A0A077YYQ4_TRITR Loading...

Protein YIF1

Has a role in transport between endoplasmic reticulum and Golgi.

AlphaFold DB , UniProt , Accession A0A077YYQ4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 302 aa.

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

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M40.7Very low40.8Very low248 Ų248135.9 Ų135.9100%1.22278%0.78SS**  0103.30-78.7167168.100106.9
2T39.2Very low40.9Very low145 Ų145138.1 Ų138.189%0.8978%0.778SS**PPolyproline II helixtrans-71.5122.1-179.116.30000109.2
3A42.4Very low41.2Very low92 Ų92143.3 Ų143.376%0.7678%0.778SS**PPolyproline II helixtrans-67.4141.6175.400000110.3
4P41.2Very low41.6Very low114 Ų114141.9 Ų141.974%0.7477%0.769SS**PPolyproline II helixtrans-70.8151.5-178.228.6-33.1000111.8D6P4-D6 PolarHBondContact O-N 2.83Å
5P44.1Very low42.2Very low102 Ų102146 Ų14666%0.66277%0.769SS**PPolyproline II helixtrans-73.3126.7-177.427.5-31.7000111.9Y7P5-Y7 HydrophobicContact CB-CE2 4.35Å; P5-Y7 HydrophobicContact CG-CD2 4.38Å; P5-Y7 HydrophobicContact CG-CE2 3.98Å; P5-Y7 PolarHBondContact O-N 2.78Å; P5-Y7 VanDerWaalsContact O-N 3.17Å
6D40.3Very low42.5Very low150 Ų150147.3 Ų147.380%0.80277%0.767SS**  trans-66.9102.6172.8-90-35.8000111.1P4 A8P4-D6 PolarHBondContact O-N 2.83Å; D6-A8 PolarHBondContact O-N 3.24Å
7Y42.6Very low42.6Very low216 Ų216141.4 Ų141.485%0.84775%0.75SS**THydrogen-bonded Turntrans-82.710.3172.9-89.3-89.2000114P5P5-Y7 HydrophobicContact CB-CE2 4.35Å; P5-Y7 HydrophobicContact CG-CD2 4.38Å; P5-Y7 HydrophobicContact CG-CE2 3.98Å; P5-Y7 PolarHBondContact O-N 2.78Å; P5-Y7 VanDerWaalsContact O-N 3.17Å
8A39Very low43.1Very low76 Ų76141.1 Ų141.163%0.62874%0.744SS**THydrogen-bonded Turntrans-90.6-4-174.400000115.1D6D6-A8 PolarHBondContact O-N 3.24Å
9S40.9Very low43.7Very low91 Ų91136.6 Ų136.664%0.63673%0.725SS**SBendtrans-95.34.3-171.766.20000116.1
10G38Very low44.1Very low57 Ų57135.1 Ų135.159%0.58872%0.717SS**SBendtrans-97-18.1-172.700000117
11Y40.7Very low44.8Very low204 Ų204133.4 Ų133.480%0.871%0.705SS**SBendtrans-106.4-13.8-166.4-137.2-97.3000115.3
12E41.9Very low45.5Very low162 Ų162125.8 Ų125.876%0.75767%0.67SS**SBendtrans-93.1-12.5-174.8-83.1174.3110.400114.7
13R44.4Very low46.2Very low206 Ų206123.5 Ų123.578%0.77765%0.651SS**Hα-helixtrans-79.9-28.6-177.2-111.6-172.8-78.2172.1-3.1114.4
14D47.6Very low46.8Very low124 Ų124128.4 Ų128.466%0.66365%0.65SS**Hα-helixtrans-82.2-27.9-173.9-62.1-24.7000112.8F16 E18D14-F16 PolarHBondContact O-N 3.29Å; D14-E18 PolarHBondContact O-N 3.1Å
15R49.6Very low47.6Very low203 Ų203128.9 Ų128.977%0.76664%0.64SS**Hα-helixtrans-74.7-25.9-173.1-147.7-164.5-90.6-162.3-3113.9S19R15-S19 PolarHBondContact O-OG 2.82Å
16F47.1Very low48Very low167 Ų167130 Ų13073%0.73264%0.64SS**Hα-helixtrans-85.3-32.2177.2-89.3-82.9000113D14 S19D14-F16 PolarHBondContact O-N 3.29Å; F16-S19 PolarHBondContact O-OG 3.5Å
17G45.2Very low48.2Very low47 Ų47128.3 Ų128.349%0.48563%0.631SS.*Hα-helixtrans-68.7-38.1179.500000113.4S19 D20 E21G17-S19 PolarHBondContact O-N 2.77Å; G17-D20 PolarHBondContact O-N 3.49Å; G17-E21 PolarHBondContact O-N 3.47Å
18E51.4Low48.6Very low136 Ų136121.9 Ų121.964%0.63662%0.623SS**Hα-helixtrans-72.8-29.7-175.8-160.6155.9107.500112.7D14 N22D14-E18 PolarHBondContact O-N 3.1Å; E18-N22 PolarHBondContact O-N 3.32Å; E18-N22 VanDerWaalsContact O-N 3.14Å; E18-N22 PolarHBondContact O-ND2 3.39Å
19S54.5Low48.9Very low55 Ų55127.4 Ų127.439%0.38563%0.633SS.*Hα-helixtrans-66.1-41.2173.623.60000112.8R15 F16 G17 N22 I23R15-S19 PolarHBondContact O-OG 2.82Å; F16-S19 PolarHBondContact O-OG 3.5Å; G17-S19 PolarHBondContact O-N 2.77Å; S19-N22 PolarHBondContact O-N 3.05Å; S19-I23 WeakPolarHBondContact O-CG1 3.37Å; S19-I23 PolarHBondContact O-N 3.23Å; S19-I23 VanDerWaalsContact O-N 3.14Å
20D51.4Low48.8Very low106 Ų106131.6 Ų131.657%0.56764%0.642SS**Hα-helixtrans-71.4-35.2178.6-92.3-22.3000112.2G17 I23 R24G17-D20 PolarHBondContact O-N 3.49Å; D20-I23 PolarHBondContact O-N 3.32Å; D20-R24 WeakPolarHBondContact O-CG 3.09Å; D20-R24 PolarHBondContact O-N 2.88Å
21E58.4Low48.4Very low100 Ų100132.4 Ų132.447%0.46765%0.651SS.*Hα-helixtrans-68-37.2176.4-158.2-172.8154.800111.8G17 R24 K25G17-E21 PolarHBondContact O-N 3.47Å; E21-R24 PolarHBondContact O-N 3.42Å; E21-K25 WeakPolarHBondContact O-CB 3.48Å; E21-K25 WeakPolarHBondContact O-CG 3.31Å; E21-K25 PolarHBondContact O-N 3.06Å; E21-K25 WeakPolarHBondContact OE1-CE 3.38Å; E21-K25 IonicContact OE1-NZ 3.89Å; E21-K25 PolarHBondContact OE1-NZ 2.74Å
22N55.3Low48Very low89 Ų89126.2 Ų126.248%0.47665%0.649SS.*Hα-helixtrans-65.9-39.6174.5-81-65.4000112.1E18 S19 K25 L26E18-N22 PolarHBondContact O-N 3.32Å; E18-N22 VanDerWaalsContact O-N 3.14Å; E18-N22 PolarHBondContact O-ND2 3.39Å; S19-N22 PolarHBondContact O-N 3.05Å; N22-K25 PolarHBondContact O-N 2.81Å; N22-L26 WeakPolarHBondContact O-CD1 3.23Å; N22-L26 VanDerWaalsContact O-CG 3.26Å; N22-L26 WeakPolarHBondContact O-CG 3.15Å; N22-L26 PolarHBondContact O-N 2.86Å; N22-L26 VanDerWaalsContact O-N 3.08Å
23I53.9Low47.3Very low97 Ų97127 Ų12750%0.49765%0.652SS.*Hα-helixtrans-66.5-42.5175.4-66.8-178.1000110.8S19 D20 K25 L26 D27S19-I23 WeakPolarHBondContact O-CG1 3.37Å; S19-I23 PolarHBondContact O-N 3.23Å; S19-I23 VanDerWaalsContact O-N 3.14Å; D20-I23 PolarHBondContact O-N 3.32Å; I23-K25 PolarHBondContact O-N 2.62Å; I23-L26 PolarHBondContact O-N 3.44Å; I23-L26 VanDerWaalsContact O-N 3.17Å; I23-D27 PolarHBondContact O-N 2.88Å
24R54.9Low46.5Very low195 Ų195123.1 Ų123.174%0.73665%0.647SS**Hα-helixtrans-63.9-36.7175.9-74.4-176.6179-168.21.4113.3D20 E21 L26 A28D20-R24 WeakPolarHBondContact O-CG 3.09Å; D20-R24 PolarHBondContact O-N 2.88Å; E21-R24 PolarHBondContact O-N 3.42Å; R24-L26 VanDerWaalsContact C-N 3.32Å; R24-A28 VanDerWaalsContact O-CB 3.32Å; R24-A28 WeakPolarHBondContact O-CB 3.4Å; R24-A28 PolarHBondContact O-N 2.73Å
25K58Low45.6Very low124 Ų124122.8 Ų122.854%0.53965%0.649SS.*Hα-helixtrans-68.9-30.8175.1-76.9176.7-176.5162.70112.4E21 N22 I23E21-K25 WeakPolarHBondContact O-CB 3.48Å; E21-K25 WeakPolarHBondContact O-CG 3.31Å; E21-K25 PolarHBondContact O-N 3.06Å; E21-K25 WeakPolarHBondContact OE1-CE 3.38Å; E21-K25 IonicContact OE1-NZ 3.89Å; E21-K25 PolarHBondContact OE1-NZ 2.74Å; N22-K25 PolarHBondContact O-N 2.81Å; I23-K25 PolarHBondContact O-N 2.62Å
26L52.5Low44.6Very low124 Ų124118.3 Ų118.365%0.64965%0.649SS**Hα-helixtrans-71.8-43.1175-71.6165.3000111.4N22 I23 R24 K29N22-L26 WeakPolarHBondContact O-CD1 3.23Å; N22-L26 VanDerWaalsContact O-CG 3.26Å; N22-L26 WeakPolarHBondContact O-CG 3.15Å; N22-L26 PolarHBondContact O-N 2.86Å; N22-L26 VanDerWaalsContact O-N 3.08Å; I23-L26 PolarHBondContact O-N 3.44Å; I23-L26 VanDerWaalsContact O-N 3.17Å; R24-L26 VanDerWaalsContact C-N 3.32Å; L26-K29 PolarHBondContact O-N 3.25Å
27D44.4Very low43.8Very low115 Ų115115.7 Ų115.762%0.61565%0.651SS**Hα-helixtrans-69.9-36.5177.6-80.1-21.9000113I23 K29 Q30I23-D27 PolarHBondContact O-N 2.88Å; D27-K29 PolarHBondContact O-N 3.48Å; D27-K29 VanDerWaalsContact O-N 3.14Å; D27-Q30 PolarHBondContact O-N 3.25Å
28A51.3Low43Very low82 Ų82119.4 Ų119.468%0.67867%0.67SS**THydrogen-bonded Turntrans-63.4-19.9176.400000113.2R24R24-A28 VanDerWaalsContact O-CB 3.32Å; R24-A28 WeakPolarHBondContact O-CB 3.4Å; R24-A28 PolarHBondContact O-N 2.73Å
29K45.3Very low42.2Very low192 Ų192118.9 Ų118.984%0.83568%0.678SS**THydrogen-bonded Turntrans-86.6-8.7-179.6-130.7178.7-176.4-178.20114.1L26 D27L26-K29 PolarHBondContact O-N 3.25Å; D27-K29 PolarHBondContact O-N 3.48Å; D27-K29 VanDerWaalsContact O-N 3.14Å
30Q40.2Very low41.1Very low178 Ų178126.8 Ų126.883%0.83271%0.706SS**THydrogen-bonded Turntrans-106.3-6.7179.1-80.1-170.6-0.600114.9D27 G32D27-Q30 PolarHBondContact O-N 3.25Å; Q30-G32 PolarHBondContact O-N 2.96Å
31G29.2Very low40.2Very low75 Ų75124.8 Ų124.877%0.77371%0.711SS**  trans-92.570.9177.600000113.8
32G31.6Very low39.3Very low74 Ų74124.1 Ų124.176%0.76372%0.717SS**  trans-14969.6-17800000113.6Q30Q30-G32 PolarHBondContact O-N 2.96Å
33H28.1Very low38.7Very low178 Ų178131.5 Ų131.582%0.82474%0.738SS**  trans-74.6123.8166.9-147.178000108.9
34N27.5Very low38.3Very low125 Ų125129.6 Ų129.667%0.66874%0.743SS**  trans157.4119.8133.5-83.7-17.8000115.2
35T27.3Very low37.8Very low116 Ų116128.9 Ų128.971%0.71274%0.741SS**  trans57.6122.8130.367.20000122
36S29.3Very low37.4Very low109 Ų109129.1 Ų129.176%0.76275%0.748SS**  95.4134.1128.272.50000120.8
37S30.5Very low37.6Very low112 Ų112129 Ų12978%0.78375%0.748SS**  trans80.998.4164.671.30000118.2
38S28.2Very low38.1Very low126 Ų126130.2 Ų130.288%0.88175%0.75SS**PPolyproline II helixtrans-87.4121.5160.1-50.40000109.6
39P34.4Very low38.6Very low124 Ų124133.5 Ų133.581%0.80575%0.749SS**PPolyproline II helixtrans-92.1125.4157.3316.5000109.7
40F31.1Very low39.8Very low221 Ų221125.9 Ų125.997%0.96973%0.725SS**PPolyproline II helixtrans-53.5128.7167.4-166.5-99.4000111.7
41G32.8Very low41.3Very low64 Ų64119.9 Ų119.966%0.6671%0.706SS**  trans130.857.3159.900000118.9
42S38.8Very low43.4Very low86 Ų86120.5 Ų120.560%0.60170%0.695SS**  trans-164.462.8155.5-93.20000110.7
43R42.9Very low45.5Very low244 Ų244118.9 Ų118.992%0.92168%0.678SS**THydrogen-bonded Turntrans-85.7-4.3-174.2-159.9167.1168.2134.8-3.5113.9
44G46.1Very low47.8Very low58 Ų58116.9 Ų116.960%0.59867%0.67SS**THydrogen-bonded Turntrans-95.2-40.8178.900000114.4
45Y43.5Very low50Low179 Ų179113.7 Ų113.770%0.70266%0.662SS**Hα-helixtrans-77.6-30.5-176-104.8-104.9000113.5F49Y45-F49 HydrophobicContact CD1-CD2 4.45Å; Y45-F49 HydrophobicContact CD1-CE2 4.14Å; Y45-F49 WeakPolarHBondContact O-CD2 3.47Å; Y45-F49 PolarHBondContact O-N 3.44Å
46L49.5Very low52.5Low129 Ų129114.2 Ų114.268%0.67565%0.654SS**Hα-helixtrans-74.3-26.2-177.4-66.7178.1000113.2G50L46-G50 WeakPolarHBondContact O-CA 2.99Å; L46-G50 PolarHBondContact O-N 2.76Å
47D57.8Low54.7Low122 Ų122111.4 Ų111.465%0.65264%0.637SS**Hα-helixtrans-75.4-36.8-178.9-153.444.4000111.1G50 A51D47-G50 PolarHBondContact O-N 3.18Å; D47-A51 WeakPolarHBondContact O-CB 3.41Å; D47-A51 PolarHBondContact O-N 2.9Å
48E55Low56.8Low140 Ų140113 Ų11365%0.65463%0.627SS**Hα-helixtrans-68.7-46.3175.1-164.5179.7154.400111.6G50 A51 V52E48-G50 VanDerWaalsContact C-N 3.33Å; E48-G50 PolarHBondContact O-N 2.97Å; E48-A51 PolarHBondContact O-N 2.77Å; E48-V52 WeakPolarHBondContact O-CB 3.24Å; E48-V52 WeakPolarHBondContact O-CG2 3.13Å; E48-V52 PolarHBondContact O-N 3.36Å
49F62.1Low58.7Low152 Ų152110.1 Ų110.167%0.66761%0.607SS**Hα-helixtrans-65.3-35.8174.1-86.7-80.9000112.5Y45 G53Y45-F49 HydrophobicContact CD1-CD2 4.45Å; Y45-F49 HydrophobicContact CD1-CE2 4.14Å; Y45-F49 WeakPolarHBondContact O-CD2 3.47Å; Y45-F49 PolarHBondContact O-N 3.44Å; F49-G53 PolarHBondContact O-N 2.82Å
50G69.7Low60.7Low31 Ų31108.8 Ų108.832%0.3259%0.59SS.*Hα-helixtrans-68.2-43.3176.200000112.7L46 D47 E48 G53 M54L46-G50 WeakPolarHBondContact O-CA 2.99Å; L46-G50 PolarHBondContact O-N 2.76Å; D47-G50 PolarHBondContact O-N 3.18Å; E48-G50 VanDerWaalsContact C-N 3.33Å; E48-G50 PolarHBondContact O-N 2.97Å; G50-G53 PolarHBondContact O-N 3.48Å; G50-M54 WeakPolarHBondContact O-CB 3.43Å; G50-M54 PolarHBondContact O-N 3.15Å
51A71.8Confident62.7Low53 Ų53103.7 Ų103.744%0.43857%0.569SS.*Hα-helixtrans-67-41.6175.500000111.6D47 E48 G53 M54 A55D47-A51 WeakPolarHBondContact O-CB 3.41Å; D47-A51 PolarHBondContact O-N 2.9Å; E48-A51 PolarHBondContact O-N 2.77Å; A51-G53 VanDerWaalsContact C-N 3.35Å; A51-M54 PolarHBondContact O-N 3.23Å; A51-A55 WeakPolarHBondContact O-CB 3.37Å; A51-A55 PolarHBondContact O-N 3.18Å
52V73.9Confident64.1Low88 Ų88106.1 Ų106.153%0.53356%0.564SS.*Hα-helixtrans-63.6-41.2173.2171.20000110.9E48 A55 K56E48-V52 WeakPolarHBondContact O-CB 3.24Å; E48-V52 WeakPolarHBondContact O-CG2 3.13Å; E48-V52 PolarHBondContact O-N 3.36Å; V52-A55 PolarHBondContact O-N 2.71Å; V52-K56 VanDerWaalsContact O-CB 3.28Å; V52-K56 WeakPolarHBondContact O-CB 3.36Å; V52-K56 PolarHBondContact O-N 2.84Å
53G76Confident65.4Low39 Ų39104 Ų10440%0.40255%0.552SS.*Hα-helixtrans-64.2-44.517600000113.2F49 G50 A51 K56 A57F49-G53 PolarHBondContact O-N 2.82Å; G50-G53 PolarHBondContact O-N 3.48Å; A51-G53 VanDerWaalsContact C-N 3.35Å; G53-K56 PolarHBondContact O-N 3.31Å; G53-A57 WeakPolarHBondContact O-CB 3.14Å; G53-A57 PolarHBondContact O-N 3.5Å
54M75.8Confident66.4Low136 Ų13698.9 Ų98.967%0.6754%0.539SS*.Hα-helixtrans-67-41174.4-81.3-168.7-82.200112.1G50 A51 K56 A57 Y58G50-M54 WeakPolarHBondContact O-CB 3.43Å; G50-M54 PolarHBondContact O-N 3.15Å; A51-M54 PolarHBondContact O-N 3.23Å; M54-K56 VanDerWaalsContact C-N 3.3Å; M54-K56 PolarHBondContact O-N 3.37Å; M54-A57 PolarHBondContact O-N 2.9Å; M54-Y58 VanDerWaalsContact O-CB 3.23Å; M54-Y58 WeakPolarHBondContact O-CB 3.5Å; M54-Y58 PolarHBondContact O-N 3.48Å
55A74.3Confident67Low59 Ų59101.6 Ų101.649%0.48854%0.536SS..Hα-helixtrans-62.3-39.5174.400000111.1A51 V52 S59A51-A55 WeakPolarHBondContact O-CB 3.37Å; A51-A55 PolarHBondContact O-N 3.18Å; V52-A55 PolarHBondContact O-N 2.71Å; A55-S59 WeakPolarHBondContact O-CB 3.42Å; A55-S59 PolarHBondContact O-N 3.45Å; A55-S59 PolarHBondContact O-OG 3.47Å
56K78.3Confident67.7Low126 Ų12694.4 Ų94.455%0.54852%0.516SS..Hα-helixtrans-66.1-48.4175.3-164.2-179-178.8-166.50111.4V52 G53 M54 Y58 S59 E60V52-K56 VanDerWaalsContact O-CB 3.28Å; V52-K56 WeakPolarHBondContact O-CB 3.36Å; V52-K56 PolarHBondContact O-N 2.84Å; G53-K56 PolarHBondContact O-N 3.31Å; M54-K56 VanDerWaalsContact C-N 3.3Å; M54-K56 PolarHBondContact O-N 3.37Å; K56-Y58 VanDerWaalsContact C-N 3.33Å; K56-Y58 PolarHBondContact O-N 3.42Å; K56-S59 WeakPolarHBondContact CA-OG 3.23Å; K56-S59 CarbonylContact O-C 3.59Å; K56-S59 PolarHBondContact O-N 2.83Å; K56-S59 VanDerWaalsContact O-N 3.17Å; K56-S59 PolarHBondContact O-OG 2.84Å; K56-E60 VanDerWaalsContact CE-OE1 3.29Å; K56-E60 WeakPolarHBondContact CE-OE1 2.88Å; K56-E60 WeakPolarHBondContact O-CB 3.49Å; K56-E60 WeakPolarHBondContact O-CG 3.41Å; K56-E60 PolarHBondContact O-N 3.41Å
57A76.7Confident67.9Low50 Ų5093.5 Ų93.541%0.41351%0.51SS..Hα-helixtrans-61.7-39.7176.800000112.5G53 M54 E60 Q61G53-A57 WeakPolarHBondContact O-CB 3.14Å; G53-A57 PolarHBondContact O-N 3.5Å; M54-A57 PolarHBondContact O-N 2.9Å; A57-E60 PolarHBondContact O-N 3.46Å; A57-Q61 WeakPolarHBondContact O-CB 3.27Å; A57-Q61 PolarHBondContact O-N 2.96Å
58Y73.6Confident67.8Low147 Ų14790.5 Ų90.558%0.57650%0.503SS*.Hα-helixtrans-67.6-39.8174.5-169.5-95000111.5M54 K56 Q61 M62M54-Y58 VanDerWaalsContact O-CB 3.23Å; M54-Y58 WeakPolarHBondContact O-CB 3.5Å; M54-Y58 PolarHBondContact O-N 3.48Å; K56-Y58 VanDerWaalsContact C-N 3.33Å; K56-Y58 PolarHBondContact O-N 3.42Å; Y58-Q61 PolarHBondContact O-N 3.29Å; Y58-M62 HydrophobicContact CD1-CG 4.38Å; Y58-M62 HydrophobicContact CE1-CE 3.97Å; Y58-M62 HydrophobicContact CE1-CG 3.95Å; Y58-M62 HydrophobicContact CE1-SD 4.17Å; Y58-M62 WeakPolarHBondContact O-CB 3.3Å; Y58-M62 PolarHBondContact O-N 2.78Å
59S69.9Low67.7Low64 Ų6490.9 Ų90.945%0.44850%0.502SS..Hα-helixtrans-65.8-37.8174.776.80000112.2A55 K56 A63A55-S59 WeakPolarHBondContact O-CB 3.42Å; A55-S59 PolarHBondContact O-N 3.45Å; A55-S59 PolarHBondContact O-OG 3.47Å; K56-S59 WeakPolarHBondContact CA-OG 3.23Å; K56-S59 CarbonylContact O-C 3.59Å; K56-S59 PolarHBondContact O-N 2.83Å; K56-S59 VanDerWaalsContact O-N 3.17Å; K56-S59 PolarHBondContact O-OG 2.84Å; S59-A63 WeakPolarHBondContact O-CB 3.37Å; S59-A63 PolarHBondContact O-N 3.45Å
60E75.2Confident67.2Low96 Ų9689.1 Ų89.145%0.44950%0.499SS..Hα-helixtrans-70.7-40.2176.1-75.2174.8-174.800110.8K56 A57 A63 Q64K56-E60 VanDerWaalsContact CE-OE1 3.29Å; K56-E60 WeakPolarHBondContact CE-OE1 2.88Å; K56-E60 WeakPolarHBondContact O-CB 3.49Å; K56-E60 WeakPolarHBondContact O-CG 3.41Å; K56-E60 PolarHBondContact O-N 3.41Å; A57-E60 PolarHBondContact O-N 3.46Å; E60-A63 PolarHBondContact O-N 3.32Å; E60-Q64 WeakPolarHBondContact O-CB 3.34Å; E60-Q64 VanDerWaalsContact O-CG 3.28Å; E60-Q64 WeakPolarHBondContact O-CG 3.38Å; E60-Q64 PolarHBondContact O-N 3.46Å
61Q72.5Confident66.4Low115 Ų11591.5 Ų91.554%0.53751%0.505SS..Hα-helixtrans-67.3-40.2173.1-84.7-171.8-18.200112.8A57 Y58 Q64 H65A57-Q61 WeakPolarHBondContact O-CB 3.27Å; A57-Q61 PolarHBondContact O-N 2.96Å; Y58-Q61 PolarHBondContact O-N 3.29Å; Q61-Q64 PolarHBondContact O-N 2.92Å; Q61-H65 VanDerWaalsContact O-CB 3.3Å; Q61-H65 WeakPolarHBondContact O-CB 3.32Å; Q61-H65 PolarHBondContact O-N 3.28Å; Q61-H65 PolarHBondContact O-ND1 3.23Å
62M63.3Low65.6Low114 Ų11499.4 Ų99.456%0.56252%0.523SS*.Hα-helixtrans-69-34.5173.4-96.8-141.517400112Y58 G66Y58-M62 HydrophobicContact CD1-CG 4.38Å; Y58-M62 HydrophobicContact CE1-CE 3.97Å; Y58-M62 HydrophobicContact CE1-CG 3.95Å; Y58-M62 HydrophobicContact CE1-SD 4.17Å; Y58-M62 WeakPolarHBondContact O-CB 3.3Å; Y58-M62 PolarHBondContact O-N 2.78Å; M62-G66 WeakPolarHBondContact O-CA 3.36Å; M62-G66 PolarHBondContact O-N 3.28Å
63A66.8Low64.5Low42 Ų42105 Ų10535%0.34754%0.536SS..Hα-helixtrans-63.6-51.7170.100000109.2S59 E60 H65 I67S59-A63 WeakPolarHBondContact O-CB 3.37Å; S59-A63 PolarHBondContact O-N 3.45Å; E60-A63 PolarHBondContact O-N 3.32Å; A63-H65 PolarHBondContact O-N 3.42Å; A63-I67 HydrophobicContact CB-CD1 3.85Å; A63-I67 WeakPolarHBondContact O-CA 3.41Å; A63-I67 WeakPolarHBondContact O-CB 3.13Å; A63-I67 WeakPolarHBondContact O-CD1 3.43Å; A63-I67 WeakPolarHBondContact O-CG1 3.47Å; A63-I67 PolarHBondContact O-N 3.09Å
64Q63.9Low63.3Low136 Ų136106.1 Ų106.164%0.63654%0.535SS*.Hα-helixtrans-62.8-44.9-179.7-71.3175.64.100112.9E60 Q61 A68E60-Q64 WeakPolarHBondContact O-CB 3.34Å; E60-Q64 VanDerWaalsContact O-CG 3.28Å; E60-Q64 WeakPolarHBondContact O-CG 3.38Å; E60-Q64 PolarHBondContact O-N 3.46Å; Q61-Q64 PolarHBondContact O-N 2.92Å; Q64-A68 WeakPolarHBondContact O-CB 3.32Å; Q64-A68 PolarHBondContact O-N 3.47Å
65H58.4Low62.4Low116 Ų116101.4 Ų101.454%0.53752%0.515SS..Hα-helixtrans-79.5-35-179.9-72.879.5000113.3Q61 A63 K69Q61-H65 VanDerWaalsContact O-CB 3.3Å; Q61-H65 WeakPolarHBondContact O-CB 3.32Å; Q61-H65 PolarHBondContact O-N 3.28Å; Q61-H65 PolarHBondContact O-ND1 3.23Å; A63-H65 PolarHBondContact O-N 3.42Å; H65-K69 VanDerWaalsContact O-CB 3.26Å; H65-K69 WeakPolarHBondContact O-CB 3.38Å; H65-K69 WeakPolarHBondContact O-CG 3.27Å; H65-K69 PolarHBondContact O-N 3.28Å
66G56.4Low61.8Low27 Ų27101.1 Ų101.128%0.27851%0.513SS..Hα-helixtrans-75.2-44.1178.900000111.3M62 K69 L70M62-G66 WeakPolarHBondContact O-CA 3.36Å; M62-G66 PolarHBondContact O-N 3.28Å; G66-K69 PolarHBondContact O-N 3.29Å; G66-L70 WeakPolarHBondContact O-CB 3.27Å; G66-L70 WeakPolarHBondContact O-CD1 3.44Å; G66-L70 VanDerWaalsContact O-CG 3.26Å; G66-L70 WeakPolarHBondContact O-CG 3.46Å; G66-L70 PolarHBondContact O-N 3.01Å
67I54.2Low61.3Low110 Ų11099.2 Ų99.256%0.56451%0.512SS*.Hα-helixtrans-64.2-43.9171.4-55.9163.4000108.9A63 K69 L70 D71A63-I67 HydrophobicContact CB-CD1 3.85Å; A63-I67 WeakPolarHBondContact O-CA 3.41Å; A63-I67 WeakPolarHBondContact O-CB 3.13Å; A63-I67 WeakPolarHBondContact O-CD1 3.43Å; A63-I67 WeakPolarHBondContact O-CG1 3.47Å; A63-I67 PolarHBondContact O-N 3.09Å; I67-K69 PolarHBondContact O-N 2.98Å; I67-L70 PolarHBondContact O-N 2.92Å; I67-D71 WeakPolarHBondContact O-CB 3.4Å; I67-D71 PolarHBondContact O-N 3.45Å
68A56.8Low61Low59 Ų59101 Ų10149%0.48851%0.51SS..Hα-helixtrans-64.2-35.4176.300000113.9Q64 R72Q64-A68 WeakPolarHBondContact O-CB 3.32Å; Q64-A68 PolarHBondContact O-N 3.47Å; A68-R72 PolarHBondContact O-N 3.03Å
69K52.5Low61.2Low149 Ų14996.2 Ų96.265%0.64849%0.494SS*.Hα-helixtrans-74.8-39.2175.4-78.5179.6-178.8-176.70112.4H65 G66 I67 D71 R72 Y73H65-K69 VanDerWaalsContact O-CB 3.26Å; H65-K69 WeakPolarHBondContact O-CB 3.38Å; H65-K69 WeakPolarHBondContact O-CG 3.27Å; H65-K69 PolarHBondContact O-N 3.28Å; G66-K69 PolarHBondContact O-N 3.29Å; I67-K69 PolarHBondContact O-N 2.98Å; K69-D71 VanDerWaalsContact C-N 3.31Å; K69-R72 PolarHBondContact O-N 3.23Å; K69-Y73 PolarHBondContact O-N 2.97Å; K69-Y73 VanDerWaalsContact O-N 3.08Å
