Very high6 Ų641.6 Ų41.64%0.03723%0.228CC..Iπ-helixtrans-86.6-25.5-16855.20000114.5F127 Y131 F170 W206 I207 P215F127-T210 WeakPolarHBondContact CE1-OG1 3.22Å; F127-T210 WeakPolarHBondContact CZ-OG1 3.32Å; Y131-T210 WeakPolarHBondContact CE1-O 3.4Å; Y131-T210 PolarHBondContact OH-O 3.1Å; F170-T210 HydrophobicContact CD2-CG2 4.48Å; F170-T210 HydrophobicContact CE2-CG2 4.43Å; W206-T210 HydrophobicContact CD2-CG2 3.89Å; W206-T210 HydrophobicContact CE3-CG2 3.85Å; W206-T210 HydrophobicContact CH2-CG2 3.73Å; W206-T210 HydrophobicContact CZ2-CG2 3.76Å; W206-T210 HydrophobicContact CZ3-CG2 3.77Å; W206-T210 WeakPolarHBondContact O-CB 3.49Å; W206-T210 WeakPolarHBondContact O-CG2 3.29Å; W206-T210 PolarHBondContact O-N 3.42Å; W206-T210 PolarHBondContact O-OG1 3.37Å; I207-T210 PolarHBondContact O-N 3.33Å; T210-P215 WeakPolarHBondContact O-CD 3.38Å; T210-P215 WeakPolarHBondContact O-CG 3.42Å
211I93.6Very high94.1Very high0 Ų045 Ų450%024%0.241CC..Iπ-helixtrans-94.2-40173.3-57.5-169.8000111.1M126 F127 T130 I207 P215 Y283 F291M126-I211 HydrophobicContact CB-CD1 3.82Å; M126-I211 HydrophobicContact SD-CD1 4.32Å; F127-I211 HydrophobicContact CD1-CD1 4.15Å; F127-I211 HydrophobicContact CD1-CG1 3.67Å; F127-I211 HydrophobicContact CD2-CD1 4.22Å; F127-I211 HydrophobicContact CE1-CD1 4.03Å; F127-I211 HydrophobicContact CE1-CG1 3.38Å; F127-I211 HydrophobicContact CE2-CD1 4.12Å; F127-I211 HydrophobicContact CE2-CG1 4.35Å; F127-I211 HydrophobicContact CG-CD1 4.24Å; F127-I211 HydrophobicContact CG-CG1 4.26Å; F127-I211 HydrophobicContact CZ-CD1 4.02Å; F127-I211 HydrophobicContact CZ-CG1 3.76Å; T130-I211 HydrophobicContact CG2-CG2 4.36Å; T130-I211 WeakPolarHBondContact CG2-O 3.48Å; I207-I211 HydrophobicContact CG2-CD1 3.63Å; I207-I211 HydrophobicContact CG2-CG1 4.11Å; I207-I211 WeakPolarHBondContact O-CB 3.27Å; I207-I211 PolarHBondContact O-N 3.48Å; I211-P215 WeakPolarHBondContact O-CB 3.01Å; I211-P215 WeakPolarHBondContact O-CG 3.38Å; I211-Y283 PolarHBondContact O-OH 3.47Å; I211-F291 HydrophobicContact CB-CE2 4.27Å; I211-F291 HydrophobicContact CB-CZ 3.8Å; I211-F291 HydrophobicContact CG2-CE2 3.89Å; I211-F291 HydrophobicContact CG2-CZ 3.73Å
212Y94.4Very high94.3Very high35 Ų3541.9 Ų41.914%0.13723%0.228CC..Iπ-helixtrans-106.4-65.7-173.1-178.2-111.6000114.1S208 I214 P215 V216 Y283 W287 T288 F291S208-Y212 WeakPolarHBondContact O-CA 3.05Å; S208-Y212 VanDerWaalsContact O-CB 3.32Å; S208-Y212 WeakPolarHBondContact O-CB 3.38Å; S208-Y212 PolarHBondContact O-N 2.96Å; Y212-I214 PolarHBondContact O-N 3.39Å; Y212-P215 WeakPolarHBondContact O-CD 3.4Å; Y212-V216 HydrophobicContact CD2-CG2 3.77Å; Y212-V216 HydrophobicContact CE2-CG2 3.6Å; Y212-V216 HydrophobicContact CG-CG2 4.48Å; Y212-V216 WeakPolarHBondContact O-CB 3.2Å; Y212-V216 VanDerWaalsContact O-CG2 3.27Å; Y212-V216 WeakPolarHBondContact O-CG2 3.36Å; Y212-V216 PolarHBondContact O-N 3.38Å; Y212-Y283 HydrophobicContact CD2-CE1 4.5Å; Y212-W287 HydrophobicContact CD2-CB 3.93Å; Y212-W287 HydrophobicContact CE2-CB 4.3Å; Y212-T288 PolarHBondContact OH-OG1 3.14Å; Y212-F291 HydrophobicContact CD1-CB 4.11Å; Y212-F291 HydrophobicContact CD1-CD2 4.37Å; Y212-F291 HydrophobicContact CD1-CG 4.5Å; Y212-F291 HydrophobicContact CD2-CD2 4.05Å; Y212-F291 HydrophobicContact CG-CB 4.27Å; Y212-F291 AromaticContact CG-CD2 3.67Å; Y212-F291 HydrophobicContact CG-CD2 3.67Å; Y212-F291 HydrophobicContact CG-CE2 4.37Å; Y212-F291 HydrophobicContact CG-CG 4.2Å
213I95.9Very high94.2Very high86 Ų8640.3 Ų40.344%0.44121%0.212SC..Iπ-helixtrans-60.5-51.9-168.9-56.6-66.9000112.2S208 L209 V216 A217S208-I213 PolarHBondContact O-N 3.38Å; L209-I213 HydrophobicContact CD2-CB 4.19Å; L209-I213 HydrophobicContact CD2-CG1 4.25Å; L209-I213 HydrophobicContact CD2-CG2 4.33Å; L209-I213 PolarHBondContact O-N 2.87Å; I213-V216 PolarHBondContact O-N 3.48Å; I213-A217 WeakPolarHBondContact O-CB 3.32Å; I213-A217 PolarHBondContact O-N 3.08Å
214I96.5Very high94.2Very high88 Ų8840.2 Ų40.245%0.45123%0.225SC..Hα-helixtrans-65.8-49-177.9-68.2166.8000111L209 Y212 V216 A217 I218L209-I214 WeakPolarHBondContact O-CB 3.48Å; L209-I214 WeakPolarHBondContact O-CG1 3.43Å; L209-I214 PolarHBondContact O-N 3.42Å; Y212-I214 PolarHBondContact O-N 3.39Å; I214-V216 PolarHBondContact O-N 2.77Å; I214-A217 PolarHBondContact O-N 3.26Å; I214-I218 HydrophobicContact CG2-CD1 3.8Å; I214-I218 WeakPolarHBondContact O-CG1 3.47Å; I214-I218 PolarHBondContact O-N 3.49Å
215P96.1Very high94.3Very high2 Ų243.1 Ų43.11%0.01324%0.24CC..Hα-helixtrans-54.7-50.2172-35.544.8000113.5T130 Y131 V134 T210 I211 Y212 A217 I218 L219T130-P215 HydrophobicContact CG2-CB 3.78Å; T130-P215 HydrophobicContact CG2-CG 3.53Å; Y131-P215 HydrophobicContact CE1-CG 4.37Å; V134-P215 HydrophobicContact CG2-CB 3.67Å; V134-P215 HydrophobicContact CG2-CG 4.23Å; T210-P215 WeakPolarHBondContact O-CD 3.38Å; T210-P215 WeakPolarHBondContact O-CG 3.42Å; I211-P215 WeakPolarHBondContact O-CB 3.01Å; I211-P215 WeakPolarHBondContact O-CG 3.38Å; Y212-P215 WeakPolarHBondContact O-CD 3.4Å; P215-A217 VanDerWaalsContact C-N 3.31Å; P215-A217 PolarHBondContact O-N 3.27Å; P215-I218 PolarHBondContact O-N 3.28Å; P215-I218 VanDerWaalsContact O-N 3.13Å; P215-L219 WeakPolarHBondContact O-CB 3.37Å; P215-L219 WeakPolarHBondContact O-CG 3.4Å; P215-L219 PolarHBondContact O-N 3.49Å
216V96.1Very high94.1Very high23 Ų2341.6 Ų41.614%0.13923%0.231CC..Hα-helixtrans-61.2-37.6179.8172.10000112.2Y212 I213 I214 L219 S220 Y283 I284Y212-V216 HydrophobicContact CD2-CG2 3.77Å; Y212-V216 HydrophobicContact CE2-CG2 3.6Å; Y212-V216 HydrophobicContact CG-CG2 4.48Å; Y212-V216 WeakPolarHBondContact O-CB 3.2Å; Y212-V216 VanDerWaalsContact O-CG2 3.27Å; Y212-V216 WeakPolarHBondContact O-CG2 3.36Å; Y212-V216 PolarHBondContact O-N 3.38Å; I213-V216 PolarHBondContact O-N 3.48Å; I214-V216 PolarHBondContact O-N 2.77Å; V216-L219 PolarHBondContact O-N 3.48Å; V216-S220 VanDerWaalsContact O-CB 3.28Å; V216-S220 WeakPolarHBondContact O-CB 3.35Å; V216-S220 PolarHBondContact O-N 2.9Å; V216-S220 PolarHBondContact O-OG 3.03Å; V216-Y283 HydrophobicContact CG2-CD1 4.43Å; V216-Y283 HydrophobicContact CG2-CE1 4.21Å; V216-I284 HydrophobicContact CG1-CD1 4.25Å; V216-I284 HydrophobicContact CG1-CG1 4.33Å; V216-I284 HydrophobicContact CG2-CG1 3.92Å
217A96.9Very high93.8Very high47 Ų4739.9 Ų39.939%0.38824%0.235SC..Hα-helixtrans-62.4-48.517300000111.9I213 I214 P215 L219 S220 I221I213-A217 WeakPolarHBondContact O-CB 3.32Å; I213-A217 PolarHBondContact O-N 3.08Å; I214-A217 PolarHBondContact O-N 3.26Å; P215-A217 VanDerWaalsContact C-N 3.31Å; P215-A217 PolarHBondContact O-N 3.27Å; A217-L219 VanDerWaalsContact C-N 3.35Å; A217-L219 PolarHBondContact O-N 2.98Å; A217-S220 PolarHBondContact O-N 3.14Å; A217-I221 VanDerWaalsContact O-CG1 3.31Å; A217-I221 WeakPolarHBondContact O-CG1 3.46Å; A217-I221 PolarHBondContact O-N 2.95Å
218I96.4Very high93.6Very high59 Ų5944.7 Ų44.730%0.30326%0.256SS..Hα-helixtrans-61.9-43178.3-64.1164.3000111V134 V138 I214 P215 I221 C222V134-I218 HydrophobicContact CG1-CB 4.38Å; V134-I218 HydrophobicContact CG1-CD1 4.28Å; V134-I218 HydrophobicContact CG1-CG2 3.77Å; V138-I218 HydrophobicContact CG2-CG2 3.96Å; I214-I218 HydrophobicContact CG2-CD1 3.8Å; I214-I218 WeakPolarHBondContact O-CG1 3.47Å; I214-I218 PolarHBondContact O-N 3.49Å; P215-I218 PolarHBondContact O-N 3.28Å; P215-I218 VanDerWaalsContact O-N 3.13Å; I218-I221 PolarHBondContact O-N 3.26Å; I218-C222 WeakPolarHBondContact O-CB 3.16Å; I218-C222 PolarHBondContact O-N 2.92Å; I218-C222 PolarHBondContact O-SG 3.2Å
219L94.4Very high93.2Very high1 Ų147.8 Ų47.81%0.00527%0.269CS..Hα-helixtrans-62.2-49.8177.1-64.2170.8000110.4L133 V134 S137 P215 V216 A217 I221 C222 Y223 V280 Y283L133-L219 HydrophobicContact CD2-CD1 3.57Å; L133-L219 HydrophobicContact CD2-CD2 3.59Å; L133-L219 HydrophobicContact CD2-CG 4.21Å; V134-L219 HydrophobicContact CG2-CD2 4.35Å; V134-L219 HydrophobicContact CG2-CG 4.43Å; S137-L219 VanDerWaalsContact OG-CD2 3.29Å; S137-L219 WeakPolarHBondContact OG-CD2 3.27Å; P215-L219 WeakPolarHBondContact O-CB 3.37Å; P215-L219 WeakPolarHBondContact O-CG 3.4Å; P215-L219 PolarHBondContact O-N 3.49Å; V216-L219 PolarHBondContact O-N 3.48Å; A217-L219 VanDerWaalsContact C-N 3.35Å; A217-L219 PolarHBondContact O-N 2.98Å; L219-I221 VanDerWaalsContact C-N 3.31Å; L219-I221 PolarHBondContact O-N 3.09Å; L219-C222 WeakPolarHBondContact O-CB 3.46Å; L219-C222 PolarHBondContact O-N 2.66Å; L219-Y223 HydrophobicContact CD2-CE2 4.44Å; L219-Y223 VanDerWaalsContact O-CD2 3.24Å; L219-Y223 WeakPolarHBondContact O-CD2 3.35Å; L219-Y223 PolarHBondContact O-N 3.36Å; L219-V280 HydrophobicContact CB-CG1 4.05Å; L219-V280 HydrophobicContact CB-CG2 4.38Å; L219-V280 HydrophobicContact CD1-CG1 4.11Å; L219-V280 HydrophobicContact CD1-CG2 4.02Å; L219-V280 HydrophobicContact CD2-CG2 3.79Å; L219-V280 HydrophobicContact CG-CG2 4.26Å; L219-Y283 HydrophobicContact CD1-CD1 4.34Å
220S94Very high92.6Very high70 Ų7047.1 Ų47.149%0.4927%0.265SS..Hα-helixtrans-55.9-44.7178.4-60.20000112.1V216 A217 G224V216-S220 VanDerWaalsContact O-CB 3.28Å; V216-S220 WeakPolarHBondContact O-CB 3.35Å; V216-S220 PolarHBondContact O-N 2.9Å; V216-S220 PolarHBondContact O-OG 3.03Å; A217-S220 PolarHBondContact O-N 3.14Å; S220-G224 PolarHBondContact O-N 3.02Å
221I94.8Very high92.1Very high107 Ų10753.8 Ų53.855%0.54929%0.289SS..Hα-helixtrans-62-47.2174.4-66.7164.4000110.8A217 I218 L219 G224 L225A217-I221 VanDerWaalsContact O-CG1 3.31Å; A217-I221 WeakPolarHBondContact O-CG1 3.46Å; A217-I221 PolarHBondContact O-N 2.95Å; I218-I221 PolarHBondContact O-N 3.26Å; L219-I221 VanDerWaalsContact C-N 3.31Å; L219-I221 PolarHBondContact O-N 3.09Å; I221-G224 PolarHBondContact O-N 2.9Å; I221-L225 HydrophobicContact CG2-CD1 3.97Å; I221-L225 HydrophobicContact CG2-CG 4.46Å; I221-L225 WeakPolarHBondContact O-CB 3.32Å; I221-L225 VanDerWaalsContact O-CG 3.29Å; I221-L225 WeakPolarHBondContact O-CG 3.41Å; I221-L225 PolarHBondContact O-N 3.12Å
222C93.4Very high91.6Very high10 Ų1057.4 Ų57.47%0.06831%0.306CS..Hα-helixtrans-60.2-49.2179.8-71.10000112.4C141 I218 L219 L225 I226C141-C222 HydrophobicContact CB-CB 4.03Å; I218-C222 WeakPolarHBondContact O-CB 3.16Å; I218-C222 PolarHBondContact O-N 2.92Å; I218-C222 PolarHBondContact O-SG 3.2Å; L219-C222 WeakPolarHBondContact O-CB 3.46Å; L219-C222 PolarHBondContact O-N 2.66Å; C222-L225 PolarHBondContact O-N 2.9Å; C222-I226 WeakPolarHBondContact O-CD1 3.49Å; C222-I226 WeakPolarHBondContact O-CG1 3.39Å; C222-I226 PolarHBondContact O-N 2.72Å
