A0A087YCT0_POEFO Loading...

Solute carrier family 8 member B1

AlphaFold DB , UniProt , Accession A0A087YCT0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 587 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M32.2Very low33.4Very low211 Ų211101.5 Ų101.5100%1.03959%0.591SS**  0155.30-93.3160.85700110.2Y518M1-Y518 HydrophobicContact CE-CE1 4.4Å; M1-Y518 HydrophobicContact SD-CD1 4.44Å; M1-Y518 HydrophobicContact SD-CE1 3.76Å
2S30.4Very low33.4Very low91 Ų91100.1 Ų100.164%0.63660%0.6SS**  trans-83.9167.9-145.373.50000117.3S4 G5S2-S4 PolarHBondContact O-N 3.01Å; S2-G5 PolarHBondContact O-N 3.03Å; S2-G5 VanDerWaalsContact O-N 3.08Å
3V30.4Very low33.5Very low112 Ų112100.6 Ų100.668%0.67960%0.597SS**THydrogen-bonded Turntrans-14.7-28.9157.8179.60000117.6G5 F6 L7V3-G5 VanDerWaalsContact C-N 3.33Å; V3-G5 PolarHBondContact O-N 2.04Å; V3-F6 PolarHBondContact O-N 3.48Å; V3-L7 HydrophobicContact CG1-CD1 4.45Å; V3-L7 PolarHBondContact O-N 2.94Å
4S27.9Very low33.4Very low84 Ų84102.4 Ų102.459%0.58760%0.601SS**Hα-helixtrans-52.5-42.7171.41720000113.8S2 F6 L7 A8S2-S4 PolarHBondContact O-N 3.01Å; S4-F6 PolarHBondContact O-N 3.23Å; S4-L7 PolarHBondContact O-N 2.74Å; S4-A8 VanDerWaalsContact O-CB 3.28Å; S4-A8 WeakPolarHBondContact O-CB 3.4Å; S4-A8 PolarHBondContact O-N 3.26Å
5G32.6Very low33.2Very low46 Ų46103.6 Ų103.647%0.47461%0.613SS.*Hα-helixtrans-67.6-37.4-176.600000113.6S2 V3 L9S2-G5 PolarHBondContact O-N 3.03Å; S2-G5 VanDerWaalsContact O-N 3.08Å; V3-G5 VanDerWaalsContact C-N 3.33Å; V3-G5 PolarHBondContact O-N 2.04Å; G5-L9 PolarHBondContact O-N 3.11Å; G5-L9 VanDerWaalsContact O-N 3.09Å
6F40.1Very low33Very low101 Ų101104.8 Ų104.844%0.44363%0.628SS.*Hα-helixtrans-74.3-38.6179-167.8-102.8000111.6V3 S4 L9 L10 F380V3-F6 PolarHBondContact O-N 3.48Å; S4-F6 PolarHBondContact O-N 3.23Å; F6-L9 PolarHBondContact O-N 2.93Å; F6-L10 HydrophobicContact CD1-CD1 3.68Å; F6-L10 HydrophobicContact CE1-CD1 3.32Å; F6-L10 HydrophobicContact CG-CD1 4.46Å; F6-L10 HydrophobicContact CZ-CD1 3.84Å; F6-L10 PolarHBondContact O-N 3.13Å; F6-F380 HydrophobicContact CE2-CE1 4.18Å; F6-F380 HydrophobicContact CE2-CZ 4.07Å
7L34.7Very low32.7Very low99 Ų99103.3 Ų103.352%0.51864%0.64SS.*Hα-helixtrans-65.9-38.8172.5-118.389.8000111.9V3 S4 L9 L10 L11V3-L7 HydrophobicContact CG1-CD1 4.45Å; V3-L7 PolarHBondContact O-N 2.94Å; S4-L7 PolarHBondContact O-N 2.74Å; L7-L9 VanDerWaalsContact C-N 3.35Å; L7-L10 PolarHBondContact O-N 3.39Å; L7-L11 HydrophobicContact CD2-CD1 4.36Å; L7-L11 VanDerWaalsContact O-CB 3.24Å; L7-L11 WeakPolarHBondContact O-CB 2.98Å; L7-L11 WeakPolarHBondContact O-CD1 3.05Å; L7-L11 VanDerWaalsContact O-CG 3.24Å; L7-L11 WeakPolarHBondContact O-CG 3.49Å; L7-L11 PolarHBondContact O-N 3.11Å
8A31.3Very low32.6Very low57 Ų57107.7 Ų107.747%0.47165%0.652SS.*Hα-helixtrans-65.2-37.2176.900000112.2S4 L11 A12S4-A8 VanDerWaalsContact O-CB 3.28Å; S4-A8 WeakPolarHBondContact O-CB 3.4Å; S4-A8 PolarHBondContact O-N 3.26Å; A8-L11 PolarHBondContact O-N 3.15Å; A8-A12 VanDerWaalsContact O-CB 3.26Å; A8-A12 WeakPolarHBondContact O-CB 3.38Å; A8-A12 PolarHBondContact O-N 3.42Å
9L38.3Very low32.2Very low109 Ų109111.3 Ų111.357%0.57167%0.666SS**Hα-helixtrans-70.7-38.9175.8-142.789.4000112.1G5 F6 L7G5-L9 PolarHBondContact O-N 3.11Å; G5-L9 VanDerWaalsContact O-N 3.09Å; F6-L9 PolarHBondContact O-N 2.93Å; L7-L9 VanDerWaalsContact C-N 3.35Å
10L36.3Very low31.8Very low99 Ų99113.7 Ų113.752%0.51867%0.674SS.*Hα-helixtrans-67.8-35.8173.5-106.6129.3000112.6F6 L7F6-L10 HydrophobicContact CD1-CD1 3.68Å; F6-L10 HydrophobicContact CE1-CD1 3.32Å; F6-L10 HydrophobicContact CG-CD1 4.46Å; F6-L10 HydrophobicContact CZ-CD1 3.84Å; F6-L10 PolarHBondContact O-N 3.13Å; L7-L10 PolarHBondContact O-N 3.39Å
11L32.9Very low31.5Very low108 Ų108113.2 Ų113.257%0.56568%0.683SS**Hα-helixtrans-76.4-29.4176.8-76.5162.3000112.6L7 A8 L13 L14L7-L11 HydrophobicContact CD2-CD1 4.36Å; L7-L11 VanDerWaalsContact O-CB 3.24Å; L7-L11 WeakPolarHBondContact O-CB 2.98Å; L7-L11 WeakPolarHBondContact O-CD1 3.05Å; L7-L11 VanDerWaalsContact O-CG 3.24Å; L7-L11 WeakPolarHBondContact O-CG 3.49Å; L7-L11 PolarHBondContact O-N 3.11Å; A8-L11 PolarHBondContact O-N 3.15Å; L11-L13 PolarHBondContact O-N 2.94Å; L11-L14 PolarHBondContact O-N 2.95Å
12A34Very low31.1Very low84 Ų84108.8 Ų108.869%0.69467%0.673SS**THydrogen-bonded Turntrans-68.3-14.3174.900000113.7A8A8-A12 VanDerWaalsContact O-CB 3.26Å; A8-A12 WeakPolarHBondContact O-CB 3.38Å; A8-A12 PolarHBondContact O-N 3.42Å
13L34.4Very low30.8Very low107 Ų107108 Ų10856%0.5668%0.68SS**THydrogen-bonded Turntrans-89.6-2.1177.8-71.5162.4000113.7L11 F429L11-L13 PolarHBondContact O-N 2.94Å; L13-F429 HydrophobicContact CD1-CZ 4.2Å
14L31.8Very low30.4Very low125 Ų125109.6 Ų109.665%0.65469%0.689SS**SBendtrans-100121.4174.7-77.4160.3000110.3L11 S16L11-L14 PolarHBondContact O-N 2.95Å; L14-S16 PolarHBondContact O-N 2.64Å; L14-S16 VanDerWaalsContact O-N 3.13Å
15P30.9Very low30.2Very low121 Ų121109.1 Ų109.179%0.78670%0.698SS**  trans-79100.6171.430.4-27.2000108.1
16S30Very low29.7Very low122 Ų122114.7 Ų114.785%0.85372%0.717SS**  trans160.6130.6142.5-72.10000112.6L14L14-S16 PolarHBondContact O-N 2.64Å; L14-S16 VanDerWaalsContact O-N 3.13Å
17G27.4Very low28.9Very low80 Ų80119.6 Ų119.683%0.82574%0.739SS**  trans100.8109.7144.500000117.3
18Q31.8Very low28.3Very low183 Ų183119.7 Ų119.786%0.85575%0.747SS**  trans-52.3144.5167-63.8171.9-31.400112.6
19L24.3Very low27.8Very low176 Ų176123.1 Ų123.192%0.92176%0.763SS**  trans-154.4125.5137.1-134.285.2000111.1
20L25.5Very low27.1Very low159 Ų159126.4 Ų126.483%0.83278%0.775SS**  trans-66.9150.2170.7-79.297000111.4
21A25.2Very low26.8Very low104 Ų104127.3 Ų127.386%0.8679%0.787SS**  trans-150.1110.5141.400000111.1
22S22.1Very low26.3Very low117 Ų117125.5 Ų125.582%0.81879%0.794SS**  trans-69.9148.1163.5-178.20000110.2
23G24.4Very low25.7Very low76 Ų76129 Ų12978%0.78481%0.806SS**  trans-176.477.7176.800000113.3
24T23.3Very low25.1Very low144 Ų144126.9 Ų126.988%0.88381%0.811SS**  trans-62.4135.5166.2450000111.8
25G23.9Very low24.7Very low75 Ų75129.4 Ų129.477%0.77382%0.824SS**  trans-162.296.5169.700000112.1
26N21.9Very low24.3Very low162 Ų162128.6 Ų128.687%0.86683%0.827SS**  trans-57137.9163.7-87.1-13.7000110.3
27F22.3Very low23.9Very low205 Ų205126.2 Ų126.290%0.89982%0.822SS**  trans-150.9143.3143.9-128.3-89.3000112.9
28S22.3Very low23.8Very low101 Ų101128.4 Ų128.471%0.70682%0.822SS**  trans-81.5163.6-158.9-34.60000114.7
29T21.3Very low23.4Very low129 Ų129126.7 Ų126.779%0.79182%0.824SS**  trans-66.7159.7176.441.80000116.2
30E22.8Very low23.4Very low178 Ų178123.4 Ų123.483%0.83282%0.816SS**  trans107.6152.1150-68-129133.900119.2
31P30.3Very low23.5Very low117 Ų117121.9 Ų121.976%0.7681%0.808SS**  -131.1170.5-94.724.22.1000114.5
32G21.4Very low23.7Very low70 Ų70119.4 Ų119.472%0.72279%0.787SS**  trans149.998.7159.400000119.7
33V21.9Very low24Very low157 Ų157120.4 Ų120.495%0.95278%0.781SS**  trans55.6117.9135.8-1690000121.4
34G21.5Very low24.2Very low63 Ų63122.4 Ų122.465%0.64977%0.771SS**  trans140.286.5135.400000120.5
35L23.8Very low24.3Very low179 Ų179118 Ų11894%0.93775%0.746SS**  trans5898.4147.5-79.883.5000121.8
36A22.4Very low24.5Very low103 Ų103123.4 Ų123.485%0.85175%0.751SS**  -166.2127.5128.900000108.3
37G22.3Very low24.8Very low72 Ų72119 Ų11974%0.74273%0.733SS**  trans-69.5153.2-157.500000116.7
38P25Very low25.5Very low127 Ų127113.7 Ų113.783%0.82572%0.721SS**  trans-75.9134.8175.230.6-31.4000111.2S40P38-S40 PolarHBondContact O-N 3.29Å
39T24.2Very low26.7Very low147 Ų147112.2 Ų112.290%0.90271%0.706SS**  trans-56109.7169.138.30000111
40S23.1Very low28.9Very low106 Ų106109.7 Ų109.774%0.74169%0.685SS**  trans-84.2105.5173.554.10000110.2P38P38-S40 PolarHBondContact O-N 3.29Å
41L28.8Very low31.4Very low128 Ų128101.4 Ų101.467%0.6765%0.647SS**  trans-76.3120.1159.1-142.791.9000106.3M43 E75L41-M43 PolarHBondContact O-N 3.47Å; L41-E75 WeakPolarHBondContact CD1-OE2 3.06Å