70L51.8Low61.9Low114 Ų114100.5 Ų100.560%0.59751%0.505SS*.Hα-helixtrans-62.9-40.5171.9-79.2163.4000110.4G66 I67 R72 Y73 V74G66-L70 WeakPolarHBondContact O-CB 3.27Å; G66-L70 WeakPolarHBondContact O-CD1 3.44Å; G66-L70 VanDerWaalsContact O-CG 3.26Å; G66-L70 WeakPolarHBondContact O-CG 3.46Å; G66-L70 PolarHBondContact O-N 3.01Å; I67-L70 PolarHBondContact O-N 2.92Å; L70-R72 PolarHBondContact O-N 2.51Å; L70-Y73 PolarHBondContact O-N 2.69Å; L70-V74 CarbonylContact O-C 3.58Å; L70-V74 VanDerWaalsContact O-C 3.3Å; L70-V74 VanDerWaalsContact O-CA 3.31Å; L70-V74 WeakPolarHBondContact O-CA 3.06Å; L70-V74 WeakPolarHBondContact O-CB 3.39Å; L70-V74 PolarHBondContact O-N 3.25Å
71D52.8Low62.2Low82 Ų8299.4 Ų99.444%0.43950%0.5SS..Hα-helixtrans-68.1-24.4177.9-150.626.7000112.1I67 K69 V74 S75I67-D71 WeakPolarHBondContact O-CB 3.4Å; I67-D71 PolarHBondContact O-N 3.45Å; K69-D71 VanDerWaalsContact C-N 3.31Å; D71-V74 WeakPolarHBondContact CA-O 3.41Å; D71-V74 CarbonylContact O-C 3.3Å; D71-S75 WeakPolarHBondContact O-CA 3.36Å; D71-S75 PolarHBondContact O-N 3.09Å
72R55.5Low62.8Low219 Ų21994.7 Ų94.783%0.82648%0.477SS*.Hα-helixtrans-77.6-41.9172.1-168.9174.3-179.8171.3-0.1113.2A68 K69 L70A68-R72 PolarHBondContact O-N 3.03Å; K69-R72 PolarHBondContact O-N 3.23Å; L70-R72 PolarHBondContact O-N 2.51Å
73Y49.8Very low64Low205 Ų20593.3 Ų93.380%0.80447%0.468SS*.Hα-helixtrans-84.4-36-178.5-93.5-85.2000113.2K69 L70K69-Y73 PolarHBondContact O-N 2.97Å; K69-Y73 VanDerWaalsContact O-N 3.08Å; L70-Y73 PolarHBondContact O-N 2.69Å
74V51.4Low64.9Low62 Ų6297.3 Ų97.338%0.37648%0.484SS..SBendtrans-119.783.5172-173.90000104.8L70 D71 A76L70-V74 CarbonylContact O-C 3.58Å; L70-V74 VanDerWaalsContact O-C 3.3Å; L70-V74 VanDerWaalsContact O-CA 3.31Å; L70-V74 WeakPolarHBondContact O-CA 3.06Å; L70-V74 WeakPolarHBondContact O-CB 3.39Å; L70-V74 PolarHBondContact O-N 3.25Å; D71-V74 WeakPolarHBondContact CA-O 3.41Å; D71-V74 CarbonylContact O-C 3.3Å; V74-A76 PolarHBondContact O-N 2.82Å
75S57.1Low65.9Low37 Ų3792.3 Ų92.326%0.25946%0.462SS..  trans-61.984.6167.6-165.60000107.1D71 V77 K78 L79D71-S75 WeakPolarHBondContact O-CA 3.36Å; D71-S75 PolarHBondContact O-N 3.09Å; S75-V77 PolarHBondContact O-N 3.42Å; S75-V77 VanDerWaalsContact O-N 3.16Å; S75-K78 WeakPolarHBondContact O-CA 3.48Å; S75-K78 WeakPolarHBondContact O-CB 3.5Å; S75-K78 PolarHBondContact O-N 2.85Å; S75-L79 PolarHBondContact O-N 3Å
76A61Low67.2Low53 Ų5391.7 Ų91.744%0.43846%0.463SS..Hα-helixtrans-61.2-30.2-171.300000109.5V74 L79 K80V74-A76 PolarHBondContact O-N 2.82Å; A76-L79 PolarHBondContact O-N 3.3Å; A76-K80 VanDerWaalsContact O-CB 3.32Å; A76-K80 WeakPolarHBondContact O-CB 3.41Å; A76-K80 PolarHBondContact O-N 2.9Å
77V67.8Low68.7Low87 Ų8797.1 Ų97.153%0.52749%0.485SS..Hα-helixtrans-60.1-46.1170.5-175.10000111.9S75 Q81S75-V77 PolarHBondContact O-N 3.42Å; S75-V77 VanDerWaalsContact O-N 3.16Å; V77-Q81 WeakPolarHBondContact O-CG 3.45Å; V77-Q81 PolarHBondContact O-N 3.33Å
78K70.7Confident70Confident88 Ų8893.8 Ų93.838%0.38347%0.469SS..Hα-helixtrans-68.4-41.6175.9-70.5-177.9-179.6175.90111.3S75 K80 Q81 Y82S75-K78 WeakPolarHBondContact O-CA 3.48Å; S75-K78 WeakPolarHBondContact O-CB 3.5Å; S75-K78 PolarHBondContact O-N 2.85Å; K78-K80 VanDerWaalsContact C-N 3.32Å; K78-K80 PolarHBondContact O-N 3.46Å; K78-Q81 WeakPolarHBondContact O-CB 3.33Å; K78-Q81 PolarHBondContact O-N 2.9Å; K78-Q81 VanDerWaalsContact O-N 3.11Å; K78-Y82 HydrophobicContact CB-CE2 4.4Å; K78-Y82 WeakPolarHBondContact O-CD2 3.21Å; K78-Y82 PolarHBondContact O-N 3.49Å
79L78.5Confident71.4Confident45 Ų4592.4 Ų92.424%0.23645%0.451CS..Hα-helixtrans-58.7-46.7176.7-16966.7000110.8S75 A76 Q81 Y82 F83 L137 W200S75-L79 PolarHBondContact O-N 3Å; A76-L79 PolarHBondContact O-N 3.3Å; L79-Q81 PolarHBondContact O-N 3.42Å; L79-Y82 PolarHBondContact O-N 3.42Å; L79-F83 HydrophobicContact CD1-CD2 4.37Å; L79-F83 HydrophobicContact CD1-CE2 3.89Å; L79-F83 HydrophobicContact CG-CD2 4.28Å; L79-F83 HydrophobicContact CG-CE2 4.14Å; L79-F83 WeakPolarHBondContact O-CD2 2.97Å; L79-F83 PolarHBondContact O-N 2.92Å; L79-L137 HydrophobicContact CD1-CD2 4.18Å; L79-W200 HydrophobicContact CD1-CD2 3.86Å; L79-W200 HydrophobicContact CD1-CE3 3.9Å; L79-W200 HydrophobicContact CD1-CG 4.48Å; L79-W200 HydrophobicContact CD1-CH2 4.11Å; L79-W200 HydrophobicContact CD1-CZ2 4.08Å; L79-W200 HydrophobicContact CD1-CZ3 4.03Å
80K83.2Confident73.1Confident154 Ų15486.5 Ų86.567%0.6743%0.428SS*.Hα-helixtrans-53.8-42.7174.7-175.5180177.1-175.50111.5A76 K78 Y82 F83 D84A76-K80 VanDerWaalsContact O-CB 3.32Å; A76-K80 WeakPolarHBondContact O-CB 3.41Å; A76-K80 PolarHBondContact O-N 2.9Å; K78-K80 VanDerWaalsContact C-N 3.32Å; K78-K80 PolarHBondContact O-N 3.46Å; K80-Y82 VanDerWaalsContact C-N 3.34Å; K80-Y82 PolarHBondContact O-N 3.1Å; K80-F83 CarbonylContact O-C 3.42Å; K80-F83 PolarHBondContact O-N 3.45Å; K80-F83 VanDerWaalsContact O-N 3.09Å; K80-D84 PolarHBondContact O-N 2.92Å
81Q81.7Confident74.9Confident74 Ų7483.1 Ų83.135%0.34642%0.42SS..Hα-helixtrans-64.5-32.1178.1-70167.9-8.900113.9V77 K78 L79 F83 D84 R129V77-Q81 WeakPolarHBondContact O-CG 3.45Å; V77-Q81 PolarHBondContact O-N 3.33Å; K78-Q81 WeakPolarHBondContact O-CB 3.33Å; K78-Q81 PolarHBondContact O-N 2.9Å; K78-Q81 VanDerWaalsContact O-N 3.11Å; L79-Q81 PolarHBondContact O-N 3.42Å; Q81-F83 PolarHBondContact O-N 3.31Å; Q81-D84 PolarHBondContact O-N 2.99Å; Q81-R129 VanDerWaalsContact OE1-CZ 3.24Å
82Y86Confident76.3Confident16 Ų1680.7 Ų80.76%0.06341%0.405CS..Hα-helixtrans-70.3-17.5175.1-69.8-77.5000113.3K78 L79 K80 I135 L137 Y138 W200 D201K78-Y82 HydrophobicContact CB-CE2 4.4Å; K78-Y82 WeakPolarHBondContact O-CD2 3.21Å; K78-Y82 PolarHBondContact O-N 3.49Å; L79-Y82 PolarHBondContact O-N 3.42Å; K80-Y82 VanDerWaalsContact C-N 3.34Å; K80-Y82 PolarHBondContact O-N 3.1Å; Y82-I135 HydrophobicContact CD1-CG2 4.32Å; Y82-I135 WeakPolarHBondContact CD1-O 3.48Å; Y82-I135 HydrophobicContact CE1-CB 4.32Å; Y82-I135 HydrophobicContact CE1-CG2 3.97Å; Y82-L137 HydrophobicContact CD1-CB 4.39Å; Y82-L137 HydrophobicContact CG-CB 4.19Å; Y82-L137 PolarHBondContact O-N 2.84Å; Y82-Y138 PolarHBondContact O-N 3Å; Y82-W200 HydrophobicContact CD2-CB 4.06Å; Y82-W200 HydrophobicContact CE1-CB 4.38Å; Y82-W200 HydrophobicContact CE2-CB 3.5Å; Y82-W200 HydrophobicContact CE2-CG 4.14Å; Y82-D201 WeakPolarHBondContact CE1-OD1 3.41Å; Y82-D201 PolarHBondContact OH-OD1 2.97Å; Y82-D201 PolarHBondContact OH-OD2 3.39Å
83F88.3Confident77.9Confident85 Ų8570.4 Ų70.437%0.37337%0.367SS..Hα-helixtrans-108.8-4.7178.8-72.6-76.8000113.5L79 K80 Q81 V85 L137 Y138 V141L79-F83 HydrophobicContact CD1-CD2 4.37Å; L79-F83 HydrophobicContact CD1-CE2 3.89Å; L79-F83 HydrophobicContact CG-CD2 4.28Å; L79-F83 HydrophobicContact CG-CE2 4.14Å; L79-F83 WeakPolarHBondContact O-CD2 2.97Å; L79-F83 PolarHBondContact O-N 2.92Å; K80-F83 CarbonylContact O-C 3.42Å; K80-F83 PolarHBondContact O-N 3.45Å; K80-F83 VanDerWaalsContact O-N 3.09Å; Q81-F83 PolarHBondContact O-N 3.31Å; F83-V85 VanDerWaalsContact C-N 3.27Å; F83-V85 PolarHBondContact O-N 3.21Å; F83-L137 HydrophobicContact CE2-CB 4.42Å; F83-L137 HydrophobicContact CE2-CD2 3.82Å; F83-L137 HydrophobicContact CE2-CG 4.39Å; F83-L137 HydrophobicContact CZ-CB 4.3Å; F83-L137 HydrophobicContact CZ-CD2 3.84Å; F83-L137 HydrophobicContact CZ-CG 4.05Å; F83-Y138 HydrophobicContact CD1-CD2 4.22Å; F83-V141 HydrophobicContact CE1-CG2 4.36Å; F83-V141 HydrophobicContact CZ-CG2 4.27Å
84D85.7Confident79.9Confident126 Ų12663.4 Ų63.467%0.67434%0.343SS*.  trans-80.278.4177.6-163.522.3000109.3K80 Q81K80-D84 PolarHBondContact O-N 2.92Å; Q81-D84 PolarHBondContact O-N 2.99Å
85V85.5Confident81.7Confident30 Ų3063.3 Ų63.318%0.18234%0.34CS..  trans-133.6127.1-168.9175.50000110.3F83 Y89 V90 D136 Y138F83-V85 VanDerWaalsContact C-N 3.27Å; F83-V85 PolarHBondContact O-N 3.21Å; V85-Y89 HydrophobicContact CB-CD1 4.45Å; V85-Y89 HydrophobicContact CG1-CD1 3.34Å; V85-Y89 HydrophobicContact CG1-CE1 4.03Å; V85-Y89 HydrophobicContact CG1-CG 4Å; V85-Y89 HydrophobicContact CG2-CD1 4.42Å; V85-Y89 HydrophobicContact CG2-CE1 4.41Å; V85-V90 HydrophobicContact CG1-CG2 3.48Å; V85-V90 VanDerWaalsContact CG1-CG2 3.48Å; V85-D136 HydrophobicContact CG2-CB 4.04Å; V85-Y138 HydrophobicContact CB-CG 4.43Å; V85-Y138 HydrophobicContact CG1-CD1 4.34Å
86D85Confident83.2Confident103 Ų10361.7 Ų61.755%0.55133%0.328SS*.  trans-84.8152.9173.2-71.1-43.2000112.9L88 Y89 V90D86-L88 PolarHBondContact O-N 3.13Å; D86-L88 VanDerWaalsContact O-N 3.1Å; D86-Y89 WeakPolarHBondContact O-CA 3.43Å; D86-Y89 VanDerWaalsContact O-CB 3.31Å; D86-Y89 WeakPolarHBondContact O-CB 3.25Å; D86-Y89 PolarHBondContact O-N 3.36Å; D86-V90 PolarHBondContact O-N 2.86Å
87N87Confident84.7Confident141 Ų14159.1 Ų59.175%0.75431%0.307SS*.Hα-helixtrans-52.9-35.9173.4-70.1-31.8000112.9V90 G91N87-V90 PolarHBondContact O-N 3.45Å; N87-G91 PolarHBondContact O-N 2.83Å; N87-G91 VanDerWaalsContact O-N 3.1Å
88L83Confident85.8Confident40 Ų4056.1 Ų56.121%0.20929%0.288CS..Hα-helixtrans-67.7-40177.5177.858.7000112.2D86 V90 K92 W114D86-L88 PolarHBondContact O-N 3.13Å; D86-L88 VanDerWaalsContact O-N 3.1Å; L88-V90 VanDerWaalsContact C-N 3.33Å; L88-K92 HydrophobicContact CD1-CD 4.46Å; L88-K92 HydrophobicContact CG-CD 4.4Å; L88-K92 WeakPolarHBondContact O-CB 3.41Å; L88-K92 WeakPolarHBondContact O-CG 3.43Å; L88-K92 PolarHBondContact O-N 3.02Å; L88-W114 HydrophobicContact CD1-CD2 3.42Å; L88-W114 VanDerWaalsContact CD1-CD2 3.42Å; L88-W114 HydrophobicContact CD1-CE3 3.39Å; L88-W114 HydrophobicContact CD1-CG 3.92Å; L88-W114 HydrophobicContact CD1-CH2 4Å; L88-W114 HydrophobicContact CD1-CZ2 4.04Å; L88-W114 HydrophobicContact CD1-CZ3 3.68Å; L88-W114 HydrophobicContact CD2-CB 4.07Å; L88-W114 HydrophobicContact CD2-CD2 4.14Å; L88-W114 HydrophobicContact CD2-CE3 3.76Å; L88-W114 HydrophobicContact CD2-CG 4.26Å; L88-W114 HydrophobicContact CD2-CZ3 4.5Å; L88-W114 HydrophobicContact CG-CD2 4.41Å; L88-W114 HydrophobicContact CG-CE3 4.22Å
89Y84.5Confident86.8Confident31 Ų3156.1 Ų56.112%0.12229%0.288CS..Hα-helixtrans-60.8-46173.1174.5-78.8000110.1V85 D86 G91 K92 K93 A134 D136 I139V85-Y89 HydrophobicContact CB-CD1 4.45Å; V85-Y89 HydrophobicContact CG1-CD1 3.34Å; V85-Y89 HydrophobicContact CG1-CE1 4.03Å; V85-Y89 HydrophobicContact CG1-CG 4Å; V85-Y89 HydrophobicContact CG2-CD1 4.42Å; V85-Y89 HydrophobicContact CG2-CE1 4.41Å; D86-Y89 WeakPolarHBondContact O-CA 3.43Å; D86-Y89 VanDerWaalsContact O-CB 3.31Å; D86-Y89 WeakPolarHBondContact O-CB 3.25Å; D86-Y89 PolarHBondContact O-N 3.36Å; Y89-G91 PolarHBondContact O-N 2.84Å; Y89-K92 WeakPolarHBondContact O-CB 3.37Å; Y89-K92 PolarHBondContact O-N 3.32Å; Y89-K93 HydrophobicContact CD1-CB 4.38Å; Y89-K93 HydrophobicContact CE1-CB 4.13Å; Y89-K93 HydrophobicContact CE1-CD 4.32Å; Y89-K93 HydrophobicContact CE1-CG 4.27Å; Y89-K93 WeakPolarHBondContact O-CB 3.4Å; Y89-K93 PolarHBondContact O-N 2.74Å; Y89-K93 PolarHBondContact OH-NZ 3.34Å; Y89-A134 PolarHBondContact OH-O 3.41Å; Y89-D136 HydrophobicContact CE1-CB 4.14Å; Y89-D136 PolarHBondContact OH-OD2 3.32Å; Y89-I139 HydrophobicContact CD1-CD1 4.48Å; Y89-I139 HydrophobicContact CE1-CD1 4.13Å
90V89.8Confident87.1Confident25 Ų2554 Ų5415%0.15228%0.277CS..Hα-helixtrans-57.6-50.1-179.7178.90000111.2V85 D86 N87 L88 K92 K93 L94 Y138 I139V85-V90 HydrophobicContact CG1-CG2 3.48Å; V85-V90 VanDerWaalsContact CG1-CG2 3.48Å; D86-V90 PolarHBondContact O-N 2.86Å; N87-V90 PolarHBondContact O-N 3.45Å; L88-V90 VanDerWaalsContact C-N 3.33Å; V90-K92 VanDerWaalsContact C-N 3.34Å; V90-K92 PolarHBondContact O-N 3.33Å; V90-K93 PolarHBondContact O-N 3.22Å; V90-L94 HydrophobicContact CG1-CD1 3.74Å; V90-L94 HydrophobicContact CG1-CG 4.08Å; V90-L94 WeakPolarHBondContact O-CB 3.34Å; V90-L94 VanDerWaalsContact O-CG 3.3Å; V90-L94 WeakPolarHBondContact O-CG 3.3Å; V90-L94 PolarHBondContact O-N 3.07Å; V90-Y138 HydrophobicContact CG2-CD1 4.03Å; V90-Y138 HydrophobicContact CG2-CE1 3.86Å; V90-I139 HydrophobicContact CG1-CD1 4.4Å; V90-I139 HydrophobicContact CG1-CG1 4.24Å; V90-I139 HydrophobicContact CG2-CG1 4.34Å
91G88.3Confident87.1Confident42 Ų4252 Ų5243%0.43327%0.268SS..Hα-helixtrans-60.1-43.3-179.900000112.8N87 Y89 L95N87-G91 PolarHBondContact O-N 2.83Å; N87-G91 VanDerWaalsContact O-N 3.1Å; Y89-G91 PolarHBondContact O-N 2.84Å; G91-L95 PolarHBondContact O-N 3.3Å; G91-L95 VanDerWaalsContact O-N 3.12Å
92K83.3Confident86.8Confident32 Ų3252.9 Ų52.914%0.13928%0.275CS..Hα-helixtrans-60.2-46.3174.6-78.8175.3-174.9172.10111.6L88 Y89 V90 L96 F107 I110L88-K92 HydrophobicContact CD1-CD 4.46Å; L88-K92 HydrophobicContact CG-CD 4.4Å; L88-K92 WeakPolarHBondContact O-CB 3.41Å; L88-K92 WeakPolarHBondContact O-CG 3.43Å; L88-K92 PolarHBondContact O-N 3.02Å; Y89-K92 WeakPolarHBondContact O-CB 3.37Å; Y89-K92 PolarHBondContact O-N 3.32Å; V90-K92 VanDerWaalsContact C-N 3.34Å; V90-K92 PolarHBondContact O-N 3.33Å; K92-L96 WeakPolarHBondContact O-CB 3.24Å; K92-L96 PolarHBondContact O-N 3.3Å; K92-L96 VanDerWaalsContact O-N 3.12Å; K92-F107 HydrophobicContact CB-CE2 3.7Å; K92-F107 HydrophobicContact CB-CZ 4.02Å; K92-F107 HydrophobicContact CD-CZ 4.3Å; K92-F107 HydrophobicContact CG-CE2 4.09Å; K92-F107 HydrophobicContact CG-CZ 4.26Å; K92-I110 HydrophobicContact CG-CG2 4.45Å
93K88.5Confident85.7Confident2 Ų253.2 Ų53.21%0.00928%0.278CS..Hα-helixtrans-67.3-44.1-178.4-166.876.4164-136.80111.8Y89 V90 L95 L96 V97 V132 A134 D136 I139 Y208Y89-K93 HydrophobicContact CD1-CB 4.38Å; Y89-K93 HydrophobicContact CE1-CB 4.13Å; Y89-K93 HydrophobicContact CE1-CD 4.32Å; Y89-K93 HydrophobicContact CE1-CG 4.27Å; Y89-K93 WeakPolarHBondContact O-CB 3.4Å; Y89-K93 PolarHBondContact O-N 2.74Å; Y89-K93 PolarHBondContact OH-NZ 3.34Å; V90-K93 PolarHBondContact O-N 3.22Å; K93-L95 VanDerWaalsContact C-N 3.34Å; K93-L95 PolarHBondContact O-N 3.08Å; K93-L96 WeakPolarHBondContact O-CB 3.42Å; K93-L96 PolarHBondContact O-N 3.21Å; K93-L96 VanDerWaalsContact O-N 3.13Å; K93-V97 HydrophobicContact CG-CG2 4.39Å; K93-V97 WeakPolarHBondContact O-CB 3.46Å; K93-V97 WeakPolarHBondContact O-CG2 3.44Å; K93-V97 PolarHBondContact O-N 2.92Å; K93-V132 WeakPolarHBondContact CD-O 3.26Å; K93-V132 PolarHBondContact NZ-O 2.89Å; K93-A134 PolarHBondContact NZ-O 3.44Å; K93-D136 WeakPolarHBondContact CE-OD2 3.38Å; K93-D136 IonicContact NZ-OD2 3.35Å; K93-D136 PolarHBondContact NZ-OD2 2.91Å; K93-I139 HydrophobicContact CB-CD1 3.55Å; K93-I139 HydrophobicContact CG-CD1 3.46Å; K93-I139 VanDerWaalsContact CG-CD1 3.46Å; K93-Y208 WeakPolarHBondContact CE-OH 3.42Å
94L91.8Very high84.5Confident59 Ų5956.8 Ų56.831%0.30930%0.295SS..Hα-helixtrans-60.5-43.8177.2-71.8176.3000111.6V90 L96 V97 L98 I139 V211V90-L94 HydrophobicContact CG1-CD1 3.74Å; V90-L94 HydrophobicContact CG1-CG 4.08Å; V90-L94 WeakPolarHBondContact O-CB 3.34Å; V90-L94 VanDerWaalsContact O-CG 3.3Å; V90-L94 WeakPolarHBondContact O-CG 3.3Å; V90-L94 PolarHBondContact O-N 3.07Å; L94-L96 VanDerWaalsContact C-N 3.26Å; L94-L96 PolarHBondContact O-N 3.41Å; L94-V97 PolarHBondContact O-N 3.06Å; L94-L98 WeakPolarHBondContact O-CB 3.08Å; L94-L98 WeakPolarHBondContact O-CG 3.38Å; L94-L98 PolarHBondContact O-N 3.36Å; L94-I139 HydrophobicContact CD2-CG2 4.02Å; L94-V211 HydrophobicContact CD2-CG1 3.66Å; L94-V211 HydrophobicContact CD2-CG2 4.11Å
95L90.2Very high83.5Confident60 Ų6057.9 Ų57.931%0.31430%0.3SS..Hα-helixtrans-59.7-41.2175.2-173.574.8000111.4G91 K93 L98 F99 T106 I110G91-L95 PolarHBondContact O-N 3.3Å; G91-L95 VanDerWaalsContact O-N 3.12Å; K93-L95 VanDerWaalsContact C-N 3.34Å; K93-L95 PolarHBondContact O-N 3.08Å; L95-L98 PolarHBondContact O-N 2.86Å; L95-F99 HydrophobicContact CD1-CD2 3.74Å; L95-F99 HydrophobicContact CD1-CE2 4.23Å; L95-F99 HydrophobicContact CG-CD2 4.48Å; L95-F99 WeakPolarHBondContact O-CA 3.31Å; L95-F99 WeakPolarHBondContact O-CB 3.41Å; L95-F99 PolarHBondContact O-N 2.85Å; L95-T106 HydrophobicContact CD2-CG2 4.46Å; L95-I110 HydrophobicContact CD2-CD1 3.58Å
96L88.6Confident82.5Confident2 Ų259.1 Ų59.11%0.0131%0.308CS..Hα-helixtrans-66.9-42.4178.9-172.2164.8000111.9K92 K93 L94 L98 F99 P100 H103 F107 V132 F242K92-L96 WeakPolarHBondContact O-CB 3.24Å; K92-L96 PolarHBondContact O-N 3.3Å; K92-L96 VanDerWaalsContact O-N 3.12Å; K93-L96 WeakPolarHBondContact O-CB 3.42Å; K93-L96 PolarHBondContact O-N 3.21Å; K93-L96 VanDerWaalsContact O-N 3.13Å; L94-L96 VanDerWaalsContact C-N 3.26Å; L94-L96 PolarHBondContact O-N 3.41Å; L96-L98 VanDerWaalsContact C-N 3.33Å; L96-L98 PolarHBondContact O-N 2.9Å; L96-F99 CarbonylContact O-C 3.58Å; L96-P100 WeakPolarHBondContact O-CA 3.37Å; L96-P100 WeakPolarHBondContact O-CB 3.25Å; L96-H103 WeakPolarHBondContact CD1-CD2 3.39Å; L96-H103 VanDerWaalsContact CD1-NE2 3.3Å; L96-H103 WeakPolarHBondContact CD1-NE2 3.25Å; L96-H103 VanDerWaalsContact CG-CD2 3.48Å; L96-H103 WeakPolarHBondContact CG-CD2 3.28Å; L96-F107 HydrophobicContact CB-CD2 4.49Å; L96-F107 HydrophobicContact CD1-CE2 4.49Å; L96-V132 HydrophobicContact CD1-CG1 3.32Å; L96-F242 HydrophobicContact CD2-CD2 3.05Å; L96-F242 HydrophobicContact CD2-CE2 3.15Å; L96-F242 HydrophobicContact CD2-CG 4.23Å; L96-F242 HydrophobicContact CD2-CZ 4.39Å
97V91Very high81.7Confident0 Ų055 Ų550%029%0.285CS..Hα-helixtrans-62.6-39.9177.1171.20000111.2K93 L94 Y208 V211 I239 F242K93-V97 HydrophobicContact CG-CG2 4.39Å; K93-V97 WeakPolarHBondContact O-CB 3.46Å; K93-V97 WeakPolarHBondContact O-CG2 3.44Å; K93-V97 PolarHBondContact O-N 2.92Å; L94-V97 PolarHBondContact O-N 3.06Å; V97-Y208 HydrophobicContact CG2-CD1 4.11Å; V97-V211 HydrophobicContact CG1-CB 3.95Å; V97-V211 HydrophobicContact CG1-CG1 3.83Å; V97-V211 HydrophobicContact CG1-CG2 4.46Å; V97-I239 HydrophobicContact CG1-CD1 3.38Å; V97-F242 HydrophobicContact CG2-CD1 3.98Å; V97-F242 HydrophobicContact CG2-CD2 4.41Å; V97-F242 HydrophobicContact CG2-CE1 3.67Å; V97-F242 HydrophobicContact CG2-CE2 4.1Å; V97-F242 HydrophobicContact CG2-CG 4.33Å; V97-F242 HydrophobicContact CG2-CZ 3.71Å
98L91.5Very high80.7Confident23 Ų2350.5 Ų50.512%0.1227%0.268CS..Hα-helixtrans-84.9-31.2-177.8-65.5178.6000114.1L94 L95 L96 V211 M215 Y234L94-L98 WeakPolarHBondContact O-CB 3.08Å; L94-L98 WeakPolarHBondContact O-CG 3.38Å; L94-L98 PolarHBondContact O-N 3.36Å; L95-L98 PolarHBondContact O-N 2.86Å; L96-L98 VanDerWaalsContact C-N 3.33Å; L96-L98 PolarHBondContact O-N 2.9Å; L98-V211 HydrophobicContact CD2-CG1 4.06Å; L98-V211 HydrophobicContact CG-CG1 4.34Å; L98-M215 HydrophobicContact CD1-CE 4.28Å; L98-M215 HydrophobicContact CD1-CG 3.69Å; L98-M215 HydrophobicContact CD1-SD 3.92Å; L98-M215 HydrophobicContact CD2-CB 4.26Å; L98-M215 HydrophobicContact CD2-CG 3.46Å; L98-M215 VanDerWaalsContact CD2-CG 3.46Å; L98-M215 HydrophobicContact CG-CG 4.22Å; L98-Y234 WeakPolarHBondContact O-CE1 3.21Å; L98-Y234 PolarHBondContact O-OH 3.29Å
99F90.7Very high80Confident88 Ų8851.7 Ų51.739%0.38628%0.279SS..  trans-130.264.5-178-57-80.7000110.8L95 L96 F101 L102 Y234L95-F99 HydrophobicContact CD1-CD2 3.74Å; L95-F99 HydrophobicContact CD1-CE2 4.23Å; L95-F99 HydrophobicContact CG-CD2 4.48Å; L95-F99 WeakPolarHBondContact O-CA 3.31Å; L95-F99 WeakPolarHBondContact O-CB 3.41Å; L95-F99 PolarHBondContact O-N 2.85Å; L96-F99 CarbonylContact O-C 3.58Å; F99-F101 PolarHBondContact O-N 3.29Å; F99-L102 HydrophobicContact CB-CB 4.33Å; F99-L102 PolarHBondContact O-N 2.92Å; F99-Y234 VanDerWaalsContact CD1-OH 3.3Å; F99-Y234 WeakPolarHBondContact CD1-OH 3.5Å
100P86.2Confident79.3Confident1 Ų152.3 Ų52.31%0.00628%0.284CS..SBendtrans-72.4-18.1-172.735.5-41.9000112.5L96 H103 A238 F241 F242L96-P100 WeakPolarHBondContact O-CA 3.37Å; L96-P100 WeakPolarHBondContact O-CB 3.25Å; P100-H103 VanDerWaalsContact O-CB 3.27Å; P100-H103 WeakPolarHBondContact O-CB 3.34Å; P100-A238 HydrophobicContact CG-CB 4Å; P100-A238 WeakPolarHBondContact CG-O 3.49Å; P100-F241 HydrophobicContact CB-CD1 3.68Å; P100-F241 HydrophobicContact CB-CE1 4.18Å; P100-F241 HydrophobicContact CG-CD1 3.78Å; P100-F242 HydrophobicContact CB-CB 4.18Å