223Y91.1Very high90.8Very high14 Ų1458 Ų586%0.05531%0.312CS..Hα-helixtrans-73.5-29.3-179.7-72.1-82.3000112.9S137 L219 I226 S227 T276 F277 V280S137-Y223 WeakPolarHBondContact OG-CE2 3.37Å; S137-Y223 PolarHBondContact OG-OH 3.47Å; L219-Y223 HydrophobicContact CD2-CE2 4.44Å; L219-Y223 VanDerWaalsContact O-CD2 3.24Å; L219-Y223 WeakPolarHBondContact O-CD2 3.35Å; L219-Y223 PolarHBondContact O-N 3.36Å; Y223-I226 HydrophobicContact CD1-CD1 4.11Å; Y223-I226 HydrophobicContact CE1-CD1 4.19Å; Y223-S227 VanDerWaalsContact O-CB 3.28Å; Y223-S227 WeakPolarHBondContact O-CB 3.27Å; Y223-S227 PolarHBondContact O-N 3.22Å; Y223-S227 PolarHBondContact O-OG 2.87Å; Y223-T276 VanDerWaalsContact OH-C 3.25Å; Y223-T276 WeakPolarHBondContact OH-CB 3.32Å; Y223-T276 PolarHBondContact OH-O 2.89Å; Y223-T276 PolarHBondContact OH-OG1 2.87Å; Y223-F277 HydrophobicContact CD1-CB 4.06Å; Y223-F277 AromaticContact CD1-CD2 3.79Å; Y223-F277 HydrophobicContact CD1-CD2 3.79Å; Y223-F277 HydrophobicContact CD1-CG 4.43Å; Y223-F277 HydrophobicContact CE1-CB 3.81Å; Y223-F277 HydrophobicContact CE1-CD2 4.35Å; Y223-F277 HydrophobicContact CG-CD2 4.17Å; Y223-V280 HydrophobicContact CD2-CG1 4.45Å; Y223-V280 HydrophobicContact CD2-CG2 4.15Å; Y223-V280 HydrophobicContact CE2-CB 4.22Å; Y223-V280 HydrophobicContact CE2-CG2 3.42Å; Y223-V280 VanDerWaalsContact CE2-CG2 3.42Å
224G91.3Very high90Very high43 Ų4360.2 Ų60.244%0.44332%0.319SS..Hα-helixtrans-60.1-49.8167.800000112S220 I221 I226 S227 F228S220-G224 PolarHBondContact O-N 3.02Å; I221-G224 PolarHBondContact O-N 2.9Å; G224-I226 PolarHBondContact O-N 3.11Å; G224-S227 PolarHBondContact O-N 3.11Å; G224-F228 WeakPolarHBondContact O-CB 3.49Å; G224-F228 PolarHBondContact O-N 3.29Å
225L91.6Very high89.1Confident86 Ų8660.8 Ų60.845%0.4532%0.318SS..Hα-helixtrans-63.6-40.4177.2-70.4173.6000112.9I221 C222 K229I221-L225 HydrophobicContact CG2-CD1 3.97Å; I221-L225 HydrophobicContact CG2-CG 4.46Å; I221-L225 WeakPolarHBondContact O-CB 3.32Å; I221-L225 VanDerWaalsContact O-CG 3.29Å; I221-L225 WeakPolarHBondContact O-CG 3.41Å; I221-L225 PolarHBondContact O-N 3.12Å; C222-L225 PolarHBondContact O-N 2.9Å; L225-K229 WeakPolarHBondContact O-CB 3.44Å; L225-K229 WeakPolarHBondContact O-CG 3.42Å; L225-K229 PolarHBondContact O-N 3.24Å
226I88.9Confident88.1Confident1 Ų165 Ų651%0.00534%0.34CS..Hα-helixtrans-60.8-48.9173.9-70.4164.9000110.2R140 C141 I144 C222 Y223 G224 K229 I230 V273R140-I226 HydrophobicContact CB-CD1 4.31Å; C141-I226 HydrophobicContact CB-CD1 4.05Å; C141-I226 HydrophobicContact CB-CG1 4.09Å; I144-I226 HydrophobicContact CD1-CD1 4.38Å; I144-I226 HydrophobicContact CD1-CG1 4.14Å; I144-I226 HydrophobicContact CD1-CG2 3.99Å; C222-I226 WeakPolarHBondContact O-CD1 3.49Å; C222-I226 WeakPolarHBondContact O-CG1 3.39Å; C222-I226 PolarHBondContact O-N 2.72Å; Y223-I226 HydrophobicContact CD1-CD1 4.11Å; Y223-I226 HydrophobicContact CE1-CD1 4.19Å; G224-I226 PolarHBondContact O-N 3.11Å; I226-K229 PolarHBondContact O-N 3.05Å; I226-I230 HydrophobicContact CG2-CD1 3.65Å; I226-I230 HydrophobicContact CG2-CG1 4.4Å; I226-I230 WeakPolarHBondContact O-CG1 3.5Å; I226-I230 PolarHBondContact O-N 2.68Å; I226-V273 HydrophobicContact CG2-CG1 3.78Å; I226-V273 HydrophobicContact CG2-CG2 4.33Å
227S87.8Confident87Confident70 Ų7068.4 Ų68.449%0.4935%0.353SS..Hα-helixtrans-62.3-45.6-179-58.80000111.5Y223 G224 K229 I230 W231Y223-S227 VanDerWaalsContact O-CB 3.28Å; Y223-S227 WeakPolarHBondContact O-CB 3.27Å; Y223-S227 PolarHBondContact O-N 3.22Å; Y223-S227 PolarHBondContact O-OG 2.87Å; G224-S227 PolarHBondContact O-N 3.11Å; S227-K229 PolarHBondContact O-N 2.94Å; S227-I230 PolarHBondContact O-N 3.33Å; S227-W231 WeakPolarHBondContact O-CB 3.35Å; S227-W231 PolarHBondContact O-N 3.44Å
228F88Confident85.9Confident115 Ų11568.4 Ų68.450%0.50435%0.348SS..Hα-helixtrans-58.8-43.9174.1179-99.3000112.1G224 W231 Q232G224-F228 WeakPolarHBondContact O-CB 3.49Å; G224-F228 PolarHBondContact O-N 3.29Å; F228-W231 PolarHBondContact O-N 3.5Å; F228-Q232 WeakPolarHBondContact O-CB 3.33Å; F228-Q232 PolarHBondContact O-N 2.85Å
229K85.8Confident84.6Confident68 Ų6874 Ų7430%0.29637%0.365SS..Hα-helixtrans-68.9-36178-76.9-69.3172.3-165.60113.2I144 C145 L225 I226 S227 N233I144-K229 HydrophobicContact CG2-CB 4.38Å; C145-K229 HydrophobicContact CB-CG 4.42Å; L225-K229 WeakPolarHBondContact O-CB 3.44Å; L225-K229 WeakPolarHBondContact O-CG 3.42Å; L225-K229 PolarHBondContact O-N 3.24Å; I226-K229 PolarHBondContact O-N 3.05Å; S227-K229 PolarHBondContact O-N 2.94Å; K229-N233 PolarHBondContact O-N 3.38Å; K229-N233 PolarHBondContact O-ND2 2.89Å
230I83.5Confident83.3Confident59 Ų5981.3 Ų81.330%0.30339%0.393SS..Hα-helixtrans-64.7-46.3173.5-69.7168.4000110I226 S227 Q232 N233 F234 I265 V273I226-I230 HydrophobicContact CG2-CD1 3.65Å; I226-I230 HydrophobicContact CG2-CG1 4.4Å; I226-I230 WeakPolarHBondContact O-CG1 3.5Å; I226-I230 PolarHBondContact O-N 2.68Å; S227-I230 PolarHBondContact O-N 3.33Å; I230-Q232 PolarHBondContact O-N 3.46Å; I230-N233 PolarHBondContact O-N 3Å; I230-F234 PolarHBondContact O-N 2.88Å; I230-I265 HydrophobicContact CG1-CD1 3.95Å; I230-V273 HydrophobicContact CD1-CG1 4.48Å
231W83.9Confident82Confident145 Ų14582.8 Ų82.855%0.54939%0.392SS..Hα-helixtrans-60.6-43.9176-178.583.2000112.5S227 F228 N233 F234 K235S227-W231 WeakPolarHBondContact O-CB 3.35Å; S227-W231 PolarHBondContact O-N 3.44Å; F228-W231 PolarHBondContact O-N 3.5Å; W231-N233 VanDerWaalsContact C-N 3.33Å; W231-N233 PolarHBondContact O-N 2.95Å; W231-F234 PolarHBondContact O-N 3.29Å; W231-K235 HydrophobicContact CH2-CD 3.86Å; W231-K235 HydrophobicContact CZ2-CD 4.01Å; W231-K235 HydrophobicContact CZ3-CD 4.23Å; W231-K235 WeakPolarHBondContact O-CB 3.34Å; W231-K235 PolarHBondContact O-N 2.84Å
232Q82.4Confident80.5Confident76 Ų7682.9 Ų82.936%0.35539%0.39SS..Hα-helixtrans-58.7-43.3175.1-171.4-179.515.800111.7F228 I230 L236F228-Q232 WeakPolarHBondContact O-CB 3.33Å; F228-Q232 PolarHBondContact O-N 2.85Å; I230-Q232 PolarHBondContact O-N 3.46Å; Q232-L236 PolarHBondContact O-N 3.25Å; Q232-L236 VanDerWaalsContact O-N 3.07Å
233N78.8Confident79Confident48 Ų4886.3 Ų86.326%0.25741%0.414SS..Hα-helixtrans-66.2-40.6176.8-84.7-91.7000112.2K229 I230 W231 L236 K237 I265K229-N233 PolarHBondContact O-N 3.38Å; K229-N233 PolarHBondContact O-ND2 2.89Å; I230-N233 PolarHBondContact O-N 3Å; W231-N233 VanDerWaalsContact C-N 3.33Å; W231-N233 PolarHBondContact O-N 2.95Å; N233-L236 PolarHBondContact O-N 3.41Å; N233-K237 PolarHBondContact O-N 2.9Å; N233-I265 HydrophobicContact CB-CD1 4.43Å
234F78.5Confident77.7Confident133 Ų13390.7 Ų90.758%0.58344%0.437SS*.Hα-helixtrans-64.2-47.4177.1-169.8-94.8000111.5I230 W231 L236 K237 T238I230-F234 PolarHBondContact O-N 2.88Å; W231-F234 PolarHBondContact O-N 3.29Å; F234-L236 VanDerWaalsContact C-N 3.31Å; F234-L236 PolarHBondContact O-N 2.84Å; F234-K237 WeakPolarHBondContact O-CB 3.41Å; F234-K237 PolarHBondContact O-N 3.36Å; F234-T238 PolarHBondContact O-N 3.49Å; F234-T238 PolarHBondContact O-OG1 3.49Å
235K78.3Confident76.3Confident100 Ų10093.2 Ų93.244%0.43545%0.447SS..Hα-helixtrans-60-38.1176.8-171.8173.4-178.1175.40112.7W231 R239W231-K235 HydrophobicContact CH2-CD 3.86Å; W231-K235 HydrophobicContact CZ2-CD 4.01Å; W231-K235 HydrophobicContact CZ3-CD 4.23Å; W231-K235 WeakPolarHBondContact O-CB 3.34Å; W231-K235 PolarHBondContact O-N 2.84Å; K235-R239 PolarHBondContact O-N 3.29Å
236L75.3Confident74.7Confident91 Ų9196.8 Ų96.848%0.47646%0.464SS..Hα-helixtrans-65.4-41.9172.7-115.581.7000112.2Q232 N233 F234 R239 R240 V262Q232-L236 PolarHBondContact O-N 3.25Å; Q232-L236 VanDerWaalsContact O-N 3.07Å; N233-L236 PolarHBondContact O-N 3.41Å; F234-L236 VanDerWaalsContact C-N 3.31Å; F234-L236 PolarHBondContact O-N 2.84Å; L236-R239 PolarHBondContact O-N 3.43Å; L236-R240 PolarHBondContact O-N 2.9Å; L236-R240 VanDerWaalsContact O-N 3.09Å; L236-V262 HydrophobicContact CD2-CG1 4.39Å; L236-V262 HydrophobicContact CD2-CG2 3.96Å
237K72.6Confident73.1Confident93 Ų93101 Ų10140%0.40449%0.49SS..Hα-helixtrans-60.4-51.6178.3-174.5-171.3164-170.60111N233 F234 R239 R240 E241N233-K237 PolarHBondContact O-N 2.9Å; F234-K237 WeakPolarHBondContact O-CB 3.41Å; F234-K237 PolarHBondContact O-N 3.36Å; K237-R239 VanDerWaalsContact C-N 3.34Å; K237-R239 PolarHBondContact O-N 3.18Å; K237-R240 PolarHBondContact O-N 3.46Å; K237-R240 VanDerWaalsContact O-N 3.11Å; K237-E241 VanDerWaalsContact CE-CD 3.43Å; K237-E241 WeakPolarHBondContact CE-OE1 3.31Å; K237-E241 WeakPolarHBondContact CE-OE2 3.28Å; K237-E241 IonicContact NZ-OE1 2.75Å; K237-E241 PolarHBondContact NZ-OE1 3.46Å; K237-E241 PolarHBondContact O-N 3.01Å
238T73.1Confident71.2Confident48 Ų48103.2 Ų103.229%0.29450%0.502SS..Hα-helixtrans-58.2-43.3179.3-52.10000112.2F234 R240 E241 Q242F234-T238 PolarHBondContact O-N 3.49Å; F234-T238 PolarHBondContact O-OG1 3.49Å; T238-R240 VanDerWaalsContact C-N 3.34Å; T238-R240 PolarHBondContact O-N 2.95Å; T238-E241 PolarHBondContact O-N 3.36Å; T238-Q242 WeakPolarHBondContact O-CG 3.37Å; T238-Q242 PolarHBondContact O-N 3.18Å
239R70.3Confident69.6Low176 Ų176108 Ų10866%0.66452%0.523SS*.Hα-helixtrans-65-34.6176.9-76.9-166174.8-121.8-1.2113.3K235 L236 K237 C243K235-R239 PolarHBondContact O-N 3.29Å; L236-R239 PolarHBondContact O-N 3.43Å; K237-R239 VanDerWaalsContact C-N 3.34Å; K237-R239 PolarHBondContact O-N 3.18Å; R239-C243 WeakPolarHBondContact O-CB 3.44Å; R239-C243 PolarHBondContact O-N 3.16Å
240R66.3Low67.8Low154 Ų154110.7 Ų110.758%0.58155%0.545SS*.Hα-helixtrans-68.2-43174.5-176.3177.7177.1174.50.8111.7L236 K237 T238 C243 I244L236-R240 PolarHBondContact O-N 2.9Å; L236-R240 VanDerWaalsContact O-N 3.09Å; K237-R240 PolarHBondContact O-N 3.46Å; K237-R240 VanDerWaalsContact O-N 3.11Å; T238-R240 VanDerWaalsContact C-N 3.34Å; T238-R240 PolarHBondContact O-N 2.95Å; R240-C243 PolarHBondContact O-N 3.32Å; R240-I244 HydrophobicContact CG-CD1 3.91Å; R240-I244 WeakPolarHBondContact O-CG1 3.43Å; R240-I244 PolarHBondContact O-N 3.19Å
241E66.6Low65.7Low102 Ų102113.9 Ų113.948%0.47757%0.572SS.*Hα-helixtrans-63.1-42.3178-71.7171.8157.600111.2K237 T238 I244 S245K237-E241 VanDerWaalsContact CE-CD 3.43Å; K237-E241 WeakPolarHBondContact CE-OE1 3.31Å; K237-E241 WeakPolarHBondContact CE-OE2 3.28Å; K237-E241 IonicContact NZ-OE1 2.75Å; K237-E241 PolarHBondContact NZ-OE1 3.46Å; K237-E241 PolarHBondContact O-N 3.01Å; T238-E241 PolarHBondContact O-N 3.36Å; E241-I244 PolarHBondContact O-N 3.14Å; E241-S245 PolarHBondContact O-N 3.24Å
242Q64.1Low64.1Low109 Ų109117.5 Ų117.551%0.50959%0.591SS.*Hα-helixtrans-60.6-47.4172.6-74175.2-34.200112.6T238 I244 S245 M246T238-Q242 WeakPolarHBondContact O-CG 3.37Å; T238-Q242 PolarHBondContact O-N 3.18Å; Q242-I244 VanDerWaalsContact C-N 3.33Å; Q242-I244 PolarHBondContact O-N 2.92Å; Q242-S245 WeakPolarHBondContact CA-OG 3.32Å; Q242-S245 PolarHBondContact O-N 2.89Å; Q242-S245 VanDerWaalsContact O-N 3.11Å; Q242-S245 PolarHBondContact O-OG 3.37Å; Q242-M246 PolarHBondContact O-N 3.49Å; Q242-M246 VanDerWaalsContact O-N 3.1Å
243C60.6Low62.2Low82 Ų82117.4 Ų117.455%0.55460%0.599SS**Hα-helixtrans-64.4-35.1-179.4-168.50000113R239 R240 M246 T247R239-C243 WeakPolarHBondContact O-CB 3.44Å; R239-C243 PolarHBondContact O-N 3.16Å; R240-C243 PolarHBondContact O-N 3.32Å; C243-M246 PolarHBondContact O-N 3.47Å; C243-T247 PolarHBondContact O-OG1 2.98Å; C243-T247 VanDerWaalsContact O-OG1 3.05Å