42A28.3Very low33.4Very low52 Ų5297.4 Ų97.443%0.4362%0.619SS.*  trans-67.5105.2-169.200000112.1P70A42-P70 HydrophobicContact CB-CB 4.25Å
43M27.8Very low36.1Very low138 Ų13899.4 Ų99.468%0.6860%0.604SS**  17109.8128.1-79.5172.4152.400116.6L41 S45L41-M43 PolarHBondContact O-N 3.47Å; M43-S45 PolarHBondContact O-N 2.86Å
44M29.9Very low39Very low117 Ų11791.9 Ų91.958%0.57656%0.559SS**  trans-84.266.3136.5-75.4-176.567.600107.9T164 L167M44-T164 HydrophobicContact CB-CG2 3.83Å; M44-T164 HydrophobicContact CE-CG2 4.47Å; M44-T164 HydrophobicContact CG-CG2 4.13Å; M44-T164 HydrophobicContact SD-CG2 3.58Å; M44-T164 VanDerWaalsContact SD-CG2 3.58Å; M44-L167 HydrophobicContact CE-CD2 3.92Å; M44-L167 HydrophobicContact SD-CD2 4.49Å
45S24.3Very low42Very low51 Ų5191.1 Ų91.136%0.35754%0.539SS..  trans-100.1120.4172.2175.50000107.3M43 S47M43-S45 PolarHBondContact O-N 2.86Å; S45-S47 PolarHBondContact O-N 3.28Å; S45-S47 PolarHBondContact O-OG 3.04Å
46E29.4Very low44.8Very low190 Ų19089.2 Ų89.289%0.88853%0.53SS*.  trans-45.5104.6167-89-169.9133.600110.2
47S27.9Very low47.8Very low68 Ų6888.9 Ų88.948%0.47651%0.507SS..  trans-144.970.6167.258.70000109.2S45 D49S45-S47 PolarHBondContact O-N 3.28Å; S45-S47 PolarHBondContact O-OG 3.04Å; S47-D49 PolarHBondContact O-N 3.49Å
48S36.3Very low50.8Low95 Ų9588.3 Ų88.366%0.66449%0.492SS*.SBendtrans52.3-9.9161530000121.3R53S48-R53 PolarHBondContact O-NH1 2.77Å
49D47.4Very low53.4Low70 Ų7084.7 Ų84.737%0.37447%0.473SS..  trans-125.764.1-169.3-68.5-21.3000110.8S47 T69S47-D49 PolarHBondContact O-N 3.49Å; D49-T69 HydrophobicContact CB-CG2 4.26Å; D49-T69 WeakPolarHBondContact O-CG2 3.05Å
50Q68.2Low56.1Low75 Ų7581.5 Ų81.535%0.3546%0.461SS..  trans-66.5138.7175.8-64.7168.9-37.100111.2D52 R53Q50-D52 VanDerWaalsContact C-OD1 3.3Å; Q50-D52 WeakPolarHBondContact CB-OD1 3.46Å; Q50-D52 PolarHBondContact O-N 3.32Å; Q50-R53 PolarHBondContact O-N 3.29Å
51C75Confident59.1Low5 Ų581.4 Ų81.43%0.03445%0.449CS..G310 helixtrans-67.7-19.4-177.5-164.40000113.9R53 V54 D71 C72 V455C51-R53 PolarHBondContact O-N 2.85Å; C51-V54 WeakPolarHBondContact O-CG2 3.45Å; C51-V54 PolarHBondContact O-N 3.46Å; C51-D71 HydrophobicContact CB-CB 4.35Å; C51-C72 VanDerWaalsContact CA-SG 3.58Å; C51-C72 HydrophobicContact CB-CB 4.13Å; C51-C72 WeakPolarHBondContact CB-SG 3.27Å; C51-C72 WeakPolarHBondContact SG-CA 3.05Å; C51-C72 WeakPolarHBondContact SG-CB 3.28Å; C51-C72 CovalentContact SG-SG 2.04Å; C51-C72 PolarHBondContact SG-SG 2.8Å; C51-V455 WeakPolarHBondContact O-CG1 3.3Å
52D71.7Confident61.9Low33 Ų3377.7 Ų77.718%0.17643%0.426CS..G310 helixtrans-61.4-24.2172.359.3-6000113.1Q50 V54Q50-D52 VanDerWaalsContact C-OD1 3.3Å; Q50-D52 WeakPolarHBondContact CB-OD1 3.46Å; Q50-D52 PolarHBondContact O-N 3.32Å; D52-V54 VanDerWaalsContact C-N 3.28Å; D52-V54 PolarHBondContact O-N 3.15Å
53R78.5Confident64.6Low111 Ų11176.6 Ų76.642%0.41942%0.415SS..G310 helixtrans-78.5-3.4179-61.6179.9-172.7-174.5-0.4114.4S48 Q50 C51 M55 N56 Y57S48-R53 PolarHBondContact O-NH1 2.77Å; Q50-R53 PolarHBondContact O-N 3.29Å; C51-R53 PolarHBondContact O-N 2.85Å; R53-M55 PolarHBondContact O-N 3.01Å; R53-M55 VanDerWaalsContact O-N 3.09Å; R53-N56 WeakPolarHBondContact O-CB 3.48Å; R53-N56 PolarHBondContact O-N 3.32Å; R53-Y57 WeakPolarHBondContact O-CD2 3.38Å
54V83.2Confident67.4Low0 Ų073 Ų730%041%0.407CS..G310 helixtrans-51-39179.81710000111.4C51 D52 N56 Y57 R62 F65 V66 F86 V455C51-V54 WeakPolarHBondContact O-CG2 3.45Å; C51-V54 PolarHBondContact O-N 3.46Å; D52-V54 VanDerWaalsContact C-N 3.28Å; D52-V54 PolarHBondContact O-N 3.15Å; V54-N56 VanDerWaalsContact C-N 3.26Å; V54-N56 PolarHBondContact O-N 3.49Å; V54-Y57 PolarHBondContact O-N 2.95Å; V54-R62 HydrophobicContact CG1-CB 4.26Å; V54-R62 HydrophobicContact CG1-CG 4.11Å; V54-F65 HydrophobicContact CB-CD1 4.42Å; V54-F65 HydrophobicContact CG2-CD1 3.56Å; V54-F65 HydrophobicContact CG2-CE1 3.66Å; V54-V66 HydrophobicContact CG1-CG2 4.03Å; V54-V66 HydrophobicContact CG2-CG2 3.82Å; V54-F86 HydrophobicContact CG1-CD2 4.18Å; V54-F86 HydrophobicContact CG1-CE1 4.46Å; V54-F86 HydrophobicContact CG1-CE2 3.86Å; V54-F86 HydrophobicContact CG1-CZ 4Å; V54-V455 HydrophobicContact CB-CG1 4.31Å
55M83.5Confident70.1Confident47 Ų4768.5 Ų68.523%0.23239%0.385CS..G310 helixtrans-70.7-19.4-176.7-66.6-58.5-73.900113.8R53 Y57 R62 F86 V455R53-M55 PolarHBondContact O-N 3.01Å; R53-M55 VanDerWaalsContact O-N 3.09Å; M55-Y57 VanDerWaalsContact C-N 3.3Å; M55-Y57 PolarHBondContact O-N 3.27Å; M55-R62 PolarHBondContact O-NH2 2.04Å; M55-R62 VanDerWaalsContact O-NH2 3.15Å; M55-F86 HydrophobicContact SD-CE1 4.2Å; M55-F86 HydrophobicContact SD-CZ 3.99Å; M55-V455 WeakPolarHBondContact CG-O 3.37Å
56N84.6Confident73.1Confident138 Ų13866.1 Ų66.174%0.73837%0.368SS*.G310 helixtrans-75.7-16.7176.2-71.3-13.3000113.3R53 V54R53-N56 WeakPolarHBondContact O-CB 3.48Å; R53-N56 PolarHBondContact O-N 3.32Å; V54-N56 VanDerWaalsContact C-N 3.26Å; V54-N56 PolarHBondContact O-N 3.49Å
57Y84.5Confident75.7Confident96 Ų9663.8 Ų63.838%0.37636%0.355SS..SBendtrans-88155.5177.7-71.9-89.6000112.5R53 V54 M55 R62 F65R53-Y57 WeakPolarHBondContact O-CD2 3.38Å; V54-Y57 PolarHBondContact O-N 2.95Å; M55-Y57 VanDerWaalsContact C-N 3.3Å; M55-Y57 PolarHBondContact O-N 3.27Å; Y57-R62 PolarHBondContact O-NE 2.9Å; Y57-R62 PolarHBondContact O-NH2 3.24Å; Y57-F65 HydrophobicContact CD2-CD2 4.07Å; Y57-F65 HydrophobicContact CD2-CE2 4.34Å; Y57-F65 HydrophobicContact CD2-CG 4.28Å; Y57-F65 AromaticContact CE2-CD2 3.6Å; Y57-F65 HydrophobicContact CE2-CD2 3.6Å; Y57-F65 AromaticContact CE2-CE2 3.54Å; Y57-F65 HydrophobicContact CE2-CE2 3.54Å; Y57-F65 HydrophobicContact CE2-CG 4.24Å; Y57-F65 HydrophobicContact CE2-CZ 4.12Å; Y57-F65 AromaticContact CZ-CD2 3.85Å; Y57-F65 AromaticContact CZ-CE2 3.91Å
58S84.6Confident78.5Confident60 Ų6070.8 Ų70.842%0.4237%0.371SS..  trans-61.8149.3175.9750000111.3A60 E61 R62S58-A60 PolarHBondContact O-N 3.29Å; S58-E61 PolarHBondContact O-N 3.35Å; S58-E61 WeakPolarHBondContact OG-CG 3.29Å; S58-E61 PolarHBondContact OG-OE2 3.09Å; S58-R62 WeakPolarHBondContact O-CG 3.48Å; S58-R62 PolarHBondContact O-N 2.68Å
59A80.3Confident80.6Confident51 Ų5166.5 Ų66.542%0.42134%0.341SS..THydrogen-bonded Turntrans-57.2-28.1-173.300000114.1P91A59-P91 HydrophobicContact CB-CB 3.78Å
60A81.2Confident81.9Confident80 Ų8066.3 Ų66.366%0.66134%0.343SS*.THydrogen-bonded Turntrans-75.4-28.7177.600000113.3S58S58-A60 PolarHBondContact O-N 3.29Å
61E86Confident82Confident105 Ų10565 Ų6549%0.49134%0.339SS..THydrogen-bonded Turntrans-91.6-18.9-175.6-68.5166.7155.100112.8S58 C63 A64 F65S58-E61 PolarHBondContact O-N 3.35Å; S58-E61 WeakPolarHBondContact OG-CG 3.29Å; S58-E61 PolarHBondContact OG-OE2 3.09Å; E61-C63 VanDerWaalsContact C-N 3.32Å; E61-C63 PolarHBondContact O-N 3.18Å; E61-A64 WeakPolarHBondContact O-CB 3.48Å; E61-A64 PolarHBondContact O-N 3.29Å; E61-F65 PolarHBondContact O-N 2.96Å
62R86.4Confident82Confident49 Ų4964.8 Ų64.819%0.18534%0.337CS..Hα-helixtrans-52.8-44.9-178.7-73176.6-172.5-177.4-7.4113.3V54 M55 Y57 S58 A64 F65 V66 F86V54-R62 HydrophobicContact CG1-CB 4.26Å; V54-R62 HydrophobicContact CG1-CG 4.11Å; M55-R62 PolarHBondContact O-NH2 2.04Å; M55-R62 VanDerWaalsContact O-NH2 3.15Å; Y57-R62 PolarHBondContact O-NE 2.9Å; Y57-R62 PolarHBondContact O-NH2 3.24Å; S58-R62 WeakPolarHBondContact O-CG 3.48Å; S58-R62 PolarHBondContact O-N 2.68Å; R62-A64 VanDerWaalsContact C-N 3.35Å; R62-A64 PolarHBondContact O-N 3.2Å; R62-F65 PolarHBondContact O-N 3.36Å; R62-V66 WeakPolarHBondContact O-CB 3.49Å; R62-V66 VanDerWaalsContact O-CG2 3.27Å; R62-V66 WeakPolarHBondContact O-CG2 2.99Å; R62-V66 PolarHBondContact O-N 3.27Å; R62-F86 HydrophobicContact CB-CD1 4.28Å; R62-F86 HydrophobicContact CB-CG 4.5Å