101F82.6Confident78.2Confident111 Ų11152.8 Ų52.849%0.48729%0.289SS..SBendtrans-76.6-34.6176.6-49.5-64.5000112.7F99 H103 Y234 F241F99-F101 PolarHBondContact O-N 3.29Å; F101-H103 PolarHBondContact O-N 3.23Å; F101-Y234 HydrophobicContact CE2-CE2 4.48Å; F101-F241 AromaticContact CD1-CD1 3.99Å; F101-F241 HydrophobicContact CD1-CD1 3.99Å; F101-F241 AromaticContact CD1-CE1 3.97Å; F101-F241 HydrophobicContact CD1-CE1 3.97Å; F101-F241 HydrophobicContact CD1-CG 4.34Å; F101-F241 HydrophobicContact CD1-CZ 4.3Å; F101-F241 HydrophobicContact CE1-CB 4.1Å; F101-F241 AromaticContact CE1-CD1 3.75Å; F101-F241 HydrophobicContact CE1-CD1 3.75Å; F101-F241 HydrophobicContact CE1-CD2 4Å; F101-F241 HydrophobicContact CE1-CE1 4.14Å; F101-F241 HydrophobicContact CE1-CE2 4.36Å; F101-F241 AromaticContact CE1-CG 3.67Å; F101-F241 HydrophobicContact CE1-CG 3.67Å; F101-F241 HydrophobicContact CE1-CZ 4.43Å; F101-F241 HydrophobicContact CZ-CB 4.29Å; F101-F241 HydrophobicContact CZ-CG 4.34Å
102L75.5Confident77.3Confident94 Ų9458 Ų5849%0.49230%0.302SS..G310 helixtrans-77.9-0.1179.5-84.665.2000112.6F99 Q104 L105 T106F99-L102 HydrophobicContact CB-CB 4.33Å; F99-L102 PolarHBondContact O-N 2.92Å; L102-Q104 VanDerWaalsContact C-N 3.34Å; L102-Q104 PolarHBondContact O-N 2.82Å; L102-L105 PolarHBondContact O-N 3.35Å; L102-T106 PolarHBondContact O-N 3.07Å
103H63.4Low76.4Confident23 Ų2366.1 Ų66.111%0.10633%0.332CS..G310 helixtrans-56.5-39.2-171.8-177.9-43.8000113.4L96 P100 F101 L105 F107 R245L96-H103 WeakPolarHBondContact CD1-CD2 3.39Å; L96-H103 VanDerWaalsContact CD1-NE2 3.3Å; L96-H103 WeakPolarHBondContact CD1-NE2 3.25Å; L96-H103 VanDerWaalsContact CG-CD2 3.48Å; L96-H103 WeakPolarHBondContact CG-CD2 3.28Å; P100-H103 VanDerWaalsContact O-CB 3.27Å; P100-H103 WeakPolarHBondContact O-CB 3.34Å; F101-H103 PolarHBondContact O-N 3.23Å; H103-L105 PolarHBondContact O-N 3.17Å; H103-F107 AromaticContact CE1-CD1 3.72Å; H103-F107 WeakPolarHBondContact O-CB 3.38Å; H103-F107 PolarHBondContact O-N 3.42Å; H103-R245 VanDerWaalsContact CB-NH1 3.3Å; H103-R245 PolarHBondContact CD2-NH1 3.08Å; H103-R245 VanDerWaalsContact CD2-NH1 3.28Å; H103-R245 PolarHBondContact CD2-NH2 2.63Å; H103-R245 PolarHBondContact CE1-NH2 3.11Å; H103-R245 VanDerWaalsContact CG-CZ 3.42Å; H103-R245 PolarHBondContact ND1-NH2 3.45Å; H103-R245 VanDerWaalsContact ND1-NH2 3.15Å; H103-R245 PolarHBondContact NE2-NH2 3.19Å; H103-R245 VanDerWaalsContact NE2-NH2 3.14Å
104Q62.8Low75Confident159 Ų15971.1 Ų71.174%0.74335%0.35SS*.G310 helixtrans-69.9-35.5-173.5-73.5-179.1-12.600112.8L102 A108L102-Q104 VanDerWaalsContact C-N 3.34Å; L102-Q104 PolarHBondContact O-N 2.82Å; Q104-A108 WeakPolarHBondContact O-CB 3.44Å
105L64Low73.7Confident149 Ų14971.9 Ų71.978%0.7836%0.361SS*.THydrogen-bonded Turntrans-96.5-52.2-173.5-68.3170.3000112.3L102 H103 S109L102-L105 PolarHBondContact O-N 3.35Å; H103-L105 PolarHBondContact O-N 3.17Å; L105-S109 PolarHBondContact O-N 2.73Å; L105-S109 PolarHBondContact O-OG 3.4Å
106T65.9Low72.5Confident57 Ų5772.5 Ų72.535%0.3537%0.374SS..Hα-helixtrans-76.7-40.7-175-50.40000111.2L95 L102 S109 I110L95-T106 HydrophobicContact CD2-CG2 4.46Å; L102-T106 PolarHBondContact O-N 3.07Å; T106-S109 PolarHBondContact O-OG 2.91Å; T106-I110 HydrophobicContact CG2-CD1 3.79Å; T106-I110 WeakPolarHBondContact O-CB 3.38Å; T106-I110 WeakPolarHBondContact O-CD1 3.49Å; T106-I110 WeakPolarHBondContact O-CG1 3.3Å; T106-I110 PolarHBondContact O-N 2.87Å
107F67.2Low71.2Confident16 Ų1681 Ų817%0.0741%0.407CS..Hα-helixtrans-69-41.9-178.5-167.1-93.3000112.2K92 L96 H103 I110 S111 V132K92-F107 HydrophobicContact CB-CE2 3.7Å; K92-F107 HydrophobicContact CB-CZ 4.02Å; K92-F107 HydrophobicContact CD-CZ 4.3Å; K92-F107 HydrophobicContact CG-CE2 4.09Å; K92-F107 HydrophobicContact CG-CZ 4.26Å; L96-F107 HydrophobicContact CB-CD2 4.49Å; L96-F107 HydrophobicContact CD1-CE2 4.49Å; H103-F107 AromaticContact CE1-CD1 3.72Å; H103-F107 WeakPolarHBondContact O-CB 3.38Å; H103-F107 PolarHBondContact O-N 3.42Å; F107-I110 PolarHBondContact O-N 3.2Å; F107-S111 WeakPolarHBondContact O-CB 3.3Å; F107-S111 PolarHBondContact O-N 3.26Å; F107-S111 PolarHBondContact O-OG 3.21Å; F107-V132 HydrophobicContact CE1-CB 3.87Å; F107-V132 HydrophobicContact CE1-CG1 3.86Å; F107-V132 HydrophobicContact CE1-CG2 3.62Å; F107-V132 HydrophobicContact CE2-CG1 3.83Å; F107-V132 HydrophobicContact CE2-CG2 4.31Å; F107-V132 HydrophobicContact CZ-CB 3.65Å; F107-V132 HydrophobicContact CZ-CG1 3.36Å; F107-V132 HydrophobicContact CZ-CG2 3.2Å
108A66.9Low69.7Low47 Ų4785.5 Ų85.539%0.38843%0.428SS..Hα-helixtrans-62.9-45.1179.200000112Q104 S111 Q112Q104-A108 WeakPolarHBondContact O-CB 3.44Å; A108-S111 VanDerWaalsContact CA-OG 3.32Å; A108-S111 WeakPolarHBondContact CA-OG 3.11Å; A108-S111 PolarHBondContact O-N 2.91Å; A108-S111 PolarHBondContact O-OG 3.27Å; A108-Q112 PolarHBondContact O-N 3.02Å
109S66.9Low68.2Low64 Ų6488.8 Ų88.845%0.44846%0.458SS..Hα-helixtrans-65.4-40.2177.455.60000112.6L105 T106 R113L105-S109 PolarHBondContact O-N 2.73Å; L105-S109 PolarHBondContact O-OG 3.4Å; T106-S109 PolarHBondContact O-OG 2.91Å; S109-R113 WeakPolarHBondContact O-CG 3.39Å; S109-R113 PolarHBondContact O-N 3.42Å
110I69.6Low66.6Low44 Ų4488.9 Ų88.923%0.22647%0.47CS..Hα-helixtrans-60.1-54.8171.1-72172.6000109.1K92 L95 T106 F107 Q112 R113 W114K92-I110 HydrophobicContact CG-CG2 4.45Å; L95-I110 HydrophobicContact CD2-CD1 3.58Å; T106-I110 HydrophobicContact CG2-CD1 3.79Å; T106-I110 WeakPolarHBondContact O-CB 3.38Å; T106-I110 WeakPolarHBondContact O-CD1 3.49Å; T106-I110 WeakPolarHBondContact O-CG1 3.3Å; T106-I110 PolarHBondContact O-N 2.87Å; F107-I110 PolarHBondContact O-N 3.2Å; I110-Q112 VanDerWaalsContact C-N 3.3Å; I110-Q112 PolarHBondContact O-N 2.91Å; I110-R113 PolarHBondContact O-N 3.3Å; I110-R113 VanDerWaalsContact O-N 3.09Å; I110-W114 VanDerWaalsContact CG2-CD1 3.43Å; I110-W114 VanDerWaalsContact CG2-NE1 3.29Å; I110-W114 PolarHBondContact O-N 3.31Å
111S68Low64.8Low35 Ų3595.9 Ų95.925%0.24550%0.502CS..Hα-helixtrans-54.4-42.6-175.9560000113.3F107 A108 R113 W114 S115F107-S111 WeakPolarHBondContact O-CB 3.3Å; F107-S111 PolarHBondContact O-N 3.26Å; F107-S111 PolarHBondContact O-OG 3.21Å; A108-S111 VanDerWaalsContact CA-OG 3.32Å; A108-S111 WeakPolarHBondContact CA-OG 3.11Å; A108-S111 PolarHBondContact O-N 2.91Å; A108-S111 PolarHBondContact O-OG 3.27Å; S111-R113 PolarHBondContact O-N 3.2Å; S111-W114 PolarHBondContact O-N 2.72Å; S111-S115 PolarHBondContact O-N 3.35Å; S111-S115 PolarHBondContact O-OG 2.83Å
112Q68.5Low63.3Low152 Ų15295.7 Ų95.771%0.7151%0.506SS*.Hα-helixtrans-62.9-43.1179.9-170.1179.9-5600112.2A108 I110 W114 A116A108-Q112 PolarHBondContact O-N 3.02Å; I110-Q112 VanDerWaalsContact C-N 3.3Å; I110-Q112 PolarHBondContact O-N 2.91Å; Q112-W114 VanDerWaalsContact C-N 3.26Å; Q112-W114 PolarHBondContact O-N 3.2Å; Q112-A116 PolarHBondContact O-N 2.98Å
113R64.3Low62.1Low203 Ų203100.9 Ų100.977%0.76653%0.528SS*.Hα-helixtrans-62.6-32.9178.1-69.2174.868.9168.92.1112.5S109 I110 S111S109-R113 WeakPolarHBondContact O-CG 3.39Å; S109-R113 PolarHBondContact O-N 3.42Å; I110-R113 PolarHBondContact O-N 3.3Å; I110-R113 VanDerWaalsContact O-N 3.09Å; S111-R113 PolarHBondContact O-N 3.2Å
114W59.9Low61.3Low106 Ų106108 Ų10840%0.40256%0.558SS.*Hα-helixtrans-86.6-36.3-179.4-62.9105.3000113.3L88 I110 S111 Q112 A116 R117 Q118L88-W114 HydrophobicContact CD1-CD2 3.42Å; L88-W114 VanDerWaalsContact CD1-CD2 3.42Å; L88-W114 HydrophobicContact CD1-CE3 3.39Å; L88-W114 HydrophobicContact CD1-CG 3.92Å; L88-W114 HydrophobicContact CD1-CH2 4Å; L88-W114 HydrophobicContact CD1-CZ2 4.04Å; L88-W114 HydrophobicContact CD1-CZ3 3.68Å; L88-W114 HydrophobicContact CD2-CB 4.07Å; L88-W114 HydrophobicContact CD2-CD2 4.14Å; L88-W114 HydrophobicContact CD2-CE3 3.76Å; L88-W114 HydrophobicContact CD2-CG 4.26Å; L88-W114 HydrophobicContact CD2-CZ3 4.5Å; L88-W114 HydrophobicContact CG-CD2 4.41Å; L88-W114 HydrophobicContact CG-CE3 4.22Å; I110-W114 VanDerWaalsContact CG2-CD1 3.43Å; I110-W114 VanDerWaalsContact CG2-NE1 3.29Å; I110-W114 PolarHBondContact O-N 3.31Å; S111-W114 PolarHBondContact O-N 2.72Å; Q112-W114 VanDerWaalsContact C-N 3.26Å; Q112-W114 PolarHBondContact O-N 3.2Å; W114-A116 PolarHBondContact O-N 3.37Å; W114-R117 CarbonylContact O-C 3.54Å; W114-R117 WeakPolarHBondContact O-CA 3.37Å; W114-R117 WeakPolarHBondContact O-CB 3.31Å; W114-R117 PolarHBondContact O-N 3.35Å; W114-Q118 PolarHBondContact O-N 3.43Å
115S65Low60.5Low75 Ų75108 Ų10852%0.52456%0.564SS.*Hα-helixtrans-58.5-38.3173.9-66.60000111.4S111 R117 Q118 A119S111-S115 PolarHBondContact O-N 3.35Å; S111-S115 PolarHBondContact O-OG 2.83Å; S115-R117 PolarHBondContact O-N 3.27Å; S115-Q118 PolarHBondContact O-N 3.18Å; S115-A119 WeakPolarHBondContact O-CB 3.48Å; S115-A119 PolarHBondContact O-N 3.18Å
116A64.4Low59.8Low73 Ų73104.6 Ų104.660%0.60356%0.557SS**Hα-helixtrans-61.5-27.9172.400000113.7Q112 W114Q112-A116 PolarHBondContact O-N 2.98Å; W114-A116 PolarHBondContact O-N 3.37Å
117R60.4Low58.8Low182 Ų182104.4 Ų104.469%0.68756%0.558SS**Hα-helixtrans-91.5-26.1-178.8-163.1170.2173.4108.7-3.9113.1W114 S115 S120W114-R117 CarbonylContact O-C 3.54Å; W114-R117 WeakPolarHBondContact O-CA 3.37Å; W114-R117 WeakPolarHBondContact O-CB 3.31Å; W114-R117 PolarHBondContact O-N 3.35Å; S115-R117 PolarHBondContact O-N 3.27Å; R117-S120 PolarHBondContact O-OG 2.89Å
118Q59.3Low57.8Low94 Ų94109.3 Ų109.344%0.43959%0.591SS.*Hα-helixtrans-79.1-39.6174.9-151.485.331.500111.2W114 S115 S120 H121 D122W114-Q118 PolarHBondContact O-N 3.43Å; S115-Q118 PolarHBondContact O-N 3.18Å; Q118-S120 PolarHBondContact O-N 3.16Å; Q118-S120 VanDerWaalsContact O-N 3.07Å; Q118-H121 PolarHBondContact O-N 2.89Å; Q118-D122 PolarHBondContact O-N 3.48Å
119A60.3Low57Low91 Ų91113.2 Ų113.275%0.75260%0.596SS**THydrogen-bonded Turntrans-59.1-21175.600000113.1S115S115-A119 WeakPolarHBondContact O-CB 3.48Å; S115-A119 PolarHBondContact O-N 3.18Å
120S57.2Low56.3Low91 Ų91114.7 Ų114.764%0.63660%0.599SS**THydrogen-bonded Turntrans-85.4-7.6176.154.50000115.3R117 Q118R117-S120 PolarHBondContact O-OG 2.89Å; Q118-S120 PolarHBondContact O-N 3.16Å; Q118-S120 VanDerWaalsContact O-N 3.07Å
121H48.8Very low55.9Low148 Ų148115.6 Ų115.669%0.68561%0.609SS**THydrogen-bonded Turntrans-131.6-13.6-169.8-158-84000117.8Q118Q118-H121 PolarHBondContact O-N 2.89Å
122D51.1Low55.5Low106 Ų106114.9 Ų114.957%0.56760%0.603SS**  trans-158.7127.3173.6-101.3-46.7000113.6Q118 K124Q118-D122 PolarHBondContact O-N 3.48Å; D122-K124 PolarHBondContact O-N 2.96Å
123E50Low55.5Low204 Ų204109.3 Ų109.395%0.95358%0.578SS**  trans-71.435.2168.8-65.5-174.7142.800112.6D125E123-D125 PolarHBondContact O-N 2.77Å
124K46.1Very low56Low173 Ų173101 Ų10175%0.75255%0.552SS**  trans-82.8102.2160.9-75.4-174-178.4173.20105.9D122 A126D122-K124 PolarHBondContact O-N 2.96Å; K124-A126 PolarHBondContact O-N 2.9Å
125D46.1Very low57Low159 Ų15997 Ų9785%0.8554%0.539SS*.  trans-31.2106.1164.3-83.4-34.5000108.4E123 S127E123-D125 PolarHBondContact O-N 2.77Å; D125-S127 VanDerWaalsContact C-N 3.26Å; D125-S127 PolarHBondContact O-N 3.21Å
126A50Low58.2Low77 Ų7793.6 Ų93.664%0.63651%0.514SS*.  trans-57.9101.4176.500000105.1K124 D130K124-A126 PolarHBondContact O-N 2.9Å; A126-D130 WeakPolarHBondContact CA-OD2 3.29Å
127S44.8Very low59.5Low53 Ų5390.4 Ų90.437%0.37149%0.487SS..  trans-57.1139.5180-174.80000105.4D125 R129 D130D125-S127 VanDerWaalsContact C-N 3.26Å; D125-S127 PolarHBondContact O-N 3.21Å; S127-R129 PolarHBondContact O-N 2.9Å; S127-D130 PolarHBondContact N-OD2 2.88Å; S127-D130 WeakPolarHBondContact O-CB 3.46Å; S127-D130 PolarHBondContact O-N 3.18Å
128P46.2Very low61.1Low118 Ų11885 Ų8577%0.76647%0.468SS*.G310 helixtrans-54.6-11.1173.5-2835.6000113.8S131P128-S131 WeakPolarHBondContact O-CB 3.09Å; P128-S131 PolarHBondContact O-N 3.48Å; P128-S131 PolarHBondContact O-OG 3.27Å
129R50.7Low62.7Low130 Ų13080.8 Ų80.849%0.49145%0.448SS..G310 helixtrans-74.9-14.7170.2-58.7179.367.6169.8-3114.7Q81 S127 S131 A134Q81-R129 VanDerWaalsContact OE1-CZ 3.24Å; S127-R129 PolarHBondContact O-N 2.9Å; R129-S131 PolarHBondContact O-N 2.8Å; R129-A134 WeakPolarHBondContact O-CB 3.43Å
130D52.4Low64.3Low95 Ų9576.7 Ų76.751%0.50841%0.414SS..G310 helixtrans-71.2-4.4167.6-72-26.5000112.4A126 S127 V132A126-D130 WeakPolarHBondContact CA-OD2 3.29Å; S127-D130 PolarHBondContact N-OD2 2.88Å; S127-D130 WeakPolarHBondContact O-CB 3.46Å; S127-D130 PolarHBondContact O-N 3.18Å; D130-V132 PolarHBondContact O-N 3.18Å; D130-V132 VanDerWaalsContact O-N 3.16Å
131S59.6Low66.1Low63 Ų6375.2 Ų75.244%0.44140%0.401SS..SBendtrans-58.3124.6165.865.70000107.9P128 R129 N133 A134P128-S131 WeakPolarHBondContact O-CB 3.09Å; P128-S131 PolarHBondContact O-N 3.48Å; P128-S131 PolarHBondContact O-OG 3.27Å; R129-S131 PolarHBondContact O-N 2.8Å; S131-N133 PolarHBondContact O-N 3.23Å; S131-A134 WeakPolarHBondContact O-CB 3.25Å; S131-A134 PolarHBondContact O-N 3.1Å
132V60.7Low68.4Low19 Ų1972 Ų7212%0.11539%0.387CS..THydrogen-bonded Turntrans-53.5-12.6-171.2166.20000114.4K93 L96 F107 D130K93-V132 WeakPolarHBondContact CD-O 3.26Å; K93-V132 PolarHBondContact NZ-O 2.89Å; L96-V132 HydrophobicContact CD1-CG1 3.32Å; F107-V132 HydrophobicContact CE1-CB 3.87Å; F107-V132 HydrophobicContact CE1-CG1 3.86Å; F107-V132 HydrophobicContact CE1-CG2 3.62Å; F107-V132 HydrophobicContact CE2-CG1 3.83Å; F107-V132 HydrophobicContact CE2-CG2 4.31Å; F107-V132 HydrophobicContact CZ-CB 3.65Å; F107-V132 HydrophobicContact CZ-CG1 3.36Å; F107-V132 HydrophobicContact CZ-CG2 3.2Å; D130-V132 PolarHBondContact O-N 3.18Å; D130-V132 VanDerWaalsContact O-N 3.16Å
133N67.3Low70.5Confident36 Ų3667.3 Ų67.319%0.19336%0.362CS..THydrogen-bonded Turntrans-83-10.7174.8-62.7-33.7000114.7S131 V249S131-N133 PolarHBondContact O-N 3.23Å; N133-V249 HydrophobicContact CB-CB 4.23Å; N133-V249 HydrophobicContact CB-CG1 3.73Å
134A74.8Confident72.7Confident27 Ų2758.8 Ų58.822%0.22332%0.324CS..SBendtrans-5914317600000111.2Y89 K93 R129 S131Y89-A134 PolarHBondContact OH-O 3.41Å; K93-A134 PolarHBondContact NZ-O 3.44Å; R129-A134 WeakPolarHBondContact O-CB 3.43Å; S131-A134 WeakPolarHBondContact O-CB 3.25Å; S131-A134 PolarHBondContact O-N 3.1Å
135I82.8Confident75.1Confident23 Ų2353.9 Ų53.912%0.11831%0.309CS..  trans-79.5130.2-177.4-59.3168000108.4Y82 D201 A204 Y205 H250Y82-I135 HydrophobicContact CD1-CG2 4.32Å; Y82-I135 WeakPolarHBondContact CD1-O 3.48Å; Y82-I135 HydrophobicContact CE1-CB 4.32Å; Y82-I135 HydrophobicContact CE1-CG2 3.97Å; I135-D201 HydrophobicContact CD1-CB 4.14Å; I135-A204 HydrophobicContact CG2-CB 3.41Å; I135-A204 VanDerWaalsContact CG2-CB 3.41Å; I135-Y205 HydrophobicContact CD1-CD2 4.34Å; I135-Y205 HydrophobicContact CD1-CE2 3.4Å; I135-Y205 WeakPolarHBondContact CD1-OH 3.24Å; I135-Y205 HydrophobicContact CG1-CE2 4.12Å; I135-H250 WeakPolarHBondContact CD1-ND1 3.42Å
136D90Very high77.5Confident3 Ų349 Ų492%0.01629%0.285CS..  trans-122147.5176.770.589.4000110V85 Y89 K93 I139 P140 A204 Y208V85-D136 HydrophobicContact CG2-CB 4.04Å; Y89-D136 HydrophobicContact CE1-CB 4.14Å; Y89-D136 PolarHBondContact OH-OD2 3.32Å; K93-D136 WeakPolarHBondContact CE-OD2 3.38Å; K93-D136 IonicContact NZ-OD2 3.35Å; K93-D136 PolarHBondContact NZ-OD2 2.91Å; D136-I139 WeakPolarHBondContact OD1-CB 3.4Å; D136-I139 WeakPolarHBondContact OD1-CD1 3.29Å; D136-I139 WeakPolarHBondContact OD1-CG1 3.34Å; D136-I139 PolarHBondContact OD1-N 3.45Å; D136-P140 WeakPolarHBondContact O-CD 3.33Å; D136-P140 WeakPolarHBondContact O-CG 3.48Å; D136-P140 WeakPolarHBondContact OD1-CD 3.35Å; D136-A204 VanDerWaalsContact O-CB 3.29Å; D136-A204 WeakPolarHBondContact O-CB 3.35Å; D136-Y208 PolarHBondContact N-OH 3.34Å; D136-Y208 PolarHBondContact O-OH 2.9Å; D136-Y208 PolarHBondContact OD2-OH 3.35Å
137L91Very high79.6Confident6 Ų645.5 Ų45.53%0.03126%0.255CS..SBendtrans-103.6-19.5175.2-169.264.7000111.3L79 Y82 F83 I139 P140 V141 W200 L203 A204L79-L137 HydrophobicContact CD1-CD2 4.18Å; Y82-L137 HydrophobicContact CD1-CB 4.39Å; Y82-L137 HydrophobicContact CG-CB 4.19Å; Y82-L137 PolarHBondContact O-N 2.84Å; F83-L137 HydrophobicContact CE2-CB 4.42Å; F83-L137 HydrophobicContact CE2-CD2 3.82Å; F83-L137 HydrophobicContact CE2-CG 4.39Å; F83-L137 HydrophobicContact CZ-CB 4.3Å; F83-L137 HydrophobicContact CZ-CD2 3.84Å; F83-L137 HydrophobicContact CZ-CG 4.05Å; L137-I139 PolarHBondContact O-N 3.32Å; L137-P140 HydrophobicContact CD1-CB 4.47Å; L137-P140 WeakPolarHBondContact O-CD 3.21Å; L137-V141 HydrophobicContact CD1-CG2 4.42Å; L137-V141 HydrophobicContact CG-CG2 3.99Å; L137-V141 WeakPolarHBondContact O-CB 3.47Å; L137-V141 VanDerWaalsContact O-CG2 3.27Å; L137-V141 WeakPolarHBondContact O-CG2 3.48Å; L137-V141 PolarHBondContact O-N 3.47Å; L137-W200 HydrophobicContact CD2-CE3 3.75Å; L137-W200 HydrophobicContact CD2-CZ3 4.19Å; L137-L203 HydrophobicContact CD1-CB 4.4Å; L137-L203 HydrophobicContact CD1-CD2 4.05Å; L137-L203 HydrophobicContact CD1-CG 3.97Å; L137-A204 HydrophobicContact CD1-CB 4.08Å
138Y93.4Very high82Confident70 Ų7044.4 Ų44.428%0.27525%0.245SC..Hα-helixtrans-55.3-51.1176.8179.2-91.5000112.3Y82 F83 V85 V90 V141 M142Y82-Y138 PolarHBondContact O-N 3Å; F83-Y138 HydrophobicContact CD1-CD2 4.22Å; V85-Y138 HydrophobicContact CB-CG 4.43Å; V85-Y138 HydrophobicContact CG1-CD1 4.34Å; V90-Y138 HydrophobicContact CG2-CD1 4.03Å; V90-Y138 HydrophobicContact CG2-CE1 3.86Å; Y138-V141 PolarHBondContact O-N 3.44Å; Y138-M142 HydrophobicContact CD1-CG 4.23Å; Y138-M142 HydrophobicContact CD2-CE 4.21Å; Y138-M142 HydrophobicContact CD2-CG 4.39Å; Y138-M142 HydrophobicContact CE1-CG 3.83Å; Y138-M142 HydrophobicContact CE2-CE 3.46Å; Y138-M142 VanDerWaalsContact CE2-CE 3.46Å; Y138-M142 HydrophobicContact CE2-CG 4.03Å; Y138-M142 HydrophobicContact CG-CG 4.48Å; Y138-M142 WeakPolarHBondContact O-CB 3.46Å; Y138-M142 WeakPolarHBondContact O-CG 3.21Å; Y138-M142 PolarHBondContact O-N 3.48Å
139I93.9Very high84.3Confident5 Ų544.1 Ų44.13%0.02624%0.236CC..Hα-helixtrans-66.6-48.4-177.1-62.9166000111.3Y89 V90 K93 L94 D136 L137 V141 M142 A143 Y208 V211Y89-I139 HydrophobicContact CD1-CD1 4.48Å; Y89-I139 HydrophobicContact CE1-CD1 4.13Å; V90-I139 HydrophobicContact CG1-CD1 4.4Å; V90-I139 HydrophobicContact CG1-CG1 4.24Å; V90-I139 HydrophobicContact CG2-CG1 4.34Å; K93-I139 HydrophobicContact CB-CD1 3.55Å; K93-I139 HydrophobicContact CG-CD1 3.46Å; K93-I139 VanDerWaalsContact CG-CD1 3.46Å; L94-I139 HydrophobicContact CD2-CG2 4.02Å; D136-I139 WeakPolarHBondContact OD1-CB 3.4Å; D136-I139 WeakPolarHBondContact OD1-CD1 3.29Å; D136-I139 WeakPolarHBondContact OD1-CG1 3.34Å; D136-I139 PolarHBondContact OD1-N 3.45Å; L137-I139 PolarHBondContact O-N 3.32Å; I139-V141 VanDerWaalsContact C-N 3.33Å; I139-V141 PolarHBondContact O-N 2.87Å; I139-M142 PolarHBondContact O-N 2.82Å; I139-A143 WeakPolarHBondContact O-CB 3.39Å; I139-A143 PolarHBondContact O-N 3.28Å; I139-Y208 HydrophobicContact CB-CE1 4.31Å; I139-Y208 HydrophobicContact CG2-CD1 4.37Å; I139-Y208 HydrophobicContact CG2-CE1 4.28Å; I139-V211 HydrophobicContact CG2-CG2 3.92Å
140P94.1Very high86.4Confident5 Ų538.5 Ų38.53%0.03222%0.217CC..Hα-helixtrans-50.2-47.5171.9-34.139000114.4D136 L137 A143 V144 A204 Y208D136-P140 WeakPolarHBondContact O-CD 3.33Å; D136-P140 WeakPolarHBondContact O-CG 3.48Å; D136-P140 WeakPolarHBondContact OD1-CD 3.35Å; L137-P140 HydrophobicContact CD1-CB 4.47Å; L137-P140 WeakPolarHBondContact O-CD 3.21Å; P140-A143 PolarHBondContact O-N 3Å; P140-V144 WeakPolarHBondContact O-CG2 3.23Å; P140-V144 PolarHBondContact O-N 3.37Å; P140-A204 HydrophobicContact CG-CB 4.29Å; P140-A204 WeakPolarHBondContact CG-O 3.26Å; P140-Y208 HydrophobicContact CG-CD1 4.35Å; P140-Y208 HydrophobicContact CG-CD2 4.33Å; P140-Y208 HydrophobicContact CG-CE1 4.22Å; P140-Y208 HydrophobicContact CG-CE2 4.21Å; P140-Y208 HydrophobicContact CG-CG 4.41Å