244I64.9Low60.6Low105 Ų105123 Ų12354%0.53863%0.629SS.*Hα-helixtrans-68.5-38172.3-67.5168.2000111.2R240 E241 Q242 M246 T247R240-I244 HydrophobicContact CG-CD1 3.91Å; R240-I244 WeakPolarHBondContact O-CG1 3.43Å; R240-I244 PolarHBondContact O-N 3.19Å; E241-I244 PolarHBondContact O-N 3.14Å; Q242-I244 VanDerWaalsContact C-N 3.33Å; Q242-I244 PolarHBondContact O-N 2.92Å; I244-M246 VanDerWaalsContact C-N 3.26Å; I244-M246 PolarHBondContact O-N 3.2Å; I244-T247 PolarHBondContact O-N 3.37Å; I244-T247 PolarHBondContact O-OG1 3.1Å
245S61.1Low59Low96 Ų96121.9 Ų121.967%0.67163%0.633SS**Hα-helixtrans-69.6-21.1177.368.90000114.3E241 Q242E241-S245 PolarHBondContact O-N 3.24Å; Q242-S245 WeakPolarHBondContact CA-OG 3.32Å; Q242-S245 PolarHBondContact O-N 2.89Å; Q242-S245 VanDerWaalsContact O-N 3.11Å; Q242-S245 PolarHBondContact O-OG 3.37Å
246M58.4Low57.4Low161 Ų161123.9 Ų123.979%0.79365%0.648SS**THydrogen-bonded Turntrans-94.5-0.5-179.6-74.1179.7146.600114.3Q242 C243 I244Q242-M246 PolarHBondContact O-N 3.49Å; Q242-M246 VanDerWaalsContact O-N 3.1Å; C243-M246 PolarHBondContact O-N 3.47Å; I244-M246 VanDerWaalsContact C-N 3.26Å; I244-M246 PolarHBondContact O-N 3.2Å
247T55.3Low55.9Low91 Ų91123.4 Ų123.456%0.55866%0.656SS**SBendtrans-103.5120.7178.330.70000110.8C243 I244C243-T247 PolarHBondContact O-OG1 2.98Å; C243-T247 VanDerWaalsContact O-OG1 3.05Å; I244-T247 PolarHBondContact O-N 3.37Å; I244-T247 PolarHBondContact O-OG1 3.1Å
248P48.3Very low54.5Low115 Ų115129.4 Ų129.475%0.74768%0.677SS**  trans-60155.8176.2-23.934.3000112.4T250P248-T250 PolarHBondContact O-N 2.03Å
249K52.7Low52.9Low217 Ų217133.3 Ų133.394%0.94370%0.7SS**SBendtrans-68.857.8-173.9-65.8179.5177.5173.60114.6
250T48.4Very low51.7Low123 Ų123129.6 Ų129.676%0.75570%0.701SS**  trans-149.882.9177.8-8.90000112.4P248P248-T250 PolarHBondContact O-N 2.03Å
251C40.9Very low50.6Low127 Ų127126.6 Ų126.686%0.85870%0.704SS**  trans-167.2119.1146-104.30000111.8S253C251-S253 PolarHBondContact O-N 3.18Å; C251-S253 VanDerWaalsContact O-N 3.11Å
252K48.9Very low50Low221 Ų221125.4 Ų125.496%0.96170%0.703SS**  trans-73.193.6164.8-69.3178.2179.51760108.8
253S43Very low49.7Very low73 Ų73127.8 Ų127.851%0.5171%0.708SS.*  trans-136.184.6170.6-169.90000111.5C251 T255C251-S253 PolarHBondContact O-N 3.18Å; C251-S253 VanDerWaalsContact O-N 3.11Å; S253-T255 PolarHBondContact O-N 2.8Å
254N45.9Very low49.7Very low167 Ų167130.3 Ų130.389%0.89372%0.715SS**  trans-79.28.6176.1-90.4-7.8000113.5
255T44.3Very low49.7Very low109 Ų109126.9 Ų126.967%0.66970%0.697SS**SBendtrans-117.8-24.1-159.2-24.20000115.6S253S253-T255 PolarHBondContact O-N 2.8Å
256L43.8Very low50.1Low142 Ų142125 Ų12574%0.74368%0.684SS**SBendtrans-102.3-14.1-178.7-99.283.7000116.3R258L256-R258 PolarHBondContact O-N 3.27Å
257A44.6Very low50.7Low80 Ų80126.2 Ų126.266%0.66169%0.685SS**THydrogen-bonded Turntrans-70.14.6179.800000114.8
258R43.9Very low51.3Low219 Ų219125.1 Ų125.183%0.82669%0.686SS**THydrogen-bonded Turntrans-98.7-15.4-166.3-148.3172.7-167148.11.1114.8L256L256-R258 PolarHBondContact O-N 3.27Å
259V39.1Very low52.6Low131 Ų131123.5 Ų123.579%0.79467%0.667SS**SBendtrans-100.6-23.7-162.9-171.60000114.5
260S43.8Very low53.7Low98 Ų98116.5 Ų116.569%0.68564%0.639SS**  trans-101.974.817055.40000111.3V262S260-V262 PolarHBondContact O-N 3.5Å
261S45Very low55.2Low90 Ų90113.5 Ų113.563%0.62962%0.621SS**  trans-69.976.8174.266.90000111.9R263S261-R263 PolarHBondContact O-N 3.06Å
262V52.3Low57Low77 Ų77108.9 Ų108.947%0.46759%0.589SS.*  trans-63.883.7157.8-176.60000106.1L236 S260 L264L236-V262 HydrophobicContact CD2-CG1 4.39Å; L236-V262 HydrophobicContact CD2-CG2 3.96Å; S260-V262 PolarHBondContact O-N 3.5Å; V262-L264 PolarHBondContact O-N 3.33Å
263R57.8Low58.6Low160 Ų16099.1 Ų99.160%0.60455%0.547SS*.  trans-60100.5-178.1-79.4-179.8170.5171.4-3.9107.9P147 S261 I265P147-R263 PolarHBondContact O-NH1 3.15Å; S261-R263 PolarHBondContact O-N 3.06Å; R263-I265 PolarHBondContact O-N 3.42Å
264L60.6Low60.6Low134 Ų134101.5 Ų101.570%0.70255%0.548SS*.  trans-47.4126177-149.888000108.7V262 S266V262-L264 PolarHBondContact O-N 3.33Å; L264-S266 PolarHBondContact O-N 2.98Å
265I66.3Low62.5Low33 Ų3393.8 Ų93.817%0.16951%0.507CS..  trans-64.1110.8-179.6-56.1176.8000107.1I144 I230 N233 R263 K269 I270I144-I265 HydrophobicContact CG2-CD1 4.26Å; I230-I265 HydrophobicContact CG1-CD1 3.95Å; N233-I265 HydrophobicContact CB-CD1 4.43Å; R263-I265 PolarHBondContact O-N 3.42Å; I265-K269 HydrophobicContact CG2-CB 3.82Å; I265-K269 HydrophobicContact CG2-CD 4.34Å; I265-I270 HydrophobicContact CG2-CD1 4.42Å; I265-I270 HydrophobicContact CG2-CG1 3.79Å
266S69Low64.5Low58 Ų5888.6 Ų88.641%0.40648%0.475SS..  trans-62147.6-175.161.40000111.2L264 A268 K269 I270L264-S266 PolarHBondContact O-N 2.98Å; S266-A268 PolarHBondContact O-N 3.44Å; S266-A268 VanDerWaalsContact O-N 3.12Å; S266-K269 WeakPolarHBondContact O-CB 3.26Å; S266-K269 PolarHBondContact O-N 2.9Å; S266-I270 PolarHBondContact O-N 3.24Å
267K70.4Confident66.7Low185 Ų18586.7 Ų86.780%0.80446%0.461SS*.Hα-helixtrans-49.2-42.5177.7-70.4-174.1175.9-177.60111.8K269 I270 T271K267-K269 PolarHBondContact O-N 3.48Å; K267-I270 PolarHBondContact O-N 2.95Å; K267-I270 VanDerWaalsContact O-N 3.1Å; K267-T271 PolarHBondContact O-N 2.88Å; K267-T271 PolarHBondContact O-OG1 3.26Å
268A68.6Low68.9Low69 Ų6985.5 Ų85.557%0.5745%0.446SS*.Hα-helixtrans-57-42.2176.300000113.8S266 T271 T272S266-A268 PolarHBondContact O-N 3.44Å; S266-A268 VanDerWaalsContact O-N 3.12Å; A268-T271 PolarHBondContact O-N 3.35Å; A268-T272 PolarHBondContact O-N 3.08Å; A268-T272 PolarHBondContact O-OG1 2.98Å
269K74.4Confident71Confident80 Ų8075.1 Ų75.135%0.34841%0.406SS..Hα-helixtrans-64-41.8174.7-75.9-173.2175.4-1620111.5A143 I265 S266 K267 T272 V273A143-K269 PolarHBondContact O-NZ 3.38Å; I265-K269 HydrophobicContact CG2-CB 3.82Å; I265-K269 HydrophobicContact CG2-CD 4.34Å; S266-K269 WeakPolarHBondContact O-CB 3.26Å; S266-K269 PolarHBondContact O-N 2.9Å; K267-K269 PolarHBondContact O-N 3.48Å; K269-T272 PolarHBondContact O-N 3.46Å; K269-V273 WeakPolarHBondContact O-CG2 3.44Å; K269-V273 PolarHBondContact O-N 2.75Å
270I77.3Confident73.5Confident70 Ų7069.2 Ų69.236%0.35937%0.371SS..Hα-helixtrans-64.1-44.4178.6-60.3175.2000110.8I265 S266 K267 T272 V273 K274I265-I270 HydrophobicContact CG2-CD1 4.42Å; I265-I270 HydrophobicContact CG2-CG1 3.79Å; S266-I270 PolarHBondContact O-N 3.24Å; K267-I270 PolarHBondContact O-N 2.95Å; K267-I270 VanDerWaalsContact O-N 3.1Å; I270-T272 VanDerWaalsContact C-N 3.25Å; I270-T272 PolarHBondContact O-N 3.21Å; I270-V273 PolarHBondContact O-N 2.87Å; I270-V273 VanDerWaalsContact O-N 3.13Å; I270-K274 HydrophobicContact CG2-CD 4.4Å; I270-K274 HydrophobicContact CG2-CG 4.44Å; I270-K274 WeakPolarHBondContact O-CG 3.47Å; I270-K274 PolarHBondContact O-N 3.04Å
271T79.3Confident75.7Confident61 Ų6167.7 Ų67.737%0.37436%0.357SS..Hα-helixtrans-54.9-43.8174.6-55.40000111.1K267 A268 K274 M275 F331K267-T271 PolarHBondContact O-N 2.88Å; K267-T271 PolarHBondContact O-OG1 3.26Å; A268-T271 PolarHBondContact O-N 3.35Å; T271-K274 PolarHBondContact O-N 3.3Å; T271-M275 PolarHBondContact O-N 2.9Å; T271-F331 HydrophobicContact CG2-CD1 4.11Å
272T78.6Confident78Confident30 Ų3064.3 Ų64.318%0.18433%0.334CS..Hα-helixtrans-69.4-34.9178.8-32.70000113.2M77 R140 A268 K269 I270 M275 T276M77-T272 HydrophobicContact CG-CG2 4Å; M77-T272 HydrophobicContact SD-CG2 3.22Å; M77-T272 WeakPolarHBondContact SD-CG2 3.43Å; R140-T272 VanDerWaalsContact NH1-CG2 3.31Å; A268-T272 PolarHBondContact O-N 3.08Å; A268-T272 PolarHBondContact O-OG1 2.98Å; K269-T272 PolarHBondContact O-N 3.46Å; I270-T272 VanDerWaalsContact C-N 3.25Å; I270-T272 PolarHBondContact O-N 3.21Å; T272-M275 PolarHBondContact O-N 2.73Å; T272-T276 WeakPolarHBondContact O-CG2 3.3Å; T272-T276 PolarHBondContact O-N 3.35Å; T272-T276 PolarHBondContact O-OG1 3.48Å
273V83Confident79.8Confident15 Ų1560.6 Ų60.69%0.09131%0.312CS..Hα-helixtrans-63.2-45.6172.5172.10000111.3I144 I226 I230 K269 I270 M275 T276 F277I144-V273 HydrophobicContact CD1-CG2 3.17Å; I144-V273 HydrophobicContact CG1-CG2 4.46Å; I226-V273 HydrophobicContact CG2-CG1 3.78Å; I226-V273 HydrophobicContact CG2-CG2 4.33Å; I230-V273 HydrophobicContact CD1-CG1 4.48Å; K269-V273 WeakPolarHBondContact O-CG2 3.44Å; K269-V273 PolarHBondContact O-N 2.75Å; I270-V273 PolarHBondContact O-N 2.87Å; I270-V273 VanDerWaalsContact O-N 3.13Å; V273-M275 VanDerWaalsContact C-N 3.3Å; V273-M275 PolarHBondContact O-N 3.34Å; V273-T276 PolarHBondContact O-N 3.44Å; V273-T276 PolarHBondContact O-OG1 3.13Å; V273-F277 VanDerWaalsContact O-CB 3.23Å; V273-F277 WeakPolarHBondContact O-CB 3.4Å; V273-F277 PolarHBondContact O-N 2.62Å
274K85.4Confident81.5Confident124 Ų12455.3 Ų55.354%0.53930%0.295SS..Hα-helixtrans-59.6-44.1177.3-69.6-176.168177.70110.7I270 T271 F277 V278 F331I270-K274 HydrophobicContact CG2-CD 4.4Å; I270-K274 HydrophobicContact CG2-CG 4.44Å; I270-K274 WeakPolarHBondContact O-CG 3.47Å; I270-K274 PolarHBondContact O-N 3.04Å; T271-K274 PolarHBondContact O-N 3.3Å; K274-F277 PolarHBondContact O-N 3.01Å; K274-V278 WeakPolarHBondContact O-CG2 3.26Å; K274-V278 PolarHBondContact O-N 3.17Å; K274-F331 HydrophobicContact CB-CD1 4.34Å; K274-F331 HydrophobicContact CB-CE1 3.58Å; K274-F331 HydrophobicContact CB-CZ 4.18Å
275M85.5Confident82.9Confident4 Ų453.2 Ų53.22%0.0229%0.288CS..Hα-helixtrans-58.7-52.9175.8-171-16386.400112.1M77 M81 T271 T272 V273 F277 V278 I279 I327 Y328 F331M77-M275 HydrophobicContact SD-CE 4.16Å; M81-M275 HydrophobicContact CE-CE 3.59Å; M81-M275 HydrophobicContact CE-SD 3.45Å; M81-M275 WeakPolarHBondContact CE-SD 3.47Å; T271-M275 PolarHBondContact O-N 2.9Å; T272-M275 PolarHBondContact O-N 2.73Å; V273-M275 VanDerWaalsContact C-N 3.3Å; V273-M275 PolarHBondContact O-N 3.34Å; M275-F277 VanDerWaalsContact C-N 3.33Å; M275-F277 PolarHBondContact O-N 2.98Å; M275-V278 PolarHBondContact O-N 3.4Å; M275-I279 HydrophobicContact CE-CD1 3.98Å; M275-I279 HydrophobicContact CG-CD1 4.41Å; M275-I279 WeakPolarHBondContact O-CG1 3.11Å; M275-I279 PolarHBondContact O-N 3.49Å; M275-I279 VanDerWaalsContact O-N 3.09Å; M275-I327 HydrophobicContact CG-CG2 3.83Å; M275-Y328 HydrophobicContact CE-CD1 3.92Å; M275-Y328 HydrophobicContact CE-CE1 3.72Å; M275-Y328 HydrophobicContact CG-CD1 4.48Å; M275-Y328 HydrophobicContact SD-CD1 3.7Å; M275-Y328 HydrophobicContact SD-CE1 4.15Å; M275-F331 HydrophobicContact CB-CB 3.67Å; M275-F331 HydrophobicContact CB-CD1 4Å; M275-F331 HydrophobicContact CB-CD2 3.96Å; M275-F331 HydrophobicContact CB-CG 3.61Å; M275-F331 HydrophobicContact CG-CB 3.58Å; M275-F331 HydrophobicContact CG-CD2 3.91Å; M275-F331 HydrophobicContact CG-CG 3.82Å; M275-F331 HydrophobicContact SD-CB 4.11Å