63C87Confident81.8Confident29 Ų2965.2 Ų65.220%0.19634%0.343CS..Hα-helixtrans-66-37.9178.5177.10000112.5E61 K67 F86 C87E61-C63 VanDerWaalsContact C-N 3.32Å; E61-C63 PolarHBondContact O-N 3.18Å; C63-K67 WeakPolarHBondContact O-CB 3.39Å; C63-K67 WeakPolarHBondContact O-CG 3.01Å; C63-K67 PolarHBondContact O-N 3.05Å; C63-K67 VanDerWaalsContact O-N 3.11Å; C63-F86 WeakPolarHBondContact CB-O 3.33Å; C63-C87 WeakPolarHBondContact CA-SG 3.12Å; C63-C87 HydrophobicContact CB-CB 4.08Å; C63-C87 WeakPolarHBondContact CB-SG 3.39Å; C63-C87 VanDerWaalsContact SG-CA 3.53Å; C63-C87 WeakPolarHBondContact SG-CB 3.43Å; C63-C87 CovalentContact SG-SG 2.04Å; C63-C87 PolarHBondContact SG-SG 3.44Å
64A86.1Confident81Confident63 Ų6363.2 Ų63.252%0.52134%0.339SS..Hα-helixtrans-66.9-41.4177.700000111E61 R62 K67 R68E61-A64 WeakPolarHBondContact O-CB 3.48Å; E61-A64 PolarHBondContact O-N 3.29Å; R62-A64 VanDerWaalsContact C-N 3.35Å; R62-A64 PolarHBondContact O-N 3.2Å; A64-K67 PolarHBondContact O-N 3.22Å; A64-R68 WeakPolarHBondContact O-CB 3.27Å; A64-R68 PolarHBondContact O-N 3.26Å; A64-R68 VanDerWaalsContact O-N 3.11Å
65F87.1Confident79.8Confident22 Ų2268.8 Ų68.810%0.09637%0.365CS..Hα-helixtrans-61-53.2174.5-175.2-91000111.5V54 Y57 E61 R62 K67 R68 T69V54-F65 HydrophobicContact CB-CD1 4.42Å; V54-F65 HydrophobicContact CG2-CD1 3.56Å; V54-F65 HydrophobicContact CG2-CE1 3.66Å; Y57-F65 HydrophobicContact CD2-CD2 4.07Å; Y57-F65 HydrophobicContact CD2-CE2 4.34Å; Y57-F65 HydrophobicContact CD2-CG 4.28Å; Y57-F65 AromaticContact CE2-CD2 3.6Å; Y57-F65 HydrophobicContact CE2-CD2 3.6Å; Y57-F65 AromaticContact CE2-CE2 3.54Å; Y57-F65 HydrophobicContact CE2-CE2 3.54Å; Y57-F65 HydrophobicContact CE2-CG 4.24Å; Y57-F65 HydrophobicContact CE2-CZ 4.12Å; Y57-F65 AromaticContact CZ-CD2 3.85Å; Y57-F65 AromaticContact CZ-CE2 3.91Å; E61-F65 PolarHBondContact O-N 2.96Å; R62-F65 PolarHBondContact O-N 3.36Å; F65-K67 PolarHBondContact O-N 3.03Å; F65-K67 VanDerWaalsContact O-N 3.13Å; F65-R68 PolarHBondContact O-N 3.37Å; F65-T69 PolarHBondContact O-N 2.84Å; F65-T69 PolarHBondContact O-OG1 3.31Å
66V86Confident78.6Confident1 Ų171.3 Ų71.31%0.00638%0.379CS..Hα-helixtrans-58.2-31179.41700000112.9V54 R62 C72 L82 K83 F86V54-V66 HydrophobicContact CG1-CG2 4.03Å; V54-V66 HydrophobicContact CG2-CG2 3.82Å; R62-V66 WeakPolarHBondContact O-CB 3.49Å; R62-V66 VanDerWaalsContact O-CG2 3.27Å; R62-V66 WeakPolarHBondContact O-CG2 2.99Å; R62-V66 PolarHBondContact O-N 3.27Å; V66-C72 HydrophobicContact CG1-CB 4.13Å; V66-L82 HydrophobicContact CG1-CB 4.15Å; V66-K83 HydrophobicContact CG1-CG 3.82Å; V66-F86 HydrophobicContact CG2-CD2 4.05Å
67K85.3Confident77.7Confident141 Ų14165.4 Ų65.461%0.61335%0.351SS*.Hα-helixtrans-78.5-28.6176-76.9178.8176.8177.30113.5C63 A64 F65C63-K67 WeakPolarHBondContact O-CB 3.39Å; C63-K67 WeakPolarHBondContact O-CG 3.01Å; C63-K67 PolarHBondContact O-N 3.05Å; C63-K67 VanDerWaalsContact O-N 3.11Å; A64-K67 PolarHBondContact O-N 3.22Å; F65-K67 PolarHBondContact O-N 3.03Å; F65-K67 VanDerWaalsContact O-N 3.13Å
68R84.8Confident77.3Confident216 Ų21664.7 Ų64.782%0.81535%0.35SS*.Hα-helixtrans-86.6-31.4-176.5-173.4176.3178177.5-2112A64 F65A64-R68 WeakPolarHBondContact O-CB 3.27Å; A64-R68 PolarHBondContact O-N 3.26Å; A64-R68 VanDerWaalsContact O-N 3.11Å; F65-R68 PolarHBondContact O-N 3.37Å
69T81.7Confident77.2Confident5 Ų567.6 Ų67.63%0.03136%0.355CS..  trans-87.1117.2-176.5-55.10000111.2D49 F65 D71 C72D49-T69 HydrophobicContact CB-CG2 4.26Å; D49-T69 WeakPolarHBondContact O-CG2 3.05Å; F65-T69 PolarHBondContact O-N 2.84Å; F65-T69 PolarHBondContact O-OG1 3.31Å; T69-D71 VanDerWaalsContact C-N 3.32Å; T69-D71 HydrophobicContact CG2-CB 4.08Å; T69-D71 PolarHBondContact O-N 3.02Å; T69-C72 PolarHBondContact O-N 3.19Å
70P73.5Confident77.4Confident66 Ų6667 Ų6743%0.42935%0.345SS..G310 helixtrans-66.8-30.5-179.627.1-33.5000112.9A42 C72 S73A42-P70 HydrophobicContact CB-CB 4.25Å; P70-C72 PolarHBondContact O-N 3.04Å; P70-S73 WeakPolarHBondContact O-CA 3.37Å; P70-S73 PolarHBondContact O-N 3.36Å; P70-S73 PolarHBondContact O-OG 3.46Å
71D72.1Confident77.7Confident48 Ų4863.4 Ų63.426%0.25731%0.314SS..G310 helixtrans-62.4-23.8176-62.92.6000112.8C51 T69 S73C51-D71 HydrophobicContact CB-CB 4.35Å; T69-D71 VanDerWaalsContact C-N 3.32Å; T69-D71 HydrophobicContact CG2-CB 4.08Å; T69-D71 PolarHBondContact O-N 3.02Å; D71-S73 VanDerWaalsContact C-N 3.29Å
72C74.4Confident77.7Confident0 Ų058.6 Ų58.60%029%0.292CS..G310 helixtrans-80.2-10.4174.4-660000113C51 V66 T69 P70 M74 N80 L82C51-C72 VanDerWaalsContact CA-SG 3.58Å; C51-C72 HydrophobicContact CB-CB 4.13Å; C51-C72 WeakPolarHBondContact CB-SG 3.27Å; C51-C72 WeakPolarHBondContact SG-CA 3.05Å; C51-C72 WeakPolarHBondContact SG-CB 3.28Å; C51-C72 CovalentContact SG-SG 2.04Å; C51-C72 PolarHBondContact SG-SG 2.8Å; V66-C72 HydrophobicContact CG1-CB 4.13Å; T69-C72 PolarHBondContact O-N 3.19Å; P70-C72 PolarHBondContact O-N 3.04Å; C72-M74 PolarHBondContact O-N 3.42Å; C72-N80 PolarHBondContact O-ND2 2.86Å; C72-L82 HydrophobicContact CB-CD1 4.3Å
73S67.9Low77.7Confident41 Ų4160.2 Ų60.229%0.28730%0.3SS..  trans-9077.7170.839.80000112.3P70 D71 E75 N80P70-S73 WeakPolarHBondContact O-CA 3.37Å; P70-S73 PolarHBondContact O-N 3.36Å; P70-S73 PolarHBondContact O-OG 3.46Å; D71-S73 VanDerWaalsContact C-N 3.29Å; S73-E75 PolarHBondContact O-N 2.91Å; S73-N80 WeakPolarHBondContact CA-ND2 3.2Å
74M61.7Low77.7Confident70 Ų7061.6 Ų61.635%0.34531%0.305SS..  trans-66.8127.6168.8-55.5-63.8-92.400109.7C72C72-M74 PolarHBondContact O-N 3.42Å
75E57.4Low77.6Confident117 Ų11758.6 Ų58.655%0.54728%0.281SS..  trans-94.8-6.4-178.8-65.6-172.7165.700113.5L41 S73 G77L41-E75 WeakPolarHBondContact CD1-OE2 3.06Å; S73-E75 PolarHBondContact O-N 2.91Å; E75-G77 VanDerWaalsContact C-N 3.35Å; E75-G77 PolarHBondContact O-N 3.46Å
76D57.8Low77.6Confident100 Ų10058.3 Ų58.354%0.53528%0.279SS..SBendtrans-79.5-11.6-173.7-65.1-33.4000114.7S382D76-S382 WeakPolarHBondContact O-CB 3.17Å; D76-S382 PolarHBondContact O-OG 2.91Å
77G65.4Low77.5Confident13 Ų1360 Ų6013%0.13429%0.291CS..SBendtrans-112.9150.1178.600000112.6E75 F79 E445E75-G77 VanDerWaalsContact C-N 3.35Å; E75-G77 PolarHBondContact O-N 3.46Å; G77-F79 PolarHBondContact O-N 3.06Å; G77-E445 VanDerWaalsContact CA-OE1 3.25Å; G77-E445 WeakPolarHBondContact CA-OE1 3.31Å
78F76.1Confident77.6Confident81 Ų8158.3 Ų58.336%0.35529%0.288SS..SBendtrans-55.9-35.9170.7-77.3-86.2000111.9V379 S382 A441 E445F78-V379 HydrophobicContact CE2-CG1 4.4Å; F78-V379 HydrophobicContact CZ-CB 4.34Å; F78-V379 HydrophobicContact CZ-CG1 4.14Å; F78-V379 WeakPolarHBondContact CZ-O 3.29Å; F78-S382 WeakPolarHBondContact CE1-O 3.25Å; F78-S382 VanDerWaalsContact CZ-C 3.42Å; F78-S382 VanDerWaalsContact CZ-CA 3.47Å; F78-A441 HydrophobicContact CE2-CB 4.2Å; F78-E445 HydrophobicContact CD2-CG 4.24Å; F78-E445 WeakPolarHBondContact CD2-OE1 3.05Å; F78-E445 PolarHBondContact N-OE1 3.17Å
79F82.6Confident77.6Confident121 Ų12150.1 Ų50.153%0.53126%0.26SS..SBendtrans-117.8134-179.9-58.7-73.4000111.1G77 Y81G77-F79 PolarHBondContact O-N 3.06Å; F79-Y81 HydrophobicContact CB-CD2 4.49Å; F79-Y81 HydrophobicContact CB-CE1 4.3Å; F79-Y81 HydrophobicContact CB-CE2 4.1Å; F79-Y81 WeakPolarHBondContact O-CD2 3.45Å; F79-Y81 WeakPolarHBondContact O-CE2 3.35Å; F79-Y81 PolarHBondContact O-N 3.32Å
80N84.6Confident77.6Confident38 Ų3853.7 Ų53.720%0.20328%0.283CS..  trans-77.993.9168.2-171.2-58.6000110C72 S73 L82 K83 L84C72-N80 PolarHBondContact O-ND2 2.86Å; S73-N80 WeakPolarHBondContact CA-ND2 3.2Å; N80-L82 VanDerWaalsContact C-N 3.29Å; N80-L82 PolarHBondContact O-N 3.35Å; N80-L82 PolarHBondContact OD1-N 3.04Å; N80-K83 HydrophobicContact CB-CB 4.19Å; N80-K83 HydrophobicContact CB-CD 4.12Å; N80-K83 HydrophobicContact CB-CG 4.37Å; N80-K83 PolarHBondContact O-N 3.21Å; N80-K83 WeakPolarHBondContact OD1-CB 3.38Å; N80-K83 WeakPolarHBondContact OD1-CG 3.5Å; N80-K83 PolarHBondContact OD1-N 3.35Å; N80-L84 PolarHBondContact O-N 3.28Å