141V94.6Very high88.3Confident60 Ų6034.1 Ų34.136%0.36419%0.193SC..Hα-helixtrans-65.3-48.5-179.2169.90000110.8F83 L137 Y138 I139 A143 V144 V145F83-V141 HydrophobicContact CE1-CG2 4.36Å; F83-V141 HydrophobicContact CZ-CG2 4.27Å; L137-V141 HydrophobicContact CD1-CG2 4.42Å; L137-V141 HydrophobicContact CG-CG2 3.99Å; L137-V141 WeakPolarHBondContact O-CB 3.47Å; L137-V141 VanDerWaalsContact O-CG2 3.27Å; L137-V141 WeakPolarHBondContact O-CG2 3.48Å; L137-V141 PolarHBondContact O-N 3.47Å; Y138-V141 PolarHBondContact O-N 3.44Å; I139-V141 VanDerWaalsContact C-N 3.33Å; I139-V141 PolarHBondContact O-N 2.87Å; V141-A143 VanDerWaalsContact C-N 3.29Å; V141-A143 PolarHBondContact O-N 3.22Å; V141-V144 PolarHBondContact O-N 3.34Å; V141-V145 PolarHBondContact O-N 3.23Å; V141-V145 VanDerWaalsContact O-N 3.16Å
142M96Very high89.9Confident81 Ų8131.5 Ų31.540%0.39918%0.176SC..Hα-helixtrans-62.9-38.3177.3-69.1-58.6176.800111.5Y138 I139 V144 V145 T146Y138-M142 HydrophobicContact CD1-CG 4.23Å; Y138-M142 HydrophobicContact CD2-CE 4.21Å; Y138-M142 HydrophobicContact CD2-CG 4.39Å; Y138-M142 HydrophobicContact CE1-CG 3.83Å; Y138-M142 HydrophobicContact CE2-CE 3.46Å; Y138-M142 VanDerWaalsContact CE2-CE 3.46Å; Y138-M142 HydrophobicContact CE2-CG 4.03Å; Y138-M142 HydrophobicContact CG-CG 4.48Å; Y138-M142 WeakPolarHBondContact O-CB 3.46Å; Y138-M142 WeakPolarHBondContact O-CG 3.21Å; Y138-M142 PolarHBondContact O-N 3.48Å; I139-M142 PolarHBondContact O-N 2.82Å; M142-V144 PolarHBondContact O-N 3.43Å; M142-V145 PolarHBondContact O-N 3.06Å; M142-T146 WeakPolarHBondContact O-CB 3.27Å; M142-T146 PolarHBondContact O-N 3.46Å; M142-T146 PolarHBondContact O-OG1 2.98Å
143A96.2Very high91.4Very high6 Ų635.1 Ų35.15%0.0519%0.194CC..Hα-helixtrans-64.5-37.6177.100000112.3I139 P140 V141 Y147 V211 I214I139-A143 WeakPolarHBondContact O-CB 3.39Å; I139-A143 PolarHBondContact O-N 3.28Å; P140-A143 PolarHBondContact O-N 3Å; V141-A143 VanDerWaalsContact C-N 3.29Å; V141-A143 PolarHBondContact O-N 3.22Å; A143-Y147 WeakPolarHBondContact O-CB 3.4Å; A143-Y147 PolarHBondContact O-N 3.37Å; A143-V211 HydrophobicContact CB-CG2 3.76Å; A143-I214 HydrophobicContact CB-CD1 4.14Å; A143-I214 WeakPolarHBondContact O-CD1 3.3Å
144V95.5Very high92.5Very high25 Ų2534 Ų3415%0.15219%0.189CC..Hα-helixtrans-62.2-48.7173168.60000110.8P140 V141 M142 Y147 I148 I173 L177 Y210P140-V144 WeakPolarHBondContact O-CG2 3.23Å; P140-V144 PolarHBondContact O-N 3.37Å; V141-V144 PolarHBondContact O-N 3.34Å; M142-V144 PolarHBondContact O-N 3.43Å; V144-Y147 PolarHBondContact O-N 2.91Å; V144-I148 HydrophobicContact CG1-CD1 4Å; V144-I148 WeakPolarHBondContact O-CG1 3.32Å; V144-I148 PolarHBondContact O-N 2.92Å; V144-I173 HydrophobicContact CG1-CG2 3.93Å; V144-L177 HydrophobicContact CG1-CD1 4.45Å; V144-L177 HydrophobicContact CG2-CD1 3.95Å; V144-Y210 HydrophobicContact CG2-CD1 4.32Å; V144-Y210 HydrophobicContact CG2-CD2 3.47Å; V144-Y210 VanDerWaalsContact CG2-CD2 3.47Å; V144-Y210 HydrophobicContact CG2-CE1 4.48Å; V144-Y210 HydrophobicContact CG2-CE2 3.68Å; V144-Y210 HydrophobicContact CG2-CG 3.88Å
145V96.4Very high93.3Very high70 Ų7033.4 Ų33.442%0.42418%0.182SC..Hα-helixtrans-61.9-49.4179.4175.90000110.9V141 M142 Y147 I148 L149V141-V145 PolarHBondContact O-N 3.23Å; V141-V145 VanDerWaalsContact O-N 3.16Å; M142-V145 PolarHBondContact O-N 3.06Å; V145-Y147 VanDerWaalsContact C-N 3.32Å; V145-Y147 PolarHBondContact O-N 2.8Å; V145-I148 WeakPolarHBondContact O-CB 3.38Å; V145-I148 PolarHBondContact O-N 3.41Å; V145-L149 HydrophobicContact CG1-CD1 4.1Å; V145-L149 WeakPolarHBondContact O-CG 3.29Å; V145-L149 PolarHBondContact O-N 2.86Å
146T96.5Very high93.7Very high58 Ų5833.8 Ų33.836%0.35619%0.192SC..Hα-helixtrans-62.1-39.9178-57.60000111.3M142 I148 L149 T150 I214M142-T146 WeakPolarHBondContact O-CB 3.27Å; M142-T146 PolarHBondContact O-N 3.46Å; M142-T146 PolarHBondContact O-OG1 2.98Å; T146-I148 VanDerWaalsContact C-N 3.34Å; T146-I148 PolarHBondContact O-N 2.89Å; T146-L149 PolarHBondContact O-N 3.36Å; T146-T150 WeakPolarHBondContact O-CB 3.38Å; T146-T150 PolarHBondContact O-N 3.47Å; T146-T150 PolarHBondContact O-OG1 3.32Å; T146-I214 HydrophobicContact CG2-CD1 3.79Å; T146-I214 HydrophobicContact CG2-CG1 4.25Å; T146-I214 HydrophobicContact CG2-CG2 4.21Å
147Y94.7Very high93.7Very high2 Ų238.2 Ų38.21%0.00822%0.219CC..Hα-helixtrans-61.7-41.8176.7178-107.5000112.2A143 V144 V145 S151 I173 Y210 M213 I214 L217 L282A143-Y147 WeakPolarHBondContact O-CB 3.4Å; A143-Y147 PolarHBondContact O-N 3.37Å; V144-Y147 PolarHBondContact O-N 2.91Å; V145-Y147 VanDerWaalsContact C-N 3.32Å; V145-Y147 PolarHBondContact O-N 2.8Å; Y147-S151 VanDerWaalsContact O-CB 3.25Å; Y147-S151 WeakPolarHBondContact O-CB 3.44Å; Y147-S151 PolarHBondContact O-N 2.94Å; Y147-S151 PolarHBondContact O-OG 3.42Å; Y147-I173 HydrophobicContact CD1-CD1 3.52Å; Y147-I173 HydrophobicContact CD1-CG1 4.3Å; Y147-I173 HydrophobicContact CE1-CD1 3.63Å; Y147-I173 HydrophobicContact CE1-CG1 4.13Å; Y147-Y210 AromaticContact CD1-CD1 3.83Å; Y147-Y210 HydrophobicContact CD1-CD1 3.83Å; Y147-Y210 HydrophobicContact CD1-CE1 4.23Å; Y147-Y210 HydrophobicContact CE1-CD1 4.44Å; Y147-Y210 HydrophobicContact CG-CD1 4.04Å; Y147-M213 HydrophobicContact CD2-CB 3.85Å; Y147-M213 HydrophobicContact CE2-CB 3.65Å; Y147-I214 HydrophobicContact CD2-CG1 4.25Å; Y147-L217 HydrophobicContact CD2-CD1 3.75Å; Y147-L217 HydrophobicContact CE2-CD1 3.47Å; Y147-L217 VanDerWaalsContact CE2-CD1 3.47Å; Y147-L217 HydrophobicContact CE2-CG 4.23Å; Y147-L282 HydrophobicContact CE1-CD2 4.17Å; Y147-L282 VanDerWaalsContact OH-CD2 3.31Å; Y147-L282 WeakPolarHBondContact OH-CD2 3.46Å
148I94.5Very high93.6Very high30 Ų3040 Ų4015%0.15423%0.227CC..Hα-helixtrans-59.8-49.2173.5-69162.3000110.2V144 V145 T146 S151 G152 L166 L169 C170 I173V144-I148 HydrophobicContact CG1-CD1 4Å; V144-I148 WeakPolarHBondContact O-CG1 3.32Å; V144-I148 PolarHBondContact O-N 2.92Å; V145-I148 WeakPolarHBondContact O-CB 3.38Å; V145-I148 PolarHBondContact O-N 3.41Å; T146-I148 VanDerWaalsContact C-N 3.34Å; T146-I148 PolarHBondContact O-N 2.89Å; I148-S151 PolarHBondContact O-N 3.33Å; I148-G152 PolarHBondContact O-N 2.96Å; I148-L166 HydrophobicContact CG2-CD1 3.78Å; I148-L166 HydrophobicContact CG2-CG 4.32Å; I148-L166 WeakPolarHBondContact O-CD1 3.03Å; I148-L169 HydrophobicContact CB-CD2 4.21Å; I148-L169 HydrophobicContact CG1-CD2 3.86Å; I148-L169 HydrophobicContact CG2-CD2 4.35Å; I148-C170 HydrophobicContact CD1-CB 4.45Å; I148-C170 WeakPolarHBondContact CG2-SG 3.45Å; I148-I173 HydrophobicContact CD1-CD1 4.34Å; I148-I173 HydrophobicContact CG1-CD1 3.64Å
149L95.4Very high93.5Very high112 Ų11244.1 Ų44.159%0.58625%0.254SS*.Hα-helixtrans-64.5-45.3-179.1-67.4176000112.5V145 T146 S151 G152 L153V145-L149 HydrophobicContact CG1-CD1 4.1Å; V145-L149 WeakPolarHBondContact O-CG 3.29Å; V145-L149 PolarHBondContact O-N 2.86Å; T146-L149 PolarHBondContact O-N 3.36Å; L149-S151 VanDerWaalsContact C-N 3.33Å; L149-S151 PolarHBondContact O-N 3.43Å; L149-G152 CarbonylContact O-C 3.49Å; L149-G152 PolarHBondContact O-N 3.39Å; L149-L153 PolarHBondContact O-N 3.48Å
150T94.1Very high93.1Very high13 Ų1347.6 Ų47.68%0.0827%0.266CS..Hα-helixtrans-65.8-36.3177.2-54.30000111.2T146 L153 V154 L217 L218T146-T150 WeakPolarHBondContact O-CB 3.38Å; T146-T150 PolarHBondContact O-N 3.47Å; T146-T150 PolarHBondContact O-OG1 3.32Å; T150-L153 WeakPolarHBondContact O-CB 3.36Å; T150-L153 PolarHBondContact O-N 2.7Å; T150-V154 WeakPolarHBondContact O-CG2 3.32Å; T150-V154 PolarHBondContact O-N 2.86Å; T150-L217 HydrophobicContact CG2-CB 3.81Å; T150-L217 HydrophobicContact CG2-CD1 4.15Å; T150-L218 HydrophobicContact CG2-CD2 4.04Å
151S92.3Very high92.9Very high3 Ų353 Ų532%0.02129%0.289CS..Hα-helixtrans-64.6-41.7172.4-59.50000111.4Y147 I148 L149 L153 V154 L155 L217Y147-S151 VanDerWaalsContact O-CB 3.25Å; Y147-S151 WeakPolarHBondContact O-CB 3.44Å; Y147-S151 PolarHBondContact O-N 2.94Å; Y147-S151 PolarHBondContact O-OG 3.42Å; I148-S151 PolarHBondContact O-N 3.33Å; L149-S151 VanDerWaalsContact C-N 3.33Å; L149-S151 PolarHBondContact O-N 3.43Å; S151-L153 VanDerWaalsContact C-N 3.33Å; S151-L153 PolarHBondContact O-N 3.38Å; S151-V154 PolarHBondContact O-N 2.87Å; S151-L155 WeakPolarHBondContact O-CG 3.25Å; S151-L155 PolarHBondContact O-N 3.5Å; S151-L217 WeakPolarHBondContact OG-CD1 3.33Å
152G92.9Very high92.7Very high8 Ų851.5 Ų51.58%0.08228%0.282CS..Hα-helixtrans-59.7-41.8171.600000112.7I148 L149 L155 G156I148-G152 PolarHBondContact O-N 2.96Å; L149-G152 CarbonylContact O-C 3.49Å; L149-G152 PolarHBondContact O-N 3.39Å; G152-L155 PolarHBondContact O-N 2.64Å; G152-G156 PolarHBondContact O-N 2.87Å
153L93.1Very high92.6Very high94 Ų9451.6 Ų51.649%0.49229%0.288SS..Hα-helixtrans-61-45.8174.8179.265000111.5L149 T150 S151 L155 G156 V157 L221L149-L153 PolarHBondContact O-N 3.48Å; T150-L153 WeakPolarHBondContact O-CB 3.36Å; T150-L153 PolarHBondContact O-N 2.7Å; S151-L153 VanDerWaalsContact C-N 3.33Å; S151-L153 PolarHBondContact O-N 3.38Å; L153-L155 VanDerWaalsContact C-N 3.34Å; L153-L155 PolarHBondContact O-N 2.64Å; L153-G156 WeakPolarHBondContact O-CA 3.22Å; L153-G156 PolarHBondContact O-N 2.99Å; L153-G156 VanDerWaalsContact O-N 3.1Å; L153-V157 WeakPolarHBondContact O-CG2 3.47Å; L153-V157 PolarHBondContact O-N 3.24Å; L153-L221 HydrophobicContact CD2-CD1 3.88Å; L153-L221 HydrophobicContact CG-CD1 4.31Å
154V91.5Very high92.4Very high13 Ų1357.3 Ų57.38%0.07931%0.314CS..Hα-helixtrans-59.5-43.9176169.90000111.4T150 S151 G156 V157 Q158 L217 Y220 L221T150-V154 WeakPolarHBondContact O-CG2 3.32Å; T150-V154 PolarHBondContact O-N 2.86Å; S151-V154 PolarHBondContact O-N 2.87Å; V154-G156 VanDerWaalsContact C-N 3.29Å; V154-G156 PolarHBondContact O-N 3.2Å; V154-V157 PolarHBondContact O-N 3.43Å; V154-Q158 WeakPolarHBondContact O-CG 3.42Å; V154-Q158 PolarHBondContact O-N 3.04Å; V154-Q158 VanDerWaalsContact O-N 3.15Å; V154-L217 HydrophobicContact CG2-CB 4.45Å; V154-L217 HydrophobicContact CG2-CD2 4.41Å; V154-Y220 HydrophobicContact CG1-CD1 3.94Å; V154-Y220 HydrophobicContact CG1-CE1 3.67Å; V154-Y220 HydrophobicContact CG2-CD1 4.27Å; V154-L221 HydrophobicContact CB-CD2 4.43Å; V154-L221 HydrophobicContact CG2-CD1 4.17Å; V154-L221 HydrophobicContact CG2-CD2 3.7Å; V154-L221 HydrophobicContact CG2-CG 3.87Å
155L90Very high92Very high15 Ų1559.8 Ų59.88%0.07932%0.323CS..Hα-helixtrans-62.8-36.2174.8-68.5172.5000112.2S151 G152 L153 Q158 N159 R160 F161 K165S151-L155 WeakPolarHBondContact O-CG 3.25Å; S151-L155 PolarHBondContact O-N 3.5Å; G152-L155 PolarHBondContact O-N 2.64Å; L153-L155 VanDerWaalsContact C-N 3.34Å; L153-L155 PolarHBondContact O-N 2.64Å; L155-Q158 PolarHBondContact O-N 3.01Å; L155-N159 PolarHBondContact O-N 3.38Å; L155-R160 CarbonylContact O-C 3.57Å; L155-R160 WeakPolarHBondContact O-CA 3.38Å; L155-R160 PolarHBondContact O-N 3.36Å; L155-F161 PolarHBondContact O-N 2.84Å; L155-F161 VanDerWaalsContact O-N 3.09Å; L155-K165 HydrophobicContact CD1-CB 3.93Å; L155-K165 HydrophobicContact CD2-CD 4.27Å
156G92.2Very high91.7Very high31 Ų3158.2 Ų58.232%0.3231%0.312SS..Hα-helixtrans-64.5-49.617500000112.9G152 L153 V154 Q158 N159G152-G156 PolarHBondContact O-N 2.87Å; L153-G156 WeakPolarHBondContact O-CA 3.22Å; L153-G156 PolarHBondContact O-N 2.99Å; L153-G156 VanDerWaalsContact O-N 3.1Å; V154-G156 VanDerWaalsContact C-N 3.29Å; V154-G156 PolarHBondContact O-N 3.2Å; G156-Q158 PolarHBondContact O-N 3.43Å; G156-N159 PolarHBondContact O-N 3.17Å
157V90.4Very high91.6Very high96 Ų9657 Ų5758%0.58231%0.311SS*.Hα-helixtrans-59.3-32.5177.1172.80000111.6L153 V154 N159 L221L153-V157 WeakPolarHBondContact O-CG2 3.47Å; L153-V157 PolarHBondContact O-N 3.24Å; V154-V157 PolarHBondContact O-N 3.43Å; V157-N159 PolarHBondContact O-N 3.11Å; V157-L221 HydrophobicContact CB-CD2 4.3Å; V157-L221 HydrophobicContact CG1-CD2 4.43Å; V157-L221 HydrophobicContact CG2-CD2 4.09Å
158Q88.4Confident91.5Very high43 Ų4362.4 Ų62.420%0.20134%0.339CS..THydrogen-bonded Turntrans-80.75.4175.3-67.4177.55.900114.3V154 L155 G156 R160 Y220V154-Q158 WeakPolarHBondContact O-CG 3.42Å; V154-Q158 PolarHBondContact O-N 3.04Å; V154-Q158 VanDerWaalsContact O-N 3.15Å; L155-Q158 PolarHBondContact O-N 3.01Å; G156-Q158 PolarHBondContact O-N 3.43Å; Q158-R160 HydrophobicContact CB-CB 4.32Å; Q158-R160 HydrophobicContact CB-CG 4.44Å; Q158-R160 WeakPolarHBondContact O-CG 3.36Å; Q158-R160 PolarHBondContact O-N 3.33Å; Q158-Y220 PolarHBondContact NE2-OH 2.94Å
159N90.3Very high91.3Very high157 Ų15761.8 Ų61.884%0.8434%0.336SS*.THydrogen-bonded Turntrans54.429.5-173.3-61.5-58.5000113.7L155 G156 V157L155-N159 PolarHBondContact O-N 3.38Å; G156-N159 PolarHBondContact O-N 3.17Å; V157-N159 PolarHBondContact O-N 3.11Å
160R85.5Confident91.2Very high78 Ų7858.4 Ų58.429%0.29432%0.321SS..  trans-122.514.7-174.3-76174.8-165.6-169.85.4112.2L155 Q158 S162 K165 V290L155-R160 CarbonylContact O-C 3.57Å; L155-R160 WeakPolarHBondContact O-CA 3.38Å; L155-R160 PolarHBondContact O-N 3.36Å; Q158-R160 HydrophobicContact CB-CB 4.32Å; Q158-R160 HydrophobicContact CB-CG 4.44Å; Q158-R160 WeakPolarHBondContact O-CG 3.36Å; Q158-R160 PolarHBondContact O-N 3.33Å; R160-S162 PolarHBondContact O-N 3.42Å; R160-K165 PolarHBondContact O-NZ 2.8Å; R160-V290 PolarHBondContact NH1-O 2.96Å
161F90Very high91.2Very high117 Ų11761.4 Ų61.451%0.51334%0.343SS..  trans-61.5121.2177.3-178.1-98.5000109.5L155 L166L155-F161 PolarHBondContact O-N 2.84Å; L155-F161 VanDerWaalsContact O-N 3.09Å; F161-L166 HydrophobicContact CE2-CD2 4.25Å
162S91Very high91.1Very high29 Ų2964 Ų6420%0.20336%0.359CS..  trans-143136.4166.8109.90000107.5R160 E164 K165 L166R160-S162 PolarHBondContact O-N 3.42Å; S162-E164 WeakPolarHBondContact CB-OE2 3.37Å; S162-E164 PolarHBondContact O-N 3.25Å; S162-E164 VanDerWaalsContact O-N 3.17Å; S162-E164 PolarHBondContact OG-OE2 3.26Å; S162-K165 PolarHBondContact O-N 2.98Å; S162-K165 VanDerWaalsContact O-N 3.07Å; S162-L166 PolarHBondContact O-N 3.49Å
163P93.1Very high91.1Very high83 Ų8363.8 Ų63.854%0.53936%0.356SS..Hα-helixtrans-59.7-26.8-17824.5-33.5000111.8L166 G167P163-L166 PolarHBondContact O-N 3.16Å; P163-G167 PolarHBondContact O-N 3.45Å
164E92.3Very high91Very high126 Ų12664.3 Ų64.359%0.58936%0.358SS*.Hα-helixtrans-62.6-44175.4-56.675.7-16400111.4S162 G167 L168S162-E164 WeakPolarHBondContact CB-OE2 3.37Å; S162-E164 PolarHBondContact O-N 3.25Å; S162-E164 VanDerWaalsContact O-N 3.17Å; S162-E164 PolarHBondContact OG-OE2 3.26Å; E164-G167 PolarHBondContact O-N 3.01Å; E164-L168 WeakPolarHBondContact O-CB 3.23Å; E164-L168 VanDerWaalsContact O-CG 3.24Å; E164-L168 WeakPolarHBondContact O-CG 3.49Å; E164-L168 PolarHBondContact O-N 3.26Å
165K87.6Confident91Very high78 Ų7866.3 Ų66.334%0.33938%0.376SS..Hα-helixtrans-66.4-40177.2-66.3179.2-171.3166.90111.8L155 R160 S162 L169L155-K165 HydrophobicContact CD1-CB 3.93Å; L155-K165 HydrophobicContact CD2-CD 4.27Å; R160-K165 PolarHBondContact O-NZ 2.8Å; S162-K165 PolarHBondContact O-N 2.98Å; S162-K165 VanDerWaalsContact O-N 3.07Å; K165-L169 WeakPolarHBondContact O-CB 3.24Å; K165-L169 PolarHBondContact O-N 3.37Å
166L91Very high91Very high37 Ų3769.9 Ų69.919%0.19439%0.389CS..Hα-helixtrans-65.5-44.5177.3-170.865.4000110.8I148 F161 S162 P163 L169 C170I148-L166 HydrophobicContact CG2-CD1 3.78Å; I148-L166 HydrophobicContact CG2-CG 4.32Å; I148-L166 WeakPolarHBondContact O-CD1 3.03Å; F161-L166 HydrophobicContact CE2-CD2 4.25Å; S162-L166 PolarHBondContact O-N 3.49Å; P163-L166 PolarHBondContact O-N 3.16Å; L166-L169 WeakPolarHBondContact O-CB 3.42Å; L166-L169 PolarHBondContact O-N 3.09Å; L166-C170 PolarHBondContact O-N 3.49Å; L166-C170 PolarHBondContact O-SG 2.99Å
167G93.2Very high91Very high32 Ų3269.4 Ų69.433%0.3338%0.379SS..Hα-helixtrans-63.3-40.1176.700000113.3P163 E164 L169 C170 S171P163-G167 PolarHBondContact O-N 3.45Å; E164-G167 PolarHBondContact O-N 3.01Å; G167-L169 VanDerWaalsContact C-N 3.34Å; G167-C170 PolarHBondContact O-N 3.44Å; G167-S171 WeakPolarHBondContact O-CB 3.08Å; G167-S171 PolarHBondContact O-N 3.44Å; G167-S171 PolarHBondContact O-OG 3.29Å
168L92.2Very high91.1Very high116 Ų11669.7 Ų69.761%0.60738%0.376SS*.Hα-helixtrans-62.3-41.3172.8-74.6171.6000111.8E164 S171 T172E164-L168 WeakPolarHBondContact O-CB 3.23Å; E164-L168 VanDerWaalsContact O-CG 3.24Å; E164-L168 WeakPolarHBondContact O-CG 3.49Å; E164-L168 PolarHBondContact O-N 3.26Å; L168-S171 PolarHBondContact O-N 2.98Å; L168-T172 VanDerWaalsContact O-CB 3.28Å; L168-T172 WeakPolarHBondContact O-CB 3.45Å; L168-T172 PolarHBondContact O-N 2.87Å; L168-T172 PolarHBondContact O-OG1 2.86Å
169L91Very high91.2Very high16 Ų1669.5 Ų69.58%0.08438%0.382CS..Hα-helixtrans-63.8-47.6175.7178.4136000111.3I148 K165 L166 G167 S171 T172 I173 L286I148-L169 HydrophobicContact CB-CD2 4.21Å; I148-L169 HydrophobicContact CG1-CD2 3.86Å; I148-L169 HydrophobicContact CG2-CD2 4.35Å; K165-L169 WeakPolarHBondContact O-CB 3.24Å; K165-L169 PolarHBondContact O-N 3.37Å; L166-L169 WeakPolarHBondContact O-CB 3.42Å; L166-L169 PolarHBondContact O-N 3.09Å; G167-L169 VanDerWaalsContact C-N 3.34Å; L169-S171 VanDerWaalsContact C-N 3.32Å; L169-S171 PolarHBondContact O-N 3.09Å; L169-T172 PolarHBondContact O-N 3.41Å; L169-I173 HydrophobicContact CD2-CD1 3.43Å; L169-I173 VanDerWaalsContact CD2-CD1 3.43Å; L169-I173 HydrophobicContact CG-CD1 3.84Å; L169-I173 WeakPolarHBondContact O-CD1 3.17Å; L169-I173 VanDerWaalsContact O-CG1 3.25Å; L169-I173 WeakPolarHBondContact O-CG1 3.36Å; L169-I173 PolarHBondContact O-N 2.78Å; L169-L286 HydrophobicContact CD1-CD1 3.79Å; L169-L286 HydrophobicContact CD1-CD2 4.39Å
170C92.4Very high91.2Very high42 Ų4262.7 Ų62.728%0.28435%0.345SS..Hα-helixtrans-55-48.5174.3-660000111.8I148 L166 G167 T172 I173 L174I148-C170 HydrophobicContact CD1-CB 4.45Å; I148-C170 WeakPolarHBondContact CG2-SG 3.45Å; L166-C170 PolarHBondContact O-N 3.49Å; L166-C170 PolarHBondContact O-SG 2.99Å; G167-C170 PolarHBondContact O-N 3.44Å; C170-T172 PolarHBondContact O-N 3.05Å; C170-I173 PolarHBondContact O-N 3.26Å; C170-L174 WeakPolarHBondContact O-CB 3.48Å; C170-L174 PolarHBondContact O-N 3.29Å
171S94Very high91.4Very high75 Ų7559.2 Ų59.252%0.52433%0.332SS..Hα-helixtrans-64.9-40.3-179-56.10000111.6G167 L168 L169 L174 A175G167-S171 WeakPolarHBondContact O-CB 3.08Å; G167-S171 PolarHBondContact O-N 3.44Å; G167-S171 PolarHBondContact O-OG 3.29Å; L168-S171 PolarHBondContact O-N 2.98Å; L169-S171 VanDerWaalsContact C-N 3.32Å; L169-S171 PolarHBondContact O-N 3.09Å; S171-L174 PolarHBondContact O-N 3.31Å; S171-A175 VanDerWaalsContact O-CB 3.29Å; S171-A175 WeakPolarHBondContact O-CB 3.08Å; S171-A175 PolarHBondContact O-N 3.46Å
172T91.1Very high91.4Very high58 Ų5858.4 Ų58.436%0.35633%0.333SS..Hα-helixtrans-64.8-45.3177.4-60.50000111.2L168 L169 C170 A175 W176L168-T172 VanDerWaalsContact O-CB 3.28Å; L168-T172 WeakPolarHBondContact O-CB 3.45Å; L168-T172 PolarHBondContact O-N 2.87Å; L168-T172 PolarHBondContact O-OG1 2.86Å; L169-T172 PolarHBondContact O-N 3.41Å; C170-T172 PolarHBondContact O-N 3.05Å; T172-A175 PolarHBondContact O-N 3.39Å; T172-W176 PolarHBondContact O-N 2.85Å
173I92Very high91.3Very high4 Ų461 Ų612%0.02135%0.347CS..Hα-helixtrans-60.6-47176.3-70160.1000110.5V144 Y147 I148 L169 C170 A175 W176 L177 Y210V144-I173 HydrophobicContact CG1-CG2 3.93Å; Y147-I173 HydrophobicContact CD1-CD1 3.52Å; Y147-I173 HydrophobicContact CD1-CG1 4.3Å; Y147-I173 HydrophobicContact CE1-CD1 3.63Å; Y147-I173 HydrophobicContact CE1-CG1 4.13Å; I148-I173 HydrophobicContact CD1-CD1 4.34Å; I148-I173 HydrophobicContact CG1-CD1 3.64Å; L169-I173 HydrophobicContact CD2-CD1 3.43Å; L169-I173 VanDerWaalsContact CD2-CD1 3.43Å; L169-I173 HydrophobicContact CG-CD1 3.84Å; L169-I173 WeakPolarHBondContact O-CD1 3.17Å; L169-I173 VanDerWaalsContact O-CG1 3.25Å; L169-I173 WeakPolarHBondContact O-CG1 3.36Å; L169-I173 PolarHBondContact O-N 2.78Å; C170-I173 PolarHBondContact O-N 3.26Å; I173-A175 PolarHBondContact O-N 2.85Å; I173-W176 PolarHBondContact O-N 3.13Å; I173-L177 HydrophobicContact CG2-CD1 3.89Å; I173-L177 HydrophobicContact CG2-CG 4.42Å; I173-L177 WeakPolarHBondContact O-CB 3.48Å; I173-L177 WeakPolarHBondContact O-CG 3.45Å; I173-L177 PolarHBondContact O-N 2.84Å; I173-Y210 HydrophobicContact CG1-CE1 4.28Å; I173-Y210 HydrophobicContact CG2-CE1 3.76Å