276T85.8Confident84.1Confident0 Ų052 Ų520%028%0.282CS..Hα-helixtrans-70.9-29.4-177.163.70000112.5M136 R140 Y223 T272 V273 I279 V280M136-T276 HydrophobicContact CE-CG2 3.94Å; M136-T276 HydrophobicContact CG-CG2 3.91Å; M136-T276 HydrophobicContact SD-CG2 3.75Å; R140-T276 HydrophobicContact CG-CG2 3.87Å; Y223-T276 VanDerWaalsContact OH-C 3.25Å; Y223-T276 WeakPolarHBondContact OH-CB 3.32Å; Y223-T276 PolarHBondContact OH-O 2.89Å; Y223-T276 PolarHBondContact OH-OG1 2.87Å; T272-T276 WeakPolarHBondContact O-CG2 3.3Å; T272-T276 PolarHBondContact O-N 3.35Å; T272-T276 PolarHBondContact O-OG1 3.48Å; V273-T276 PolarHBondContact O-N 3.44Å; V273-T276 PolarHBondContact O-OG1 3.13Å; T276-I279 PolarHBondContact O-N 3.46Å; T276-V280 WeakPolarHBondContact O-CG2 3.43Å; T276-V280 PolarHBondContact O-N 2.88Å
277F89.3Confident85.1Confident102 Ų10249.5 Ų49.545%0.44726%0.264SS..Hα-helixtrans-62.6-44.8170177.9-97.9000111.9Y223 V273 K274 M275 I279 V280 V281Y223-F277 HydrophobicContact CD1-CB 4.06Å; Y223-F277 AromaticContact CD1-CD2 3.79Å; Y223-F277 HydrophobicContact CD1-CD2 3.79Å; Y223-F277 HydrophobicContact CD1-CG 4.43Å; Y223-F277 HydrophobicContact CE1-CB 3.81Å; Y223-F277 HydrophobicContact CE1-CD2 4.35Å; Y223-F277 HydrophobicContact CG-CD2 4.17Å; V273-F277 VanDerWaalsContact O-CB 3.23Å; V273-F277 WeakPolarHBondContact O-CB 3.4Å; V273-F277 PolarHBondContact O-N 2.62Å; K274-F277 PolarHBondContact O-N 3.01Å; M275-F277 VanDerWaalsContact C-N 3.33Å; M275-F277 PolarHBondContact O-N 2.98Å; F277-I279 VanDerWaalsContact C-N 3.3Å; F277-I279 PolarHBondContact O-N 2.72Å; F277-V280 PolarHBondContact O-N 3.06Å; F277-V280 VanDerWaalsContact O-N 3.14Å; F277-V281 HydrophobicContact CD1-CG2 4.25Å; F277-V281 HydrophobicContact CE1-CG2 3.8Å; F277-V281 HydrophobicContact CE2-CG2 4.33Å; F277-V281 HydrophobicContact CZ-CG2 3.85Å; F277-V281 WeakPolarHBondContact O-CG2 3.38Å; F277-V281 PolarHBondContact O-N 3.01Å
278V90.6Very high86.1Confident56 Ų5642.7 Ų42.734%0.33924%0.238SC..Hα-helixtrans-61.6-39.1175.4171.80000111.3K274 M275 V280 V281 A282 I327 F331K274-V278 WeakPolarHBondContact O-CG2 3.26Å; K274-V278 PolarHBondContact O-N 3.17Å; M275-V278 PolarHBondContact O-N 3.4Å; V278-V280 VanDerWaalsContact C-N 3.34Å; V278-V280 PolarHBondContact O-N 3.32Å; V278-V281 PolarHBondContact O-N 3.32Å; V278-A282 WeakPolarHBondContact O-CB 3.14Å; V278-A282 PolarHBondContact O-N 2.97Å; V278-I327 HydrophobicContact CB-CG2 4.3Å; V278-I327 HydrophobicContact CG1-CD1 3.97Å; V278-I327 HydrophobicContact CG1-CG1 3.95Å; V278-I327 HydrophobicContact CG1-CG2 4.04Å; V278-F331 HydrophobicContact CB-CE2 4.33Å; V278-F331 HydrophobicContact CG2-CE2 4.05Å; V278-F331 HydrophobicContact CG2-CZ 4.03Å
279I89.5Confident87.1Confident0 Ų041 Ų410%022%0.221CC..Hα-helixtrans-61.6-40.6173.9-65.7169.1000111.5L133 M136 M275 T276 F277 A282 Y283 I327 Y328L133-I279 HydrophobicContact CD1-CG2 3.66Å; L133-I279 HydrophobicContact CG-CG2 3.93Å; M136-I279 HydrophobicContact CE-CB 4.49Å; M136-I279 HydrophobicContact CE-CD1 3.85Å; M136-I279 HydrophobicContact CE-CG2 4.09Å; M275-I279 HydrophobicContact CE-CD1 3.98Å; M275-I279 HydrophobicContact CG-CD1 4.41Å; M275-I279 WeakPolarHBondContact O-CG1 3.11Å; M275-I279 PolarHBondContact O-N 3.49Å; M275-I279 VanDerWaalsContact O-N 3.09Å; T276-I279 PolarHBondContact O-N 3.46Å; F277-I279 VanDerWaalsContact C-N 3.3Å; F277-I279 PolarHBondContact O-N 2.72Å; I279-A282 PolarHBondContact O-N 3.4Å; I279-Y283 WeakPolarHBondContact O-CB 3.35Å; I279-Y283 PolarHBondContact O-N 3.33Å; I279-I327 HydrophobicContact CD1-CG2 4.31Å; I279-I327 HydrophobicContact CG1-CB 4.29Å; I279-I327 HydrophobicContact CG1-CD1 3.77Å; I279-I327 HydrophobicContact CG1-CG2 3.84Å; I279-Y328 HydrophobicContact CD1-CD1 4.32Å; I279-Y328 HydrophobicContact CD1-CE1 3.55Å
280V90.3Very high87.7Confident8 Ų838.6 Ų38.65%0.04821%0.211CC..Hα-helixtrans-66.8-40.9175.9168.30000112.8L133 L219 Y223 T276 F277 V278 Y283 I284L133-V280 HydrophobicContact CD2-CG2 3.88Å; L219-V280 HydrophobicContact CB-CG1 4.05Å; L219-V280 HydrophobicContact CB-CG2 4.38Å; L219-V280 HydrophobicContact CD1-CG1 4.11Å; L219-V280 HydrophobicContact CD1-CG2 4.02Å; L219-V280 HydrophobicContact CD2-CG2 3.79Å; L219-V280 HydrophobicContact CG-CG2 4.26Å; Y223-V280 HydrophobicContact CD2-CG1 4.45Å; Y223-V280 HydrophobicContact CD2-CG2 4.15Å; Y223-V280 HydrophobicContact CE2-CB 4.22Å; Y223-V280 HydrophobicContact CE2-CG2 3.42Å; Y223-V280 VanDerWaalsContact CE2-CG2 3.42Å; T276-V280 WeakPolarHBondContact O-CG2 3.43Å; T276-V280 PolarHBondContact O-N 2.88Å; F277-V280 PolarHBondContact O-N 3.06Å; F277-V280 VanDerWaalsContact O-N 3.14Å; V278-V280 VanDerWaalsContact C-N 3.34Å; V278-V280 PolarHBondContact O-N 3.32Å; V280-Y283 WeakPolarHBondContact O-CB 3.2Å; V280-Y283 PolarHBondContact O-N 3.15Å; V280-I284 HydrophobicContact CG1-CD1 3.88Å; V280-I284 WeakPolarHBondContact O-CG1 3.21Å; V280-I284 PolarHBondContact O-N 3.38Å
281V91.5Very high88.3Confident65 Ų6535.6 Ų35.639%0.39420%0.195SC..Hα-helixtrans-64.4-44.9176.1174.10000110.2F277 V278 Y283 I284 V285F277-V281 HydrophobicContact CD1-CG2 4.25Å; F277-V281 HydrophobicContact CE1-CG2 3.8Å; F277-V281 HydrophobicContact CE2-CG2 4.33Å; F277-V281 HydrophobicContact CZ-CG2 3.85Å; F277-V281 WeakPolarHBondContact O-CG2 3.38Å; F277-V281 PolarHBondContact O-N 3.01Å; V278-V281 PolarHBondContact O-N 3.32Å; V281-Y283 VanDerWaalsContact C-N 3.33Å; V281-Y283 PolarHBondContact O-N 3.44Å; V281-I284 PolarHBondContact O-N 3.27Å; V281-V285 HydrophobicContact CG1-CG2 4.35Å; V281-V285 WeakPolarHBondContact O-CB 3.5Å; V281-V285 VanDerWaalsContact O-CG2 3.31Å; V281-V285 WeakPolarHBondContact O-CG2 3.31Å; V281-V285 PolarHBondContact O-N 2.84Å
282A91.6Very high88.8Confident19 Ų1936 Ų3616%0.15720%0.2CC..Hα-helixtrans-57.7-46174.300000111.4V278 I279 I284 V285 C286 I327V278-A282 WeakPolarHBondContact O-CB 3.14Å; V278-A282 PolarHBondContact O-N 2.97Å; I279-A282 PolarHBondContact O-N 3.4Å; A282-I284 PolarHBondContact O-N 2.91Å; A282-V285 PolarHBondContact O-N 3.4Å; A282-C286 VanDerWaalsContact O-CB 3.27Å; A282-C286 WeakPolarHBondContact O-CB 3.43Å; A282-C286 PolarHBondContact O-N 3.24Å; A282-C286 PolarHBondContact O-SG 3.27Å; A282-I327 HydrophobicContact CB-CD1 4.27Å
283Y91.9Very high89.1Confident0 Ų035.4 Ų35.40%020%0.197CC..Hα-helixtrans-56.1-52175.9-176.6-92.9000112.6T130 L133 I211 Y212 V216 L219 I279 V280 V281 V285 C286 W287 N320T130-Y283 HydrophobicContact CG2-CE2 4.34Å; T130-Y283 VanDerWaalsContact CG2-OH 3.23Å; T130-Y283 WeakPolarHBondContact CG2-OH 3.42Å; T130-Y283 PolarHBondContact OG1-OH 3.11Å; T130-Y283 VanDerWaalsContact OG1-OH 3.12Å; L133-Y283 HydrophobicContact CD1-CD2 3.53Å; L133-Y283 HydrophobicContact CD1-CE2 4.36Å; L133-Y283 HydrophobicContact CD1-CG 3.8Å; I211-Y283 PolarHBondContact O-OH 3.47Å; Y212-Y283 HydrophobicContact CD2-CE1 4.5Å; V216-Y283 HydrophobicContact CG2-CD1 4.43Å; V216-Y283 HydrophobicContact CG2-CE1 4.21Å; L219-Y283 HydrophobicContact CD1-CD1 4.34Å; I279-Y283 WeakPolarHBondContact O-CB 3.35Å; I279-Y283 PolarHBondContact O-N 3.33Å; V280-Y283 WeakPolarHBondContact O-CB 3.2Å; V280-Y283 PolarHBondContact O-N 3.15Å; V281-Y283 VanDerWaalsContact C-N 3.33Å; V281-Y283 PolarHBondContact O-N 3.44Å; Y283-V285 PolarHBondContact O-N 3.44Å; Y283-C286 PolarHBondContact O-N 3.49Å; Y283-W287 AromaticContact CD2-CD1 3.33Å; Y283-W287 HydrophobicContact CD2-CG 4.47Å; Y283-W287 AromaticContact CD2-NE1 3.53Å; Y283-W287 AromaticContact CE2-CD1 3.2Å; Y283-W287 HydrophobicContact CE2-CG 4.1Å; Y283-W287 AromaticContact CE2-NE1 3.2Å; Y283-W287 AromaticContact CG-CD1 3.83Å; Y283-W287 AromaticContact CZ-CD1 3.58Å; Y283-W287 AromaticContact CZ-NE1 3.91Å; Y283-W287 WeakPolarHBondContact O-CB 3.48Å; Y283-W287 VanDerWaalsContact O-CD1 3.27Å; Y283-W287 PolarHBondContact O-N 2.93Å; Y283-N320 WeakPolarHBondContact CA-OD1 3.43Å; Y283-N320 WeakPolarHBondContact CD2-OD1 3.46Å
284I92.4Very high89.2Confident48 Ų4837.4 Ų37.425%0.24621%0.205CC..Hα-helixtrans-60.8-48.7-179.9-67.3165.7000110.1V216 V280 V281 A282 C286 W287 T288V216-I284 HydrophobicContact CG1-CD1 4.25Å; V216-I284 HydrophobicContact CG1-CG1 4.33Å; V216-I284 HydrophobicContact CG2-CG1 3.92Å; V280-I284 HydrophobicContact CG1-CD1 3.88Å; V280-I284 WeakPolarHBondContact O-CG1 3.21Å; V280-I284 PolarHBondContact O-N 3.38Å; V281-I284 PolarHBondContact O-N 3.27Å; A282-I284 PolarHBondContact O-N 2.91Å; I284-C286 PolarHBondContact O-N 2.87Å; I284-W287 PolarHBondContact O-N 2.89Å; I284-T288 VanDerWaalsContact O-CB 3.31Å; I284-T288 WeakPolarHBondContact O-CB 3.31Å; I284-T288 PolarHBondContact O-N 2.88Å; I284-T288 PolarHBondContact O-OG1 3.47Å
285V91.2Very high89.4Confident90 Ų9034.1 Ų34.155%0.54519%0.192SC..Hα-helixtrans-62.8-39.3-178.7172.40000112.3V281 A282 Y283 P289V281-V285 HydrophobicContact CG1-CG2 4.35Å; V281-V285 WeakPolarHBondContact O-CB 3.5Å; V281-V285 VanDerWaalsContact O-CG2 3.31Å; V281-V285 WeakPolarHBondContact O-CG2 3.31Å; V281-V285 PolarHBondContact O-N 2.84Å; A282-V285 PolarHBondContact O-N 3.4Å; Y283-V285 PolarHBondContact O-N 3.44Å; V285-P289 WeakPolarHBondContact O-CD 3.33Å
286C90.1Very high89.5Confident8 Ų841 Ų415%0.05422%0.218CC..Hα-helixtrans-72.3-40.6179.1-68.10000112.7A282 Y283 I284 L316 A317 N320A282-C286 VanDerWaalsContact O-CB 3.27Å; A282-C286 WeakPolarHBondContact O-CB 3.43Å; A282-C286 PolarHBondContact O-N 3.24Å; A282-C286 PolarHBondContact O-SG 3.27Å; Y283-C286 PolarHBondContact O-N 3.49Å; I284-C286 PolarHBondContact O-N 2.87Å; C286-L316 WeakPolarHBondContact CB-O 3.36Å; C286-L316 CarbonylContact O-C 3.53Å; C286-A317 PolarHBondContact O-N 3.42Å; C286-N320 HydrophobicContact CB-CB 3.82Å
287W90.7Very high89.4Confident5 Ų542.2 Ų42.22%0.01923%0.226CC..Hα-helixtrans-92.4-24.9-172.3-74.8104.5000115.2M126 Y212 Y283 I284 F290 F291 A317 N320M126-W287 HydrophobicContact CB-CH2 4.18Å; M126-W287 HydrophobicContact CG-CH2 3.85Å; M126-W287 HydrophobicContact SD-CH2 4.01Å; M126-W287 HydrophobicContact SD-CZ3 4.47Å; Y212-W287 HydrophobicContact CD2-CB 3.93Å; Y212-W287 HydrophobicContact CE2-CB 4.3Å; Y283-W287 AromaticContact CD2-CD1 3.33Å; Y283-W287 HydrophobicContact CD2-CG 4.47Å; Y283-W287 AromaticContact CD2-NE1 3.53Å; Y283-W287 AromaticContact CE2-CD1 3.2Å; Y283-W287 HydrophobicContact CE2-CG 4.1Å; Y283-W287 AromaticContact CE2-NE1 3.2Å; Y283-W287 AromaticContact CG-CD1 3.83Å; Y283-W287 AromaticContact CZ-CD1 3.58Å; Y283-W287 AromaticContact CZ-NE1 3.91Å; Y283-W287 WeakPolarHBondContact O-CB 3.48Å; Y283-W287 VanDerWaalsContact O-CD1 3.27Å; Y283-W287 PolarHBondContact O-N 2.93Å; I284-W287 PolarHBondContact O-N 2.89Å; W287-F290 HydrophobicContact CE3-CB 4.42Å; W287-F290 AromaticContact CE3-CD1 3.82Å; W287-F290 HydrophobicContact CE3-CD1 3.82Å; W287-F290 HydrophobicContact CE3-CG 4.35Å; W287-F290 AromaticContact CZ3-CD1 3.77Å; W287-F290 HydrophobicContact CZ3-CD1 3.77Å; W287-F290 HydrophobicContact CZ3-CE1 4.02Å; W287-F290 HydrophobicContact CZ3-CG 4.44Å; W287-F290 PolarHBondContact O-N 2.93Å; W287-F291 HydrophobicContact CB-CD2 4.09Å; W287-F291 HydrophobicContact CB-CE2 4.2Å; W287-F291 AromaticContact CD2-CE2 3.88Å; W287-F291 HydrophobicContact CD2-CE2 3.88Å; W287-F291 AromaticContact CE3-CD2 3.88Å; W287-F291 HydrophobicContact CE3-CD2 3.88Å; W287-F291 AromaticContact CE3-CE2 3.16Å; W287-F291 HydrophobicContact CE3-CE2 3.16Å; W287-F291 AromaticContact CE3-CZ 3.79Å; W287-F291 HydrophobicContact CE3-CZ 3.79Å; W287-F291 HydrophobicContact CG-CE2 4.35Å; W287-F291 AromaticContact CZ3-CE2 3.72Å; W287-F291 HydrophobicContact CZ3-CE2 3.72Å; W287-F291 AromaticContact CZ3-CZ 3.83Å; W287-F291 HydrophobicContact CZ3-CZ 3.83Å; W287-F291 WeakPolarHBondContact O-CD2 3.46Å; W287-F291 PolarHBondContact O-N 2.87Å; W287-A317 HydrophobicContact CD2-CB 4.35Å; W287-A317 HydrophobicContact CE3-CB 3.83Å; W287-A317 HydrophobicContact CH2-CB 4.23Å; W287-A317 HydrophobicContact CZ3-CB 3.78Å; W287-N320 PolarHBondContact NE1-ND2 2.96Å