81Y87Confident77.9Confident6 Ų653.2 Ų53.22%0.02428%0.28CS..Hα-helixtrans-66.7-25.2-176-69.4-77.7000114.1F79 L84 A85 W104 E445 L449F79-Y81 HydrophobicContact CB-CD2 4.49Å; F79-Y81 HydrophobicContact CB-CE1 4.3Å; F79-Y81 HydrophobicContact CB-CE2 4.1Å; F79-Y81 WeakPolarHBondContact O-CD2 3.45Å; F79-Y81 WeakPolarHBondContact O-CE2 3.35Å; F79-Y81 PolarHBondContact O-N 3.32Å; Y81-L84 HydrophobicContact CD1-CD2 4.03Å; Y81-L84 HydrophobicContact CE1-CD2 4.38Å; Y81-L84 PolarHBondContact O-N 3.13Å; Y81-A85 WeakPolarHBondContact O-CB 3.35Å; Y81-A85 PolarHBondContact O-N 3.42Å; Y81-W104 AromaticContact CE1-CD1 3.81Å; Y81-W104 AromaticContact CZ-NE1 3.9Å; Y81-W104 PolarHBondContact OH-NE1 3.38Å; Y81-E445 VanDerWaalsContact CE2-OE2 3.29Å; Y81-E445 WeakPolarHBondContact CE2-OE2 3.45Å; Y81-E445 VanDerWaalsContact CZ-OE2 3.27Å; Y81-E445 PolarHBondContact OH-OE2 3.31Å; Y81-L449 HydrophobicContact CD1-CD2 3.24Å; Y81-L449 HydrophobicContact CD1-CG 3.8Å; Y81-L449 HydrophobicContact CD2-CD2 4.36Å; Y81-L449 HydrophobicContact CD2-CG 4.1Å; Y81-L449 HydrophobicContact CE1-CD1 4.13Å; Y81-L449 HydrophobicContact CE1-CD2 3.39Å; Y81-L449 HydrophobicContact CE1-CG 3.64Å; Y81-L449 HydrophobicContact CE2-CD2 4.48Å; Y81-L449 HydrophobicContact CE2-CG 3.96Å; Y81-L449 HydrophobicContact CG-CD2 3.76Å; Y81-L449 HydrophobicContact CG-CG 4.02Å
82L86Confident78.4Confident4 Ų457.9 Ų57.92%0.02131%0.305CS..Hα-helixtrans-69.2-46.9174.2-77.4163.9000111.1V66 C72 N80 L84 A85 F86 M452 V455V66-L82 HydrophobicContact CG1-CB 4.15Å; C72-L82 HydrophobicContact CB-CD1 4.3Å; N80-L82 VanDerWaalsContact C-N 3.29Å; N80-L82 PolarHBondContact O-N 3.35Å; N80-L82 PolarHBondContact OD1-N 3.04Å; L82-L84 VanDerWaalsContact C-N 3.29Å; L82-L84 PolarHBondContact O-N 3.17Å; L82-A85 PolarHBondContact O-N 3.39Å; L82-F86 HydrophobicContact CD2-CD2 4.37Å; L82-F86 HydrophobicContact CD2-CE2 3.93Å; L82-F86 WeakPolarHBondContact O-CD2 3.37Å; L82-F86 PolarHBondContact O-N 3.33Å; L82-M452 HydrophobicContact CD2-CB 4.39Å; L82-M452 HydrophobicContact CD2-CG 4.14Å; L82-M452 HydrophobicContact CG-CB 4.41Å; L82-M452 HydrophobicContact CG-CG 4.43Å; L82-V455 HydrophobicContact CD2-CB 4.07Å; L82-V455 HydrophobicContact CD2-CG1 3.97Å; L82-V455 HydrophobicContact CD2-CG2 4.32Å
83K86.6Confident79Confident82 Ų8261.7 Ų61.736%0.35733%0.325SS..Hα-helixtrans-61.2-40.9171-72175.6-175.11720110.4V66 N80 C87V66-K83 HydrophobicContact CG1-CG 3.82Å; N80-K83 HydrophobicContact CB-CB 4.19Å; N80-K83 HydrophobicContact CB-CD 4.12Å; N80-K83 HydrophobicContact CB-CG 4.37Å; N80-K83 PolarHBondContact O-N 3.21Å; N80-K83 WeakPolarHBondContact OD1-CB 3.38Å; N80-K83 WeakPolarHBondContact OD1-CG 3.5Å; N80-K83 PolarHBondContact OD1-N 3.35Å; K83-C87 WeakPolarHBondContact O-CA 2.86Å; K83-C87 WeakPolarHBondContact O-CB 3.4Å; K83-C87 PolarHBondContact O-N 3.42Å
84L87Confident79.7Confident58 Ų5861 Ų6130%0.30432%0.319SS..Hα-helixtrans-60.6-51.4176.3-165.370000111.1N80 Y81 L82 F86 L88 T97N80-L84 PolarHBondContact O-N 3.28Å; Y81-L84 HydrophobicContact CD1-CD2 4.03Å; Y81-L84 HydrophobicContact CE1-CD2 4.38Å; Y81-L84 PolarHBondContact O-N 3.13Å; L82-L84 VanDerWaalsContact C-N 3.29Å; L82-L84 PolarHBondContact O-N 3.17Å; L84-F86 PolarHBondContact O-N 3.32Å; L84-L88 HydrophobicContact CD1-CB 4.24Å; L84-L88 HydrophobicContact CD1-CD1 4.15Å; L84-L88 HydrophobicContact CD1-CD2 3.73Å; L84-L88 HydrophobicContact CD1-CG 4.26Å; L84-L88 HydrophobicContact CG-CD2 4.33Å; L84-L88 WeakPolarHBondContact O-CB 3.14Å; L84-L88 PolarHBondContact O-N 3.45Å; L84-T97 WeakPolarHBondContact O-CG2 3.31Å
85A85.4Confident81Confident1 Ų161.6 Ų61.61%0.00833%0.328CS..Hα-helixtrans-61.3-45.1-17600000113Y81 L82 M452Y81-A85 WeakPolarHBondContact O-CB 3.35Å; Y81-A85 PolarHBondContact O-N 3.42Å; L82-A85 PolarHBondContact O-N 3.39Å; A85-M452 HydrophobicContact CB-CG 4.04Å; A85-M452 HydrophobicContact CB-SD 4Å
86F85.5Confident82.5Confident16 Ų1660.1 Ų60.17%0.0732%0.324CS..Hα-helixtrans-102.1-19-171.4-62.2-66.2000114.9V54 M55 R62 C63 V66 L82 L84 V456V54-F86 HydrophobicContact CG1-CD2 4.18Å; V54-F86 HydrophobicContact CG1-CE1 4.46Å; V54-F86 HydrophobicContact CG1-CE2 3.86Å; V54-F86 HydrophobicContact CG1-CZ 4Å; M55-F86 HydrophobicContact SD-CE1 4.2Å; M55-F86 HydrophobicContact SD-CZ 3.99Å; R62-F86 HydrophobicContact CB-CD1 4.28Å; R62-F86 HydrophobicContact CB-CG 4.5Å; C63-F86 WeakPolarHBondContact CB-O 3.33Å; V66-F86 HydrophobicContact CG2-CD2 4.05Å; L82-F86 HydrophobicContact CD2-CD2 4.37Å; L82-F86 HydrophobicContact CD2-CE2 3.93Å; L82-F86 WeakPolarHBondContact O-CD2 3.37Å; L82-F86 PolarHBondContact O-N 3.33Å; L84-F86 PolarHBondContact O-N 3.32Å; F86-V456 HydrophobicContact CE2-CG2 4.42Å; F86-V456 HydrophobicContact CZ-CG2 3.82Å
87C84.9Confident84Confident36 Ų3655.5 Ų55.524%0.24330%0.299CS..Hα-helixtrans-114.5-12.7-176.1-64.40000115.7C63 K83C63-C87 WeakPolarHBondContact CA-SG 3.12Å; C63-C87 HydrophobicContact CB-CB 4.08Å; C63-C87 WeakPolarHBondContact CB-SG 3.39Å; C63-C87 VanDerWaalsContact SG-CA 3.53Å; C63-C87 WeakPolarHBondContact SG-CB 3.43Å; C63-C87 CovalentContact SG-SG 2.04Å; C63-C87 PolarHBondContact SG-SG 3.44Å; K83-C87 WeakPolarHBondContact O-CA 2.86Å; K83-C87 WeakPolarHBondContact O-CB 3.4Å; K83-C87 PolarHBondContact O-N 3.42Å
88L86.3Confident85.1Confident106 Ų10656.5 Ų56.556%0.55530%0.301SS*.SBendtrans-72.3-44.3-177.4-174.972.1000112.5L84 T97L84-L88 HydrophobicContact CD1-CB 4.24Å; L84-L88 HydrophobicContact CD1-CD1 4.15Å; L84-L88 HydrophobicContact CD1-CD2 3.73Å; L84-L88 HydrophobicContact CD1-CG 4.26Å; L84-L88 HydrophobicContact CG-CD2 4.33Å; L84-L88 WeakPolarHBondContact O-CB 3.14Å; L84-L88 PolarHBondContact O-N 3.45Å; L88-T97 HydrophobicContact CD2-CG2 4.44Å
89L85.3Confident85.7Confident44 Ų4456.1 Ų56.123%0.2331%0.306CS..SBendtrans-119.1158.6-177.6-78.5101.7000111.6L93 L96 T97L89-L93 HydrophobicContact CB-CB 4.03Å; L89-L93 HydrophobicContact CD2-CB 3.82Å; L89-L93 HydrophobicContact CD2-CD1 3.82Å; L89-L93 HydrophobicContact CD2-CG 4.46Å; L89-L96 HydrophobicContact CD2-CD2 4.32Å; L89-T97 HydrophobicContact CD1-CG2 4.47Å; L89-T97 VanDerWaalsContact CD1-OG1 3.28Å; L89-T97 WeakPolarHBondContact CD1-OG1 3.49Å
90P82.8Confident86.1Confident80 Ų8055.1 Ų55.152%0.51931%0.305SS..  trans-53.9153.8172.6-2332.2000112.1N92 L93 T94P90-N92 PolarHBondContact O-N 2.77Å; P90-L93 PolarHBondContact O-N 2.86Å; P90-T94 PolarHBondContact O-N 3.33Å
91P80Confident86.4Confident55 Ų5553.6 Ų53.636%0.35730%0.297SS..G310 helixtrans-54.7-33.4-174.417.9-30.8000113.9A59 L93 T94A59-P91 HydrophobicContact CB-CB 3.78Å; P91-L93 PolarHBondContact O-N 2.92Å; P91-T94 WeakPolarHBondContact O-CB 3.37Å; P91-T94 VanDerWaalsContact O-CG2 3.29Å; P91-T94 WeakPolarHBondContact O-CG2 3.39Å; P91-T94 PolarHBondContact O-N 3.31Å; P91-T94 PolarHBondContact O-OG1 2.93Å
92N82Confident86.5Confident147 Ų14756.7 Ų56.779%0.78631%0.314SS*.G310 helixtrans-66.1-20.9177.8-64.7-13.7000114P90P90-N92 PolarHBondContact O-N 2.77Å
93L85.9Confident86.8Confident80 Ų8061 Ų6142%0.41934%0.339SS..G310 helixtrans-108.78.4-178.6-65.8174.2000112.8L89 P90 P91 L96 T97L89-L93 HydrophobicContact CB-CB 4.03Å; L89-L93 HydrophobicContact CD2-CB 3.82Å; L89-L93 HydrophobicContact CD2-CD1 3.82Å; L89-L93 HydrophobicContact CD2-CG 4.46Å; P90-L93 PolarHBondContact O-N 2.86Å; P91-L93 PolarHBondContact O-N 2.92Å; L93-L96 VanDerWaalsContact O-CB 3.27Å; L93-L96 WeakPolarHBondContact O-CB 3.42Å; L93-L96 PolarHBondContact O-N 3.02Å; L93-T97 PolarHBondContact O-N 2.88Å
94T84.1Confident87Confident27 Ų2761.8 Ų61.817%0.16634%0.34CS..Hα-helixtrans-50.7-40.6171.751.20000115P90 P91 L96 T97 I98P90-T94 PolarHBondContact O-N 3.33Å; P91-T94 WeakPolarHBondContact O-CB 3.37Å; P91-T94 VanDerWaalsContact O-CG2 3.29Å; P91-T94 WeakPolarHBondContact O-CG2 3.39Å; P91-T94 PolarHBondContact O-N 3.31Å; P91-T94 PolarHBondContact O-OG1 2.93Å; T94-L96 VanDerWaalsContact C-N 3.25Å; T94-L96 PolarHBondContact O-N 3.43Å; T94-T97 PolarHBondContact O-N 3.39Å; T94-I98 WeakPolarHBondContact O-CG1 3.48Å; T94-I98 PolarHBondContact O-N 3.08Å
95P87.8Confident87.2Confident82 Ų8259.8 Ų59.853%0.53233%0.33SS..Hα-helixtrans-63.3-32.8176.524.5-35.3000112.3I98 T99P95-I98 PolarHBondContact O-N 2.94Å; P95-T99 VanDerWaalsContact O-CG2 3.31Å; P95-T99 WeakPolarHBondContact O-CG2 3.41Å; P95-T99 PolarHBondContact O-N 3.21Å; P95-T99 PolarHBondContact O-OG1 3.43Å