174L92.4Very high90.9Very high104 Ų10457.6 Ų57.655%0.54532%0.324SS..Hα-helixtrans-62.5-44.1179.2-174.765.4000111.4C170 S171 W176 L177 I178C170-L174 WeakPolarHBondContact O-CB 3.48Å; C170-L174 PolarHBondContact O-N 3.29Å; S171-L174 PolarHBondContact O-N 3.31Å; L174-W176 PolarHBondContact O-N 3.12Å; L174-L177 PolarHBondContact O-N 3.11Å; L174-I178 HydrophobicContact CD1-CD1 4.28Å; L174-I178 HydrophobicContact CG-CD1 3.99Å; L174-I178 VanDerWaalsContact O-CG1 3.31Å; L174-I178 WeakPolarHBondContact O-CG1 3.21Å; L174-I178 PolarHBondContact O-N 3.45Å
175A92Very high90.6Very high56 Ų5654.8 Ų54.846%0.46332%0.316SS..Hα-helixtrans-60.3-44.3176.400000111.7S171 T172 I173 I178 A179S171-A175 VanDerWaalsContact O-CB 3.29Å; S171-A175 WeakPolarHBondContact O-CB 3.08Å; S171-A175 PolarHBondContact O-N 3.46Å; T172-A175 PolarHBondContact O-N 3.39Å; I173-A175 PolarHBondContact O-N 2.85Å; A175-I178 PolarHBondContact O-N 3.22Å; A175-A179 VanDerWaalsContact O-CB 3.23Å; A175-A179 WeakPolarHBondContact O-CB 3.49Å; A175-A179 PolarHBondContact O-N 3.39Å
176W89.9Confident90.6Very high89 Ų8955.8 Ų55.834%0.33732%0.324SS..Hα-helixtrans-65.8-41.5176-82.4114.9000112.9T172 I173 L174 I178 A179 E180 W281 L282T172-W176 PolarHBondContact O-N 2.85Å; I173-W176 PolarHBondContact O-N 3.13Å; L174-W176 PolarHBondContact O-N 3.12Å; W176-I178 PolarHBondContact O-N 3.12Å; W176-A179 PolarHBondContact O-N 3.28Å; W176-E180 WeakPolarHBondContact O-CB 3.3Å; W176-E180 WeakPolarHBondContact O-CG 3.3Å; W176-E180 PolarHBondContact O-N 3.06Å; W176-W281 AromaticContact CZ2-CD1 3.89Å; W176-W281 AromaticContact CZ2-NE1 3.95Å; W176-L282 HydrophobicContact CG-CD1 4.34Å
177L91Very high90.2Very high21 Ų2155.6 Ų55.611%0.1132%0.324CS..Hα-helixtrans-59.2-46.4174.8-79.5170.5000111.4V144 I173 L174 N181 Y210V144-L177 HydrophobicContact CG1-CD1 4.45Å; V144-L177 HydrophobicContact CG2-CD1 3.95Å; I173-L177 HydrophobicContact CG2-CD1 3.89Å; I173-L177 HydrophobicContact CG2-CG 4.42Å; I173-L177 WeakPolarHBondContact O-CB 3.48Å; I173-L177 WeakPolarHBondContact O-CG 3.45Å; I173-L177 PolarHBondContact O-N 2.84Å; L174-L177 PolarHBondContact O-N 3.11Å; L177-N181 WeakPolarHBondContact O-CB 3.48Å; L177-N181 PolarHBondContact O-N 3.16Å; L177-N181 VanDerWaalsContact O-N 3.11Å; L177-N181 PolarHBondContact O-ND2 2.95Å; L177-Y210 HydrophobicContact CD1-CE2 4.46Å; L177-Y210 HydrophobicContact CD2-CE2 3.74Å; L177-Y210 HydrophobicContact CG-CE2 4.25Å
178I91.9Very high89.6Confident102 Ų10256.9 Ų56.952%0.52332%0.319SS..Hα-helixtrans-64.7-47.3177.6-67.7168.5000110.3L174 A175 W176 E180 N181 L182L174-I178 HydrophobicContact CD1-CD1 4.28Å; L174-I178 HydrophobicContact CG-CD1 3.99Å; L174-I178 VanDerWaalsContact O-CG1 3.31Å; L174-I178 WeakPolarHBondContact O-CG1 3.21Å; L174-I178 PolarHBondContact O-N 3.45Å; A175-I178 PolarHBondContact O-N 3.22Å; W176-I178 PolarHBondContact O-N 3.12Å; I178-E180 PolarHBondContact O-N 3.14Å; I178-N181 PolarHBondContact O-N 3.04Å; I178-L182 VanDerWaalsContact O-CB 3.31Å; I178-L182 WeakPolarHBondContact O-CB 2.99Å; I178-L182 PolarHBondContact O-N 3.15Å
179A91.1Very high89.1Confident39 Ų3960.8 Ų60.832%0.32233%0.327SS..Hα-helixtrans-61.3-44.5-17900000112.2A175 W176 L182 V183A175-A179 VanDerWaalsContact O-CB 3.23Å; A175-A179 WeakPolarHBondContact O-CB 3.49Å; A175-A179 PolarHBondContact O-N 3.39Å; W176-A179 PolarHBondContact O-N 3.28Å; A179-L182 PolarHBondContact O-N 3.46Å; A179-V183 VanDerWaalsContact O-CG2 3.3Å; A179-V183 WeakPolarHBondContact O-CG2 3.32Å; A179-V183 PolarHBondContact O-N 3.41Å
180E90.1Very high88.7Confident15 Ų1563.5 Ų63.57%0.0735%0.352CS..Hα-helixtrans-61-48.9175.9-77.4178.514300111.6W176 I178 L182 V183 I184 K209 I278W176-E180 WeakPolarHBondContact O-CB 3.3Å; W176-E180 WeakPolarHBondContact O-CG 3.3Å; W176-E180 PolarHBondContact O-N 3.06Å; I178-E180 PolarHBondContact O-N 3.14Å; E180-L182 VanDerWaalsContact C-N 3.26Å; E180-L182 PolarHBondContact O-N 2.85Å; E180-V183 PolarHBondContact O-N 2.86Å; E180-I184 WeakPolarHBondContact O-CD1 3.3Å; E180-I184 WeakPolarHBondContact O-CG1 3.46Å; E180-I184 PolarHBondContact O-N 3.33Å; E180-K209 IonicContact OE1-NZ 2.64Å; E180-K209 PolarHBondContact OE1-NZ 3.32Å; E180-K209 IonicContact OE2-NZ 2.64Å; E180-K209 PolarHBondContact OE2-NZ 3.49Å; E180-I278 HydrophobicContact CG-CD1 4.25Å; E180-I278 WeakPolarHBondContact OE1-CD1 3.42Å
181N89.8Confident88.1Confident4 Ų465 Ų652%0.02136%0.356CS..Hα-helixtrans-64.3-34.2179.5-80.1-84.5000111.8L177 I178 T185 F199 L203 S206L177-N181 WeakPolarHBondContact O-CB 3.48Å; L177-N181 PolarHBondContact O-N 3.16Å; L177-N181 VanDerWaalsContact O-N 3.11Å; L177-N181 PolarHBondContact O-ND2 2.95Å; I178-N181 PolarHBondContact O-N 3.04Å; N181-T185 VanDerWaalsContact O-CB 3.3Å; N181-T185 WeakPolarHBondContact O-CB 3.41Å; N181-T185 PolarHBondContact O-N 3.47Å; N181-T185 PolarHBondContact O-OG1 2.81Å; N181-F199 HydrophobicContact CB-CE2 4.03Å; N181-L203 VanDerWaalsContact ND2-CD1 3.29Å; N181-L203 WeakPolarHBondContact ND2-CD1 3.46Å; N181-L203 VanDerWaalsContact OD1-CA 3.24Å; N181-L203 WeakPolarHBondContact OD1-CA 3.45Å; N181-L203 PolarHBondContact OD1-N 3.06Å; N181-S206 PolarHBondContact ND2-OG 3.42Å
182L90.2Very high87.2Confident100 Ų10067 Ų6752%0.52436%0.364SS..Hα-helixtrans-66.8-48.3174.5-177.262.8000111.5I178 A179 E180 I184 T185 I186I178-L182 VanDerWaalsContact O-CB 3.31Å; I178-L182 WeakPolarHBondContact O-CB 2.99Å; I178-L182 PolarHBondContact O-N 3.15Å; A179-L182 PolarHBondContact O-N 3.46Å; E180-L182 VanDerWaalsContact C-N 3.26Å; E180-L182 PolarHBondContact O-N 2.85Å; L182-I184 VanDerWaalsContact C-N 3.27Å; L182-I184 PolarHBondContact O-N 3.18Å; L182-T185 PolarHBondContact O-N 3.35Å; L182-I186 HydrophobicContact CD1-CD1 4.1Å; L182-I186 HydrophobicContact CD1-CG1 4.34Å; L182-I186 HydrophobicContact CG-CD1 3.88Å; L182-I186 HydrophobicContact CG-CG1 4.5Å; L182-I186 WeakPolarHBondContact O-CB 3.17Å; L182-I186 VanDerWaalsContact O-CG1 3.28Å; L182-I186 WeakPolarHBondContact O-CG1 3.35Å; L182-I186 PolarHBondContact O-N 3.28Å
183V88.7Confident86Confident83 Ų8364.7 Ų64.750%0.50335%0.35SS..Hα-helixtrans-58.2-42.2176.6170.50000110.7A179 E180 I186 T187A179-V183 VanDerWaalsContact O-CG2 3.3Å; A179-V183 WeakPolarHBondContact O-CG2 3.32Å; A179-V183 PolarHBondContact O-N 3.41Å; E180-V183 PolarHBondContact O-N 2.86Å; V183-I186 PolarHBondContact O-N 3.48Å; V183-T187 WeakPolarHBondContact O-CB 3.43Å; V183-T187 PolarHBondContact O-N 3.32Å; V183-T187 PolarHBondContact O-OG1 3.39Å
184I85.7Confident84.5Confident13 Ų1368 Ų687%0.06737%0.374CS..Hα-helixtrans-69.3-39.9179.1-61162.1000111E180 L182 T187 R188 T202 L267 I271E180-I184 WeakPolarHBondContact O-CD1 3.3Å; E180-I184 WeakPolarHBondContact O-CG1 3.46Å; E180-I184 PolarHBondContact O-N 3.33Å; L182-I184 VanDerWaalsContact C-N 3.27Å; L182-I184 PolarHBondContact O-N 3.18Å; I184-T187 PolarHBondContact O-N 3.39Å; I184-R188 VanDerWaalsContact O-CB 3.26Å; I184-R188 WeakPolarHBondContact O-CB 3.44Å; I184-R188 PolarHBondContact O-N 3.4Å; I184-T202 HydrophobicContact CB-CG2 3.63Å; I184-T202 HydrophobicContact CD1-CG2 3.39Å; I184-T202 HydrophobicContact CG1-CG2 4.07Å; I184-T202 HydrophobicContact CG2-CG2 3.31Å; I184-L267 HydrophobicContact CG2-CD2 4.14Å; I184-I271 HydrophobicContact CB-CD1 4.32Å; I184-I271 HydrophobicContact CD1-CD1 3.64Å; I184-I271 HydrophobicContact CD1-CG1 4.01Å; I184-I271 HydrophobicContact CD1-CG2 4.3Å; I184-I271 HydrophobicContact CG1-CD1 3.58Å; I184-I271 HydrophobicContact CG1-CG1 3.9Å; I184-I271 HydrophobicContact CG2-CD1 3.77Å
185T85Confident83Confident66 Ų6670.6 Ų70.641%0.40538%0.383SS..Hα-helixtrans-61.2-45.8175.5-60.60000111.1N181 L182 R188 Y189N181-T185 VanDerWaalsContact O-CB 3.3Å; N181-T185 WeakPolarHBondContact O-CB 3.41Å; N181-T185 PolarHBondContact O-N 3.47Å; N181-T185 PolarHBondContact O-OG1 2.81Å; L182-T185 PolarHBondContact O-N 3.35Å; T185-R188 PolarHBondContact O-N 2.83Å; T185-Y189 WeakPolarHBondContact O-CB 3.31Å; T185-Y189 PolarHBondContact O-N 2.81Å
186I87.5Confident81.5Confident99 Ų9970.2 Ų70.251%0.50838%0.377SS..Hα-helixtrans-62.2-46.3175.8-67.5167.4000110.2L182 V183 R188 Y189 A190L182-I186 HydrophobicContact CD1-CD1 4.1Å; L182-I186 HydrophobicContact CD1-CG1 4.34Å; L182-I186 HydrophobicContact CG-CD1 3.88Å; L182-I186 HydrophobicContact CG-CG1 4.5Å; L182-I186 WeakPolarHBondContact O-CB 3.17Å; L182-I186 VanDerWaalsContact O-CG1 3.28Å; L182-I186 WeakPolarHBondContact O-CG1 3.35Å; L182-I186 PolarHBondContact O-N 3.28Å; V183-I186 PolarHBondContact O-N 3.48Å; I186-R188 PolarHBondContact O-N 3.45Å; I186-Y189 PolarHBondContact O-N 2.94Å; I186-A190 WeakPolarHBondContact O-CB 3.31Å; I186-A190 PolarHBondContact O-N 3.49Å
187T83.9Confident80.3Confident34 Ų3466.2 Ų66.221%0.20936%0.362CS..Hα-helixtrans-62.9-42.1179.8-54.30000111.5V183 I184 Y189 A190 M191 L267V183-T187 WeakPolarHBondContact O-CB 3.43Å; V183-T187 PolarHBondContact O-N 3.32Å; V183-T187 PolarHBondContact O-OG1 3.39Å; I184-T187 PolarHBondContact O-N 3.39Å; T187-Y189 VanDerWaalsContact C-N 3.34Å; T187-Y189 PolarHBondContact O-N 2.93Å; T187-A190 PolarHBondContact O-N 3.3Å; T187-M191 HydrophobicContact CG2-CE 3.98Å; T187-M191 HydrophobicContact CG2-CG 4.44Å; T187-M191 HydrophobicContact CG2-SD 4.25Å; T187-M191 WeakPolarHBondContact O-CB 3.28Å; T187-M191 WeakPolarHBondContact O-CG 3.5Å; T187-M191 PolarHBondContact O-N 3.24Å; T187-L267 HydrophobicContact CG2-CD1 3.74Å; T187-L267 HydrophobicContact CG2-CG 4.11Å
188R80Confident79.6Confident59 Ų5967.6 Ų67.622%0.22337%0.37CS..Hα-helixtrans-60.1-45.2175.4176.8-171.2-179.8-86.618.9111.2I184 T185 I186 V192 I193 E195 L197 L267I184-R188 VanDerWaalsContact O-CB 3.26Å; I184-R188 WeakPolarHBondContact O-CB 3.44Å; I184-R188 PolarHBondContact O-N 3.4Å; T185-R188 PolarHBondContact O-N 2.83Å; I186-R188 PolarHBondContact O-N 3.45Å; R188-V192 PolarHBondContact O-N 2.9Å; R188-I193 PolarHBondContact O-N 3.42Å; R188-E195 VanDerWaalsContact NH2-CB 3.34Å; R188-E195 PolarHBondContact NH2-O 3.11Å; R188-E195 VanDerWaalsContact NH2-O 3.13Å; R188-L197 PolarHBondContact NE-O 3.49Å; R188-L197 PolarHBondContact NH2-O 2.98Å; R188-L197 VanDerWaalsContact NH2-O 3.13Å; R188-L267 HydrophobicContact CB-CD1 4.28Å
189Y82.4Confident79.1Confident197 Ų19767.8 Ų67.877%0.77337%0.367SS*.Hα-helixtrans-65.5-47178.1-174.1-100000111.3T185 I186 T187 M191 V192T185-Y189 WeakPolarHBondContact O-CB 3.31Å; T185-Y189 PolarHBondContact O-N 2.81Å; I186-Y189 PolarHBondContact O-N 2.94Å; T187-Y189 VanDerWaalsContact C-N 3.34Å; T187-Y189 PolarHBondContact O-N 2.93Å; Y189-M191 VanDerWaalsContact C-N 3.34Å; Y189-M191 PolarHBondContact O-N 3.45Å; Y189-V192 PolarHBondContact O-N 2.94Å; Y189-V192 VanDerWaalsContact O-N 3.16Å
190A82.8Confident78.9Confident74 Ų7469.3 Ų69.361%0.61236%0.364SS*.Hα-helixtrans-62.1-37.3178.700000113.1I186 T187 V192I186-A190 WeakPolarHBondContact O-CB 3.31Å; I186-A190 PolarHBondContact O-N 3.49Å; T187-A190 PolarHBondContact O-N 3.3Å; A190-V192 VanDerWaalsContact C-N 3.25Å; A190-V192 PolarHBondContact O-N 2.87Å
191M78.9Confident78.6Confident73 Ų7369 Ų6936%0.3636%0.363SS..THydrogen-bonded Turntrans-80.5-0.9179.1-70.2-168.2177.100114.2T187 Y189 I193 R263 L267T187-M191 HydrophobicContact CG2-CE 3.98Å; T187-M191 HydrophobicContact CG2-CG 4.44Å; T187-M191 HydrophobicContact CG2-SD 4.25Å; T187-M191 WeakPolarHBondContact O-CB 3.28Å; T187-M191 WeakPolarHBondContact O-CG 3.5Å; T187-M191 PolarHBondContact O-N 3.24Å; Y189-M191 VanDerWaalsContact C-N 3.34Å; Y189-M191 PolarHBondContact O-N 3.45Å; M191-I193 HydrophobicContact CB-CD1 3.65Å; M191-I193 HydrophobicContact CB-CG1 3.71Å; M191-I193 HydrophobicContact CG-CD1 4.42Å; M191-I193 PolarHBondContact O-N 3.2Å; M191-I193 HydrophobicContact SD-CD1 4Å; M191-R263 PolarHBondContact O-NH1 3.27Å; M191-R263 VanDerWaalsContact O-NH1 3.15Å; M191-L267 HydrophobicContact SD-CB 4.22Å; M191-L267 HydrophobicContact SD-CD1 4.36Å
192V74.3Confident78.4Confident116 Ų11669.2 Ų69.270%0.70337%0.365SS*.THydrogen-bonded Turntrans48.243-175.9-166.10000110.5R188 Y189 A190 S194R188-V192 PolarHBondContact O-N 2.9Å; Y189-V192 PolarHBondContact O-N 2.94Å; Y189-V192 VanDerWaalsContact O-N 3.16Å; A190-V192 VanDerWaalsContact C-N 3.25Å; A190-V192 PolarHBondContact O-N 2.87Å; V192-S194 PolarHBondContact O-N 3.35Å
193I67.4Low78.3Confident10 Ų1066.2 Ų66.25%0.05135%0.349CS..  trans-76.4126.2178.1-68.4165.3000107.1R188 M191 E195 R263 K264 L267R188-I193 PolarHBondContact O-N 3.42Å; M191-I193 HydrophobicContact CB-CD1 3.65Å; M191-I193 HydrophobicContact CB-CG1 3.71Å; M191-I193 HydrophobicContact CG-CD1 4.42Å; M191-I193 PolarHBondContact O-N 3.2Å; M191-I193 HydrophobicContact SD-CD1 4Å; I193-E195 PolarHBondContact O-N 2.7Å; I193-R263 HydrophobicContact CD1-CB 4.04Å; I193-R263 HydrophobicContact CG1-CB 3.82Å; I193-K264 HydrophobicContact CG2-CB 4.41Å; I193-L267 HydrophobicContact CD1-CB 4.17Å; I193-L267 HydrophobicContact CD1-CD1 3.64Å
194S59.7Low78.4Confident75 Ų7562.3 Ų62.352%0.52433%0.325SS..  trans-46.6140.6174.3-46.90000109.9V192 S196V192-S194 PolarHBondContact O-N 3.35Å; S194-S196 PolarHBondContact O-N 3.37Å; S194-S196 PolarHBondContact O-OG 3.31Å
195E60.2Low78.4Confident157 Ų15762.2 Ų62.273%0.73432%0.324SS*.THydrogen-bonded Turntrans-60.913.1-165.4-64.5-176.3162.600117.2R188 I193 L197R188-E195 VanDerWaalsContact NH2-CB 3.34Å; R188-E195 PolarHBondContact NH2-O 3.11Å; R188-E195 VanDerWaalsContact NH2-O 3.13Å; I193-E195 PolarHBondContact O-N 2.7Å; E195-L197 PolarHBondContact O-N 2.78Å; E195-L197 VanDerWaalsContact O-N 3.08Å
196S60.7Low78.5Confident49 Ų4959.1 Ų59.134%0.34331%0.305SS..THydrogen-bonded Turntrans-51.6-30.2-176.864.80000115.9S194S194-S196 PolarHBondContact O-N 3.37Å; S194-S196 PolarHBondContact O-OG 3.31Å
197L65.8Low78.7Confident4 Ų454.5 Ų54.52%0.02128%0.282CS..SBendtrans-91.8119.5175-72.2175.7000110R188 E195 D201 K264 L268R188-L197 PolarHBondContact NE-O 3.49Å; R188-L197 PolarHBondContact NH2-O 2.98Å; R188-L197 VanDerWaalsContact NH2-O 3.13Å; E195-L197 PolarHBondContact O-N 2.78Å; E195-L197 VanDerWaalsContact O-N 3.08Å; L197-D201 HydrophobicContact CD2-CB 4.26Å; L197-K264 HydrophobicContact CD1-CG 4.35Å; L197-K264 VanDerWaalsContact CD2-CE 3.47Å; L197-K264 HydrophobicContact CG-CD 4.34Å; L197-L268 HydrophobicContact CD1-CD1 4.07Å; L197-L268 HydrophobicContact CD1-CD2 4.39Å; L197-L268 HydrophobicContact CD1-CG 4.46Å
198N75.3Confident79.1Confident50 Ų5053 Ų5327%0.26727%0.273SS..  trans-75.3155.8170.6-56.4-56.1000109.5W200 D201 T202N198-W200 PolarHBondContact O-N 3.31Å; N198-D201 WeakPolarHBondContact CB-OD2 3.34Å; N198-D201 PolarHBondContact N-OD2 3.5Å; N198-D201 PolarHBondContact ND2-OD2 3.49Å; N198-D201 PolarHBondContact O-N 3.49Å; N198-D201 VanDerWaalsContact O-N 3.12Å; N198-T202 PolarHBondContact O-N 2.99Å; N198-T202 PolarHBondContact O-OG1 3.43Å
199F82.5Confident79.7Confident107 Ų10750.3 Ų50.347%0.46926%0.262SS..Hα-helixtrans-50.8-42.3169.6173.2-101.4000111.4N181 D201 T202 L203N181-F199 HydrophobicContact CB-CE2 4.03Å; F199-D201 PolarHBondContact O-N 2.73Å; F199-T202 PolarHBondContact O-N 3.05Å; F199-L203 HydrophobicContact CE1-CD2 4.19Å; F199-L203 PolarHBondContact O-N 3.48Å
200W86Confident80.2Confident70 Ų7040.9 Ų40.927%0.26523%0.226SC..Hα-helixtrans-62.3-35.9179-55.1115.4000114.2L79 Y82 L137 N198 L203 A204L79-W200 HydrophobicContact CD1-CD2 3.86Å; L79-W200 HydrophobicContact CD1-CE3 3.9Å; L79-W200 HydrophobicContact CD1-CG 4.48Å; L79-W200 HydrophobicContact CD1-CH2 4.11Å; L79-W200 HydrophobicContact CD1-CZ2 4.08Å; L79-W200 HydrophobicContact CD1-CZ3 4.03Å; Y82-W200 HydrophobicContact CD2-CB 4.06Å; Y82-W200 HydrophobicContact CE1-CB 4.38Å; Y82-W200 HydrophobicContact CE2-CB 3.5Å; Y82-W200 HydrophobicContact CE2-CG 4.14Å; L137-W200 HydrophobicContact CD2-CE3 3.75Å; L137-W200 HydrophobicContact CD2-CZ3 4.19Å; N198-W200 PolarHBondContact O-N 3.31Å; W200-L203 HydrophobicContact CE3-CD2 4.08Å; W200-L203 HydrophobicContact CZ3-CD2 4.15Å; W200-L203 PolarHBondContact O-N 3.23Å; W200-A204 WeakPolarHBondContact O-CB 3.38Å; W200-A204 PolarHBondContact O-N 3.41Å
201D84.4Confident80.8Confident8 Ų837.8 Ų37.84%0.04320%0.199CC..Hα-helixtrans-65-44.2177-63.7-46.5000110.8Y82 I135 L197 N198 F199 A204 Y205Y82-D201 WeakPolarHBondContact CE1-OD1 3.41Å; Y82-D201 PolarHBondContact OH-OD1 2.97Å; Y82-D201 PolarHBondContact OH-OD2 3.39Å; I135-D201 HydrophobicContact CD1-CB 4.14Å; L197-D201 HydrophobicContact CD2-CB 4.26Å; N198-D201 WeakPolarHBondContact CB-OD2 3.34Å; N198-D201 PolarHBondContact N-OD2 3.5Å; N198-D201 PolarHBondContact ND2-OD2 3.49Å; N198-D201 PolarHBondContact O-N 3.49Å; N198-D201 VanDerWaalsContact O-N 3.12Å; F199-D201 PolarHBondContact O-N 2.73Å; D201-A204 PolarHBondContact O-N 3.45Å; D201-Y205 WeakPolarHBondContact O-CD2 3.2Å; D201-Y205 PolarHBondContact O-N 3.36Å
202T84.7Confident81.5Confident9 Ų934.4 Ų34.46%0.05518%0.182CC..Hα-helixtrans-65.2-44.1-179.8-570000110.9I184 N198 F199 A204 Y205 S206I184-T202 HydrophobicContact CB-CG2 3.63Å; I184-T202 HydrophobicContact CD1-CG2 3.39Å; I184-T202 HydrophobicContact CG1-CG2 4.07Å; I184-T202 HydrophobicContact CG2-CG2 3.31Å; N198-T202 PolarHBondContact O-N 2.99Å; N198-T202 PolarHBondContact O-OG1 3.43Å; F199-T202 PolarHBondContact O-N 3.05Å; T202-A204 VanDerWaalsContact C-N 3.35Å; T202-A204 PolarHBondContact O-N 3.36Å; T202-Y205 PolarHBondContact O-N 3.37Å; T202-S206 PolarHBondContact O-N 3.37Å; T202-S206 PolarHBondContact O-OG 3.41Å
203L89.3Confident82.3Confident38 Ų3829.1 Ų29.120%0.19915%0.15CC..Hα-helixtrans-60.6-45.7176.7-17861.6000111.1L137 N181 F199 W200 Y205 S206 G207L137-L203 HydrophobicContact CD1-CB 4.4Å; L137-L203 HydrophobicContact CD1-CD2 4.05Å; L137-L203 HydrophobicContact CD1-CG 3.97Å; N181-L203 VanDerWaalsContact ND2-CD1 3.29Å; N181-L203 WeakPolarHBondContact ND2-CD1 3.46Å; N181-L203 VanDerWaalsContact OD1-CA 3.24Å; N181-L203 WeakPolarHBondContact OD1-CA 3.45Å; N181-L203 PolarHBondContact OD1-N 3.06Å; F199-L203 HydrophobicContact CE1-CD2 4.19Å; F199-L203 PolarHBondContact O-N 3.48Å; W200-L203 HydrophobicContact CE3-CD2 4.08Å; W200-L203 HydrophobicContact CZ3-CD2 4.15Å; W200-L203 PolarHBondContact O-N 3.23Å; L203-Y205 PolarHBondContact O-N 3.5Å; L203-S206 PolarHBondContact O-N 3.44Å; L203-S206 PolarHBondContact O-OG 3.49Å; L203-G207 PolarHBondContact O-N 2.96Å
204A89.8Confident83.6Confident0 Ų029.5 Ų29.50%015%0.152CC..Hα-helixtrans-58.5-49.2175.800000112I135 D136 L137 P140 W200 D201 T202 S206 G207 Y208I135-A204 HydrophobicContact CG2-CB 3.41Å; I135-A204 VanDerWaalsContact CG2-CB 3.41Å; D136-A204 VanDerWaalsContact O-CB 3.29Å; D136-A204 WeakPolarHBondContact O-CB 3.35Å; L137-A204 HydrophobicContact CD1-CB 4.08Å; P140-A204 HydrophobicContact CG-CB 4.29Å; P140-A204 WeakPolarHBondContact CG-O 3.26Å; W200-A204 WeakPolarHBondContact O-CB 3.38Å; W200-A204 PolarHBondContact O-N 3.41Å; D201-A204 PolarHBondContact O-N 3.45Å; T202-A204 VanDerWaalsContact C-N 3.35Å; T202-A204 PolarHBondContact O-N 3.36Å; A204-S206 VanDerWaalsContact C-N 3.32Å; A204-S206 PolarHBondContact O-N 3Å; A204-G207 PolarHBondContact O-N 3Å; A204-G207 VanDerWaalsContact O-N 3.11Å; A204-Y208 WeakPolarHBondContact O-CD2 3.3Å; A204-Y208 WeakPolarHBondContact O-CE2 3.46Å; A204-Y208 PolarHBondContact O-N 3.01Å