288T91.2Very high89.2Confident43 Ų4338 Ų3826%0.26421%0.21SC..Hα-helixtrans-50.9-56.8175.3-57.10000112.8Y212 I284 F290 F291 S292Y212-T288 PolarHBondContact OH-OG1 3.14Å; I284-T288 VanDerWaalsContact O-CB 3.31Å; I284-T288 WeakPolarHBondContact O-CB 3.31Å; I284-T288 PolarHBondContact O-N 2.88Å; I284-T288 PolarHBondContact O-OG1 3.47Å; T288-F290 VanDerWaalsContact C-N 3.34Å; T288-F290 PolarHBondContact O-N 3.35Å; T288-F291 PolarHBondContact O-N 2.99Å; T288-S292 WeakPolarHBondContact O-CB 3.4Å; T288-S292 PolarHBondContact O-N 3.3Å; T288-S292 PolarHBondContact O-OG 3.35Å
289P90.2Very high89Confident34 Ų3442.1 Ų42.122%0.22122%0.22CC..Hα-helixtrans-61.1-42.8-175.224.2-34.8000111.9V285 S292 V293 S313 L316V285-P289 WeakPolarHBondContact O-CD 3.33Å; P289-S292 PolarHBondContact O-N 3.18Å; P289-V293 WeakPolarHBondContact O-CB 3.46Å; P289-V293 WeakPolarHBondContact O-CG2 3.39Å; P289-V293 PolarHBondContact O-N 3.45Å; P289-S313 PolarHBondContact O-OG 3.38Å; P289-L316 HydrophobicContact CB-CD1 4.14Å; P289-L316 HydrophobicContact CG-CB 3.79Å; P289-L316 HydrophobicContact CG-CD1 3.68Å; P289-L316 HydrophobicContact CG-CG 4.24Å
290F87.4Confident88.8Confident28 Ų2844.8 Ų44.812%0.12323%0.234CC..Hα-helixtrans-54.8-55.9174.9-176.4-102000112.3W287 T288 S292 V293 Q294 A317W287-F290 HydrophobicContact CE3-CB 4.42Å; W287-F290 AromaticContact CE3-CD1 3.82Å; W287-F290 HydrophobicContact CE3-CD1 3.82Å; W287-F290 HydrophobicContact CE3-CG 4.35Å; W287-F290 AromaticContact CZ3-CD1 3.77Å; W287-F290 HydrophobicContact CZ3-CD1 3.77Å; W287-F290 HydrophobicContact CZ3-CE1 4.02Å; W287-F290 HydrophobicContact CZ3-CG 4.44Å; W287-F290 PolarHBondContact O-N 2.93Å; T288-F290 VanDerWaalsContact C-N 3.34Å; T288-F290 PolarHBondContact O-N 3.35Å; F290-S292 PolarHBondContact O-N 2.95Å; F290-V293 PolarHBondContact O-N 3.5Å; F290-Q294 HydrophobicContact CD1-CG 4.3Å; F290-Q294 HydrophobicContact CD2-CG 4.37Å; F290-Q294 HydrophobicContact CE1-CG 4.01Å; F290-Q294 HydrophobicContact CE2-CG 4.07Å; F290-Q294 HydrophobicContact CG-CG 4.48Å; F290-Q294 HydrophobicContact CZ-CG 3.89Å; F290-Q294 WeakPolarHBondContact O-CB 3.32Å; F290-Q294 WeakPolarHBondContact O-CG 3.27Å; F290-Q294 PolarHBondContact O-N 3.37Å; F290-A317 HydrophobicContact CB-CB 3.99Å; F290-A317 HydrophobicContact CD2-CB 4.08Å; F290-A317 HydrophobicContact CG-CB 3.94Å
291F89.6Confident88.1Confident8 Ų849.5 Ų49.54%0.03527%0.265CS..Hα-helixtrans-72.9-29.9-176.8-72.7-62.7000113.6I207 S208 I211 Y212 W287 T288 M295I207-F291 HydrophobicContact CG2-CE1 3.94Å; I207-F291 HydrophobicContact CG2-CZ 4.35Å; S208-F291 WeakPolarHBondContact OG-CD1 3.49Å; I211-F291 HydrophobicContact CB-CE2 4.27Å; I211-F291 HydrophobicContact CB-CZ 3.8Å; I211-F291 HydrophobicContact CG2-CE2 3.89Å; I211-F291 HydrophobicContact CG2-CZ 3.73Å; Y212-F291 HydrophobicContact CD1-CB 4.11Å; Y212-F291 HydrophobicContact CD1-CD2 4.37Å; Y212-F291 HydrophobicContact CD1-CG 4.5Å; Y212-F291 HydrophobicContact CD2-CD2 4.05Å; Y212-F291 HydrophobicContact CG-CB 4.27Å; Y212-F291 AromaticContact CG-CD2 3.67Å; Y212-F291 HydrophobicContact CG-CD2 3.67Å; Y212-F291 HydrophobicContact CG-CE2 4.37Å; Y212-F291 HydrophobicContact CG-CG 4.2Å; W287-F291 HydrophobicContact CB-CD2 4.09Å; W287-F291 HydrophobicContact CB-CE2 4.2Å; W287-F291 AromaticContact CD2-CE2 3.88Å; W287-F291 HydrophobicContact CD2-CE2 3.88Å; W287-F291 AromaticContact CE3-CD2 3.88Å; W287-F291 HydrophobicContact CE3-CD2 3.88Å; W287-F291 AromaticContact CE3-CE2 3.16Å; W287-F291 HydrophobicContact CE3-CE2 3.16Å; W287-F291 AromaticContact CE3-CZ 3.79Å; W287-F291 HydrophobicContact CE3-CZ 3.79Å; W287-F291 HydrophobicContact CG-CE2 4.35Å; W287-F291 AromaticContact CZ3-CE2 3.72Å; W287-F291 HydrophobicContact CZ3-CE2 3.72Å; W287-F291 AromaticContact CZ3-CZ 3.83Å; W287-F291 HydrophobicContact CZ3-CZ 3.83Å; W287-F291 WeakPolarHBondContact O-CD2 3.46Å; W287-F291 PolarHBondContact O-N 2.87Å; T288-F291 PolarHBondContact O-N 2.99Å; F291-M295 WeakPolarHBondContact O-CB 3.42Å; F291-M295 PolarHBondContact O-N 3.49Å
292S89.3Confident87.3Confident68 Ų6850.4 Ų50.448%0.47628%0.279SS..Hα-helixtrans-62.3-48.6170.9-71.30000111.9T288 P289 F290 M295 W296T288-S292 WeakPolarHBondContact O-CB 3.4Å; T288-S292 PolarHBondContact O-N 3.3Å; T288-S292 PolarHBondContact O-OG 3.35Å; P289-S292 PolarHBondContact O-N 3.18Å; F290-S292 PolarHBondContact O-N 2.95Å; S292-M295 PolarHBondContact O-N 3.42Å; S292-W296 WeakPolarHBondContact O-CB 3.26Å; S292-W296 PolarHBondContact O-N 3.34Å
293V85.6Confident86.4Confident18 Ų1849.7 Ų49.711%0.10927%0.274CS..Hα-helixtrans-68.3-42.5179.5170.30000111.6P289 F290 M295 W296 S297 F310 S313P289-V293 WeakPolarHBondContact O-CB 3.46Å; P289-V293 WeakPolarHBondContact O-CG2 3.39Å; P289-V293 PolarHBondContact O-N 3.45Å; F290-V293 PolarHBondContact O-N 3.5Å; V293-M295 PolarHBondContact O-N 3.39Å; V293-W296 PolarHBondContact O-N 3.13Å; V293-S297 WeakPolarHBondContact O-CB 3.27Å; V293-S297 PolarHBondContact O-N 3.43Å; V293-F310 HydrophobicContact CG1-CB 4.46Å; V293-F310 HydrophobicContact CG1-CD1 3.46Å; V293-F310 VanDerWaalsContact CG1-CD1 3.46Å; V293-F310 HydrophobicContact CG1-CD2 3.66Å; V293-F310 HydrophobicContact CG1-CE1 3.44Å; V293-F310 VanDerWaalsContact CG1-CE1 3.44Å; V293-F310 HydrophobicContact CG1-CE2 3.62Å; V293-F310 HydrophobicContact CG1-CG 3.59Å; V293-F310 HydrophobicContact CG1-CZ 3.52Å; V293-S313 WeakPolarHBondContact CG2-OG 3.39Å
294Q85.3Confident85.2Confident57 Ų5753.2 Ų53.227%0.26630%0.296SS..Hα-helixtrans-60.6-44.2175.4-70.6-69.390.900111.6I204 F290 S297 A298I204-Q294 HydrophobicContact CG2-CB 3.97Å; I204-Q294 WeakPolarHBondContact CG2-O 3.49Å; F290-Q294 HydrophobicContact CD1-CG 4.3Å; F290-Q294 HydrophobicContact CD2-CG 4.37Å; F290-Q294 HydrophobicContact CE1-CG 4.01Å; F290-Q294 HydrophobicContact CE2-CG 4.07Å; F290-Q294 HydrophobicContact CG-CG 4.48Å; F290-Q294 HydrophobicContact CZ-CG 3.89Å; F290-Q294 WeakPolarHBondContact O-CB 3.32Å; F290-Q294 WeakPolarHBondContact O-CG 3.27Å; F290-Q294 PolarHBondContact O-N 3.37Å; Q294-S297 PolarHBondContact O-N 3.25Å; Q294-A298 WeakPolarHBondContact O-CB 3.29Å; Q294-A298 PolarHBondContact O-N 2.97Å
295M89Confident83.6Confident56 Ų5658.4 Ų58.428%0.27631%0.313SS..Hα-helixtrans-64.3-43.8177-166.967.868.300111.5S208 F291 S292 V293 A298 W299S208-M295 VanDerWaalsContact CB-CE 3.44Å; S208-M295 WeakPolarHBondContact OG-CE 3.41Å; F291-M295 WeakPolarHBondContact O-CB 3.42Å; F291-M295 PolarHBondContact O-N 3.49Å; S292-M295 PolarHBondContact O-N 3.42Å; V293-M295 PolarHBondContact O-N 3.39Å; M295-A298 PolarHBondContact O-N 3.05Å; M295-W299 PolarHBondContact O-N 2.6Å; M295-W299 VanDerWaalsContact O-N 3.13Å; M295-W299 PolarHBondContact SD-NE1 2.87Å
296W87.8Confident81.9Confident148 Ų14862.7 Ų62.756%0.56133%0.327SS*.Hα-helixtrans-59.1-49.5176.1-170.74.5000110.7S292 V293 A298 W299 D300 A303S292-W296 WeakPolarHBondContact O-CB 3.26Å; S292-W296 PolarHBondContact O-N 3.34Å; V293-W296 PolarHBondContact O-N 3.13Å; W296-A298 PolarHBondContact O-N 3.42Å; W296-W299 PolarHBondContact O-N 2.91Å; W296-D300 VanDerWaalsContact CD1-CB 3.47Å; W296-D300 PolarHBondContact NE1-OD2 3.25Å; W296-D300 WeakPolarHBondContact O-CB 3.38Å; W296-D300 PolarHBondContact O-N 2.92Å; W296-A303 HydrophobicContact CG-CB 4.25Å
297S82.8Confident80.3Confident25 Ų2563.6 Ų63.618%0.17534%0.335CS..Hα-helixtrans-59.1-28.8177.1-166.30000114.6V293 Q294V293-S297 WeakPolarHBondContact O-CB 3.27Å; V293-S297 PolarHBondContact O-N 3.43Å; Q294-S297 PolarHBondContact O-N 3.25Å
298A85.1Confident78.8Confident13 Ų1367.8 Ų67.811%0.10736%0.356CS..Hα-helixtrans-79.8-40-179.500000112K201 I204 Q294 M295 W296K201-A298 WeakPolarHBondContact CE-O 3.3Å; K201-A298 WeakPolarHBondContact CG-O 3.41Å; I204-A298 HydrophobicContact CB-CB 3.96Å; I204-A298 HydrophobicContact CD1-CB 3.71Å; I204-A298 HydrophobicContact CG1-CB 4.43Å; I204-A298 HydrophobicContact CG2-CB 3.88Å; Q294-A298 WeakPolarHBondContact O-CB 3.29Å; Q294-A298 PolarHBondContact O-N 2.97Å; M295-A298 PolarHBondContact O-N 3.05Å; W296-A298 PolarHBondContact O-N 3.42Å
299W87.3Confident77.2Confident144 Ų14468.8 Ų68.855%0.54536%0.363SS..Hα-helixtrans-96.6-28.6-169.9-73.491.3000114K201 T205 M295 W296K201-W299 HydrophobicContact CD-CE3 4.37Å; T205-W299 PolarHBondContact OG1-NE1 3.47Å; M295-W299 PolarHBondContact O-N 2.6Å; M295-W299 VanDerWaalsContact O-N 3.13Å; M295-W299 PolarHBondContact SD-NE1 2.87Å; W296-W299 PolarHBondContact O-N 2.91Å
300D84.4Confident76Confident56 Ų5669.3 Ų69.330%0.29936%0.362SS..  trans-106.7114.5-179.6-174.8-0.7000111.6W296 A302 A303W296-D300 VanDerWaalsContact CD1-CB 3.47Å; W296-D300 PolarHBondContact NE1-OD2 3.25Å; W296-D300 WeakPolarHBondContact O-CB 3.38Å; W296-D300 PolarHBondContact O-N 2.92Å; D300-A302 PolarHBondContact O-N 2.91Å; D300-A302 WeakPolarHBondContact OD1-CB 3.4Å; D300-A302 PolarHBondContact OD1-N 3Å; D300-A303 HydrophobicContact CB-CB 4.27Å; D300-A303 WeakPolarHBondContact O-CB 3.32Å; D300-A303 PolarHBondContact O-N 2.87Å
301P75.2Confident74.9Confident107 Ų10769.7 Ų69.770%0.69537%0.365SS*.THydrogen-bonded Turntrans-61.8-25.8173.8-22.434.6000114.1
302A76Confident73.8Confident83 Ų8373.6 Ų73.669%0.68639%0.385SS*.THydrogen-bonded Turntrans-88.70.3-178.100000113.7D300D300-A302 PolarHBondContact O-N 2.91Å; D300-A302 WeakPolarHBondContact OD1-CB 3.4Å; D300-A302 PolarHBondContact OD1-N 3Å
303A71.9Confident72.9Confident5 Ų570.7 Ų70.74%0.04137%0.365CS..SBendtrans-59.6127.6176.900000111.2W296 D300 R305W296-A303 HydrophobicContact CG-CB 4.25Å; D300-A303 HydrophobicContact CB-CB 4.27Å; D300-A303 WeakPolarHBondContact O-CB 3.32Å; D300-A303 PolarHBondContact O-N 2.87Å; A303-R305 WeakPolarHBondContact O-CG 3.35Å; A303-R305 PolarHBondContact O-N 2.75Å
304P66.1Low72.1Confident73 Ų7373.1 Ų73.147%0.47438%0.376SS..  trans-74.895.7-175.128.9-35000111.9E306 A307 F310P304-E306 VanDerWaalsContact C-N 3.31Å; P304-E306 PolarHBondContact O-N 3Å; P304-A307 HydrophobicContact CB-CB 4.21Å; P304-A307 HydrophobicContact CG-CB 4.43Å; P304-F310 WeakPolarHBondContact O-CD2 3.25Å; P304-F310 WeakPolarHBondContact O-CE2 3.41Å