96L89.7Confident87.3Confident85 Ų8565.1 Ų65.145%0.44536%0.358SS..Hα-helixtrans-63.1-46.5175.5-176.568.4000110.4L89 L93 T94 I98 T99 L100L89-L96 HydrophobicContact CD2-CD2 4.32Å; L93-L96 VanDerWaalsContact O-CB 3.27Å; L93-L96 WeakPolarHBondContact O-CB 3.42Å; L93-L96 PolarHBondContact O-N 3.02Å; T94-L96 VanDerWaalsContact C-N 3.25Å; T94-L96 PolarHBondContact O-N 3.43Å; L96-I98 VanDerWaalsContact C-N 3.34Å; L96-I98 PolarHBondContact O-N 2.69Å; L96-T99 WeakPolarHBondContact CA-OG1 3.31Å; L96-T99 PolarHBondContact O-N 3.29Å; L96-T99 PolarHBondContact O-OG1 3.31Å; L96-L100 HydrophobicContact CG-CD1 4.45Å; L96-L100 WeakPolarHBondContact O-CG 3.44Å; L96-L100 PolarHBondContact O-N 2.91Å
97T88.3Confident87.4Confident3 Ų366 Ų662%0.01837%0.368CS..Hα-helixtrans-59.7-44.7176.9-44.10000111.8L84 L88 L89 L93 T94 T99 L100 C101L84-T97 WeakPolarHBondContact O-CG2 3.31Å; L88-T97 HydrophobicContact CD2-CG2 4.44Å; L89-T97 HydrophobicContact CD1-CG2 4.47Å; L89-T97 VanDerWaalsContact CD1-OG1 3.28Å; L89-T97 WeakPolarHBondContact CD1-OG1 3.49Å; L93-T97 PolarHBondContact O-N 2.88Å; T94-T97 PolarHBondContact O-N 3.39Å; T97-T99 VanDerWaalsContact C-N 3.34Å; T97-T99 PolarHBondContact O-N 2.93Å; T97-L100 PolarHBondContact O-N 3.35Å; T97-C101 PolarHBondContact O-N 2.93Å; T97-C101 PolarHBondContact O-SG 3.21Å; T97-C101 VanDerWaalsContact O-SG 3.35Å
98I88.4Confident87.6Confident35 Ų3564.6 Ų64.618%0.17936%0.358CS..Hα-helixtrans-61.8-43.1177.2-64.8168.1000110.5T94 P95 L96 L100 C101 I102 V456T94-I98 WeakPolarHBondContact O-CG1 3.48Å; T94-I98 PolarHBondContact O-N 3.08Å; P95-I98 PolarHBondContact O-N 2.94Å; L96-I98 VanDerWaalsContact C-N 3.34Å; L96-I98 PolarHBondContact O-N 2.69Å; I98-L100 VanDerWaalsContact C-N 3.33Å; I98-L100 PolarHBondContact O-N 3.45Å; I98-C101 WeakPolarHBondContact O-CB 3.37Å; I98-C101 PolarHBondContact O-N 2.52Å; I98-I102 HydrophobicContact CG2-CD1 4.03Å; I98-I102 WeakPolarHBondContact O-CG1 3.44Å; I98-I102 PolarHBondContact O-N 3.21Å; I98-V456 HydrophobicContact CD1-CG1 4.25Å
99T89.8Confident87.7Confident73 Ų7361.5 Ų61.545%0.44834%0.34SS..Hα-helixtrans-62.9-38.3176.158.30000112.7P95 L96 T97 I102 V103P95-T99 VanDerWaalsContact O-CG2 3.31Å; P95-T99 WeakPolarHBondContact O-CG2 3.41Å; P95-T99 PolarHBondContact O-N 3.21Å; P95-T99 PolarHBondContact O-OG1 3.43Å; L96-T99 WeakPolarHBondContact CA-OG1 3.31Å; L96-T99 PolarHBondContact O-N 3.29Å; L96-T99 PolarHBondContact O-OG1 3.31Å; T97-T99 VanDerWaalsContact C-N 3.34Å; T97-T99 PolarHBondContact O-N 2.93Å; T99-I102 PolarHBondContact O-N 3.27Å; T99-V103 WeakPolarHBondContact O-CG2 3.46Å; T99-V103 PolarHBondContact O-N 2.94Å
100L91Very high87.7Confident100 Ų10061.8 Ų61.852%0.52434%0.342SS..Hα-helixtrans-64.8-40.7174.2-69.5173000111.6L96 T97 I98 I102 V103 W104L96-L100 HydrophobicContact CG-CD1 4.45Å; L96-L100 WeakPolarHBondContact O-CG 3.44Å; L96-L100 PolarHBondContact O-N 2.91Å; T97-L100 PolarHBondContact O-N 3.35Å; I98-L100 VanDerWaalsContact C-N 3.33Å; I98-L100 PolarHBondContact O-N 3.45Å; L100-I102 VanDerWaalsContact C-N 3.34Å; L100-I102 PolarHBondContact O-N 3.21Å; L100-V103 PolarHBondContact O-N 3.48Å; L100-W104 WeakPolarHBondContact O-CB 3.4Å; L100-W104 PolarHBondContact O-N 3.34Å
101C90.5Very high87.9Confident5 Ų559 Ų593%0.03432%0.322CS..Hα-helixtrans-61.8-39.4173.4-69.90000112.2T97 I98 W104 L105 L449 M452T97-C101 PolarHBondContact O-N 2.93Å; T97-C101 PolarHBondContact O-SG 3.21Å; T97-C101 VanDerWaalsContact O-SG 3.35Å; I98-C101 WeakPolarHBondContact O-CB 3.37Å; I98-C101 PolarHBondContact O-N 2.52Å; C101-W104 PolarHBondContact O-N 3.28Å; C101-L105 WeakPolarHBondContact O-CB 3.29Å; C101-L105 PolarHBondContact O-N 3.25Å; C101-L449 HydrophobicContact CB-CD2 3.77Å; C101-M452 HydrophobicContact CB-CE 3.7Å
102I90.3Very high88.3Confident72 Ų7256.4 Ų56.437%0.36931%0.305SS..Hα-helixtrans-67.4-41.4175.3-66.9167000111I98 T99 L100 W104 L105 L106 L453I98-I102 HydrophobicContact CG2-CD1 4.03Å; I98-I102 WeakPolarHBondContact O-CG1 3.44Å; I98-I102 PolarHBondContact O-N 3.21Å; T99-I102 PolarHBondContact O-N 3.27Å; L100-I102 VanDerWaalsContact C-N 3.34Å; L100-I102 PolarHBondContact O-N 3.21Å; I102-W104 VanDerWaalsContact C-N 3.3Å; I102-W104 PolarHBondContact O-N 3.04Å; I102-L105 WeakPolarHBondContact O-CB 3.14Å; I102-L105 PolarHBondContact O-N 3.35Å; I102-L106 WeakPolarHBondContact O-CG 3.34Å; I102-L106 PolarHBondContact O-N 3.28Å; I102-L453 HydrophobicContact CG1-CD2 4.33Å
103V90.7Very high88.3Confident93 Ų9350.2 Ų50.256%0.56428%0.276SS*.Hα-helixtrans-62.8-40.5174.7172.50000110.8T99 L100 L106 A107T99-V103 WeakPolarHBondContact O-CG2 3.46Å; T99-V103 PolarHBondContact O-N 2.94Å; L100-V103 PolarHBondContact O-N 3.48Å; V103-L106 PolarHBondContact O-N 2.96Å; V103-A107 PolarHBondContact O-N 2.91Å
104W91.7Very high88.3Confident100 Ų10047.1 Ų47.138%0.37926%0.26SS..Hα-helixtrans-64.8-41.7174.9178.9-122.3000112.3Y81 L100 C101 I102 L106 A107 L108 I111Y81-W104 AromaticContact CE1-CD1 3.81Å; Y81-W104 AromaticContact CZ-NE1 3.9Å; Y81-W104 PolarHBondContact OH-NE1 3.38Å; L100-W104 WeakPolarHBondContact O-CB 3.4Å; L100-W104 PolarHBondContact O-N 3.34Å; C101-W104 PolarHBondContact O-N 3.28Å; I102-W104 VanDerWaalsContact C-N 3.3Å; I102-W104 PolarHBondContact O-N 3.04Å; W104-L106 VanDerWaalsContact C-N 3.31Å; W104-L106 PolarHBondContact O-N 2.99Å; W104-A107 HydrophobicContact CE3-CB 4.04Å; W104-A107 HydrophobicContact CZ3-CB 4.37Å; W104-A107 CarbonylContact O-C 3.58Å; W104-A107 WeakPolarHBondContact O-CA 3.49Å; W104-A107 WeakPolarHBondContact O-CB 3.25Å; W104-A107 PolarHBondContact O-N 3.29Å; W104-L108 HydrophobicContact CD2-CG 4.38Å; W104-L108 HydrophobicContact CH2-CD2 4.38Å; W104-L108 HydrophobicContact CZ2-CD2 3.8Å; W104-L108 HydrophobicContact CZ2-CG 4.12Å; W104-L108 PolarHBondContact O-N 3.41Å; W104-I111 HydrophobicContact CH2-CD1 4.42Å
105L90.1Very high88.5Confident16 Ų1645.9 Ų45.98%0.08425%0.253CS..Hα-helixtrans-55.9-45.2172.5-17965.7000111.6C101 I102 A107 L108 F109 V446 L449 L453C101-L105 WeakPolarHBondContact O-CB 3.29Å; C101-L105 PolarHBondContact O-N 3.25Å; I102-L105 WeakPolarHBondContact O-CB 3.14Å; I102-L105 PolarHBondContact O-N 3.35Å; L105-A107 VanDerWaalsContact C-N 3.31Å; L105-A107 PolarHBondContact O-N 3.09Å; L105-L108 PolarHBondContact O-N 2.96Å; L105-F109 HydrophobicContact CD1-CE2 3.89Å; L105-F109 HydrophobicContact CD1-CZ 3.95Å; L105-F109 HydrophobicContact CD2-CE2 4.19Å; L105-F109 HydrophobicContact CG-CD2 4.27Å; L105-F109 HydrophobicContact CG-CE2 3.67Å; L105-F109 HydrophobicContact CG-CZ 4.23Å; L105-F109 VanDerWaalsContact O-CD2 3.3Å; L105-F109 WeakPolarHBondContact O-CD2 3.39Å; L105-F109 PolarHBondContact O-N 2.59Å; L105-F109 VanDerWaalsContact O-N 3.08Å; L105-V446 HydrophobicContact CD1-CB 4.28Å; L105-V446 HydrophobicContact CD1-CG1 3.96Å; L105-V446 HydrophobicContact CD1-CG2 4.1Å; L105-L449 HydrophobicContact CB-CD1 3.97Å; L105-L449 HydrophobicContact CD1-CB 4.06Å; L105-L449 HydrophobicContact CD1-CD1 4.01Å; L105-L453 HydrophobicContact CD2-CD1 4Å
106L88.1Confident88.3Confident113 Ų11342 Ų4259%0.59223%0.228SC*.Hα-helixtrans-63.8-36.2175.3-67.5173.6000112.4I102 V103 W104 L110I102-L106 WeakPolarHBondContact O-CG 3.34Å; I102-L106 PolarHBondContact O-N 3.28Å; V103-L106 PolarHBondContact O-N 2.96Å; W104-L106 VanDerWaalsContact C-N 3.31Å; W104-L106 PolarHBondContact O-N 2.99Å; L106-L110 PolarHBondContact O-N 3.22Å
107A88.4Confident87.9Confident35 Ų3539.6 Ų39.629%0.28922%0.218SC..Hα-helixtrans-65.6-42.2174.300000111.6V103 W104 L105 F109 L110 I111V103-A107 PolarHBondContact O-N 2.91Å; W104-A107 HydrophobicContact CE3-CB 4.04Å; W104-A107 HydrophobicContact CZ3-CB 4.37Å; W104-A107 CarbonylContact O-C 3.58Å; W104-A107 WeakPolarHBondContact O-CA 3.49Å; W104-A107 WeakPolarHBondContact O-CB 3.25Å; W104-A107 PolarHBondContact O-N 3.29Å; L105-A107 VanDerWaalsContact C-N 3.31Å; L105-A107 PolarHBondContact O-N 3.09Å; A107-F109 PolarHBondContact O-N 3.42Å; A107-L110 CarbonylContact O-C 3.57Å; A107-L110 WeakPolarHBondContact O-CA 3.48Å; A107-L110 WeakPolarHBondContact O-CB 3.25Å; A107-L110 PolarHBondContact O-N 3.08Å; A107-L110 VanDerWaalsContact O-N 3.09Å; A107-I111 WeakPolarHBondContact O-CG1 3.34Å; A107-I111 PolarHBondContact O-N 3.16Å