205Y87.1Confident85.3Confident12 Ų1229.1 Ų29.15%0.04714%0.143CC..Hα-helixtrans-59.1-40.9177.8-80-57.8000113.1I135 D201 T202 L203 G207 L243 S246 H250 L268I135-Y205 HydrophobicContact CD1-CD2 4.34Å; I135-Y205 HydrophobicContact CD1-CE2 3.4Å; I135-Y205 WeakPolarHBondContact CD1-OH 3.24Å; I135-Y205 HydrophobicContact CG1-CE2 4.12Å; D201-Y205 WeakPolarHBondContact O-CD2 3.2Å; D201-Y205 PolarHBondContact O-N 3.36Å; T202-Y205 PolarHBondContact O-N 3.37Å; L203-Y205 PolarHBondContact O-N 3.5Å; Y205-G207 VanDerWaalsContact C-N 3.26Å; Y205-G207 PolarHBondContact O-N 3.47Å; Y205-L243 HydrophobicContact CD1-CD2 3.61Å; Y205-L243 HydrophobicContact CE1-CD2 4.41Å; Y205-L243 HydrophobicContact CG-CD2 4.48Å; Y205-S246 PolarHBondContact OH-O 3.46Å; Y205-H250 WeakPolarHBondContact OH-CB 3.44Å; Y205-L268 HydrophobicContact CD2-CD2 4.38Å
206S86.6Confident86.8Confident1 Ų121.8 Ų21.81%0.00711%0.109CC..Hα-helixtrans-66.5-25.717870.60000113.4N181 T202 L203 A204 K209N181-S206 PolarHBondContact ND2-OG 3.42Å; T202-S206 PolarHBondContact O-N 3.37Å; T202-S206 PolarHBondContact O-OG 3.41Å; L203-S206 PolarHBondContact O-N 3.44Å; L203-S206 PolarHBondContact O-OG 3.49Å; A204-S206 VanDerWaalsContact C-N 3.32Å; A204-S206 PolarHBondContact O-N 3Å; S206-K209 WeakPolarHBondContact O-CD 3.46Å; S206-K209 VanDerWaalsContact O-CE 3.25Å; S206-K209 WeakPolarHBondContact O-CE 3.43Å; S206-K209 VanDerWaalsContact O-CG 3.3Å; S206-K209 WeakPolarHBondContact O-CG 3.29Å
207G91.1Very high88.3Confident2 Ų219.8 Ų19.82%0.0219%0.094CC..Hα-helixtrans-92.5-15.2-173.900000115.6L203 A204 Y205 K209 Y210L203-G207 PolarHBondContact O-N 2.96Å; A204-G207 PolarHBondContact O-N 3Å; A204-G207 VanDerWaalsContact O-N 3.11Å; Y205-G207 VanDerWaalsContact C-N 3.26Å; Y205-G207 PolarHBondContact O-N 3.47Å; G207-K209 PolarHBondContact O-N 2.95Å; G207-K209 VanDerWaalsContact O-N 3.09Å; G207-Y210 VanDerWaalsContact O-CD2 3.22Å; G207-Y210 WeakPolarHBondContact O-CD2 3.39Å; G207-Y210 PolarHBondContact O-N 2.85Å; G207-Y210 VanDerWaalsContact O-N 3.16Å
208Y92.1Very high89.6Confident3 Ų323.1 Ų23.11%0.01211%0.112CC..THydrogen-bonded Turntrans-61.5-23.3176.7-74-74000113.2K93 V97 D136 I139 P140 A204 Y210 V211 I239 F242 L243K93-Y208 WeakPolarHBondContact CE-OH 3.42Å; V97-Y208 HydrophobicContact CG2-CD1 4.11Å; D136-Y208 PolarHBondContact N-OH 3.34Å; D136-Y208 PolarHBondContact O-OH 2.9Å; D136-Y208 PolarHBondContact OD2-OH 3.35Å; I139-Y208 HydrophobicContact CB-CE1 4.31Å; I139-Y208 HydrophobicContact CG2-CD1 4.37Å; I139-Y208 HydrophobicContact CG2-CE1 4.28Å; P140-Y208 HydrophobicContact CG-CD1 4.35Å; P140-Y208 HydrophobicContact CG-CD2 4.33Å; P140-Y208 HydrophobicContact CG-CE1 4.22Å; P140-Y208 HydrophobicContact CG-CE2 4.21Å; P140-Y208 HydrophobicContact CG-CG 4.41Å; A204-Y208 WeakPolarHBondContact O-CD2 3.3Å; A204-Y208 WeakPolarHBondContact O-CE2 3.46Å; A204-Y208 PolarHBondContact O-N 3.01Å; Y208-Y210 PolarHBondContact O-N 3.36Å; Y208-V211 WeakPolarHBondContact O-CB 3.43Å; Y208-V211 PolarHBondContact O-N 3.2Å; Y208-V211 VanDerWaalsContact O-N 3.1Å; Y208-I239 VanDerWaalsContact O-CD1 3.26Å; Y208-I239 WeakPolarHBondContact O-CD1 3.37Å; Y208-F242 AromaticContact CD1-CE1 3.97Å; Y208-F242 HydrophobicContact CD1-CE1 3.97Å; Y208-F242 HydrophobicContact CD1-CZ 4.42Å; Y208-F242 AromaticContact CD2-CE1 3.96Å; Y208-F242 HydrophobicContact CD2-CE1 3.96Å; Y208-F242 HydrophobicContact CE1-CE1 4.38Å; Y208-F242 HydrophobicContact CE1-CZ 4.41Å; Y208-F242 HydrophobicContact CE2-CE1 4.36Å; Y208-F242 AromaticContact CG-CE1 3.74Å; Y208-F242 HydrophobicContact CG-CE1 3.74Å; Y208-L243 HydrophobicContact CD2-CD2 4.24Å
209K91.9Very high90.5Very high1 Ų122.7 Ų22.70%0.00411%0.111CC..Hα-helixtrans-55.4-33.1176.373.4-178.8170.1-175.80113E180 S206 G207 V211 G212 M213 I239 M279E180-K209 IonicContact OE1-NZ 2.64Å; E180-K209 PolarHBondContact OE1-NZ 3.32Å; E180-K209 IonicContact OE2-NZ 2.64Å; E180-K209 PolarHBondContact OE2-NZ 3.49Å; S206-K209 WeakPolarHBondContact O-CD 3.46Å; S206-K209 VanDerWaalsContact O-CE 3.25Å; S206-K209 WeakPolarHBondContact O-CE 3.43Å; S206-K209 VanDerWaalsContact O-CG 3.3Å; S206-K209 WeakPolarHBondContact O-CG 3.29Å; G207-K209 PolarHBondContact O-N 2.95Å; G207-K209 VanDerWaalsContact O-N 3.09Å; K209-V211 PolarHBondContact O-N 3.23Å; K209-G212 PolarHBondContact O-N 3.49Å; K209-M213 HydrophobicContact CG-CE 4.11Å; K209-M213 PolarHBondContact O-N 3.32Å; K209-I239 HydrophobicContact CB-CG2 4.42Å; K209-M279 HydrophobicContact CB-CE 3.41Å; K209-M279 VanDerWaalsContact CB-CE 3.41Å; K209-M279 HydrophobicContact CB-CG 4.39Å; K209-M279 WeakPolarHBondContact O-CE 3.38Å
210Y94Very high90.9Very high0 Ų020 Ų200%010%0.098CC..Hα-helixtrans-63.9-27.9-178.3-65.1-80.2000111.9V144 Y147 I173 L177 G207 Y208 M213 I214V144-Y210 HydrophobicContact CG2-CD1 4.32Å; V144-Y210 HydrophobicContact CG2-CD2 3.47Å; V144-Y210 VanDerWaalsContact CG2-CD2 3.47Å; V144-Y210 HydrophobicContact CG2-CE1 4.48Å; V144-Y210 HydrophobicContact CG2-CE2 3.68Å; V144-Y210 HydrophobicContact CG2-CG 3.88Å; Y147-Y210 AromaticContact CD1-CD1 3.83Å; Y147-Y210 HydrophobicContact CD1-CD1 3.83Å; Y147-Y210 HydrophobicContact CD1-CE1 4.23Å; Y147-Y210 HydrophobicContact CE1-CD1 4.44Å; Y147-Y210 HydrophobicContact CG-CD1 4.04Å; I173-Y210 HydrophobicContact CG1-CE1 4.28Å; I173-Y210 HydrophobicContact CG2-CE1 3.76Å; L177-Y210 HydrophobicContact CD1-CE2 4.46Å; L177-Y210 HydrophobicContact CD2-CE2 3.74Å; L177-Y210 HydrophobicContact CG-CE2 4.25Å; G207-Y210 VanDerWaalsContact O-CD2 3.22Å; G207-Y210 WeakPolarHBondContact O-CD2 3.39Å; G207-Y210 PolarHBondContact O-N 2.85Å; G207-Y210 VanDerWaalsContact O-N 3.16Å; Y208-Y210 PolarHBondContact O-N 3.36Å; Y210-M213 HydrophobicContact CD1-CE 3.05Å; Y210-M213 HydrophobicContact CE1-CE 3.32Å; Y210-M213 HydrophobicContact CG-CE 3.71Å; Y210-M213 PolarHBondContact O-N 2.54Å; Y210-I214 WeakPolarHBondContact O-CD1 3.49Å; Y210-I214 VanDerWaalsContact O-CG1 3.25Å; Y210-I214 WeakPolarHBondContact O-CG1 3.1Å; Y210-I214 PolarHBondContact O-N 3.35Å
211V94.9Very high91.1Very high9 Ų919.4 Ų19.46%0.05510%0.1CC..Hα-helixtrans-60.9-47.8175-178.80000111.3L94 V97 L98 I139 A143 Y208 K209 M213 I214 M215L94-V211 HydrophobicContact CD2-CG1 3.66Å; L94-V211 HydrophobicContact CD2-CG2 4.11Å; V97-V211 HydrophobicContact CG1-CB 3.95Å; V97-V211 HydrophobicContact CG1-CG1 3.83Å; V97-V211 HydrophobicContact CG1-CG2 4.46Å; L98-V211 HydrophobicContact CD2-CG1 4.06Å; L98-V211 HydrophobicContact CG-CG1 4.34Å; I139-V211 HydrophobicContact CG2-CG2 3.92Å; A143-V211 HydrophobicContact CB-CG2 3.76Å; Y208-V211 WeakPolarHBondContact O-CB 3.43Å; Y208-V211 PolarHBondContact O-N 3.2Å; Y208-V211 VanDerWaalsContact O-N 3.1Å; K209-V211 PolarHBondContact O-N 3.23Å; V211-M213 VanDerWaalsContact C-N 3.33Å; V211-M213 PolarHBondContact O-N 2.67Å; V211-I214 PolarHBondContact O-N 3.24Å; V211-M215 PolarHBondContact O-N 2.68Å
212G93.2Very high91.5Very high1 Ų125.3 Ų25.31%0.0114%0.136CC..Hα-helixtrans-65.9-3617700000112.7K209 M215 S216K209-G212 PolarHBondContact O-N 3.49Å; G212-M215 PolarHBondContact O-N 2.93Å; G212-S216 PolarHBondContact O-N 3.44Å; G212-S216 PolarHBondContact O-OG 2.86Å
213M92.4Very high91.8Very high5 Ų527 Ų273%0.02515%0.151CC..Hα-helixtrans-68.1-38.8177.1-64.9-168.4-63.200112.4Y147 K209 Y210 V211 S216 L217 M279 L282Y147-M213 HydrophobicContact CD2-CB 3.85Å; Y147-M213 HydrophobicContact CE2-CB 3.65Å; K209-M213 HydrophobicContact CG-CE 4.11Å; K209-M213 PolarHBondContact O-N 3.32Å; Y210-M213 HydrophobicContact CD1-CE 3.05Å; Y210-M213 HydrophobicContact CE1-CE 3.32Å; Y210-M213 HydrophobicContact CG-CE 3.71Å; Y210-M213 PolarHBondContact O-N 2.54Å; V211-M213 VanDerWaalsContact C-N 3.33Å; V211-M213 PolarHBondContact O-N 2.67Å; M213-S216 PolarHBondContact O-N 2.89Å; M213-L217 WeakPolarHBondContact O-CG 3.29Å; M213-L217 PolarHBondContact O-N 2.92Å; M213-M279 HydrophobicContact CG-CE 4.3Å; M213-M279 HydrophobicContact CG-CG 4.34Å; M213-M279 HydrophobicContact SD-CG 4.34Å; M213-L282 HydrophobicContact CE-CD2 4.44Å; M213-L282 HydrophobicContact SD-CD2 4Å
214I94.2Very high91.7Very high18 Ų1826.7 Ų26.79%0.09216%0.156CC..Hα-helixtrans-59.1-49.6172.8-68157.2000110.4A143 T146 Y147 Y210 V211 S216 L217 L218A143-I214 HydrophobicContact CB-CD1 4.14Å; A143-I214 WeakPolarHBondContact O-CD1 3.3Å; T146-I214 HydrophobicContact CG2-CD1 3.79Å; T146-I214 HydrophobicContact CG2-CG1 4.25Å; T146-I214 HydrophobicContact CG2-CG2 4.21Å; Y147-I214 HydrophobicContact CD2-CG1 4.25Å; Y210-I214 WeakPolarHBondContact O-CD1 3.49Å; Y210-I214 VanDerWaalsContact O-CG1 3.25Å; Y210-I214 WeakPolarHBondContact O-CG1 3.1Å; Y210-I214 PolarHBondContact O-N 3.35Å; V211-I214 PolarHBondContact O-N 3.24Å; I214-S216 PolarHBondContact O-N 3.06Å; I214-L217 WeakPolarHBondContact O-CB 3.36Å; I214-L217 PolarHBondContact O-N 3.39Å; I214-L218 HydrophobicContact CG2-CD1 4.05Å; I214-L218 HydrophobicContact CG2-CG 4.25Å; I214-L218 WeakPolarHBondContact O-CG 3.3Å; I214-L218 PolarHBondContact O-N 2.77Å
215M94.3Very high91.4Very high68 Ų6828.9 Ų28.934%0.33517%0.172SC..Hα-helixtrans-58.7-39.9179.6-71.7-54.9-62.700112.2L98 V211 G212 L218 V219L98-M215 HydrophobicContact CD1-CE 4.28Å; L98-M215 HydrophobicContact CD1-CG 3.69Å; L98-M215 HydrophobicContact CD1-SD 3.92Å; L98-M215 HydrophobicContact CD2-CB 4.26Å; L98-M215 HydrophobicContact CD2-CG 3.46Å; L98-M215 VanDerWaalsContact CD2-CG 3.46Å; L98-M215 HydrophobicContact CG-CG 4.22Å; V211-M215 PolarHBondContact O-N 2.68Å; G212-M215 PolarHBondContact O-N 2.93Å; M215-L218 PolarHBondContact O-N 3.13Å; M215-L218 HydrophobicContact SD-CD1 4.2Å; M215-V219 WeakPolarHBondContact O-CG2 3.13Å; M215-V219 PolarHBondContact O-N 3.21Å
216S92.7Very high91.3Very high3 Ų332.5 Ų32.52%0.02120%0.199CC..Hα-helixtrans-61.4-45.4175.2-54.20000111.1G212 M213 I214 L218 V219 Y220 Y228 L232G212-S216 PolarHBondContact O-N 3.44Å; G212-S216 PolarHBondContact O-OG 2.86Å; M213-S216 PolarHBondContact O-N 2.89Å; I214-S216 PolarHBondContact O-N 3.06Å; S216-L218 PolarHBondContact O-N 3.13Å; S216-V219 PolarHBondContact O-N 2.73Å; S216-Y220 PolarHBondContact O-N 3.18Å; S216-Y228 VanDerWaalsContact O-CD2 3.3Å; S216-Y228 WeakPolarHBondContact O-CD2 3.37Å; S216-L232 WeakPolarHBondContact OG-CA 3.41Å
217L91.8Very high91.5Very high6 Ų636.6 Ų36.63%0.03122%0.22CC..Hα-helixtrans-64.1-37176.3-69.2-179.5000113.3Y147 T150 S151 V154 M213 I214 Y220 L221 Y228Y147-L217 HydrophobicContact CD2-CD1 3.75Å; Y147-L217 HydrophobicContact CE2-CD1 3.47Å; Y147-L217 VanDerWaalsContact CE2-CD1 3.47Å; Y147-L217 HydrophobicContact CE2-CG 4.23Å; T150-L217 HydrophobicContact CG2-CB 3.81Å; T150-L217 HydrophobicContact CG2-CD1 4.15Å; S151-L217 WeakPolarHBondContact OG-CD1 3.33Å; V154-L217 HydrophobicContact CG2-CB 4.45Å; V154-L217 HydrophobicContact CG2-CD2 4.41Å; M213-L217 WeakPolarHBondContact O-CG 3.29Å; M213-L217 PolarHBondContact O-N 2.92Å; I214-L217 WeakPolarHBondContact O-CB 3.36Å; I214-L217 PolarHBondContact O-N 3.39Å; L217-Y220 WeakPolarHBondContact O-CB 3.45Å; L217-Y220 PolarHBondContact O-N 3.1Å; L217-L221 WeakPolarHBondContact O-CG 3.48Å; L217-L221 PolarHBondContact O-N 3.16Å; L217-L221 VanDerWaalsContact O-N 3.09Å; L217-Y228 HydrophobicContact CD2-CE2 4.16Å
218L94.1Very high91.4Very high74 Ų7436.9 Ų36.939%0.38722%0.221SC..Hα-helixtrans-65.5-41.1175.2-67.2177.6000111.4T150 I214 M215 S216 Y220 L221 V222T150-L218 HydrophobicContact CG2-CD2 4.04Å; I214-L218 HydrophobicContact CG2-CD1 4.05Å; I214-L218 HydrophobicContact CG2-CG 4.25Å; I214-L218 WeakPolarHBondContact O-CG 3.3Å; I214-L218 PolarHBondContact O-N 2.77Å; M215-L218 PolarHBondContact O-N 3.13Å; M215-L218 HydrophobicContact SD-CD1 4.2Å; S216-L218 PolarHBondContact O-N 3.13Å; L218-Y220 VanDerWaalsContact C-N 3.3Å; L218-Y220 PolarHBondContact O-N 3.02Å; L218-L221 HydrophobicContact CD2-CD1 4.47Å; L218-L221 PolarHBondContact O-N 2.75Å; L218-V222 PolarHBondContact O-N 3.27Å
219V93.1Very high91.2Very high41 Ų4140.7 Ų40.725%0.24824%0.238CC..Hα-helixtrans-63.7-38173.6171.10000111.2M215 S216 L221 V222 A223 L227 C231M215-V219 WeakPolarHBondContact O-CG2 3.13Å; M215-V219 PolarHBondContact O-N 3.21Å; S216-V219 PolarHBondContact O-N 2.73Å; V219-L221 VanDerWaalsContact C-N 3.31Å; V219-L221 PolarHBondContact O-N 3.18Å; V219-V222 PolarHBondContact O-N 3.43Å; V219-A223 HydrophobicContact CG1-CB 4.29Å; V219-A223 WeakPolarHBondContact O-CA 3.5Å; V219-A223 WeakPolarHBondContact O-CB 3.42Å; V219-A223 PolarHBondContact O-N 2.9Å; V219-L227 HydrophobicContact CG1-CB 3.8Å; V219-C231 HydrophobicContact CB-CB 4.17Å; V219-C231 HydrophobicContact CG1-CB 4.06Å; V219-C231 HydrophobicContact CG2-CB 4.23Å
220Y91.4Very high91.2Very high51 Ų5148.8 Ų48.820%0.227%0.269CS..Hα-helixtrans-58-43.4173.8173.1-97.6000112.2V154 Q158 S216 L217 L218 V222 G224 Y228 M287V154-Y220 HydrophobicContact CG1-CD1 3.94Å; V154-Y220 HydrophobicContact CG1-CE1 3.67Å; V154-Y220 HydrophobicContact CG2-CD1 4.27Å; Q158-Y220 PolarHBondContact NE2-OH 2.94Å; S216-Y220 PolarHBondContact O-N 3.18Å; L217-Y220 WeakPolarHBondContact O-CB 3.45Å; L217-Y220 PolarHBondContact O-N 3.1Å; L218-Y220 VanDerWaalsContact C-N 3.3Å; L218-Y220 PolarHBondContact O-N 3.02Å; Y220-V222 VanDerWaalsContact C-N 3.34Å; Y220-V222 PolarHBondContact O-N 3.36Å; Y220-G224 WeakPolarHBondContact O-CA 3.34Å; Y220-G224 PolarHBondContact O-N 3.46Å; Y220-Y228 HydrophobicContact CD2-CG 4.38Å; Y220-M287 HydrophobicContact CE2-CE 4.27Å
221L90.6Very high91.1Very high58 Ų5849.9 Ų49.930%0.30428%0.276SS..Hα-helixtrans-64.3-36.4179.1-71.2175.4000113.1L153 V154 V157 L217 L218 V219L153-L221 HydrophobicContact CD2-CD1 3.88Å; L153-L221 HydrophobicContact CG-CD1 4.31Å; V154-L221 HydrophobicContact CB-CD2 4.43Å; V154-L221 HydrophobicContact CG2-CD1 4.17Å; V154-L221 HydrophobicContact CG2-CD2 3.7Å; V154-L221 HydrophobicContact CG2-CG 3.87Å; V157-L221 HydrophobicContact CB-CD2 4.3Å; V157-L221 HydrophobicContact CG1-CD2 4.43Å; V157-L221 HydrophobicContact CG2-CD2 4.09Å; L217-L221 WeakPolarHBondContact O-CG 3.48Å; L217-L221 PolarHBondContact O-N 3.16Å; L217-L221 VanDerWaalsContact O-N 3.09Å; L218-L221 HydrophobicContact CD2-CD1 4.47Å; L218-L221 PolarHBondContact O-N 2.75Å; V219-L221 VanDerWaalsContact C-N 3.31Å; V219-L221 PolarHBondContact O-N 3.18Å
222V93Very high90.8Very high131 Ų13149.7 Ų49.779%0.79428%0.275SS*.Hα-helixtrans-89-38-175.4177.60000112.2L218 V219 Y220L218-V222 PolarHBondContact O-N 3.27Å; V219-V222 PolarHBondContact O-N 3.43Å; Y220-V222 VanDerWaalsContact C-N 3.34Å; Y220-V222 PolarHBondContact O-N 3.36Å
223A89.8Confident90.7Very high46 Ų4655.7 Ų55.738%0.3830%0.301SS..Hα-helixtrans-129.53.6-160.500000113.8V219 L227V219-A223 HydrophobicContact CG1-CB 4.29Å; V219-A223 WeakPolarHBondContact O-CA 3.5Å; V219-A223 WeakPolarHBondContact O-CB 3.42Å; V219-A223 PolarHBondContact O-N 2.9Å; A223-L227 HydrophobicContact CB-CB 4Å; A223-L227 HydrophobicContact CB-CD1 3.34Å; A223-L227 HydrophobicContact CB-CG 4.29Å
224G87.8Confident90.7Very high30 Ų3059.4 Ų59.431%0.30932%0.315SS..Hα-helixtrans80.9-172.8171.500000115.4Y220 S226 Y228Y220-G224 WeakPolarHBondContact O-CA 3.34Å; Y220-G224 PolarHBondContact O-N 3.46Å; G224-S226 PolarHBondContact O-N 3.22Å; G224-Y228 PolarHBondContact O-N 3.24Å
225S83Confident90.7Very high47 Ų4758.8 Ų58.833%0.32931%0.313SS..Hα-helixtrans-69.5-29-169.6-166.80000114.5Y228 F229S225-Y228 WeakPolarHBondContact O-CB 3.45Å; S225-F229 WeakPolarHBondContact O-CD2 3.34Å
226S86.2Confident90.5Very high87 Ų8755.9 Ų55.961%0.60830%0.299SS*.Hα-helixtrans-69.7-48.4-177.8-54.30000111.2G224 Y228 F229 Y230G224-S226 PolarHBondContact O-N 3.22Å; S226-Y228 VanDerWaalsContact C-N 3.26Å; S226-Y228 PolarHBondContact O-N 3.34Å; S226-F229 PolarHBondContact O-N 3.09Å; S226-Y230 WeakPolarHBondContact O-CD2 3.33Å
227L89.5Confident90.5Very high88 Ų8859.6 Ų59.646%0.46132%0.319SS..Hα-helixtrans-70.7-23.4179.5-74.1170.5000112.9V219 A223 Y230 C231V219-L227 HydrophobicContact CG1-CB 3.8Å; A223-L227 HydrophobicContact CB-CB 4Å; A223-L227 HydrophobicContact CB-CD1 3.34Å; A223-L227 HydrophobicContact CB-CG 4.29Å; L227-Y230 HydrophobicContact CD2-CD2 4.3Å; L227-Y230 PolarHBondContact O-N 3.2Å; L227-C231 VanDerWaalsContact O-CB 3.23Å; L227-C231 WeakPolarHBondContact O-CB 3.42Å; L227-C231 PolarHBondContact O-N 3.3Å
228Y88.5Confident90.5Very high7 Ų759.4 Ų59.43%0.02732%0.317CS..Hα-helixtrans-55.2-50.9169.5173.6-108.3000112.6S216 L217 Y220 G224 S225 S226 Y230 C231 L232 T283S216-Y228 VanDerWaalsContact O-CD2 3.3Å; S216-Y228 WeakPolarHBondContact O-CD2 3.37Å; L217-Y228 HydrophobicContact CD2-CE2 4.16Å; Y220-Y228 HydrophobicContact CD2-CG 4.38Å; G224-Y228 PolarHBondContact O-N 3.24Å; S225-Y228 WeakPolarHBondContact O-CB 3.45Å; S226-Y228 VanDerWaalsContact C-N 3.26Å; S226-Y228 PolarHBondContact O-N 3.34Å; Y228-Y230 PolarHBondContact O-N 3.28Å; Y228-C231 PolarHBondContact O-N 3.16Å; Y228-L232 HydrophobicContact CE1-CD1 4.26Å; Y228-L232 WeakPolarHBondContact O-CB 3.47Å; Y228-L232 PolarHBondContact O-N 3.15Å; Y228-T283 HydrophobicContact CE1-CG2 3.61Å; Y228-T283 WeakPolarHBondContact OH-CG2 3.37Å
229F89Confident90.3Very high84 Ų8455.9 Ų55.937%0.36830%0.299SS..Hα-helixtrans-66.6-39.1-178-67.9-68.4000112.3S225 S226 L232 F233 W280S225-F229 WeakPolarHBondContact O-CD2 3.34Å; S226-F229 PolarHBondContact O-N 3.09Å; F229-L232 PolarHBondContact O-N 3.17Å; F229-F233 WeakPolarHBondContact O-CB 3.13Å; F229-F233 PolarHBondContact O-N 3.49Å; F229-W280 HydrophobicContact CD1-CZ3 4.44Å
230Y91.5Very high90.2Very high171 Ų17154.6 Ų54.667%0.67129%0.292SS*.Hα-helixtrans-63.9-44.2174.2-68.3-64.7000112.1S226 L227 Y228 F233 Y234S226-Y230 WeakPolarHBondContact O-CD2 3.33Å; L227-Y230 HydrophobicContact CD2-CD2 4.3Å; L227-Y230 PolarHBondContact O-N 3.2Å; Y228-Y230 PolarHBondContact O-N 3.28Å; Y230-F233 PolarHBondContact O-N 3.26Å; Y230-Y234 PolarHBondContact O-N 3.25Å
231C91.1Very high90.1Very high22 Ų2256.5 Ų56.515%0.14930%0.301CS..Hα-helixtrans-64.7-43.3177.7-174.10000111.3V219 L227 Y228 F233 Y234 C235V219-C231 HydrophobicContact CB-CB 4.17Å; V219-C231 HydrophobicContact CG1-CB 4.06Å; V219-C231 HydrophobicContact CG2-CB 4.23Å; L227-C231 VanDerWaalsContact O-CB 3.23Å; L227-C231 WeakPolarHBondContact O-CB 3.42Å; L227-C231 PolarHBondContact O-N 3.3Å; Y228-C231 PolarHBondContact O-N 3.16Å; C231-F233 PolarHBondContact O-N 3.38Å; C231-Y234 PolarHBondContact O-N 3.43Å; C231-C235 VanDerWaalsContact O-CB 3.32Å; C231-C235 WeakPolarHBondContact O-CB 3.34Å; C231-C235 PolarHBondContact O-N 2.98Å; C231-C235 PolarHBondContact O-SG 3.35Å; C231-C235 VanDerWaalsContact O-SG 3.41Å
232L89.9Confident90Very high5 Ų553.7 Ų53.73%0.02629%0.287CS..Hα-helixtrans-60-47.1176.2-176.8157.7000111.6S216 Y228 F229 Y234 C235 S236 W280 T283S216-L232 WeakPolarHBondContact OG-CA 3.41Å; Y228-L232 HydrophobicContact CE1-CD1 4.26Å; Y228-L232 WeakPolarHBondContact O-CB 3.47Å; Y228-L232 PolarHBondContact O-N 3.15Å; F229-L232 PolarHBondContact O-N 3.17Å; L232-Y234 VanDerWaalsContact C-N 3.34Å; L232-Y234 PolarHBondContact O-N 3.47Å; L232-C235 PolarHBondContact O-N 3.47Å; L232-S236 WeakPolarHBondContact O-CB 3.35Å; L232-S236 PolarHBondContact O-N 3.21Å; L232-S236 PolarHBondContact O-OG 3.13Å; L232-W280 HydrophobicContact CD2-CE3 3.94Å; L232-W280 HydrophobicContact CD2-CZ3 4.48Å; L232-T283 HydrophobicContact CD1-CG2 3.28Å; L232-T283 VanDerWaalsContact CD1-OG1 3.27Å; L232-T283 WeakPolarHBondContact CD1-OG1 3.38Å
233F90.9Very high89.7Confident127 Ų12747.8 Ų47.856%0.55725%0.251SS*.Hα-helixtrans-58-49.1177.6-178.3-103.8000110.8F229 Y230 C231 C235 S236 L237F229-F233 WeakPolarHBondContact O-CB 3.13Å; F229-F233 PolarHBondContact O-N 3.49Å; Y230-F233 PolarHBondContact O-N 3.26Å; C231-F233 PolarHBondContact O-N 3.38Å; F233-C235 PolarHBondContact O-N 3.25Å; F233-S236 PolarHBondContact O-N 3.4Å; F233-S236 PolarHBondContact O-OG 3.12Å; F233-L237 HydrophobicContact CD1-CD1 4.12Å; F233-L237 HydrophobicContact CE1-CD1 3.53Å; F233-L237 HydrophobicContact CE1-CG 4.47Å; F233-L237 HydrophobicContact CE2-CD1 4.44Å; F233-L237 HydrophobicContact CZ-CD1 3.72Å; F233-L237 HydrophobicContact CZ-CG 4.41Å; F233-L237 PolarHBondContact O-N 3Å