305R59.2Low71.4Confident157 Ų15771.5 Ų71.559%0.59237%0.369SS*.THydrogen-bonded Turntrans-68.9-21.3-172.7-57.3-178.2-172.8162.24.3115.2A303A303-R305 WeakPolarHBondContact O-CG 3.35Å; A303-R305 PolarHBondContact O-N 2.75Å
306E55.1Low70.7Confident180 Ų18071 Ų7184%0.84137%0.367SS*.THydrogen-bonded Turntrans-99.515.4-175.1-67.5-69.8149.100113.2P304P304-E306 VanDerWaalsContact C-N 3.31Å; P304-E306 PolarHBondContact O-N 3Å
307A57.6Low70.2Confident27 Ų2764.1 Ų64.122%0.22334%0.342CS..SBendtrans-99.3145.1-170.100000113.6P304 P309 F310P304-A307 HydrophobicContact CB-CB 4.21Å; P304-A307 HydrophobicContact CG-CB 4.43Å; A307-P309 VanDerWaalsContact C-N 3.26Å; A307-P309 HydrophobicContact CB-CG 3.83Å; A307-P309 WeakPolarHBondContact O-CD 3.3Å; A307-F310 PolarHBondContact O-N 3.21Å
308M57.9Low69.9Low94 Ų9463 Ų6346%0.46333%0.334SS..Hα-helixtrans-32.4-45.4170.4-61.5-76.6-165.700116V41 F310 I311 I312V41-M308 HydrophobicContact CB-SD 4.48Å; V41-M308 HydrophobicContact CG1-CE 4.5Å; V41-M308 HydrophobicContact CG1-SD 3.79Å; V41-M308 HydrophobicContact CG2-CE 3.36Å; V41-M308 HydrophobicContact CG2-SD 3.77Å; M308-F310 VanDerWaalsContact C-N 3.27Å; M308-F310 PolarHBondContact O-N 2.86Å; M308-I311 PolarHBondContact O-N 3.38Å; M308-I312 HydrophobicContact CB-CD1 4.26Å; M308-I312 WeakPolarHBondContact O-CG1 3.32Å; M308-I312 PolarHBondContact O-N 3.45Å
309P58.6Low69.7Low64 Ų6465.1 Ų65.142%0.41634%0.343SS..Hα-helixtrans-54.3-31.2175.616.3-33000115.8A307 S313A307-P309 VanDerWaalsContact C-N 3.26Å; A307-P309 HydrophobicContact CB-CG 3.83Å; A307-P309 WeakPolarHBondContact O-CD 3.3Å; P309-S313 WeakPolarHBondContact O-CB 3.31Å; P309-S313 PolarHBondContact O-N 2.87Å; P309-S313 PolarHBondContact O-OG 2.97Å
310F65.3Low69.6Low44 Ų4458.2 Ų58.219%0.19332%0.317CS..Hα-helixtrans-66.8-49.6175.3-84.7-101.6000111.4V293 P304 A307 M308 S313 M314V293-F310 HydrophobicContact CG1-CB 4.46Å; V293-F310 HydrophobicContact CG1-CD1 3.46Å; V293-F310 VanDerWaalsContact CG1-CD1 3.46Å; V293-F310 HydrophobicContact CG1-CD2 3.66Å; V293-F310 HydrophobicContact CG1-CE1 3.44Å; V293-F310 VanDerWaalsContact CG1-CE1 3.44Å; V293-F310 HydrophobicContact CG1-CE2 3.62Å; V293-F310 HydrophobicContact CG1-CG 3.59Å; V293-F310 HydrophobicContact CG1-CZ 3.52Å; P304-F310 WeakPolarHBondContact O-CD2 3.25Å; P304-F310 WeakPolarHBondContact O-CE2 3.41Å; A307-F310 PolarHBondContact O-N 3.21Å; M308-F310 VanDerWaalsContact C-N 3.27Å; M308-F310 PolarHBondContact O-N 2.86Å; F310-S313 PolarHBondContact O-N 2.87Å; F310-M314 PolarHBondContact O-N 2.97Å
311I64.1Low69.4Low37 Ų3755.8 Ų55.819%0.1930%0.304CS..Hα-helixtrans-57.8-53.1176.7-66.7170.7000110.1V41 E45 M308 S313 M314 L315V41-I311 HydrophobicContact CG1-CD1 3.66Å; E45-I311 HydrophobicContact CB-CG2 4.19Å; E45-I311 HydrophobicContact CG-CG2 4.07Å; E45-I311 WeakPolarHBondContact OE1-CG2 3.31Å; M308-I311 PolarHBondContact O-N 3.38Å; I311-S313 PolarHBondContact O-N 2.7Å; I311-M314 PolarHBondContact O-N 2.69Å; I311-M314 VanDerWaalsContact O-N 3.1Å; I311-L315 HydrophobicContact CG2-CD1 3.96Å; I311-L315 HydrophobicContact CG2-CG 4.43Å; I311-L315 VanDerWaalsContact O-CG 3.32Å; I311-L315 WeakPolarHBondContact O-CG 3.02Å; I311-L315 PolarHBondContact O-N 2.99Å
312I65.4Low69.7Low90 Ų9051 Ų5146%0.46227%0.273SS..Hα-helixtrans-57-39.6179-68.1166.8000111.4M308 L315 L316M308-I312 HydrophobicContact CB-CD1 4.26Å; M308-I312 WeakPolarHBondContact O-CG1 3.32Å; M308-I312 PolarHBondContact O-N 3.45Å; I312-L315 PolarHBondContact O-N 3.26Å; I312-L316 HydrophobicContact CG2-CD1 3.69Å; I312-L316 WeakPolarHBondContact O-CB 3.16Å; I312-L316 WeakPolarHBondContact O-CD1 3.39Å; I312-L316 WeakPolarHBondContact O-CG 3.35Å; I312-L316 PolarHBondContact O-N 2.93Å
313S70.8Confident70.2Confident7 Ų749 Ų495%0.04925%0.253CS..Hα-helixtrans-70.5-34.7179.3-61.90000113.1P289 V293 P309 F310 I311 L316 A317P289-S313 PolarHBondContact O-OG 3.38Å; V293-S313 WeakPolarHBondContact CG2-OG 3.39Å; P309-S313 WeakPolarHBondContact O-CB 3.31Å; P309-S313 PolarHBondContact O-N 2.87Å; P309-S313 PolarHBondContact O-OG 2.97Å; F310-S313 PolarHBondContact O-N 2.87Å; I311-S313 PolarHBondContact O-N 2.7Å; S313-L316 PolarHBondContact O-N 2.97Å; S313-A317 PolarHBondContact O-N 2.84Å
314M69.4Low70.8Confident68 Ų6848.7 Ų48.734%0.33525%0.251SS..Hα-helixtrans-71.6-37.5175.3-159.2173.6-173.500112.1Q99 F310 I311 S318Q99-M314 VanDerWaalsContact CD-CE 3.46Å; Q99-M314 HydrophobicContact CG-CE 4.08Å; Q99-M314 PolarHBondContact NE2-SD 3.48Å; F310-M314 PolarHBondContact O-N 2.97Å; I311-M314 PolarHBondContact O-N 2.69Å; I311-M314 VanDerWaalsContact O-N 3.1Å; M314-S318 PolarHBondContact O-N 2.78Å; M314-S318 PolarHBondContact O-OG 3.3Å
315L70.6Confident71.7Confident23 Ų2345.6 Ų45.612%0.1223%0.231CC..Hα-helixtrans-63-43.7171.3-66.2173.5000111.4V48 L49 I311 I312 A317 S318 L319V48-L315 HydrophobicContact CB-CD2 4.25Å; V48-L315 HydrophobicContact CG1-CD1 4.32Å; V48-L315 HydrophobicContact CG1-CD2 3.93Å; L49-L315 HydrophobicContact CD1-CD2 4.42Å; L49-L315 HydrophobicContact CD2-CD2 3.76Å; L49-L315 HydrophobicContact CG-CD2 3.64Å; I311-L315 HydrophobicContact CG2-CD1 3.96Å; I311-L315 HydrophobicContact CG2-CG 4.43Å; I311-L315 VanDerWaalsContact O-CG 3.32Å; I311-L315 WeakPolarHBondContact O-CG 3.02Å; I311-L315 PolarHBondContact O-N 2.99Å; I312-L315 PolarHBondContact O-N 3.26Å; L315-A317 PolarHBondContact O-N 3.49Å; L315-S318 WeakPolarHBondContact O-CB 3.18Å; L315-S318 PolarHBondContact O-N 3.04Å; L315-S318 VanDerWaalsContact O-N 3.14Å; L315-L319 PolarHBondContact O-N 2.83Å
316L74Confident72.9Confident47 Ų4744.4 Ų44.425%0.24623%0.227CC..Hα-helixtrans-62-41.1179.7-82.5156.5000113C286 P289 I312 S313 S318 L319C286-L316 WeakPolarHBondContact CB-O 3.36Å; C286-L316 CarbonylContact O-C 3.53Å; P289-L316 HydrophobicContact CB-CD1 4.14Å; P289-L316 HydrophobicContact CG-CB 3.79Å; P289-L316 HydrophobicContact CG-CD1 3.68Å; P289-L316 HydrophobicContact CG-CG 4.24Å; I312-L316 HydrophobicContact CG2-CD1 3.69Å; I312-L316 WeakPolarHBondContact O-CB 3.16Å; I312-L316 WeakPolarHBondContact O-CD1 3.39Å; I312-L316 WeakPolarHBondContact O-CG 3.35Å; I312-L316 PolarHBondContact O-N 2.93Å; S313-L316 PolarHBondContact O-N 2.97Å; L316-S318 VanDerWaalsContact C-N 3.27Å; L316-S318 PolarHBondContact O-N 2.82Å; L316-L319 HydrophobicContact CD2-CD1 4.18Å; L316-L319 PolarHBondContact O-N 3.1Å
317A77.9Confident74.3Confident3 Ų336.6 Ų36.63%0.02519%0.191CC..Hα-helixtrans-59.5-39.1173.900000112.4C286 W287 F290 S313 L315 L319 N320C286-A317 PolarHBondContact O-N 3.42Å; W287-A317 HydrophobicContact CD2-CB 4.35Å; W287-A317 HydrophobicContact CE3-CB 3.83Å; W287-A317 HydrophobicContact CH2-CB 4.23Å; W287-A317 HydrophobicContact CZ3-CB 3.78Å; F290-A317 HydrophobicContact CB-CB 3.99Å; F290-A317 HydrophobicContact CD2-CB 4.08Å; F290-A317 HydrophobicContact CG-CB 3.94Å; S313-A317 PolarHBondContact O-N 2.84Å; L315-A317 PolarHBondContact O-N 3.49Å; A317-L319 VanDerWaalsContact C-N 3.33Å; A317-L319 PolarHBondContact O-N 2.98Å; A317-N320 WeakPolarHBondContact O-CB 3.37Å; A317-N320 PolarHBondContact O-N 2.99Å
318S76.6Confident75.5Confident1 Ų135.3 Ų35.31%0.00718%0.18CC..Hα-helixtrans-70.2-27.5-179.4-57.70000113.1M314 L315 L316 N320M314-S318 PolarHBondContact O-N 2.78Å; M314-S318 PolarHBondContact O-OG 3.3Å; L315-S318 WeakPolarHBondContact O-CB 3.18Å; L315-S318 PolarHBondContact O-N 3.04Å; L315-S318 VanDerWaalsContact O-N 3.14Å; L316-S318 VanDerWaalsContact C-N 3.27Å; L316-S318 PolarHBondContact O-N 2.82Å; S318-N320 PolarHBondContact O-N 2.81Å
319L80.7Confident76.5Confident57 Ų5734.6 Ų34.630%0.29818%0.176SC..Hα-helixtrans-66.2-22.4176.3-71.2171.9000113.7V52 L315 L316 A317 S321 C322 C323V52-L319 HydrophobicContact CG2-CD2 3.61Å; V52-L319 HydrophobicContact CG2-CG 4.46Å; L315-L319 PolarHBondContact O-N 2.83Å; L316-L319 HydrophobicContact CD2-CD1 4.18Å; L316-L319 PolarHBondContact O-N 3.1Å; A317-L319 VanDerWaalsContact C-N 3.33Å; A317-L319 PolarHBondContact O-N 2.98Å; L319-S321 VanDerWaalsContact C-N 3.33Å; L319-S321 PolarHBondContact O-N 3.24Å; L319-C322 PolarHBondContact O-N 2.63Å; L319-C322 PolarHBondContact O-SG 2.96Å; L319-C323 PolarHBondContact O-N 3.41Å; L319-C323 VanDerWaalsContact O-N 3.1Å; L319-C323 PolarHBondContact O-SG 3.22Å
320N83.8Confident77.5Confident0 Ų036.4 Ų36.40%019%0.19CC..Hα-helixtrans-56.1-46.4178.2176.965000112Y283 C286 W287 A317 S318 C323Y283-N320 WeakPolarHBondContact CA-OD1 3.43Å; Y283-N320 WeakPolarHBondContact CD2-OD1 3.46Å; C286-N320 HydrophobicContact CB-CB 3.82Å; W287-N320 PolarHBondContact NE1-ND2 2.96Å; A317-N320 WeakPolarHBondContact O-CB 3.37Å; A317-N320 PolarHBondContact O-N 2.99Å; S318-N320 PolarHBondContact O-N 2.81Å; N320-C323 PolarHBondContact O-N 2.93Å
321S81.6Confident77.9Confident4 Ų437.2 Ų37.23%0.02819%0.193CC..Hα-helixtrans-77-21.6-176.7-69.20000114N60 D88 L319N60-S321 PolarHBondContact ND2-O 3.48Å; N60-S321 VanDerWaalsContact ND2-O 3.1Å; D88-S321 WeakPolarHBondContact OD1-CB 3.34Å; D88-S321 PolarHBondContact OD1-OG 3.49Å; L319-S321 VanDerWaalsContact C-N 3.33Å; L319-S321 PolarHBondContact O-N 3.24Å
322C81.9Confident78.2Confident7 Ų735.8 Ų35.85%0.04719%0.187CC..Hα-helixtrans-84.9-24.5173.575.70000113.1V52 L55 A56 L319 P325V52-C322 HydrophobicContact CG1-CB 4.47Å; L55-C322 HydrophobicContact CB-CB 4.27Å; A56-C322 HydrophobicContact CB-CB 4.1Å; L319-C322 PolarHBondContact O-N 2.63Å; L319-C322 PolarHBondContact O-SG 2.96Å; C322-P325 WeakPolarHBondContact O-CD 3.44Å
323C85.1Confident78.4Confident40 Ų4033.1 Ų33.127%0.2718%0.181SC..Hα-helixtrans-67.1-34.4178.5-72.50000113.6L319 N320 W326 I327L319-C323 PolarHBondContact O-N 3.41Å; L319-C323 VanDerWaalsContact O-N 3.1Å; L319-C323 PolarHBondContact O-SG 3.22Å; N320-C323 PolarHBondContact O-N 2.93Å; C323-W326 PolarHBondContact O-N 3.3Å; C323-W326 VanDerWaalsContact O-N 3.15Å; C323-I327 HydrophobicContact CB-CD1 4.23Å; C323-I327 WeakPolarHBondContact O-CG1 3.39Å; C323-I327 PolarHBondContact O-N 3.5Å; C323-I327 VanDerWaalsContact O-N 3.11Å
324N85.8Confident78.6Confident0 Ų037.5 Ų37.50%020%0.201CC..Hα-helixtrans-56.6-48.1-171.3-70-29.1000114.1D88 W326 I327 Y328D88-N324 PolarHBondContact OD2-ND2 3.41Å; N324-W326 PolarHBondContact O-N 3.36Å; N324-I327 PolarHBondContact O-N 3.44Å; N324-Y328 HydrophobicContact CB-CE2 4.3Å; N324-Y328 WeakPolarHBondContact O-CD2 3.2Å; N324-Y328 VanDerWaalsContact O-CG 3.28Å; N324-Y328 PolarHBondContact O-N 2.96Å
325P84.3Confident78.5Confident7 Ų734.3 Ų34.35%0.04519%0.185CC..Hα-helixtrans-55.2-42.6173.2-29.836.1000115.2N60 V63 C322 Y328 M329N60-P325 HydrophobicContact CB-CG 4.4Å; V63-P325 HydrophobicContact CG2-CB 3.82Å; V63-P325 HydrophobicContact CG2-CG 4.17Å; C322-P325 WeakPolarHBondContact O-CD 3.44Å; P325-Y328 PolarHBondContact O-N 3.14Å; P325-M329 PolarHBondContact O-N 2.88Å