108L89.3Confident87.7Confident6 Ų644.5 Ų44.53%0.03124%0.239CC..Hα-helixtrans-61.4-41.2175.5-71.9167.2000112.4W104 L105 L110 I111 L112 A442 E445 V446 L449W104-L108 HydrophobicContact CD2-CG 4.38Å; W104-L108 HydrophobicContact CH2-CD2 4.38Å; W104-L108 HydrophobicContact CZ2-CD2 3.8Å; W104-L108 HydrophobicContact CZ2-CG 4.12Å; W104-L108 PolarHBondContact O-N 3.41Å; L105-L108 PolarHBondContact O-N 2.96Å; L108-L110 PolarHBondContact O-N 3.47Å; L108-I111 HydrophobicContact CD2-CD1 4.11Å; L108-I111 WeakPolarHBondContact O-CA 3.4Å; L108-I111 WeakPolarHBondContact O-CB 2.96Å; L108-I111 PolarHBondContact O-N 3.02Å; L108-I111 VanDerWaalsContact O-N 3.1Å; L108-L112 WeakPolarHBondContact O-CG 3.47Å; L108-L112 PolarHBondContact O-N 3.32Å; L108-A442 HydrophobicContact CD2-CB 4.45Å; L108-E445 HydrophobicContact CD1-CB 3.66Å; L108-E445 HydrophobicContact CD2-CB 4Å; L108-V446 HydrophobicContact CB-CG2 3.73Å; L108-V446 HydrophobicContact CD1-CG2 4.14Å; L108-L449 HydrophobicContact CD1-CD1 3.45Å; L108-L449 VanDerWaalsContact CD1-CD1 3.45Å
109F86.9Confident87.7Confident41 Ų4143 Ų4318%0.1823%0.231CC..Hα-helixtrans-61-36.3172.8-71.4-45.4000113L105 A107 L112 G113 V446 I475 F479L105-F109 HydrophobicContact CD1-CE2 3.89Å; L105-F109 HydrophobicContact CD1-CZ 3.95Å; L105-F109 HydrophobicContact CD2-CE2 4.19Å; L105-F109 HydrophobicContact CG-CD2 4.27Å; L105-F109 HydrophobicContact CG-CE2 3.67Å; L105-F109 HydrophobicContact CG-CZ 4.23Å; L105-F109 VanDerWaalsContact O-CD2 3.3Å; L105-F109 WeakPolarHBondContact O-CD2 3.39Å; L105-F109 PolarHBondContact O-N 2.59Å; L105-F109 VanDerWaalsContact O-N 3.08Å; A107-F109 PolarHBondContact O-N 3.42Å; F109-L112 HydrophobicContact CD1-CD1 4.13Å; F109-G113 PolarHBondContact O-N 2.9Å; F109-G113 VanDerWaalsContact O-N 3.07Å; F109-V446 HydrophobicContact CD1-CG2 4.31Å; F109-V446 HydrophobicContact CE1-CG1 3.72Å; F109-V446 HydrophobicContact CE1-CG2 4.01Å; F109-V446 HydrophobicContact CZ-CG1 3.89Å; F109-I475 HydrophobicContact CD1-CG1 4.31Å; F109-I475 HydrophobicContact CE1-CD1 4.33Å; F109-I475 HydrophobicContact CE1-CG1 3.59Å; F109-I475 HydrophobicContact CZ-CG1 4.49Å; F109-F479 HydrophobicContact CB-CE2 4.42Å; F109-F479 HydrophobicContact CB-CZ 4.02Å; F109-F479 AromaticContact CD1-CE2 3.53Å; F109-F479 HydrophobicContact CD1-CE2 3.53Å; F109-F479 AromaticContact CD1-CZ 3.92Å; F109-F479 HydrophobicContact CD1-CZ 3.92Å; F109-F479 HydrophobicContact CE1-CE2 4.19Å; F109-F479 HydrophobicContact CG-CE2 4.28Å; F109-F479 HydrophobicContact CG-CZ 4.21Å
110L85.4Confident87.5Confident49 Ų4939.5 Ų39.526%0.25721%0.209SC..Hα-helixtrans-70.1-36.4174.9179.2152.6000111.4L106 A107 L108 L114 K337 L340L106-L110 PolarHBondContact O-N 3.22Å; A107-L110 CarbonylContact O-C 3.57Å; A107-L110 WeakPolarHBondContact O-CA 3.48Å; A107-L110 WeakPolarHBondContact O-CB 3.25Å; A107-L110 PolarHBondContact O-N 3.08Å; A107-L110 VanDerWaalsContact O-N 3.09Å; L108-L110 PolarHBondContact O-N 3.47Å; L110-L114 HydrophobicContact CD2-CD1 3.64Å; L110-L114 HydrophobicContact CD2-CG 4.42Å; L110-L114 HydrophobicContact CG-CD1 4.4Å; L110-L114 WeakPolarHBondContact O-CB 3.5Å; L110-L114 VanDerWaalsContact O-CG 3.29Å; L110-L114 WeakPolarHBondContact O-CG 3.24Å; L110-L114 PolarHBondContact O-N 3.19Å; L110-K337 HydrophobicContact CD1-CD 4.31Å; L110-K337 VanDerWaalsContact CD1-CE 3.5Å; L110-K337 HydrophobicContact CD1-CG 3.74Å; L110-K337 HydrophobicContact CD2-CG 3.99Å; L110-K337 HydrophobicContact CG-CG 4.13Å; L110-L340 HydrophobicContact CD2-CD2 3.33Å
111I87.8Confident87Confident22 Ų2235 Ų3511%0.11319%0.186CC..Hα-helixtrans-60-52.1171.4-64.6166.9000110.5W104 A107 L108 G113 L114 A115 L340 A442W104-I111 HydrophobicContact CH2-CD1 4.42Å; A107-I111 WeakPolarHBondContact O-CG1 3.34Å; A107-I111 PolarHBondContact O-N 3.16Å; L108-I111 HydrophobicContact CD2-CD1 4.11Å; L108-I111 WeakPolarHBondContact O-CA 3.4Å; L108-I111 WeakPolarHBondContact O-CB 2.96Å; L108-I111 PolarHBondContact O-N 3.02Å; L108-I111 VanDerWaalsContact O-N 3.1Å; I111-G113 VanDerWaalsContact C-N 3.35Å; I111-G113 PolarHBondContact O-N 2.88Å; I111-L114 PolarHBondContact O-N 2.81Å; I111-A115 VanDerWaalsContact O-CB 3.3Å; I111-A115 WeakPolarHBondContact O-CB 3.27Å; I111-A115 PolarHBondContact O-N 3.18Å; I111-L340 HydrophobicContact CB-CD2 4.11Å; I111-L340 HydrophobicContact CD1-CD1 3.97Å; I111-L340 HydrophobicContact CD1-CD2 4.27Å; I111-L340 HydrophobicContact CG1-CD1 3.55Å; I111-L340 HydrophobicContact CG1-CD2 3.21Å; I111-L340 HydrophobicContact CG1-CG 3.93Å; I111-L340 HydrophobicContact CG2-CD1 4.47Å; I111-A442 HydrophobicContact CG2-CB 4.28Å
112L87.3Confident86.7Confident1 Ų135.6 Ų35.61%0.00519%0.19CC..Hα-helixtrans-54.4-49.7178.4-75.3166.8000111.6L108 F109 L114 A115 A116 I439 A442 A443 V446 I475 F479L108-L112 WeakPolarHBondContact O-CG 3.47Å; L108-L112 PolarHBondContact O-N 3.32Å; F109-L112 HydrophobicContact CD1-CD1 4.13Å; L112-L114 PolarHBondContact O-N 2.96Å; L112-A115 PolarHBondContact O-N 3.41Å; L112-A116 VanDerWaalsContact O-CB 3.3Å; L112-A116 WeakPolarHBondContact O-CB 3.49Å; L112-A116 PolarHBondContact O-N 3.22Å; L112-I439 HydrophobicContact CD2-CB 4.4Å; L112-I439 HydrophobicContact CD2-CG2 3.89Å; L112-I439 VanDerWaalsContact CD2-O 3.25Å; L112-I439 WeakPolarHBondContact CD2-O 3.35Å; L112-A442 HydrophobicContact CD2-CB 3.76Å; L112-A442 HydrophobicContact CG-CB 3.95Å; L112-A443 HydrophobicContact CD2-CB 4.43Å; L112-V446 HydrophobicContact CD1-CG2 4.03Å; L112-I475 HydrophobicContact CD1-CG2 4.04Å; L112-F479 HydrophobicContact CB-CB 4.37Å; L112-F479 HydrophobicContact CB-CD2 4.23Å; L112-F479 HydrophobicContact CB-CG 4.24Å; L112-F479 HydrophobicContact CD1-CD2 4.36Å
113G83.3Confident86.5Confident17 Ų1732.2 Ų32.218%0.17517%0.173CC..Hα-helixtrans-64.3-36.9178.900000113.8F109 I111 S117F109-G113 PolarHBondContact O-N 2.9Å; F109-G113 VanDerWaalsContact O-N 3.07Å; I111-G113 VanDerWaalsContact C-N 3.35Å; I111-G113 PolarHBondContact O-N 2.88Å; G113-S117 VanDerWaalsContact O-CB 3.27Å; G113-S117 WeakPolarHBondContact O-CB 3.46Å; G113-S117 PolarHBondContact O-N 2.83Å; G113-S117 VanDerWaalsContact O-N 3.09Å; G113-S117 PolarHBondContact O-OG 2.91Å
114L85.3Confident86.2Confident15 Ų1527.9 Ų27.98%0.07915%0.147CC..Hα-helixtrans-72.5-46.4176.7-72.7176.8000111.8L110 I111 L112 A116 S117 K118 K337 L340 L344L110-L114 HydrophobicContact CD2-CD1 3.64Å; L110-L114 HydrophobicContact CD2-CG 4.42Å; L110-L114 HydrophobicContact CG-CD1 4.4Å; L110-L114 WeakPolarHBondContact O-CB 3.5Å; L110-L114 VanDerWaalsContact O-CG 3.29Å; L110-L114 WeakPolarHBondContact O-CG 3.24Å; L110-L114 PolarHBondContact O-N 3.19Å; I111-L114 PolarHBondContact O-N 2.81Å; L112-L114 PolarHBondContact O-N 2.96Å; L114-A116 VanDerWaalsContact C-N 3.33Å; L114-A116 PolarHBondContact O-N 3.29Å; L114-S117 PolarHBondContact O-N 3.21Å; L114-S117 PolarHBondContact O-OG 3.2Å; L114-K118 WeakPolarHBondContact O-CB 3.44Å; L114-K118 PolarHBondContact O-N 2.85Å; L114-K337 HydrophobicContact CD1-CB 4.29Å; L114-K337 HydrophobicContact CD1-CG 4.26Å; L114-L340 HydrophobicContact CD1-CD2 3.85Å; L114-L340 HydrophobicContact CD1-CG 4.39Å; L114-L344 HydrophobicContact CB-CD1 4.1Å
115A87.8Confident85.7Confident1 Ų124.2 Ų24.21%0.00814%0.136CC..Hα-helixtrans-56.3-48.117700000111I111 L112 F119 F120 L438 I439I111-A115 VanDerWaalsContact O-CB 3.3Å; I111-A115 WeakPolarHBondContact O-CB 3.27Å; I111-A115 PolarHBondContact O-N 3.18Å; L112-A115 PolarHBondContact O-N 3.41Å; A115-F119 WeakPolarHBondContact O-CB 3.39Å; A115-F119 PolarHBondContact O-N 2.63Å; A115-F120 PolarHBondContact O-N 3.19Å; A115-L438 HydrophobicContact CB-CD2 4.24Å; A115-I439 HydrophobicContact CB-CD1 4.44Å; A115-I439 HydrophobicContact CB-CG1 3.81Å