234Y93.3Very high89.5Confident83 Ų8347.1 Ų47.133%0.32525%0.245SC..Hα-helixtrans-57.8-50.5175172.5-92.7000112.5L98 F99 F101 Y230 C231 L232 S236 L237 A238L98-Y234 WeakPolarHBondContact O-CE1 3.21Å; L98-Y234 PolarHBondContact O-OH 3.29Å; F99-Y234 VanDerWaalsContact CD1-OH 3.3Å; F99-Y234 WeakPolarHBondContact CD1-OH 3.5Å; F101-Y234 HydrophobicContact CE2-CE2 4.48Å; Y230-Y234 PolarHBondContact O-N 3.25Å; C231-Y234 PolarHBondContact O-N 3.43Å; L232-Y234 VanDerWaalsContact C-N 3.34Å; L232-Y234 PolarHBondContact O-N 3.47Å; Y234-S236 VanDerWaalsContact C-N 3.28Å; Y234-S236 PolarHBondContact O-N 2.53Å; Y234-L237 PolarHBondContact O-N 2.95Å; Y234-A238 HydrophobicContact CE1-CB 4.3Å; Y234-A238 WeakPolarHBondContact O-CB 3.46Å; Y234-A238 PolarHBondContact O-N 3.42Å
235C92.7Very high89.3Confident5 Ų548.6 Ų48.63%0.03424%0.241CC..Hα-helixtrans-61.8-35.4-179.5-77.90000112.2C231 L232 F233 A238 I239C231-C235 VanDerWaalsContact O-CB 3.32Å; C231-C235 WeakPolarHBondContact O-CB 3.34Å; C231-C235 PolarHBondContact O-N 2.98Å; C231-C235 PolarHBondContact O-SG 3.35Å; C231-C235 VanDerWaalsContact O-SG 3.41Å; L232-C235 PolarHBondContact O-N 3.47Å; F233-C235 PolarHBondContact O-N 3.25Å; C235-A238 PolarHBondContact O-N 2.97Å; C235-I239 WeakPolarHBondContact O-CB 3.27Å; C235-I239 VanDerWaalsContact O-CG1 3.25Å; C235-I239 WeakPolarHBondContact O-CG1 3.36Å; C235-I239 PolarHBondContact O-N 3.43Å
236S91.5Very high89.2Confident8 Ų846.5 Ų46.56%0.05623%0.226CC..Hα-helixtrans-66.1-41.917776.50000112.3L232 F233 Y234 S240L232-S236 WeakPolarHBondContact O-CB 3.35Å; L232-S236 PolarHBondContact O-N 3.21Å; L232-S236 PolarHBondContact O-OG 3.13Å; F233-S236 PolarHBondContact O-N 3.4Å; F233-S236 PolarHBondContact O-OG 3.12Å; Y234-S236 VanDerWaalsContact C-N 3.28Å; Y234-S236 PolarHBondContact O-N 2.53Å; S236-S240 WeakPolarHBondContact O-CB 3.35Å; S236-S240 PolarHBondContact O-N 3.28Å; S236-S240 VanDerWaalsContact O-N 3.08Å; S236-S240 PolarHBondContact O-OG 2.82Å
237L91Very high88.7Confident81 Ų8142.5 Ų42.542%0.42420%0.198SC..Hα-helixtrans-68.5-42.7174.5-67.4178.7000111.4F233 Y234 S240 F241F233-L237 HydrophobicContact CD1-CD1 4.12Å; F233-L237 HydrophobicContact CE1-CD1 3.53Å; F233-L237 HydrophobicContact CE1-CG 4.47Å; F233-L237 HydrophobicContact CE2-CD1 4.44Å; F233-L237 HydrophobicContact CZ-CD1 3.72Å; F233-L237 HydrophobicContact CZ-CG 4.41Å; F233-L237 PolarHBondContact O-N 3Å; Y234-L237 PolarHBondContact O-N 2.95Å; L237-S240 PolarHBondContact O-N 2.95Å; L237-F241 WeakPolarHBondContact O-CB 3.46Å; L237-F241 PolarHBondContact O-N 3.21Å
238A92.1Very high88.1Confident1 Ų145.3 Ų45.31%0.00821%0.207CC..Hα-helixtrans-60-49.2177.700000111.3P100 Y234 C235 S240 F241 F242P100-A238 HydrophobicContact CG-CB 4Å; P100-A238 WeakPolarHBondContact CG-O 3.49Å; Y234-A238 HydrophobicContact CE1-CB 4.3Å; Y234-A238 WeakPolarHBondContact O-CB 3.46Å; Y234-A238 PolarHBondContact O-N 3.42Å; C235-A238 PolarHBondContact O-N 2.97Å; A238-S240 PolarHBondContact O-N 3.27Å; A238-F241 PolarHBondContact O-N 3.1Å; A238-F242 VanDerWaalsContact O-CB 3.29Å; A238-F242 WeakPolarHBondContact O-CB 3.38Å; A238-F242 PolarHBondContact O-N 2.9Å
239I91Very high87.6Confident1 Ų147.7 Ų47.71%0.00522%0.222CC..Hα-helixtrans-61.5-44.3177.7-71.9-73.8000111.3V97 Y208 K209 C235 F241 F242 L243 M279V97-I239 HydrophobicContact CG1-CD1 3.38Å; Y208-I239 VanDerWaalsContact O-CD1 3.26Å; Y208-I239 WeakPolarHBondContact O-CD1 3.37Å; K209-I239 HydrophobicContact CB-CG2 4.42Å; C235-I239 WeakPolarHBondContact O-CB 3.27Å; C235-I239 VanDerWaalsContact O-CG1 3.25Å; C235-I239 WeakPolarHBondContact O-CG1 3.36Å; C235-I239 PolarHBondContact O-N 3.43Å; I239-F241 PolarHBondContact O-N 2.93Å; I239-F242 PolarHBondContact O-N 3.4Å; I239-L243 HydrophobicContact CG2-CD1 3.68Å; I239-L243 HydrophobicContact CG2-CG 4.2Å; I239-L243 WeakPolarHBondContact O-CB 3.34Å; I239-L243 VanDerWaalsContact O-CG 3.24Å; I239-L243 WeakPolarHBondContact O-CG 3.5Å; I239-L243 PolarHBondContact O-N 3.13Å; I239-M279 HydrophobicContact CB-CE 3.98Å; I239-M279 HydrophobicContact CG1-CE 3.69Å; I239-M279 HydrophobicContact CG2-CE 4.05Å
240S90Very high86.9Confident13 Ų1345.8 Ų45.89%0.09121%0.214CC..Hα-helixtrans-61-45.9178.5-57.20000111.6S236 L237 A238 L243 A244 S272 P276S236-S240 WeakPolarHBondContact O-CB 3.35Å; S236-S240 PolarHBondContact O-N 3.28Å; S236-S240 VanDerWaalsContact O-N 3.08Å; S236-S240 PolarHBondContact O-OG 2.82Å; L237-S240 PolarHBondContact O-N 2.95Å; A238-S240 PolarHBondContact O-N 3.27Å; S240-L243 PolarHBondContact O-N 2.88Å; S240-A244 WeakPolarHBondContact O-CB 3.39Å; S240-A244 PolarHBondContact O-N 3.49Å; S240-S272 PolarHBondContact O-OG 3.17Å; S240-S272 PolarHBondContact OG-O 3.24Å; S240-P276 WeakPolarHBondContact OG-CD 3.04Å; S240-P276 WeakPolarHBondContact OG-CG 3.3Å
241F88.7Confident85.9Confident91 Ų9138.1 Ų38.140%0.39919%0.185SC..Hα-helixtrans-67.2-40178.6-178.8-93.9000112P100 F101 L237 A238 I239 R245P100-F241 HydrophobicContact CB-CD1 3.68Å; P100-F241 HydrophobicContact CB-CE1 4.18Å; P100-F241 HydrophobicContact CG-CD1 3.78Å; F101-F241 AromaticContact CD1-CD1 3.99Å; F101-F241 HydrophobicContact CD1-CD1 3.99Å; F101-F241 AromaticContact CD1-CE1 3.97Å; F101-F241 HydrophobicContact CD1-CE1 3.97Å; F101-F241 HydrophobicContact CD1-CG 4.34Å; F101-F241 HydrophobicContact CD1-CZ 4.3Å; F101-F241 HydrophobicContact CE1-CB 4.1Å; F101-F241 AromaticContact CE1-CD1 3.75Å; F101-F241 HydrophobicContact CE1-CD1 3.75Å; F101-F241 HydrophobicContact CE1-CD2 4Å; F101-F241 HydrophobicContact CE1-CE1 4.14Å; F101-F241 HydrophobicContact CE1-CE2 4.36Å; F101-F241 AromaticContact CE1-CG 3.67Å; F101-F241 HydrophobicContact CE1-CG 3.67Å; F101-F241 HydrophobicContact CE1-CZ 4.43Å; F101-F241 HydrophobicContact CZ-CB 4.29Å; F101-F241 HydrophobicContact CZ-CG 4.34Å; L237-F241 WeakPolarHBondContact O-CB 3.46Å; L237-F241 PolarHBondContact O-N 3.21Å; A238-F241 PolarHBondContact O-N 3.1Å; I239-F241 PolarHBondContact O-N 2.93Å; F241-R245 WeakPolarHBondContact O-CB 3.43Å; F241-R245 PolarHBondContact O-N 3.41Å
242F89.2Confident84.8Confident0 Ų040.8 Ų40.80%021%0.208CC..Hα-helixtrans-57.9-52.1173.7164.4-113.2000111.7L96 V97 P100 Y208 A238 I239 A244 R245 S246L96-F242 HydrophobicContact CD2-CD2 3.05Å; L96-F242 HydrophobicContact CD2-CE2 3.15Å; L96-F242 HydrophobicContact CD2-CG 4.23Å; L96-F242 HydrophobicContact CD2-CZ 4.39Å; V97-F242 HydrophobicContact CG2-CD1 3.98Å; V97-F242 HydrophobicContact CG2-CD2 4.41Å; V97-F242 HydrophobicContact CG2-CE1 3.67Å; V97-F242 HydrophobicContact CG2-CE2 4.1Å; V97-F242 HydrophobicContact CG2-CG 4.33Å; V97-F242 HydrophobicContact CG2-CZ 3.71Å; P100-F242 HydrophobicContact CB-CB 4.18Å; Y208-F242 AromaticContact CD1-CE1 3.97Å; Y208-F242 HydrophobicContact CD1-CE1 3.97Å; Y208-F242 HydrophobicContact CD1-CZ 4.42Å; Y208-F242 AromaticContact CD2-CE1 3.96Å; Y208-F242 HydrophobicContact CD2-CE1 3.96Å; Y208-F242 HydrophobicContact CE1-CE1 4.38Å; Y208-F242 HydrophobicContact CE1-CZ 4.41Å; Y208-F242 HydrophobicContact CE2-CE1 4.36Å; Y208-F242 AromaticContact CG-CE1 3.74Å; Y208-F242 HydrophobicContact CG-CE1 3.74Å; A238-F242 VanDerWaalsContact O-CB 3.29Å; A238-F242 WeakPolarHBondContact O-CB 3.38Å; A238-F242 PolarHBondContact O-N 2.9Å; I239-F242 PolarHBondContact O-N 3.4Å; F242-A244 PolarHBondContact O-N 2.76Å; F242-R245 WeakPolarHBondContact O-CB 3.27Å; F242-R245 PolarHBondContact O-N 3.29Å; F242-R245 VanDerWaalsContact O-N 3.11Å; F242-S246 WeakPolarHBondContact CE2-OG 2.94Å; F242-S246 WeakPolarHBondContact CZ-OG 3.31Å; F242-S246 PolarHBondContact O-N 2.92Å; F242-S246 PolarHBondContact O-OG 3.05Å
243L87.8Confident83.7Confident7 Ų747.2 Ų47.24%0.03724%0.243CC..Hα-helixtrans-62.1-44.4-179.4-69.4172.5000111.5Y205 Y208 I239 S240 R245 S246 L247 Q275Y205-L243 HydrophobicContact CD1-CD2 3.61Å; Y205-L243 HydrophobicContact CE1-CD2 4.41Å; Y205-L243 HydrophobicContact CG-CD2 4.48Å; Y208-L243 HydrophobicContact CD2-CD2 4.24Å; I239-L243 HydrophobicContact CG2-CD1 3.68Å; I239-L243 HydrophobicContact CG2-CG 4.2Å; I239-L243 WeakPolarHBondContact O-CB 3.34Å; I239-L243 VanDerWaalsContact O-CG 3.24Å; I239-L243 WeakPolarHBondContact O-CG 3.5Å; I239-L243 PolarHBondContact O-N 3.13Å; S240-L243 PolarHBondContact O-N 2.88Å; L243-R245 PolarHBondContact O-N 3.05Å; L243-S246 PolarHBondContact O-N 3.35Å; L243-L247 WeakPolarHBondContact O-CB 3.37Å; L243-L247 PolarHBondContact O-N 3.4Å; L243-Q275 HydrophobicContact CD1-CG 3.55Å
244A85.1Confident82.3Confident31 Ų3142.4 Ų42.426%0.25623%0.229SC..Hα-helixtrans-60.6-33.1175.300000112.8S240 F242 L247 K248S240-A244 WeakPolarHBondContact O-CB 3.39Å; S240-A244 PolarHBondContact O-N 3.49Å; F242-A244 PolarHBondContact O-N 2.76Å; A244-L247 WeakPolarHBondContact O-CB 3.47Å; A244-K248 WeakPolarHBondContact O-CG 3.5Å; A244-K248 PolarHBondContact O-N 2.94Å
245R83.1Confident80.6Confident61 Ų6150.6 Ų50.623%0.2326%0.26CS..Hα-helixtrans-74.9-51175.5-179.2-177.2175.3149.13.2112.1H103 F241 F242 L243 L247 K248 V249H103-R245 VanDerWaalsContact CB-NH1 3.3Å; H103-R245 PolarHBondContact CD2-NH1 3.08Å; H103-R245 VanDerWaalsContact CD2-NH1 3.28Å; H103-R245 PolarHBondContact CD2-NH2 2.63Å; H103-R245 PolarHBondContact CE1-NH2 3.11Å; H103-R245 VanDerWaalsContact CG-CZ 3.42Å; H103-R245 PolarHBondContact ND1-NH2 3.45Å; H103-R245 VanDerWaalsContact ND1-NH2 3.15Å; H103-R245 PolarHBondContact NE2-NH2 3.19Å; H103-R245 VanDerWaalsContact NE2-NH2 3.14Å; F241-R245 WeakPolarHBondContact O-CB 3.43Å; F241-R245 PolarHBondContact O-N 3.41Å; F242-R245 WeakPolarHBondContact O-CB 3.27Å; F242-R245 PolarHBondContact O-N 3.29Å; F242-R245 VanDerWaalsContact O-N 3.11Å; L243-R245 PolarHBondContact O-N 3.05Å; R245-L247 PolarHBondContact O-N 3.28Å; R245-K248 PolarHBondContact O-N 2.96Å; R245-V249 PolarHBondContact O-N 3.13Å
246S81.6Confident78.9Confident3 Ų352.1 Ų52.12%0.02127%0.27CS..Hα-helixtrans-57.5-35.7177.3-67.10000111.3Y205 F242 L243 V249 H250Y205-S246 PolarHBondContact OH-O 3.46Å; F242-S246 WeakPolarHBondContact CE2-OG 2.94Å; F242-S246 WeakPolarHBondContact CZ-OG 3.31Å; F242-S246 PolarHBondContact O-N 2.92Å; F242-S246 PolarHBondContact O-OG 3.05Å; L243-S246 PolarHBondContact O-N 3.35Å; S246-V249 PolarHBondContact O-N 3.34Å; S246-H250 WeakPolarHBondContact O-CB 3.37Å; S246-H250 PolarHBondContact O-N 3.09Å
247L75.6Confident77.4Confident3 Ų361.7 Ų61.72%0.01631%0.307CS..Hα-helixtrans-56.7-54.5170.5165.958.2000112.8L243 A244 R245 V249 H250 V251 L265 L268 V269L243-L247 WeakPolarHBondContact O-CB 3.37Å; L243-L247 PolarHBondContact O-N 3.4Å; A244-L247 WeakPolarHBondContact O-CB 3.47Å; R245-L247 PolarHBondContact O-N 3.28Å; L247-V249 PolarHBondContact O-N 2.76Å; L247-H250 PolarHBondContact O-N 3.47Å; L247-V251 HydrophobicContact CD1-CG2 3.47Å; L247-V251 VanDerWaalsContact CD1-CG2 3.47Å; L247-V251 HydrophobicContact CG-CG2 4.46Å; L247-V251 WeakPolarHBondContact O-CB 3.03Å; L247-V251 WeakPolarHBondContact O-CG2 3.38Å; L247-V251 PolarHBondContact O-N 2.76Å; L247-L265 HydrophobicContact CD1-CD1 4.44Å; L247-L265 HydrophobicContact CD2-CD1 3.83Å; L247-L265 HydrophobicContact CG-CD1 3.92Å; L247-L268 HydrophobicContact CD1-CB 3.23Å; L247-L268 HydrophobicContact CD1-CD1 3.04Å; L247-L268 HydrophobicContact CD1-CG 3.67Å; L247-L268 HydrophobicContact CD2-CB 3.36Å; L247-L268 HydrophobicContact CG-CB 3.86Å; L247-L268 HydrophobicContact CG-CD1 4.41Å; L247-V269 HydrophobicContact CD2-CG2 3.74Å
248K76.3Confident76.3Confident148 Ų14863.1 Ų63.164%0.64331%0.311SS*.Hα-helixtrans-56-39.8-178.7-77.2178179179.40111.4A244 R245 A252A244-K248 WeakPolarHBondContact O-CG 3.5Å; A244-K248 PolarHBondContact O-N 2.94Å; R245-K248 PolarHBondContact O-N 2.96Å; K248-A252 VanDerWaalsContact O-CB 3.27Å; K248-A252 WeakPolarHBondContact O-CB 3.35Å; K248-A252 PolarHBondContact O-N 3.44Å
249V77.3Confident75Confident56 Ų5670.1 Ų70.134%0.33934%0.344SS..Hα-helixtrans-70.2-47.9178.3179.60000111.4N133 R245 S246 L247 V251 A252 D253N133-V249 HydrophobicContact CB-CB 4.23Å; N133-V249 HydrophobicContact CB-CG1 3.73Å; R245-V249 PolarHBondContact O-N 3.13Å; S246-V249 PolarHBondContact O-N 3.34Å; L247-V249 PolarHBondContact O-N 2.76Å; V249-V251 VanDerWaalsContact C-N 3.29Å; V249-V251 PolarHBondContact O-N 2.79Å; V249-A252 WeakPolarHBondContact O-CB 3.38Å; V249-A252 PolarHBondContact O-N 3.07Å; V249-A252 VanDerWaalsContact O-N 3.13Å; V249-D253 PolarHBondContact O-N 3.29Å; V249-D253 VanDerWaalsContact O-N 3.13Å
250H75Confident74.1Confident44 Ų4470.8 Ų70.820%0.20435%0.351CS..Hα-helixtrans-65.9-31.4-179.5-178.577.5000113I135 Y205 S246 L247 K264I135-H250 WeakPolarHBondContact CD1-ND1 3.42Å; Y205-H250 WeakPolarHBondContact OH-CB 3.44Å; S246-H250 WeakPolarHBondContact O-CB 3.37Å; S246-H250 PolarHBondContact O-N 3.09Å; L247-H250 PolarHBondContact O-N 3.47Å; H250-K264 PolarHBondContact CD2-NZ 2.79Å; H250-K264 VanDerWaalsContact CD2-NZ 3.27Å; H250-K264 PolarHBondContact NE2-NZ 3.18Å; H250-K264 VanDerWaalsContact NE2-NZ 3.13Å
251V70.3Confident73.3Confident11 Ų1174.7 Ų74.77%0.06736%0.364CS..Hα-helixtrans-75.8-31.8173.81730000111.7L247 V249 G254 R261 K264 L268L247-V251 HydrophobicContact CD1-CG2 3.47Å; L247-V251 VanDerWaalsContact CD1-CG2 3.47Å; L247-V251 HydrophobicContact CG-CG2 4.46Å; L247-V251 WeakPolarHBondContact O-CB 3.03Å; L247-V251 WeakPolarHBondContact O-CG2 3.38Å; L247-V251 PolarHBondContact O-N 2.76Å; V249-V251 VanDerWaalsContact C-N 3.29Å; V249-V251 PolarHBondContact O-N 2.79Å; V251-G254 PolarHBondContact O-N 2.73Å; V251-R261 HydrophobicContact CG1-CG 3.3Å; V251-K264 HydrophobicContact CG2-CD 3.87Å; V251-K264 HydrophobicContact CG2-CG 3.93Å; V251-L268 HydrophobicContact CG2-CD1 4.43Å
252A68.4Low72.7Confident77 Ų7776.2 Ų76.264%0.63637%0.37SS*.Hα-helixtrans-69.5-32.4176.600000113K248 V249 G254K248-A252 VanDerWaalsContact O-CB 3.27Å; K248-A252 WeakPolarHBondContact O-CB 3.35Å; K248-A252 PolarHBondContact O-N 3.44Å; V249-A252 WeakPolarHBondContact O-CB 3.38Å; V249-A252 PolarHBondContact O-N 3.07Å; V249-A252 VanDerWaalsContact O-N 3.13Å; A252-G254 VanDerWaalsContact C-N 3.33Å
253D66.7Low72.1Confident140 Ų14081.8 Ų81.875%0.74939%0.391SS*.Hα-helixtrans-72.8-26.4177.7-168.445.3000112.9V249 R255V249-D253 PolarHBondContact O-N 3.29Å; V249-D253 VanDerWaalsContact O-N 3.13Å; D253-R255 PolarHBondContact O-N 3.49Å
254G62Low71.5Confident27 Ų2781.9 Ų81.928%0.27839%0.391SS..  trans-72.8116.6176.700000111.9V251 A252 S256V251-G254 PolarHBondContact O-N 2.73Å; A252-G254 VanDerWaalsContact C-N 3.33Å; G254-S256 PolarHBondContact O-N 3Å
255R57.9Low71.2Confident254 Ų25483.4 Ų83.496%0.95840%0.395SS*.  trans-65.934.3164.1-58.9-171.7-170.3-175.73.2113.2D253D253-R255 PolarHBondContact O-N 3.49Å
256S56.9Low71.2Confident37 Ų3788.5 Ų88.526%0.25942%0.415SS..  trans-72.2138.4179.1-65.50000109.9G254 E258G254-S256 PolarHBondContact O-N 3Å; S256-E258 PolarHBondContact O-N 2.71Å
257Y59.3Low71Confident210 Ų21088.5 Ų88.582%0.82442%0.415SS*.  trans-45.5135.6168.6-72.5-90.4000110.6E259 G260 R261Y257-E259 PolarHBondContact O-N 2.96Å; Y257-G260 PolarHBondContact O-N 3.18Å; Y257-R261 PolarHBondContact O-N 3.16Å
258E67.4Low71.1Confident110 Ų11088.8 Ų88.851%0.51442%0.417SS..Hα-helixtrans-41.9-38.3-175.9-85.3-79.9157.900113.9S256 R261 K262S256-E258 PolarHBondContact O-N 2.71Å; E258-R261 WeakPolarHBondContact O-CB 3.47Å; E258-R261 PolarHBondContact O-N 2.64Å; E258-R261 IonicContact OE1-CZ 3.68Å; E258-R261 IonicContact OE1-NH2 2.77Å; E258-R261 PolarHBondContact OE1-NH2 2.84Å; E258-R261 IonicContact OE2-CZ 3.41Å; E258-R261 IonicContact OE2-NE 2.69Å; E258-R261 IonicContact OE2-NH2 2.68Å; E258-R261 PolarHBondContact OE2-NH2 3.32Å; E258-K262 PolarHBondContact O-N 2.84Å
259E66.2Low71.3Confident148 Ų14884.3 Ų84.369%0.69240%0.402SS*.Hα-helixtrans-68.2-46.9-179.3-66.6-176.117400113.7Y257 R261 K262 R263Y257-E259 PolarHBondContact O-N 2.96Å; E259-R261 VanDerWaalsContact C-N 3.25Å; E259-R261 PolarHBondContact O-N 3.39Å; E259-K262 PolarHBondContact O-N 2.86Å; E259-R263 PolarHBondContact O-N 3.08Å
260G70.7Confident71.5Confident15 Ų1587.6 Ų87.616%0.15541%0.411CS..Hα-helixtrans-65.8-32.417700000111.8Y257 R263 K264Y257-G260 PolarHBondContact O-N 3.18Å; G260-R263 PolarHBondContact O-N 3.28Å; G260-K264 VanDerWaalsContact O-CB 3.3Å; G260-K264 WeakPolarHBondContact O-CB 3.18Å; G260-K264 PolarHBondContact O-N 3.32Å
261R73.4Confident71.7Confident96 Ų9686.1 Ų86.136%0.36241%0.405SS..Hα-helixtrans-61.3-46.4177.7-166.1179.162.9156.9-3.5112.4V251 Y257 E258 E259 K264 L265V251-R261 HydrophobicContact CG1-CG 3.3Å; Y257-R261 PolarHBondContact O-N 3.16Å; E258-R261 WeakPolarHBondContact O-CB 3.47Å; E258-R261 PolarHBondContact O-N 2.64Å; E258-R261 IonicContact OE1-CZ 3.68Å; E258-R261 IonicContact OE1-NH2 2.77Å; E258-R261 PolarHBondContact OE1-NH2 2.84Å; E258-R261 IonicContact OE2-CZ 3.41Å; E258-R261 IonicContact OE2-NE 2.69Å; E258-R261 IonicContact OE2-NH2 2.68Å; E258-R261 PolarHBondContact OE2-NH2 3.32Å; E259-R261 VanDerWaalsContact C-N 3.25Å; E259-R261 PolarHBondContact O-N 3.39Å; R261-K264 PolarHBondContact O-N 3.35Å; R261-L265 WeakPolarHBondContact O-CB 3.34Å; R261-L265 PolarHBondContact O-N 2.91Å
262K77.2Confident72.2Confident122 Ų12285.8 Ų85.853%0.5340%0.403SS..Hα-helixtrans-64.2-46.3179.1-68.2176.8-174.1177.60111.5E258 E259 K264 L265 Y266E258-K262 PolarHBondContact O-N 2.84Å; E259-K262 PolarHBondContact O-N 2.86Å; K262-K264 PolarHBondContact O-N 3.27Å; K262-L265 WeakPolarHBondContact O-CB 3.46Å; K262-L265 PolarHBondContact O-N 2.95Å; K262-Y266 HydrophobicContact CB-CE2 4.41Å; K262-Y266 WeakPolarHBondContact O-CD2 3.26Å; K262-Y266 PolarHBondContact O-N 2.78Å
263R77.1Confident72.9Confident117 Ų11787.7 Ų87.744%0.44240%0.402SS..Hα-helixtrans-62.4-43.4178.1-62.9-177.9-168.7-179.16.2112.1M191 I193 E259 G260 L265 Y266 L267M191-R263 PolarHBondContact O-NH1 3.27Å; M191-R263 VanDerWaalsContact O-NH1 3.15Å; I193-R263 HydrophobicContact CD1-CB 4.04Å; I193-R263 HydrophobicContact CG1-CB 3.82Å; E259-R263 PolarHBondContact O-N 3.08Å; G260-R263 PolarHBondContact O-N 3.28Å; R263-L265 VanDerWaalsContact C-N 3.32Å; R263-L265 PolarHBondContact O-N 3.39Å; R263-Y266 PolarHBondContact O-N 2.76Å; R263-L267 PolarHBondContact O-N 2.78Å
264K74.1Confident73.6Confident10 Ų1082.6 Ų82.64%0.04338%0.376CS..Hα-helixtrans-57.9-44.6174-179.2174.6175.81750111.4I193 L197 H250 V251 G260 R261 K262 L267 L268I193-K264 HydrophobicContact CG2-CB 4.41Å; L197-K264 HydrophobicContact CD1-CG 4.35Å; L197-K264 VanDerWaalsContact CD2-CE 3.47Å; L197-K264 HydrophobicContact CG-CD 4.34Å; H250-K264 PolarHBondContact CD2-NZ 2.79Å; H250-K264 VanDerWaalsContact CD2-NZ 3.27Å; H250-K264 PolarHBondContact NE2-NZ 3.18Å; H250-K264 VanDerWaalsContact NE2-NZ 3.13Å; V251-K264 HydrophobicContact CG2-CD 3.87Å; V251-K264 HydrophobicContact CG2-CG 3.93Å; G260-K264 VanDerWaalsContact O-CB 3.3Å; G260-K264 WeakPolarHBondContact O-CB 3.18Å; G260-K264 PolarHBondContact O-N 3.32Å; R261-K264 PolarHBondContact O-N 3.35Å; K262-K264 PolarHBondContact O-N 3.27Å; K264-L267 PolarHBondContact O-N 2.93Å; K264-L268 HydrophobicContact CD-CD1 4.43Å; K264-L268 HydrophobicContact CG-CD1 3.61Å; K264-L268 WeakPolarHBondContact O-CB 3.31Å; K264-L268 WeakPolarHBondContact O-CD1 3.45Å; K264-L268 WeakPolarHBondContact O-CG 3.46Å; K264-L268 PolarHBondContact O-N 3.41Å; K264-L268 VanDerWaalsContact O-N 3.09Å