326W83.4Confident78.5Confident133 Ų13334.6 Ų34.650%0.50419%0.186SC..Hα-helixtrans-66-40.4178.8-62.498.9000111.4L55 C323 N324 Y328 M329 C330L55-W326 HydrophobicContact CD2-CZ2 4.11Å; C323-W326 PolarHBondContact O-N 3.3Å; C323-W326 VanDerWaalsContact O-N 3.15Å; N324-W326 PolarHBondContact O-N 3.36Å; W326-Y328 VanDerWaalsContact C-N 3.34Å; W326-Y328 PolarHBondContact O-N 3.45Å; W326-M329 HydrophobicContact CD2-CE 4.42Å; W326-M329 HydrophobicContact CE3-CE 3.37Å; W326-M329 HydrophobicContact CZ3-CE 3.52Å; W326-M329 PolarHBondContact O-N 3.43Å; W326-C330 PolarHBondContact O-N 2.92Å; W326-C330 PolarHBondContact O-SG 3.22Å; W326-C330 VanDerWaalsContact O-SG 3.38Å
327I85Confident78.4Confident16 Ų1637.9 Ų37.98%0.08220%0.2CC..Hα-helixtrans-63.4-42.8175.1-59.2162.6000110.1M275 V278 I279 A282 C323 N324 M329 C330 F331M275-I327 HydrophobicContact CG-CG2 3.83Å; V278-I327 HydrophobicContact CB-CG2 4.3Å; V278-I327 HydrophobicContact CG1-CD1 3.97Å; V278-I327 HydrophobicContact CG1-CG1 3.95Å; V278-I327 HydrophobicContact CG1-CG2 4.04Å; I279-I327 HydrophobicContact CD1-CG2 4.31Å; I279-I327 HydrophobicContact CG1-CB 4.29Å; I279-I327 HydrophobicContact CG1-CD1 3.77Å; I279-I327 HydrophobicContact CG1-CG2 3.84Å; A282-I327 HydrophobicContact CB-CD1 4.27Å; C323-I327 HydrophobicContact CB-CD1 4.23Å; C323-I327 WeakPolarHBondContact O-CG1 3.39Å; C323-I327 PolarHBondContact O-N 3.5Å; C323-I327 VanDerWaalsContact O-N 3.11Å; N324-I327 PolarHBondContact O-N 3.44Å; I327-M329 VanDerWaalsContact C-N 3.33Å; I327-M329 PolarHBondContact O-N 3.05Å; I327-C330 PolarHBondContact O-N 3.45Å; I327-F331 HydrophobicContact CG2-CD2 3.82Å; I327-F331 HydrophobicContact CG2-CE2 4.14Å; I327-F331 WeakPolarHBondContact O-CD2 3.47Å; I327-F331 PolarHBondContact O-N 2.94Å; I327-F331 VanDerWaalsContact O-N 3.08Å
328Y83.5Confident78.1Confident0 Ų040.1 Ų40.10%021%0.211CC..Hα-helixtrans-62.6-38.1174-58.8-29.3000112.6V63 M81 L84 M275 I279 N324 P325 W326 F331 A332V63-Y328 HydrophobicContact CG1-CD2 3.83Å; V63-Y328 HydrophobicContact CG1-CE2 4.19Å; V63-Y328 HydrophobicContact CG2-CD2 3.83Å; M81-Y328 HydrophobicContact CB-CE2 4.38Å; M81-Y328 HydrophobicContact CE-CD1 3.78Å; M81-Y328 HydrophobicContact CE-CE1 4.08Å; M81-Y328 HydrophobicContact CE-CG 4.34Å; M81-Y328 HydrophobicContact CG-CD1 4.41Å; M81-Y328 HydrophobicContact CG-CE1 3.97Å; M81-Y328 HydrophobicContact CG-CE2 4.33Å; L84-Y328 VanDerWaalsContact CD2-OH 3.25Å; L84-Y328 WeakPolarHBondContact CD2-OH 3.47Å; M275-Y328 HydrophobicContact CE-CD1 3.92Å; M275-Y328 HydrophobicContact CE-CE1 3.72Å; M275-Y328 HydrophobicContact CG-CD1 4.48Å; M275-Y328 HydrophobicContact SD-CD1 3.7Å; M275-Y328 HydrophobicContact SD-CE1 4.15Å; I279-Y328 HydrophobicContact CD1-CD1 4.32Å; I279-Y328 HydrophobicContact CD1-CE1 3.55Å; N324-Y328 HydrophobicContact CB-CE2 4.3Å; N324-Y328 WeakPolarHBondContact O-CD2 3.2Å; N324-Y328 VanDerWaalsContact O-CG 3.28Å; N324-Y328 PolarHBondContact O-N 2.96Å; P325-Y328 PolarHBondContact O-N 3.14Å; W326-Y328 VanDerWaalsContact C-N 3.34Å; W326-Y328 PolarHBondContact O-N 3.45Å; Y328-F331 PolarHBondContact O-N 3.46Å; Y328-A332 CarbonylContact O-C 3.59Å; Y328-A332 VanDerWaalsContact O-CA 3.3Å; Y328-A332 WeakPolarHBondContact O-CA 3.46Å; Y328-A332 VanDerWaalsContact O-CB 3.3Å; Y328-A332 WeakPolarHBondContact O-CB 3.5Å; Y328-A332 PolarHBondContact O-N 3.46Å
329M79.4Confident77.8Confident78 Ų7841.1 Ų41.138%0.38422%0.216SC..Hα-helixtrans-64.7-41.9176.3-171.7167.560.100112.2P325 W326 I327 G333 F336P325-M329 PolarHBondContact O-N 2.88Å; W326-M329 HydrophobicContact CD2-CE 4.42Å; W326-M329 HydrophobicContact CE3-CE 3.37Å; W326-M329 HydrophobicContact CZ3-CE 3.52Å; W326-M329 PolarHBondContact O-N 3.43Å; I327-M329 VanDerWaalsContact C-N 3.33Å; I327-M329 PolarHBondContact O-N 3.05Å; M329-G333 WeakPolarHBondContact O-CA 3.21Å; M329-G333 PolarHBondContact O-N 3.37Å; M329-G333 VanDerWaalsContact O-N 3.12Å; M329-F336 VanDerWaalsContact CA-CE2 3.46Å; M329-F336 HydrophobicContact CB-CD2 4.09Å; M329-F336 HydrophobicContact CB-CE2 3.85Å; M329-F336 HydrophobicContact CB-CZ 4.21Å; M329-F336 HydrophobicContact CG-CD2 4.03Å; M329-F336 HydrophobicContact CG-CE2 4.3Å; M329-F336 HydrophobicContact CG-CG 4.25Å
330C78.4Confident77.5Confident103 Ų10346.6 Ų46.670%0.69623%0.233SC*.Hα-helixtrans-67.2-35.4177.7-69.50000113.9W326 I327W326-C330 PolarHBondContact O-N 2.92Å; W326-C330 PolarHBondContact O-SG 3.22Å; W326-C330 VanDerWaalsContact O-SG 3.38Å; I327-C330 PolarHBondContact O-N 3.45Å
331F74.3Confident76.9Confident60 Ų6051.6 Ų51.626%0.26326%0.256SS..Hα-helixtrans-104.3-16.2-174-74.4-83.4000115.1T271 K274 M275 V278 I327 Y328T271-F331 HydrophobicContact CG2-CD1 4.11Å; K274-F331 HydrophobicContact CB-CD1 4.34Å; K274-F331 HydrophobicContact CB-CE1 3.58Å; K274-F331 HydrophobicContact CB-CZ 4.18Å; M275-F331 HydrophobicContact CB-CB 3.67Å; M275-F331 HydrophobicContact CB-CD1 4Å; M275-F331 HydrophobicContact CB-CD2 3.96Å; M275-F331 HydrophobicContact CB-CG 3.61Å; M275-F331 HydrophobicContact CG-CB 3.58Å; M275-F331 HydrophobicContact CG-CD2 3.91Å; M275-F331 HydrophobicContact CG-CG 3.82Å; M275-F331 HydrophobicContact SD-CB 4.11Å; V278-F331 HydrophobicContact CB-CE2 4.33Å; V278-F331 HydrophobicContact CG2-CE2 4.05Å; V278-F331 HydrophobicContact CG2-CZ 4.03Å; I327-F331 HydrophobicContact CG2-CD2 3.82Å; I327-F331 HydrophobicContact CG2-CE2 4.14Å; I327-F331 WeakPolarHBondContact O-CD2 3.47Å; I327-F331 PolarHBondContact O-N 2.94Å; I327-F331 VanDerWaalsContact O-N 3.08Å; Y328-F331 PolarHBondContact O-N 3.46Å
332A71.1Confident76.3Confident7 Ų754.9 Ų54.96%0.05827%0.273CS..SBendtrans-131.232.7178.500000111.8Y328 H334 L335Y328-A332 CarbonylContact O-C 3.59Å; Y328-A332 VanDerWaalsContact O-CA 3.3Å; Y328-A332 WeakPolarHBondContact O-CA 3.46Å; Y328-A332 VanDerWaalsContact O-CB 3.3Å; Y328-A332 WeakPolarHBondContact O-CB 3.5Å; Y328-A332 PolarHBondContact O-N 3.46Å; A332-H334 PolarHBondContact O-N 2.99Å; A332-H334 PolarHBondContact O-ND1 3.32Å; A332-L335 WeakPolarHBondContact O-CB 3.32Å; A332-L335 PolarHBondContact O-N 2.84Å
333G69.4Low75.7Confident34 Ų3460.5 Ų60.535%0.35130%0.297SS..Hα-helixtrans-53.9-21.9-176.100000116.1M329 L335 F336 H337M329-G333 WeakPolarHBondContact O-CA 3.21Å; M329-G333 PolarHBondContact O-N 3.37Å; M329-G333 VanDerWaalsContact O-N 3.12Å; G333-L335 PolarHBondContact O-N 2.91Å; G333-F336 PolarHBondContact O-N 2.68Å; G333-F336 VanDerWaalsContact O-N 3.14Å; G333-H337 PolarHBondContact O-N 3.29Å
334H73.5Confident74.9Confident99 Ų9963.5 Ų63.546%0.45831%0.31SS..Hα-helixtrans-58.6-32.3170.965.8-81.5000112.5Y78 A332 F336 H337 D338Y78-H334 PolarHBondContact OH-NE2 3.18Å; A332-H334 PolarHBondContact O-N 2.99Å; A332-H334 PolarHBondContact O-ND1 3.32Å; H334-F336 VanDerWaalsContact C-N 3.33Å; H334-F336 PolarHBondContact O-N 2.94Å; H334-H337 WeakPolarHBondContact O-CB 3.32Å; H334-H337 PolarHBondContact O-N 2.74Å; H334-D338 PolarHBondContact O-N 2.71Å
335L67.4Low73.7Confident1 Ų166 Ų661%0.00533%0.327CS..Hα-helixtrans-62.4-40.5176-177.665.7000111.8A66 I67 T70 Y78 A332 G333 L339A66-L335 HydrophobicContact CB-CD1 4.13Å; A66-L335 HydrophobicContact CB-CD2 4.06Å; A66-L335 HydrophobicContact CB-CG 3.68Å; A66-L335 WeakPolarHBondContact O-CD1 3.45Å; I67-L335 HydrophobicContact CG1-CD2 4.07Å; T70-L335 HydrophobicContact CG2-CD1 3.36Å; Y78-L335 HydrophobicContact CE1-CD1 4.49Å; Y78-L335 HydrophobicContact CE1-CD2 4.42Å; A332-L335 WeakPolarHBondContact O-CB 3.32Å; A332-L335 PolarHBondContact O-N 2.84Å; G333-L335 PolarHBondContact O-N 2.91Å; L335-L339 PolarHBondContact O-N 3.01Å
336F71.2Confident72.4Confident30 Ų3069.4 Ų69.413%0.13235%0.35CS..Hα-helixtrans-80.6-25.4178.9-63.4-88.2000111.8V63 M329 G333 H334 L339 R340V63-F336 HydrophobicContact CG2-CZ 4.01Å; M329-F336 VanDerWaalsContact CA-CE2 3.46Å; M329-F336 HydrophobicContact CB-CD2 4.09Å; M329-F336 HydrophobicContact CB-CE2 3.85Å; M329-F336 HydrophobicContact CB-CZ 4.21Å; M329-F336 HydrophobicContact CG-CD2 4.03Å; M329-F336 HydrophobicContact CG-CE2 4.3Å; M329-F336 HydrophobicContact CG-CG 4.25Å; G333-F336 PolarHBondContact O-N 2.68Å; G333-F336 VanDerWaalsContact O-N 3.14Å; H334-F336 VanDerWaalsContact C-N 3.33Å; H334-F336 PolarHBondContact O-N 2.94Å; F336-L339 PolarHBondContact O-N 3.41Å; F336-R340 VanDerWaalsContact O-CB 3.31Å; F336-R340 WeakPolarHBondContact O-CB 3.34Å; F336-R340 PolarHBondContact O-N 3.19Å
337H72.5Confident71Confident116 Ų11666.1 Ų66.154%0.53735%0.347SS..Hα-helixtrans-64.6-47.8168.6-171.6-81.2000111.4G333 H334 L339 R340 Q341G333-H337 PolarHBondContact O-N 3.29Å; H334-H337 WeakPolarHBondContact O-CB 3.32Å; H334-H337 PolarHBondContact O-N 2.74Å; H337-L339 VanDerWaalsContact C-N 3.32Å; H337-L339 PolarHBondContact O-N 3.47Å; H337-R340 PolarHBondContact O-N 2.87Å; H337-Q341 WeakPolarHBondContact O-CB 3.46Å; H337-Q341 PolarHBondContact O-N 2.81Å
338D70.3Confident69.5Low49 Ų4968.2 Ų68.226%0.26237%0.367SS..Hα-helixtrans-55.6-46.2173.1-75.7-3.5000111.3T70 H334 Q341 N342T70-D338 WeakPolarHBondContact CB-OD2 3.28Å; T70-D338 PolarHBondContact OG1-OD2 3.2Å; H334-D338 PolarHBondContact O-N 2.71Å; D338-Q341 PolarHBondContact O-N 3.49Å; D338-N342 WeakPolarHBondContact O-CB 3.35Å; D338-N342 PolarHBondContact O-N 3.23Å; D338-N342 PolarHBondContact O-ND2 2.88Å
339L71.4Confident67.9Low23 Ų2377 Ų7712%0.1240%0.4CS..Hα-helixtrans-63.7-46.2178.2179.3131.8000111.8L65 A66 L335 F336 H337 Q341 N342 F343L65-L339 HydrophobicContact CB-CD1 4.01Å; A66-L339 HydrophobicContact CB-CB 4.17Å; A66-L339 HydrophobicContact CB-CD1 3.77Å; L335-L339 PolarHBondContact O-N 3.01Å; F336-L339 PolarHBondContact O-N 3.41Å; H337-L339 VanDerWaalsContact C-N 3.32Å; H337-L339 PolarHBondContact O-N 3.47Å; L339-Q341 PolarHBondContact O-N 3.5Å; L339-N342 PolarHBondContact O-N 3.23Å; L339-F343 HydrophobicContact CD1-CE2 4.46Å; L339-F343 HydrophobicContact CD2-CD2 4.19Å; L339-F343 HydrophobicContact CG-CD2 4.05Å; L339-F343 HydrophobicContact CG-CE2 4.36Å; L339-F343 WeakPolarHBondContact O-CB 3.47Å; L339-F343 PolarHBondContact O-N 3.22Å
340R74.3Confident66.5Low172 Ų17282.2 Ų82.265%0.64942%0.417SS*.Hα-helixtrans-61.2-43.6176.5179.5176.9176.6179.1-0.3111.4F336 H337 F343 L344F336-R340 VanDerWaalsContact O-CB 3.31Å; F336-R340 WeakPolarHBondContact O-CB 3.34Å; F336-R340 PolarHBondContact O-N 3.19Å; H337-R340 PolarHBondContact O-N 2.87Å; R340-F343 PolarHBondContact O-N 3.19Å; R340-L344 HydrophobicContact CG-CD1 3.8Å; R340-L344 HydrophobicContact CG-CG 4.4Å; R340-L344 WeakPolarHBondContact O-CB 3.14Å; R340-L344 VanDerWaalsContact O-CG 3.27Å; R340-L344 WeakPolarHBondContact O-CG 3.44Å; R340-L344 PolarHBondContact O-N 3.25Å