116A84.7Confident85.5Confident1 Ų123.6 Ų23.61%0.00813%0.133CC..Iπ-helixtrans-59.6-54.7175.300000112L112 L114 F120 C121 I439 T483L112-A116 VanDerWaalsContact O-CB 3.3Å; L112-A116 WeakPolarHBondContact O-CB 3.49Å; L112-A116 PolarHBondContact O-N 3.22Å; L114-A116 VanDerWaalsContact C-N 3.33Å; L114-A116 PolarHBondContact O-N 3.29Å; A116-F120 PolarHBondContact O-N 2.99Å; A116-C121 PolarHBondContact O-N 3.18Å; A116-C121 VanDerWaalsContact O-N 3.08Å; A116-C121 PolarHBondContact O-SG 3Å; A116-I439 HydrophobicContact CB-CD1 4.3Å; A116-T483 HydrophobicContact CB-CG2 4.48Å
117S81.9Confident85.3Confident34 Ų3418.7 Ų18.724%0.23811%0.108CC..Iπ-helixtrans-74.7-36-16960.80000115.5G113 L114 Q487G113-S117 VanDerWaalsContact O-CB 3.27Å; G113-S117 WeakPolarHBondContact O-CB 3.46Å; G113-S117 PolarHBondContact O-N 2.83Å; G113-S117 VanDerWaalsContact O-N 3.09Å; G113-S117 PolarHBondContact O-OG 2.91Å; L114-S117 PolarHBondContact O-N 3.21Å; L114-S117 PolarHBondContact O-OG 3.2Å; S117-Q487 PolarHBondContact O-NE2 3.37Å
118K83Confident85Confident106 Ų10617.3 Ų17.346%0.46110%0.096SC..Iπ-helixtrans-97.1-24.7-172.2-69-64.7-168.8172.70113.6L114L114-K118 WeakPolarHBondContact O-CB 3.44Å; L114-K118 PolarHBondContact O-N 2.85Å
119F87.6Confident84.6Confident2 Ų219.9 Ų19.91%0.00911%0.114CC..Iπ-helixtrans-122-55.8-170-55.1-88.6000111.5A115 N123 L344 L345 V348 V350A115-F119 WeakPolarHBondContact O-CB 3.39Å; A115-F119 PolarHBondContact O-N 2.63Å; F119-N123 WeakPolarHBondContact O-CB 3.34Å; F119-N123 VanDerWaalsContact O-CG 3.28Å; F119-N123 PolarHBondContact O-N 3.29Å; F119-N123 PolarHBondContact O-ND2 3.4Å; F119-L344 HydrophobicContact CD2-CB 4.32Å; F119-L344 HydrophobicContact CE1-CB 4.16Å; F119-L344 HydrophobicContact CE2-CB 3.44Å; F119-L344 VanDerWaalsContact CE2-CB 3.44Å; F119-L344 HydrophobicContact CE2-CD1 3.87Å; F119-L344 HydrophobicContact CE2-CG 4.27Å; F119-L344 HydrophobicContact CZ-CB 3.35Å; F119-L345 HydrophobicContact CE1-CD2 3.85Å; F119-L345 HydrophobicContact CE1-CG 4.17Å; F119-L345 HydrophobicContact CZ-CD2 4.04Å; F119-L345 HydrophobicContact CZ-CG 3.98Å; F119-V348 HydrophobicContact CB-CB 4.42Å; F119-V348 HydrophobicContact CB-CG1 3.82Å; F119-V348 HydrophobicContact CD1-CB 3.61Å; F119-V348 HydrophobicContact CD1-CG1 3.82Å; F119-V348 HydrophobicContact CD1-CG2 4.42Å; F119-V348 HydrophobicContact CE1-CB 4.2Å; F119-V348 HydrophobicContact CG-CB 4.19Å; F119-V348 HydrophobicContact CG-CG1 4.13Å; F119-V350 HydrophobicContact CB-CG2 4.33Å; F119-V350 HydrophobicContact CD1-CG2 3.23Å; F119-V350 HydrophobicContact CE1-CG2 3.79Å; F119-V350 HydrophobicContact CG-CG2 4.12Å
120F85.8Confident84.3Confident0 Ų021.4 Ų21.40%013%0.127CC..Iπ-helixtrans-66.8-49.5-173-177.9-105.6000113A115 A116 L124 L143 F432 S435 A436 I439 I484A115-F120 PolarHBondContact O-N 3.19Å; A116-F120 PolarHBondContact O-N 2.99Å; F120-L124 HydrophobicContact CE1-CD2 4.37Å; F120-L124 VanDerWaalsContact O-CB 3.29Å; F120-L124 WeakPolarHBondContact O-CB 3.44Å; F120-L124 PolarHBondContact O-N 3.28Å; F120-L143 HydrophobicContact CD1-CD1 4.42Å; F120-L143 HydrophobicContact CE1-CD1 3.16Å; F120-L143 HydrophobicContact CZ-CD1 3.4Å; F120-F432 AromaticContact CD2-CD2 3.95Å; F120-F432 HydrophobicContact CD2-CD2 3.95Å; F120-F432 AromaticContact CD2-CE2 3.97Å; F120-F432 HydrophobicContact CD2-CE2 3.97Å; F120-F432 AromaticContact CE2-CD2 3.68Å; F120-F432 HydrophobicContact CE2-CD2 3.68Å; F120-F432 AromaticContact CE2-CE2 3.22Å; F120-F432 HydrophobicContact CE2-CE2 3.22Å; F120-F432 AromaticContact CE2-CZ 3.92Å; F120-F432 HydrophobicContact CE2-CZ 3.92Å; F120-F432 HydrophobicContact CZ-CD2 4.4Å; F120-F432 AromaticContact CZ-CE2 3.63Å; F120-F432 HydrophobicContact CZ-CE2 3.63Å; F120-F432 HydrophobicContact CZ-CZ 4.32Å; F120-S435 WeakPolarHBondContact CA-OG 3.42Å; F120-S435 WeakPolarHBondContact CD2-OG 3.34Å; F120-A436 HydrophobicContact CD2-CB 4.5Å; F120-A436 HydrophobicContact CE2-CB 4.08Å; F120-I439 HydrophobicContact CB-CD1 3.93Å; F120-I439 HydrophobicContact CD1-CD1 4.35Å; F120-I439 HydrophobicContact CD2-CD1 4.13Å; F120-I439 HydrophobicContact CG-CD1 3.92Å; F120-I484 HydrophobicContact CE1-CD1 4.44Å
121C80.3Confident84Confident5 Ų523.5 Ų23.53%0.03414%0.138CC..Hα-helixtrans-67.1-45.3-176.7-51.70000114.1A116 N123 L124 S125 I484A116-C121 PolarHBondContact O-N 3.18Å; A116-C121 VanDerWaalsContact O-N 3.08Å; A116-C121 PolarHBondContact O-SG 3Å; C121-N123 PolarHBondContact O-N 3.32Å; C121-L124 PolarHBondContact O-N 3.08Å; C121-S125 PolarHBondContact O-N 3.08Å; C121-I484 HydrophobicContact CB-CG1 4.26Å; C121-I484 WeakPolarHBondContact SG-CG1 3.48Å
122P84.1Confident83.5Confident19 Ų1930.5 Ų30.512%0.12317%0.17CC..Hα-helixtrans-61.2-42.2177.2-25.136.2000112.8L124 S125 A126 V350 V351P122-L124 VanDerWaalsContact C-N 3.32Å; P122-L124 PolarHBondContact O-N 3.29Å; P122-S125 WeakPolarHBondContact O-CB 3.4Å; P122-S125 PolarHBondContact O-N 3.27Å; P122-A126 PolarHBondContact O-N 2.96Å; P122-V350 HydrophobicContact CB-CG1 4.17Å; P122-V351 CarbonylContact C-O 3.59Å
123N87.9Confident82.9Confident0 Ų032.6 Ų32.60%018%0.184CC..Hα-helixtrans-62.8-40176.4-76.4-31.9000112F119 C121 A126 I127 P349 V350 V351 A428 G431 F432F119-N123 WeakPolarHBondContact O-CB 3.34Å; F119-N123 VanDerWaalsContact O-CG 3.28Å; F119-N123 PolarHBondContact O-N 3.29Å; F119-N123 PolarHBondContact O-ND2 3.4Å; C121-N123 PolarHBondContact O-N 3.32Å; N123-A126 PolarHBondContact O-N 3.05Å; N123-I127 VanDerWaalsContact O-CG1 3.25Å; N123-I127 WeakPolarHBondContact O-CG1 3.23Å; N123-I127 PolarHBondContact O-N 3.31Å; N123-P349 PolarHBondContact ND2-O 3.04Å; N123-P349 PolarHBondContact OD1-O 3.47Å; N123-V350 WeakPolarHBondContact OD1-CA 3.43Å; N123-V351 PolarHBondContact OD1-N 3.39Å; N123-A428 WeakPolarHBondContact CB-O 3.39Å; N123-G431 VanDerWaalsContact ND2-CA 3.34Å; N123-G431 WeakPolarHBondContact ND2-CA 3.36Å; N123-F432 HydrophobicContact CB-CB 4.19Å
124L84.2Confident82.4Confident3 Ų333.8 Ų33.82%0.01619%0.19CC..Hα-helixtrans-66.1-38.9175.4-17858.8000112.5F120 C121 P122 I127 S128 F142 L143 F432 I484 M492F120-L124 HydrophobicContact CE1-CD2 4.37Å; F120-L124 VanDerWaalsContact O-CB 3.29Å; F120-L124 WeakPolarHBondContact O-CB 3.44Å; F120-L124 PolarHBondContact O-N 3.28Å; C121-L124 PolarHBondContact O-N 3.08Å; P122-L124 VanDerWaalsContact C-N 3.32Å; P122-L124 PolarHBondContact O-N 3.29Å; L124-I127 PolarHBondContact O-N 3.11Å; L124-S128 WeakPolarHBondContact O-CB 3.41Å; L124-S128 PolarHBondContact O-N 2.71Å; L124-F142 HydrophobicContact CD1-CB 3.76Å; L124-L143 HydrophobicContact CD2-CB 4.06Å; L124-L143 HydrophobicContact CD2-CD1 4.15Å; L124-L143 HydrophobicContact CD2-CD2 4.4Å; L124-L143 HydrophobicContact CD2-CG 4.47Å; L124-F432 HydrophobicContact CB-CD2 4.17Å; L124-F432 HydrophobicContact CB-CE2 4.44Å; L124-F432 HydrophobicContact CD1-CD2 4.2Å; L124-F432 HydrophobicContact CD1-CE2 3.87Å; L124-I484 HydrophobicContact CD2-CD1 4.22Å; L124-M492 HydrophobicContact CD1-CE 4.08Å; L124-M492 HydrophobicContact CD2-CE 3.19Å; L124-M492 HydrophobicContact CG-CE 3.55Å
125S81.5Confident81.9Confident23 Ų2336.9 Ų36.916%0.16120%0.204CC..Hα-helixtrans-62.6-44.9172.1-174.90000111.4C121 P122 I127 S128 S129C121-S125 PolarHBondContact O-N 3.08Å; P122-S125 WeakPolarHBondContact O-CB 3.4Å; P122-S125 PolarHBondContact O-N 3.27Å; S125-I127 PolarHBondContact O-N 3.31Å; S125-S128 PolarHBondContact O-N 3.03Å; S125-S129 WeakPolarHBondContact O-CB 3.31Å; S125-S129 PolarHBondContact O-N 3.33Å; S125-S129 PolarHBondContact O-OG 3.4Å
126A84.1Confident81.1Confident3 Ų338.9 Ų38.93%0.02521%0.214CC..Hα-helixtrans-59.5-42.6174.800000112.1P122 N123 S129 T130 V351 P353 A428P122-A126 PolarHBondContact O-N 2.96Å; N123-A126 PolarHBondContact O-N 3.05Å; A126-S129 PolarHBondContact O-N 3.05Å; A126-S129 PolarHBondContact O-OG 3.47Å; A126-T130 WeakPolarHBondContact O-CB 3.4Å; A126-T130 PolarHBondContact O-N 2.86Å; A126-T130 PolarHBondContact O-OG1 3.37Å; A126-V351 HydrophobicContact CB-CB 4.18Å; A126-V351 HydrophobicContact CB-CG1 3.94Å; A126-P353 HydrophobicContact CB-CG 4.49Å; A126-A428 HydrophobicContact CB-CB 3.7Å