265L78.9Confident74.7Confident63 Ų6381.5 Ų81.533%0.3336%0.363SS..Hα-helixtrans-61.1-47.5176.3-17670.2000111.6L247 R261 K262 R263 L267 L268 V269L247-L265 HydrophobicContact CD1-CD1 4.44Å; L247-L265 HydrophobicContact CD2-CD1 3.83Å; L247-L265 HydrophobicContact CG-CD1 3.92Å; R261-L265 WeakPolarHBondContact O-CB 3.34Å; R261-L265 PolarHBondContact O-N 2.91Å; K262-L265 WeakPolarHBondContact O-CB 3.46Å; K262-L265 PolarHBondContact O-N 2.95Å; R263-L265 VanDerWaalsContact C-N 3.32Å; R263-L265 PolarHBondContact O-N 3.39Å; L265-L267 PolarHBondContact O-N 3.42Å; L265-L268 PolarHBondContact O-N 3.36Å; L265-V269 HydrophobicContact CD1-CG2 4.23Å; L265-V269 HydrophobicContact CG-CG2 4.29Å; L265-V269 WeakPolarHBondContact O-CB 3.21Å; L265-V269 VanDerWaalsContact O-CG2 3.23Å; L265-V269 WeakPolarHBondContact O-CG2 3.32Å; L265-V269 PolarHBondContact O-N 3.01Å
266Y82.2Confident76Confident167 Ų16770.9 Ų70.966%0.65533%0.327SS*.Hα-helixtrans-60.3-46.2178.3-75.5-64.4000112.7K262 R263 L268 V269 F270K262-Y266 HydrophobicContact CB-CE2 4.41Å; K262-Y266 WeakPolarHBondContact O-CD2 3.26Å; K262-Y266 PolarHBondContact O-N 2.78Å; R263-Y266 PolarHBondContact O-N 2.76Å; Y266-L268 VanDerWaalsContact C-N 3.35Å; Y266-L268 PolarHBondContact O-N 2.7Å; Y266-V269 PolarHBondContact O-N 2.81Å; Y266-F270 WeakPolarHBondContact O-CB 3.47Å; Y266-F270 PolarHBondContact O-N 2.81Å
267L78.6Confident77.2Confident4 Ų474.9 Ų74.92%0.02135%0.345CS..Hα-helixtrans-59-46.2178.5-179.8156.3000111.2I184 T187 R188 M191 I193 R263 K264 L265 F270 I271I184-L267 HydrophobicContact CG2-CD2 4.14Å; T187-L267 HydrophobicContact CG2-CD1 3.74Å; T187-L267 HydrophobicContact CG2-CG 4.11Å; R188-L267 HydrophobicContact CB-CD1 4.28Å; M191-L267 HydrophobicContact SD-CB 4.22Å; M191-L267 HydrophobicContact SD-CD1 4.36Å; I193-L267 HydrophobicContact CD1-CB 4.17Å; I193-L267 HydrophobicContact CD1-CD1 3.64Å; R263-L267 PolarHBondContact O-N 2.78Å; K264-L267 PolarHBondContact O-N 2.93Å; L265-L267 PolarHBondContact O-N 3.42Å; L267-F270 WeakPolarHBondContact O-CB 3.46Å; L267-F270 PolarHBondContact O-N 2.81Å; L267-I271 HydrophobicContact CD2-CD1 3.42Å; L267-I271 VanDerWaalsContact CD2-CD1 3.42Å; L267-I271 HydrophobicContact CD2-CG1 4.43Å; L267-I271 HydrophobicContact CG-CD1 4.41Å; L267-I271 WeakPolarHBondContact O-CG1 3.22Å; L267-I271 PolarHBondContact O-N 2.89Å
268L76.7Confident78.3Confident9 Ų966.4 Ų66.45%0.04731%0.314CS..Hα-helixtrans-77.1-31.5-176.8-69.5156.9000112.7L197 Y205 L247 V251 K264 L265 Y266 F270 I271 S272L197-L268 HydrophobicContact CD1-CD1 4.07Å; L197-L268 HydrophobicContact CD1-CD2 4.39Å; L197-L268 HydrophobicContact CD1-CG 4.46Å; Y205-L268 HydrophobicContact CD2-CD2 4.38Å; L247-L268 HydrophobicContact CD1-CB 3.23Å; L247-L268 HydrophobicContact CD1-CD1 3.04Å; L247-L268 HydrophobicContact CD1-CG 3.67Å; L247-L268 HydrophobicContact CD2-CB 3.36Å; L247-L268 HydrophobicContact CG-CB 3.86Å; L247-L268 HydrophobicContact CG-CD1 4.41Å; V251-L268 HydrophobicContact CG2-CD1 4.43Å; K264-L268 HydrophobicContact CD-CD1 4.43Å; K264-L268 HydrophobicContact CG-CD1 3.61Å; K264-L268 WeakPolarHBondContact O-CB 3.31Å; K264-L268 WeakPolarHBondContact O-CD1 3.45Å; K264-L268 WeakPolarHBondContact O-CG 3.46Å; K264-L268 PolarHBondContact O-N 3.41Å; K264-L268 VanDerWaalsContact O-N 3.09Å; L265-L268 PolarHBondContact O-N 3.36Å; Y266-L268 VanDerWaalsContact C-N 3.35Å; Y266-L268 PolarHBondContact O-N 2.7Å; L268-F270 VanDerWaalsContact C-N 3.34Å; L268-I271 HydrophobicContact CD2-CD1 4.15Å; L268-I271 PolarHBondContact O-N 3.44Å; L268-S272 VanDerWaalsContact O-CB 3.29Å; L268-S272 WeakPolarHBondContact O-CB 3.26Å; L268-S272 PolarHBondContact O-N 2.69Å
269V81.8Confident79Confident54 Ų5461.3 Ų61.333%0.32729%0.29SS..Hα-helixtrans-63.6-42.7169168.60000110.1L247 L265 Y266 S272 L273L247-V269 HydrophobicContact CD2-CG2 3.74Å; L265-V269 HydrophobicContact CD1-CG2 4.23Å; L265-V269 HydrophobicContact CG-CG2 4.29Å; L265-V269 WeakPolarHBondContact O-CB 3.21Å; L265-V269 VanDerWaalsContact O-CG2 3.23Å; L265-V269 WeakPolarHBondContact O-CG2 3.32Å; L265-V269 PolarHBondContact O-N 3.01Å; Y266-V269 PolarHBondContact O-N 2.81Å; V269-S272 WeakPolarHBondContact O-CB 3.19Å; V269-S272 PolarHBondContact O-N 3.33Å; V269-L273 HydrophobicContact CG1-CD1 3.86Å; V269-L273 HydrophobicContact CG1-CG 4.29Å; V269-L273 WeakPolarHBondContact O-CB 2.97Å; V269-L273 VanDerWaalsContact O-CG 3.31Å; V269-L273 WeakPolarHBondContact O-CG 2.89Å; V269-L273 PolarHBondContact O-N 2.8Å
270F81.7Confident79.7Confident124 Ų12460.9 Ų60.954%0.54428%0.282SS..Hα-helixtrans-58.9-48.5175177.7-100.1000111.4Y266 L267 L268 S272 L273 T274Y266-F270 WeakPolarHBondContact O-CB 3.47Å; Y266-F270 PolarHBondContact O-N 2.81Å; L267-F270 WeakPolarHBondContact O-CB 3.46Å; L267-F270 PolarHBondContact O-N 2.81Å; L268-F270 VanDerWaalsContact C-N 3.34Å; F270-S272 VanDerWaalsContact C-N 3.29Å; F270-S272 PolarHBondContact O-N 3.4Å; F270-L273 PolarHBondContact O-N 3.43Å; F270-T274 HydrophobicContact CD1-CG2 4.42Å; F270-T274 HydrophobicContact CE1-CG2 4.04Å; F270-T274 HydrophobicContact CE2-CG2 4.18Å; F270-T274 HydrophobicContact CZ-CG2 3.92Å; F270-T274 WeakPolarHBondContact O-CG2 3.09Å; F270-T274 PolarHBondContact O-N 3.17Å; F270-T274 PolarHBondContact O-OG1 3.41Å
271I78.3Confident80.1Confident14 Ų1467.9 Ų67.97%0.07230%0.304CS..Hα-helixtrans-58-44174.9-67.2163000111.3I184 L267 L268 L273 T274 Q275I184-I271 HydrophobicContact CB-CD1 4.32Å; I184-I271 HydrophobicContact CD1-CD1 3.64Å; I184-I271 HydrophobicContact CD1-CG1 4.01Å; I184-I271 HydrophobicContact CD1-CG2 4.3Å; I184-I271 HydrophobicContact CG1-CD1 3.58Å; I184-I271 HydrophobicContact CG1-CG1 3.9Å; I184-I271 HydrophobicContact CG2-CD1 3.77Å; L267-I271 HydrophobicContact CD2-CD1 3.42Å; L267-I271 VanDerWaalsContact CD2-CD1 3.42Å; L267-I271 HydrophobicContact CD2-CG1 4.43Å; L267-I271 HydrophobicContact CG-CD1 4.41Å; L267-I271 WeakPolarHBondContact O-CG1 3.22Å; L267-I271 PolarHBondContact O-N 2.89Å; L268-I271 HydrophobicContact CD2-CD1 4.15Å; L268-I271 PolarHBondContact O-N 3.44Å; I271-L273 VanDerWaalsContact C-N 3.29Å; I271-L273 PolarHBondContact O-N 2.81Å; I271-T274 WeakPolarHBondContact CA-OG1 3.35Å; I271-T274 PolarHBondContact O-N 2.79Å; I271-T274 PolarHBondContact O-OG1 3.46Å; I271-Q275 VanDerWaalsContact O-CG 3.3Å; I271-Q275 WeakPolarHBondContact O-CG 3.19Å; I271-Q275 PolarHBondContact O-N 3.37Å; I271-Q275 PolarHBondContact O-NE2 3.45Å
272S80.2Confident80.1Confident4 Ų463.6 Ų63.63%0.02829%0.289CS..Hα-helixtrans-63.8-36.2-179.4-172.90000112.2S240 L268 V269 F270S240-S272 PolarHBondContact O-OG 3.17Å; S240-S272 PolarHBondContact OG-O 3.24Å; L268-S272 VanDerWaalsContact O-CB 3.29Å; L268-S272 WeakPolarHBondContact O-CB 3.26Å; L268-S272 PolarHBondContact O-N 2.69Å; V269-S272 WeakPolarHBondContact O-CB 3.19Å; V269-S272 PolarHBondContact O-N 3.33Å; F270-S272 VanDerWaalsContact C-N 3.29Å; F270-S272 PolarHBondContact O-N 3.4Å
273L83Confident79.8Confident117 Ų11758 Ų5861%0.61326%0.264SS*.Hα-helixtrans-79.5-24.7178.8-70.5174.6000112.8V269 F270 I271 Q275 P276V269-L273 HydrophobicContact CG1-CD1 3.86Å; V269-L273 HydrophobicContact CG1-CG 4.29Å; V269-L273 WeakPolarHBondContact O-CB 2.97Å; V269-L273 VanDerWaalsContact O-CG 3.31Å; V269-L273 WeakPolarHBondContact O-CG 2.89Å; V269-L273 PolarHBondContact O-N 2.8Å; F270-L273 PolarHBondContact O-N 3.43Å; I271-L273 VanDerWaalsContact C-N 3.29Å; I271-L273 PolarHBondContact O-N 2.81Å; L273-Q275 VanDerWaalsContact C-N 3.32Å; L273-P276 WeakPolarHBondContact O-CD 3.37Å
274T82.5Confident79.6Confident33 Ų3354.1 Ų54.120%0.20226%0.255CS..Hα-helixtrans-77.6-18.8173.757.20000112.5F270 I271 L277 I278F270-T274 HydrophobicContact CD1-CG2 4.42Å; F270-T274 HydrophobicContact CE1-CG2 4.04Å; F270-T274 HydrophobicContact CE2-CG2 4.18Å; F270-T274 HydrophobicContact CZ-CG2 3.92Å; F270-T274 WeakPolarHBondContact O-CG2 3.09Å; F270-T274 PolarHBondContact O-N 3.17Å; F270-T274 PolarHBondContact O-OG1 3.41Å; I271-T274 WeakPolarHBondContact CA-OG1 3.35Å; I271-T274 PolarHBondContact O-N 2.79Å; I271-T274 PolarHBondContact O-OG1 3.46Å; T274-L277 WeakPolarHBondContact O-CB 3.41Å; T274-L277 PolarHBondContact O-N 2.82Å; T274-L277 VanDerWaalsContact O-N 3.13Å; T274-I278 WeakPolarHBondContact O-CG1 3.23Å; T274-I278 PolarHBondContact O-N 2.84Å
275Q85.5Confident79.2Confident3 Ų355.3 Ų55.31%0.01427%0.265CS..Hα-helixtrans-57.2-46.9-178.4-64.8-52.8-67.400114.4L243 I271 L273 L277 I278 M279L243-Q275 HydrophobicContact CD1-CG 3.55Å; I271-Q275 VanDerWaalsContact O-CG 3.3Å; I271-Q275 WeakPolarHBondContact O-CG 3.19Å; I271-Q275 PolarHBondContact O-N 3.37Å; I271-Q275 PolarHBondContact O-NE2 3.45Å; L273-Q275 VanDerWaalsContact C-N 3.32Å; Q275-L277 VanDerWaalsContact C-N 3.27Å; Q275-L277 PolarHBondContact O-N 3.45Å; Q275-I278 PolarHBondContact O-N 2.89Å; Q275-M279 WeakPolarHBondContact O-CB 3.4Å; Q275-M279 WeakPolarHBondContact O-CG 3.21Å; Q275-M279 PolarHBondContact O-N 2.89Å
276P84.1Confident78.6Confident31 Ų3154.2 Ų54.220%0.20126%0.259CS..Hα-helixtrans-60-38.2176.1-26.437.2000112.9S240 L273 M279 W280S240-P276 WeakPolarHBondContact OG-CD 3.04Å; S240-P276 WeakPolarHBondContact OG-CG 3.3Å; L273-P276 WeakPolarHBondContact O-CD 3.37Å; P276-M279 PolarHBondContact O-N 3.37Å; P276-W280 VanDerWaalsContact O-CB 3.23Å; P276-W280 WeakPolarHBondContact O-CB 3.45Å; P276-W280 PolarHBondContact O-N 3.41Å
277L83.3Confident77.6Confident122 Ų12248.6 Ų48.664%0.63924%0.24SC*.Hα-helixtrans-64.2-43.6177.5-61.8175.2000110.6T274 Q275 W280 W281T274-L277 WeakPolarHBondContact O-CB 3.41Å; T274-L277 PolarHBondContact O-N 2.82Å; T274-L277 VanDerWaalsContact O-N 3.13Å; Q275-L277 VanDerWaalsContact C-N 3.27Å; Q275-L277 PolarHBondContact O-N 3.45Å; L277-W280 PolarHBondContact O-N 2.86Å; L277-W281 VanDerWaalsContact O-CB 3.27Å; L277-W281 WeakPolarHBondContact O-CB 3.17Å; L277-W281 PolarHBondContact O-N 3.45Å
278I82.4Confident76.5Confident32 Ų3251.1 Ų51.116%0.16426%0.255CS..Hα-helixtrans-69.4-41.1179-62.6170.7000111E180 T274 Q275 W281 L282E180-I278 HydrophobicContact CG-CD1 4.25Å; E180-I278 WeakPolarHBondContact OE1-CD1 3.42Å; T274-I278 WeakPolarHBondContact O-CG1 3.23Å; T274-I278 PolarHBondContact O-N 2.84Å; Q275-I278 PolarHBondContact O-N 2.89Å; I278-W281 PolarHBondContact O-N 2.8Å; I278-L282 VanDerWaalsContact O-CB 3.27Å; I278-L282 WeakPolarHBondContact O-CB 3.19Å; I278-L282 PolarHBondContact O-N 2.89Å
279M80.8Confident75.4Confident2 Ų256.4 Ų56.41%0.0128%0.284CS..Hα-helixtrans-60.1-47.3174-77.9-173.9163.100111.7K209 M213 I239 Q275 P276 W281 T283K209-M279 HydrophobicContact CB-CE 3.41Å; K209-M279 VanDerWaalsContact CB-CE 3.41Å; K209-M279 HydrophobicContact CB-CG 4.39Å; K209-M279 WeakPolarHBondContact O-CE 3.38Å; M213-M279 HydrophobicContact CG-CE 4.3Å; M213-M279 HydrophobicContact CG-CG 4.34Å; M213-M279 HydrophobicContact SD-CG 4.34Å; I239-M279 HydrophobicContact CB-CE 3.98Å; I239-M279 HydrophobicContact CG1-CE 3.69Å; I239-M279 HydrophobicContact CG2-CE 4.05Å; Q275-M279 WeakPolarHBondContact O-CB 3.4Å; Q275-M279 WeakPolarHBondContact O-CG 3.21Å; Q275-M279 PolarHBondContact O-N 2.89Å; P276-M279 PolarHBondContact O-N 3.37Å; M279-W281 VanDerWaalsContact C-N 3.34Å; M279-T283 WeakPolarHBondContact O-CB 3.21Å; M279-T283 PolarHBondContact O-N 3.44Å; M279-T283 PolarHBondContact O-OG1 2.85Å
280W80.4Confident73.9Confident139 Ų13955.5 Ų55.553%0.52728%0.278SS..Hα-helixtrans-62.5-42.3177.2-178.4-94.2000111.1F229 L232 P276 L277 S284F229-W280 HydrophobicContact CD1-CZ3 4.44Å; L232-W280 HydrophobicContact CD2-CE3 3.94Å; L232-W280 HydrophobicContact CD2-CZ3 4.48Å; P276-W280 VanDerWaalsContact O-CB 3.23Å; P276-W280 WeakPolarHBondContact O-CB 3.45Å; P276-W280 PolarHBondContact O-N 3.41Å; L277-W280 PolarHBondContact O-N 2.86Å; W280-S284 WeakPolarHBondContact O-CA 3.28Å; W280-S284 WeakPolarHBondContact O-CB 3.16Å; W280-S284 PolarHBondContact O-N 3.49Å; W280-S284 PolarHBondContact O-OG 2.78Å
281W79.4Confident72.2Confident162 Ų16252.4 Ų52.461%0.61428%0.275SS*.Hα-helixtrans-66.5-50.7178.4-171.3-84.6000112.6W176 L277 I278 M279 T283 S284 S285W176-W281 AromaticContact CZ2-CD1 3.89Å; W176-W281 AromaticContact CZ2-NE1 3.95Å; L277-W281 VanDerWaalsContact O-CB 3.27Å; L277-W281 WeakPolarHBondContact O-CB 3.17Å; L277-W281 PolarHBondContact O-N 3.45Å; I278-W281 PolarHBondContact O-N 2.8Å; M279-W281 VanDerWaalsContact C-N 3.34Å; W281-T283 VanDerWaalsContact C-N 3.3Å; W281-T283 PolarHBondContact O-N 3.36Å; W281-S284 WeakPolarHBondContact CA-OG 3.43Å; W281-S284 PolarHBondContact O-N 3.14Å; W281-S284 PolarHBondContact O-OG 2.93Å; W281-S285 WeakPolarHBondContact O-CB 3.29Å; W281-S285 PolarHBondContact O-N 3.15Å
282L73.3Confident70.7Confident7 Ų760 Ų604%0.03731%0.308CS..Hα-helixtrans-63.1-41.9179.9-168.4143.8000110.5Y147 W176 M213 I278 S285 L286Y147-L282 HydrophobicContact CE1-CD2 4.17Å; Y147-L282 VanDerWaalsContact OH-CD2 3.31Å; Y147-L282 WeakPolarHBondContact OH-CD2 3.46Å; W176-L282 HydrophobicContact CG-CD1 4.34Å; M213-L282 HydrophobicContact CE-CD2 4.44Å; M213-L282 HydrophobicContact SD-CD2 4Å; I278-L282 VanDerWaalsContact O-CB 3.27Å; I278-L282 WeakPolarHBondContact O-CB 3.19Å; I278-L282 PolarHBondContact O-N 2.89Å; L282-S285 PolarHBondContact O-N 3.48Å; L282-S285 PolarHBondContact O-OG 3.01Å; L282-L286 PolarHBondContact O-N 3.31Å
283T71.9Confident69.3Low3 Ų369.6 Ų69.62%0.01834%0.343CS..Hα-helixtrans-64.3-51.6174.1-68.40000112.7Y228 L232 M279 W281 S285 L286 M287Y228-T283 HydrophobicContact CE1-CG2 3.61Å; Y228-T283 WeakPolarHBondContact OH-CG2 3.37Å; L232-T283 HydrophobicContact CD1-CG2 3.28Å; L232-T283 VanDerWaalsContact CD1-OG1 3.27Å; L232-T283 WeakPolarHBondContact CD1-OG1 3.38Å; M279-T283 WeakPolarHBondContact O-CB 3.21Å; M279-T283 PolarHBondContact O-N 3.44Å; M279-T283 PolarHBondContact O-OG1 2.85Å; W281-T283 VanDerWaalsContact C-N 3.3Å; W281-T283 PolarHBondContact O-N 3.36Å; T283-S285 PolarHBondContact O-N 3.44Å; T283-L286 WeakPolarHBondContact O-CA 3.48Å; T283-L286 WeakPolarHBondContact O-CB 3.28Å; T283-L286 PolarHBondContact O-N 3.17Å; T283-M287 PolarHBondContact O-N 3.46Å
284S71.5Confident67.8Low36 Ų3669.5 Ų69.525%0.25234%0.338SS..Hα-helixtrans-60.8-34.1-17957.60000110W280 W281 T288W280-S284 WeakPolarHBondContact O-CA 3.28Å; W280-S284 WeakPolarHBondContact O-CB 3.16Å; W280-S284 PolarHBondContact O-N 3.49Å; W280-S284 PolarHBondContact O-OG 2.78Å; W281-S284 WeakPolarHBondContact CA-OG 3.43Å; W281-S284 PolarHBondContact O-N 3.14Å; W281-S284 PolarHBondContact O-OG 2.93Å; S284-T288 WeakPolarHBondContact O-CA 3.38Å; S284-T288 WeakPolarHBondContact O-CB 3.47Å; S284-T288 PolarHBondContact O-N 3.48Å; S284-T288 PolarHBondContact O-OG1 3.08Å
285S66.6Low65.9Low36 Ų3673.5 Ų73.525%0.25237%0.365SS..Hα-helixtrans-64.2-42.7171.482.40000112.2W281 L282 T283 N289W281-S285 WeakPolarHBondContact O-CB 3.29Å; W281-S285 PolarHBondContact O-N 3.15Å; L282-S285 PolarHBondContact O-N 3.48Å; L282-S285 PolarHBondContact O-OG 3.01Å; T283-S285 PolarHBondContact O-N 3.44Å; S285-N289 VanDerWaalsContact O-CB 3.24Å; S285-N289 WeakPolarHBondContact O-CB 3.44Å; S285-N289 VanDerWaalsContact O-CG 3.28Å; S285-N289 PolarHBondContact O-N 3.43Å; S285-N289 PolarHBondContact O-ND2 3.37Å
286L65.5Low64.1Low40 Ų4077.2 Ų77.221%0.20940%0.396CS..Hα-helixtrans-62.4-49.3176.5-174.660.1000110.8L169 L282 T283 N289 V290L169-L286 HydrophobicContact CD1-CD1 3.79Å; L169-L286 HydrophobicContact CD1-CD2 4.39Å; L282-L286 PolarHBondContact O-N 3.31Å; T283-L286 WeakPolarHBondContact O-CA 3.48Å; T283-L286 WeakPolarHBondContact O-CB 3.28Å; T283-L286 PolarHBondContact O-N 3.17Å; L286-N289 PolarHBondContact O-N 3.42Å; L286-V290 WeakPolarHBondContact O-CB 3.41Å; L286-V290 WeakPolarHBondContact O-CG2 3.44Å; L286-V290 PolarHBondContact O-N 3.42Å
287M61.9Low62.3Low49 Ų4981 Ų8124%0.24141%0.414CS..Hα-helixtrans-69.7-36.5-179-154.769.9-179.800112.4Y220 T283 V290 A291Y220-M287 HydrophobicContact CE2-CE 4.27Å; T283-M287 PolarHBondContact O-N 3.46Å; M287-V290 CarbonylContact O-C 3.53Å; M287-V290 WeakPolarHBondContact O-CB 3.26Å; M287-V290 PolarHBondContact O-N 2.94Å; M287-A291 WeakPolarHBondContact O-CB 3.12Å; M287-A291 PolarHBondContact O-N 3.39Å
288T56.4Low61Low56 Ų5680.4 Ų80.434%0.34442%0.418SS..Hα-helixtrans-70.9-38.3176.7-59.60000111.2S284 V290 A291 K292S284-T288 WeakPolarHBondContact O-CA 3.38Å; S284-T288 WeakPolarHBondContact O-CB 3.47Å; S284-T288 PolarHBondContact O-N 3.48Å; S284-T288 PolarHBondContact O-OG1 3.08Å; T288-V290 VanDerWaalsContact C-N 3.26Å; T288-V290 PolarHBondContact O-N 3.42Å; T288-A291 PolarHBondContact O-N 3.14Å; T288-K292 HydrophobicContact CG2-CD 3.63Å; T288-K292 VanDerWaalsContact CG2-CE 3.42Å; T288-K292 HydrophobicContact CG2-CG 3.8Å; T288-K292 VanDerWaalsContact O-CB 3.31Å; T288-K292 WeakPolarHBondContact O-CB 3.32Å; T288-K292 WeakPolarHBondContact O-CG 3.41Å; T288-K292 PolarHBondContact O-N 3.21Å
289N52.9Low59.6Low121 Ų12183 Ų8365%0.64744%0.436SS*.Hα-helixtrans-67.7-29.5171.5-76.6-59.2000111.6S285 L286S285-N289 VanDerWaalsContact O-CB 3.24Å; S285-N289 WeakPolarHBondContact O-CB 3.44Å; S285-N289 VanDerWaalsContact O-CG 3.28Å; S285-N289 PolarHBondContact O-N 3.43Å; S285-N289 PolarHBondContact O-ND2 3.37Å; L286-N289 PolarHBondContact O-N 3.42Å
290V50.4Low58.2Low34 Ų3490 Ų9021%0.20647%0.473CS..Hα-helixtrans-69.2-37.5170.3168.30000111.6R160 L286 M287 T288R160-V290 PolarHBondContact NH1-O 2.96Å; L286-V290 WeakPolarHBondContact O-CB 3.41Å; L286-V290 WeakPolarHBondContact O-CG2 3.44Å; L286-V290 PolarHBondContact O-N 3.42Å; M287-V290 CarbonylContact O-C 3.53Å; M287-V290 WeakPolarHBondContact O-CB 3.26Å; M287-V290 PolarHBondContact O-N 2.94Å; T288-V290 VanDerWaalsContact C-N 3.26Å; T288-V290 PolarHBondContact O-N 3.42Å
291A45.1Very low56.6Low60 Ų6090.7 Ų90.750%0.49649%0.487SS..Hα-helixtrans-82-46.9-178.700000114M287 T288 R293 F294M287-A291 WeakPolarHBondContact O-CB 3.12Å; M287-A291 PolarHBondContact O-N 3.39Å; T288-A291 PolarHBondContact O-N 3.14Å; A291-R293 PolarHBondContact O-N 3.41Å; A291-R293 VanDerWaalsContact O-N 3.1Å; A291-F294 PolarHBondContact O-N 2.69Å; A291-F294 VanDerWaalsContact O-O 3.12Å
292K47.1Very low55.1Low172 Ų17293.4 Ų93.475%0.74851%0.511SS*.THydrogen-bonded Turntrans-67.5-11.6-171.5-79.2-172.8179.6178.70115.6T288T288-K292 HydrophobicContact CG2-CD 3.63Å; T288-K292 VanDerWaalsContact CG2-CE 3.42Å; T288-K292 HydrophobicContact CG2-CG 3.8Å; T288-K292 VanDerWaalsContact O-CB 3.31Å; T288-K292 WeakPolarHBondContact O-CB 3.32Å; T288-K292 WeakPolarHBondContact O-CG 3.41Å; T288-K292 PolarHBondContact O-N 3.21Å
293R51.5Low54.2Low206 Ų20697.7 Ų97.778%0.77754%0.535SS*.THydrogen-bonded Turntrans-93.73.7173.7-143.5164.7-171.2-143.70114A291A291-R293 PolarHBondContact O-N 3.41Å; A291-R293 VanDerWaalsContact O-N 3.1Å
294F50.7Low53.2Low116 Ų116102.7 Ų102.751%0.50956%0.562SS.*SBendtrans-107.1104.2159.3-71.4-95.9000105.4A291 A296A291-F294 PolarHBondContact O-N 2.69Å; A291-F294 VanDerWaalsContact O-O 3.12Å; F294-A296 PolarHBondContact O-N 3.31Å
295P42.4Very low52.2Low116 Ų116106.4 Ų106.475%0.75358%0.579SS**  trans-52.3133.3153.924.8-29.7000106.2D297P295-D297 PolarHBondContact O-N 3.21Å
296A49.1Very low51.4Low82 Ų82110.5 Ų110.568%0.67860%0.599SS**  trans-45.8132.2169.200000107.6F294F294-A296 PolarHBondContact O-N 3.31Å
297D46.2Very low50.5Low109 Ų109114.9 Ų114.958%0.58362%0.623SS**  trans-48.7132.9171.1-172.533.5000108P295 T299P295-D297 PolarHBondContact O-N 3.21Å; D297-T299 PolarHBondContact O-N 3.14Å; D297-T299 PolarHBondContact OD2-OG1 2.98Å
298P56.2Low49.7Very low110 Ų110119.3 Ų119.371%0.71465%0.648SS**G310 helixtrans-68.718.1-173.3-16.330.6000114.6
299T52Low49.3Very low87 Ų87123.9 Ų123.953%0.53467%0.67SS.*G310 helixtrans-87.51.4-174.448.30000114.2D297 D301D297-T299 PolarHBondContact O-N 3.14Å; D297-T299 PolarHBondContact OD2-OG1 2.98Å; T299-D301 VanDerWaalsContact C-N 3.3Å
300D52.4Low49Very low148 Ų148124.1 Ų124.179%0.79167%0.672SS**G310 helixtrans-83.62.3171.2-76.9-24.4000114.1
301D46.2Very low48.9Very low155 Ų155131.6 Ų131.683%0.82971%0.711SS**  trans-108.343.7172.5-73.1-34.9000112.9T299T299-D301 VanDerWaalsContact C-N 3.3Å
302I47.5Very low49.2Very low218 Ų218138.1 Ų138.1100%1.11873%0.73SS**  trans-123.30163.4-53.6-178.7000110.6

Retrieved 302 of 302 residues in 81.1 ms (Link to these results)