341Q71.6Confident65.2Low105 Ų10582.8 Ų82.849%0.49141%0.412SS..Hα-helixtrans-65.5-43.1178.7-171.3170.33.500111.1H337 D338 L339 C345H337-Q341 WeakPolarHBondContact O-CB 3.46Å; H337-Q341 PolarHBondContact O-N 2.81Å; D338-Q341 PolarHBondContact O-N 3.49Å; L339-Q341 PolarHBondContact O-N 3.5Å; Q341-C345 VanDerWaalsContact O-CB 3.22Å; Q341-C345 WeakPolarHBondContact O-CB 3.15Å; Q341-C345 PolarHBondContact O-N 3.3Å; Q341-C345 PolarHBondContact O-SG 2.95Å
342N68.3Low63.9Low72 Ų7286.9 Ų86.939%0.38543%0.43SS..Hα-helixtrans-64.7-42.9175-76.1-27.9000112.4D338 L339 C345 C346D338-N342 WeakPolarHBondContact O-CB 3.35Å; D338-N342 PolarHBondContact O-N 3.23Å; D338-N342 PolarHBondContact O-ND2 2.88Å; L339-N342 PolarHBondContact O-N 3.23Å; N342-C345 PolarHBondContact O-N 2.95Å; N342-C346 VanDerWaalsContact O-CB 3.22Å; N342-C346 WeakPolarHBondContact O-CB 3.44Å; N342-C346 PolarHBondContact O-N 3.13Å; N342-C346 PolarHBondContact O-SG 2.74Å
343F69.4Low62.8Low125 Ų12590.1 Ų90.155%0.54845%0.452SS..Hα-helixtrans-62.2-48.2175.8-102.9-92.2000112L339 R340 C345 C346 S347L339-F343 HydrophobicContact CD1-CE2 4.46Å; L339-F343 HydrophobicContact CD2-CD2 4.19Å; L339-F343 HydrophobicContact CG-CD2 4.05Å; L339-F343 HydrophobicContact CG-CE2 4.36Å; L339-F343 WeakPolarHBondContact O-CB 3.47Å; L339-F343 PolarHBondContact O-N 3.22Å; R340-F343 PolarHBondContact O-N 3.19Å; F343-C345 PolarHBondContact O-N 2.87Å; F343-C346 PolarHBondContact O-N 2.95Å; F343-S347 PolarHBondContact O-N 2.94Å; F343-S347 PolarHBondContact O-OG 3.06Å
344L68.1Low61.7Low104 Ų10491.6 Ų91.655%0.54546%0.457SS..Hα-helixtrans-64.6-40.5178.6-68.7172.1000111.9R340 A348R340-L344 HydrophobicContact CG-CD1 3.8Å; R340-L344 HydrophobicContact CG-CG 4.4Å; R340-L344 WeakPolarHBondContact O-CB 3.14Å; R340-L344 VanDerWaalsContact O-CG 3.27Å; R340-L344 WeakPolarHBondContact O-CG 3.44Å; R340-L344 PolarHBondContact O-N 3.25Å; L344-A348 VanDerWaalsContact O-CB 3.31Å; L344-A348 WeakPolarHBondContact O-CB 3.4Å; L344-A348 PolarHBondContact O-N 3.08Å
345C59.8Low60.2Low53 Ų5393.5 Ų93.536%0.35847%0.466SS..Hα-helixtrans-69.6-34175.1-71.70000113Q341 N342 F343 R349Q341-C345 VanDerWaalsContact O-CB 3.22Å; Q341-C345 WeakPolarHBondContact O-CB 3.15Å; Q341-C345 PolarHBondContact O-N 3.3Å; Q341-C345 PolarHBondContact O-SG 2.95Å; N342-C345 PolarHBondContact O-N 2.95Å; F343-C345 PolarHBondContact O-N 2.87Å; C345-R349 WeakPolarHBondContact O-CB 3.44Å; C345-R349 VanDerWaalsContact O-CG 3.23Å; C345-R349 WeakPolarHBondContact O-CG 3.41Å; C345-R349 PolarHBondContact O-N 3Å
346C56.9Low58.9Low78 Ų7897.7 Ų97.753%0.52750%0.495SS..Hα-helixtrans-69.7-43.8174.1-77.30000111.4N342 F343 A348 R349 Y350N342-C346 VanDerWaalsContact O-CB 3.22Å; N342-C346 WeakPolarHBondContact O-CB 3.44Å; N342-C346 PolarHBondContact O-N 3.13Å; N342-C346 PolarHBondContact O-SG 2.74Å; F343-C346 PolarHBondContact O-N 2.95Å; C346-A348 PolarHBondContact O-N 3.34Å; C346-R349 PolarHBondContact O-N 3.33Å; C346-Y350 VanDerWaalsContact O-CB 3.31Å; C346-Y350 WeakPolarHBondContact O-CB 3.18Å; C346-Y350 PolarHBondContact O-N 2.84Å
347S55.8Low57.1Low63 Ų63105.8 Ų105.844%0.44152%0.524SS..Hα-helixtrans-60.5-43.9172.6-64.70000111.7F343 R349 Y350 L351F343-S347 PolarHBondContact O-N 2.94Å; F343-S347 PolarHBondContact O-OG 3.06Å; S347-R349 PolarHBondContact O-N 3.31Å; S347-Y350 PolarHBondContact O-N 3.39Å; S347-L351 WeakPolarHBondContact O-CB 3.26Å; S347-L351 PolarHBondContact O-N 2.98Å
348A52.6Low55.4Low60 Ų60105.9 Ų105.950%0.49654%0.536SS..Hα-helixtrans-63.6-37.5175.900000113L344 C346 K352L344-A348 VanDerWaalsContact O-CB 3.31Å; L344-A348 WeakPolarHBondContact O-CB 3.4Å; L344-A348 PolarHBondContact O-N 3.08Å; C346-A348 PolarHBondContact O-N 3.34Å; A348-K352 VanDerWaalsContact O-CB 3.26Å; A348-K352 WeakPolarHBondContact O-CB 3.42Å; A348-K352 PolarHBondContact O-N 3.05Å
349R50.1Low53.8Low184 Ų184111.8 Ų111.869%0.69456%0.562SS**Hα-helixtrans-72.4-34174-74175.1-168-173.95.2112.7C345 C346 S347 K352 S353C345-R349 WeakPolarHBondContact O-CB 3.44Å; C345-R349 VanDerWaalsContact O-CG 3.23Å; C345-R349 WeakPolarHBondContact O-CG 3.41Å; C345-R349 PolarHBondContact O-N 3Å; C346-R349 PolarHBondContact O-N 3.33Å; S347-R349 PolarHBondContact O-N 3.31Å; R349-K352 PolarHBondContact O-N 3Å; R349-S353 WeakPolarHBondContact O-CB 3.44Å; R349-S353 PolarHBondContact O-N 3.15Å
350Y49.7Very low52.2Low189 Ų189118.6 Ų118.674%0.74159%0.594SS**Hα-helixtrans-68.6-46.9177-162.1-96000110.5C346 S347 K352 S353 S354C346-Y350 VanDerWaalsContact O-CB 3.31Å; C346-Y350 WeakPolarHBondContact O-CB 3.18Å; C346-Y350 PolarHBondContact O-N 2.84Å; S347-Y350 PolarHBondContact O-N 3.39Å; Y350-K352 PolarHBondContact O-N 3.05Å; Y350-S353 WeakPolarHBondContact O-CB 3.36Å; Y350-S353 PolarHBondContact O-N 2.86Å; Y350-S353 VanDerWaalsContact O-N 3.17Å; Y350-S354 PolarHBondContact O-N 3.43Å; Y350-S354 PolarHBondContact O-OG 3.33Å
351L51.1Low50.4Low114 Ų114117.4 Ų117.460%0.59760%0.6SS**Hα-helixtrans-58.6-44.3171.1-94131.6000112.4S347 S353 S354 Q355S347-L351 WeakPolarHBondContact O-CB 3.26Å; S347-L351 PolarHBondContact O-N 2.98Å; L351-S353 VanDerWaalsContact C-N 3.31Å; L351-S353 PolarHBondContact O-N 3.37Å; L351-S354 WeakPolarHBondContact CA-OG 3.41Å; L351-S354 PolarHBondContact O-N 2.8Å; L351-S354 PolarHBondContact O-OG 3.37Å; L351-Q355 PolarHBondContact O-N 3.18Å
352K47.1Very low48.7Very low147 Ų147122.1 Ų122.164%0.63962%0.619SS**Hα-helixtrans-66.8-32.6176.3-164.7166.2-174.4172.90112.6A348 R349 Y350 Q355 C356A348-K352 VanDerWaalsContact O-CB 3.26Å; A348-K352 WeakPolarHBondContact O-CB 3.42Å; A348-K352 PolarHBondContact O-N 3.05Å; R349-K352 PolarHBondContact O-N 3Å; Y350-K352 PolarHBondContact O-N 3.05Å; K352-Q355 PolarHBondContact O-N 3.35Å; K352-C356 WeakPolarHBondContact O-CB 3.39Å; K352-C356 PolarHBondContact O-N 3.39Å; K352-C356 PolarHBondContact O-SG 2.85Å; K352-C356 VanDerWaalsContact O-SG 3.38Å
353S47.2Very low47.2Very low74 Ų74126.3 Ų126.352%0.51764%0.642SS.*Hα-helixtrans-71.4-32.2174.7-176.70000113.1R349 Y350 L351R349-S353 WeakPolarHBondContact O-CB 3.44Å; R349-S353 PolarHBondContact O-N 3.15Å; Y350-S353 WeakPolarHBondContact O-CB 3.36Å; Y350-S353 PolarHBondContact O-N 2.86Å; Y350-S353 VanDerWaalsContact O-N 3.17Å; L351-S353 VanDerWaalsContact C-N 3.31Å; L351-S353 PolarHBondContact O-N 3.37Å
354S46.3Very low45.7Very low65 Ų65125.9 Ų125.946%0.45565%0.654SS.*Hα-helixtrans-72.4-35.2170.344.30000112.3Y350 L351Y350-S354 PolarHBondContact O-N 3.43Å; Y350-S354 PolarHBondContact O-OG 3.33Å; L351-S354 WeakPolarHBondContact CA-OG 3.41Å; L351-S354 PolarHBondContact O-N 2.8Å; L351-S354 PolarHBondContact O-OG 3.37Å
355Q43Very low44.2Very low139 Ų139125.2 Ų125.265%0.6566%0.658SS**Hα-helixtrans-75.3-40.9-178.4-156.2158.44.900112.1L351 K352 R357 C358L351-Q355 PolarHBondContact O-N 3.18Å; K352-Q355 PolarHBondContact O-N 3.35Å; Q355-R357 PolarHBondContact O-N 3.37Å; Q355-R357 VanDerWaalsContact O-N 3.07Å; Q355-C358 PolarHBondContact O-N 3.06Å
356C40.1Very low43Very low89 Ų89130.3 Ų130.360%0.60168%0.676SS**THydrogen-bonded Turntrans-71.75.9174.9-64.70000115.2K352K352-C356 WeakPolarHBondContact O-CB 3.39Å; K352-C356 PolarHBondContact O-N 3.39Å; K352-C356 PolarHBondContact O-SG 2.85Å; K352-C356 VanDerWaalsContact O-SG 3.38Å
357R34.1Very low41.9Very low201 Ų201135.3 Ų135.376%0.75869%0.689SS**THydrogen-bonded Turntrans-102.6-12.7176.3-170.1171-77.2-120.50.3113.5Q355Q355-R357 PolarHBondContact O-N 3.37Å; Q355-R357 VanDerWaalsContact O-N 3.07Å
358C36.3Very low40.8Very low117 Ų117137.6 Ų137.679%0.79171%0.705SS**SBendtrans-98.5-2.9-179.8-62.90000114.3Q355Q355-C358 PolarHBondContact O-N 3.06Å
359E36.7Very low39.9Very low173 Ų173142.7 Ų142.781%0.80872%0.724SS**SBendtrans-113.214.5-169.4-139166.6126.200113.3
360H36.9Very low39.1Very low167 Ų167139.5 Ų139.577%0.77373%0.73SS**SBendtrans-123.25.3-174.3-146.5-57.1000115
361D37.2Very low38.3Very low147 Ų147135.9 Ų135.979%0.78673%0.732SS**SBendtrans-102.610.3178.2-87.3-23000113.8
362F36.8Very low37.5Very low204 Ų204137 Ų13790%0.89574%0.744SS**SBendtrans-132.148.3179.4-106-81.6000113.7
363D35.3Very low37Very low160 Ų160139.5 Ų139.586%0.85676%0.755SS**  trans-15490.2148-129.1-18.7000112.2
364S37.6Very low36.2Very low115 Ų115140.8 Ų140.880%0.80477%0.771SS**  trans-130.756-179.560.60000113.1
365S37.3Very low35.6Very low91 Ų91145.3 Ų145.364%0.63679%0.788SS**  trans-166.2122.3137.557.40000112.8
366H34.5Very low35.2Very low160 Ų160147.6 Ų147.674%0.74180%0.796SS**  171.1129121-103-113.1000111.4
367K35.1Very low34.7Very low183 Ų183148.9 Ų148.980%0.79681%0.806SS**  trans26.8131.9135.6-72.8176.6-179.2176.70118.4
368S31.7Very low34.8Very low111 Ų111145.4 Ų145.478%0.77681%0.807SS**  cis-167.317026.4-93.90000112.6
369N34.2Very low34.5Very low166 Ų166145.1 Ų145.189%0.88881%0.806SS**  trans-51.2143.1171.9-57.9-27.3000114.4
370S32.4Very low34.4Very low118 Ų118142.1 Ų142.183%0.82580%0.804SS**  trans-154.4138.7131.8-155.90000111.5
371S34Very low34.2Very low112 Ų112141.2 Ų141.278%0.78380%0.8SS**  trans-109.8128.9-17453.70000111.3
372T33.2Very low33.9Very low138 Ų138145 Ų14585%0.84780%0.804SS**  trans-128.8118.8172.2-47.80000111.1
373F36.1Very low33.7Very low199 Ų199139.8 Ų139.887%0.87379%0.793SS**  trans-70143.2173.1-105.6-110000111.5
374A31.2Very low33.6Very low102 Ų102140.4 Ų140.484%0.84379%0.794SS**  trans-144.1116.5161.200000111.4
375I33.6Very low33.5Very low160 Ų160140.1 Ų140.182%0.82179%0.788SS**  trans-57.3147.5-167.1-69.2157.2000115.3
376K33.9Very low33.3Very low187 Ų187144.4 Ų144.481%0.81380%0.798SS**  trans-95.7132.3172.4-171.8-177.1-170.91800109.8
377S30.5Very low33.3Very low115 Ų115142.1 Ų142.180%0.80480%0.795SS**  trans-126.5122.7170.856.50000111.9
378T35.9Very low33.1Very low129 Ų129137.8 Ų137.879%0.79179%0.788SS**  trans-135127.2175.418.50000109
379S31.1Very low33.2Very low110 Ų110138.8 Ų138.877%0.76979%0.789SS**  trans-147.5122.1171.851.80000106.6
380S32.9Very low33.5Very low110 Ų110141.3 Ų141.377%0.76981%0.811SS**  cis62.9134.248.8-154.40000111.4
381Q33.2Very low33.5Very low148 Ų148142.5 Ų142.569%0.69281%0.81SS**  cis-110-147.81.6-61.5177.43.200109.4
382R31.6Very low33.5Very low227 Ų227144.1 Ų144.186%0.85781%0.812SS**  cis-157.2166.9-1.2-150.2165.5-171.4160.45.1110.7
383S32.2Very low33.5Very low95 Ų95144.4 Ų144.466%0.66481%0.81SS**  trans-112.7154.1175.855.20000112.7
384I33.2Very low33.4Very low172 Ų172141.2 Ų141.288%0.88281%0.806SS**  trans-137.1141.8150.7-63.1-174000109.1
385T35.2Very low33.5Very low109 Ų109143.6 Ų143.667%0.66980%0.804SS**  trans-123.5140.2-173.9-55.80000110.2
386Q33.4Very low33.5Very low181 Ų181142.5 Ų142.585%0.84680%0.803SS**  trans-175.6128.6148.5-103.415910.800107.7
387T34.7Very low33.5Very low112 Ų112139.4 Ų139.469%0.68780%0.802SS**  52125.351.359.70000113.6
388S31.5Very low33.7Very low93 Ų93141.2 Ų141.265%0.6580%0.802SS**  cis-164.6167.73.3-83.70000111
389T33.3Very low33.5Very low131 Ų131142.3 Ų142.380%0.80480%0.803SS**  trans45.3116147.851.90000121.3
390T40.1Very low33.8Very low219 Ų219145.2 Ų145.2100%1.34481%0.806SS**  -140.90106.543.30000108.8

Retrieved 390 of 390 residues in 72.3 ms (Link to these results)