127I85.1Confident80.8Confident10 Ų1039.6 Ų39.65%0.05122%0.219CC..Hα-helixtrans-63.9-47.3175-67.3162.7000110.9N123 L124 S125 S129 T130 L131 F142 A428 F429 F432N123-I127 VanDerWaalsContact O-CG1 3.25Å; N123-I127 WeakPolarHBondContact O-CG1 3.23Å; N123-I127 PolarHBondContact O-N 3.31Å; L124-I127 PolarHBondContact O-N 3.11Å; S125-I127 PolarHBondContact O-N 3.31Å; I127-S129 VanDerWaalsContact C-N 3.31Å; I127-S129 PolarHBondContact O-N 3.47Å; I127-T130 PolarHBondContact O-N 3.47Å; I127-T130 VanDerWaalsContact O-N 3.16Å; I127-L131 HydrophobicContact CG2-CD1 3.68Å; I127-L131 HydrophobicContact CG2-CG 4.35Å; I127-L131 WeakPolarHBondContact O-CB 3.25Å; I127-L131 WeakPolarHBondContact O-CG 3.4Å; I127-L131 PolarHBondContact O-N 3.29Å; I127-F142 HydrophobicContact CG2-CD2 4.41Å; I127-F142 HydrophobicContact CG2-CE2 4.31Å; I127-A428 HydrophobicContact CG1-CB 4.17Å; I127-F429 HydrophobicContact CD1-CD2 4.34Å; I127-F432 HydrophobicContact CD1-CB 3.48Å; I127-F432 VanDerWaalsContact CD1-CB 3.48Å; I127-F432 HydrophobicContact CD1-CD1 4.23Å; I127-F432 HydrophobicContact CD1-CD2 4.27Å; I127-F432 HydrophobicContact CD1-CG 3.73Å
128S81.8Confident80.7Confident6 Ų638 Ų384%0.04221%0.207CC..Hα-helixtrans-60.5-41.5179.7-1700000111.9L124 S125 H132 C133L124-S128 WeakPolarHBondContact O-CB 3.41Å; L124-S128 PolarHBondContact O-N 2.71Å; S125-S128 PolarHBondContact O-N 3.03Å; S128-H132 PolarHBondContact O-N 3.48Å; S128-C133 PolarHBondContact O-N 3.15Å; S128-C133 PolarHBondContact OG-O 3.03Å
129S80.4Confident80.4Confident60 Ų6033 Ų3342%0.4219%0.185SC..Hα-helixtrans-68.9-34.2176.770.30000112.4S125 A126 I127 H132S125-S129 WeakPolarHBondContact O-CB 3.31Å; S125-S129 PolarHBondContact O-N 3.33Å; S125-S129 PolarHBondContact O-OG 3.4Å; A126-S129 PolarHBondContact O-N 3.05Å; A126-S129 PolarHBondContact O-OG 3.47Å; I127-S129 VanDerWaalsContact C-N 3.31Å; I127-S129 PolarHBondContact O-N 3.47Å; S129-H132 PolarHBondContact O-CD2 3.29Å; S129-H132 VanDerWaalsContact O-CD2 3.24Å
130T81.5Confident79.9Confident72 Ų7233.6 Ų33.644%0.44219%0.189SC..Hα-helixtrans-74-37.7178.2-56.50000111.9A126 I127 H132 P425A126-T130 WeakPolarHBondContact O-CB 3.4Å; A126-T130 PolarHBondContact O-N 2.86Å; A126-T130 PolarHBondContact O-OG1 3.37Å; I127-T130 PolarHBondContact O-N 3.47Å; I127-T130 VanDerWaalsContact O-N 3.16Å; T130-H132 VanDerWaalsContact C-N 3.33Å; T130-P425 HydrophobicContact CG2-CB 3.89Å; T130-P425 HydrophobicContact CG2-CG 4.27Å
131L78.9Confident79.8Confident93 Ų9336.1 Ų36.149%0.48721%0.205SC..THydrogen-bonded Turntrans-86.91.6-179.1-66176.3000113.9I127 C133 F142I127-L131 HydrophobicContact CG2-CD1 3.68Å; I127-L131 HydrophobicContact CG2-CG 4.35Å; I127-L131 WeakPolarHBondContact O-CB 3.25Å; I127-L131 WeakPolarHBondContact O-CG 3.4Å; I127-L131 PolarHBondContact O-N 3.29Å; L131-C133 HydrophobicContact CB-CB 4.48Å; L131-C133 PolarHBondContact O-N 2.9Å; L131-C133 PolarHBondContact O-SG 2.93Å; L131-C133 VanDerWaalsContact O-SG 3.39Å; L131-F142 HydrophobicContact CD1-CE1 4.46Å; L131-F142 HydrophobicContact CD1-CE2 3.59Å; L131-F142 HydrophobicContact CD1-CZ 3.42Å; L131-F142 VanDerWaalsContact CD1-CZ 3.42Å
132H78.1Confident79.8Confident169 Ų16938.1 Ų38.178%0.78221%0.213SC*.THydrogen-bonded Turntrans48.831.3-174.2-65176.5000113.5S128 S129 T130S128-H132 PolarHBondContact O-N 3.48Å; S129-H132 PolarHBondContact O-CD2 3.29Å; S129-H132 VanDerWaalsContact O-CD2 3.24Å; T130-H132 VanDerWaalsContact C-N 3.33Å
133C73.1Confident79.7Confident45 Ų4537.2 Ų37.230%0.30421%0.207SC..  trans-86.2148.2-179.6-72.20000110.6S128 L131S128-C133 PolarHBondContact O-N 3.15Å; S128-C133 PolarHBondContact OG-O 3.03Å; L131-C133 HydrophobicContact CB-CB 4.48Å; L131-C133 PolarHBondContact O-N 2.9Å; L131-C133 PolarHBondContact O-SG 2.93Å; L131-C133 VanDerWaalsContact O-SG 3.39Å
134S74.4Confident79.4Confident43 Ų4337.3 Ų37.330%0.30121%0.208SC..  trans-69.3144.5171.374.80000110.2N136 V137 A138S134-N136 PolarHBondContact O-N 2.84Å; S134-N136 VanDerWaalsContact O-N 3.08Å; S134-V137 PolarHBondContact O-N 2.7Å; S134-V137 WeakPolarHBondContact OG-CG2 3.44Å; S134-V137 PolarHBondContact OG-N 3.28Å; S134-A138 PolarHBondContact O-N 3.42Å
135H73.8Confident79.3Confident80 Ų8041.3 Ų41.337%0.3723%0.229SC..Hα-helixtrans-52.3-33.7177.7-60.290.2000112.9A138 G139 Y489 M492H135-A138 PolarHBondContact O-N 2.88Å; H135-G139 PolarHBondContact O-N 3.08Å; H135-Y489 AromaticContact CD2-CD1 3.38Å; H135-Y489 WeakPolarHBondContact CD2-CD1 3.22Å; H135-Y489 AromaticContact CD2-CE1 3.45Å; H135-Y489 VanDerWaalsContact CD2-CE1 3.45Å; H135-Y489 WeakPolarHBondContact CD2-CE1 3.25Å; H135-Y489 AromaticContact CE1-CE1 3.97Å; H135-Y489 AromaticContact CG-CD1 3.99Å; H135-Y489 AromaticContact NE2-CD1 3.68Å; H135-Y489 AromaticContact NE2-CE1 3.21Å; H135-Y489 WeakPolarHBondContact NE2-CE1 3.44Å; H135-M492 HydrophobicContact CB-CB 4.26Å; H135-M492 HydrophobicContact CB-SD 4.22Å; H135-M492 WeakPolarHBondContact O-CG 3.49Å
136N71.8Confident79Confident43 Ų4340.6 Ų40.623%0.2323%0.225CC..Hα-helixtrans-65.7-42176.2-67.3-0.1000112.1S134 G139 V140 R491S134-N136 PolarHBondContact O-N 2.84Å; S134-N136 VanDerWaalsContact O-N 3.08Å; N136-G139 PolarHBondContact O-N 3.08Å; N136-V140 WeakPolarHBondContact O-CG2 3.23Å; N136-V140 PolarHBondContact O-N 2.82Å; N136-R491 WeakPolarHBondContact OD1-CB 3.47Å
137V77.9Confident78.6Confident16 Ų1641.2 Ų41.210%0.09723%0.228CC..Hα-helixtrans-69.7-40.5176.9174.20000110.7S134 G139 V140 T141 S246S134-V137 PolarHBondContact O-N 2.7Å; S134-V137 WeakPolarHBondContact OG-CG2 3.44Å; S134-V137 PolarHBondContact OG-N 3.28Å; V137-G139 PolarHBondContact O-N 3.35Å; V137-V140 PolarHBondContact O-N 3.02Å; V137-T141 WeakPolarHBondContact O-CB 3.26Å; V137-T141 PolarHBondContact O-N 2.87Å; V137-T141 PolarHBondContact O-OG1 3.45Å; V137-S246 VanDerWaalsContact CG2-CB 3.5Å; V137-S246 WeakPolarHBondContact CG2-OG 3.15Å
138A78.8Confident78.1Confident0 Ų040.8 Ų40.80%023%0.226CC..Hα-helixtrans-59.1-37.3174.200000111.7S134 H135 F142 L143 M492S134-A138 PolarHBondContact O-N 3.42Å; H135-A138 PolarHBondContact O-N 2.88Å; A138-F142 HydrophobicContact CB-CD2 4.44Å; A138-F142 WeakPolarHBondContact O-CB 3.45Å; A138-F142 PolarHBondContact O-N 3.01Å; A138-L143 PolarHBondContact O-N 3.48Å; A138-M492 HydrophobicContact CB-CE 3.82Å; A138-M492 HydrophobicContact CB-SD 4.45Å
139G77.5Confident77.7Confident0 Ų041.7 Ų41.70%023%0.234CC..Iπ-helixtrans-64.5-56173.900000113.1H135 N136 V137 T141 L143 A144H135-G139 PolarHBondContact O-N 3.08Å; N136-G139 PolarHBondContact O-N 3.08Å; V137-G139 PolarHBondContact O-N 3.35Å; G139-T141 PolarHBondContact O-N 3.24Å; G139-L143 WeakPolarHBondContact O-CB 3.04Å; G139-A144 PolarHBondContact O-N 3.41Å
140V77.8Confident77.1Confident15 Ų1539.6 Ų39.69%0.09122%0.219CC..Iπ-helixtrans-66.3-25.6-1771790000112.8N136 V137 A144 Y238 V242 A495N136-V140 WeakPolarHBondContact O-CG2 3.23Å; N136-V140 PolarHBondContact O-N 2.82Å; V137-V140 PolarHBondContact O-N 3.02Å; V140-A144 VanDerWaalsContact O-CB 3.25Å; V140-A144 WeakPolarHBondContact O-CB 3.44Å; V140-Y238 HydrophobicContact CG1-CE1 4.11Å; V140-Y238 VanDerWaalsContact CG1-OH 3.24Å; V140-Y238 WeakPolarHBondContact CG1-OH 3.45Å; V140-V242 HydrophobicContact CB-CG1 4.38Å; V140-V242 HydrophobicContact CG1-CG1 4.06Å; V140-V242 HydrophobicContact CG1-CG2 4.02Å; V140-A495 HydrophobicContact CG2-CB 3.66Å
141T82.1Confident76.7Confident53 Ų5337.4 Ų37.433%0.32521%0.205SC..Iπ-helixtrans-106.5-63.6-174.2-52.20000112.9V137 G139 L145V137-T141 WeakPolarHBondContact O-CB 3.26Å; V137-T141 PolarHBondContact O-N 2.87Å; V137-T141 PolarHBondContact O-OG1 3.45Å; G139-T141 PolarHBondContact O-N 3.24Å; T141-L145 WeakPolarHBondContact O-CB 3.21Å; T141-L145 PolarHBondContact O-N 3.3Å
142F81.9Confident76.7Confident47 Ų4733.2 Ų33.221%0.20618%0.183CC..Iπ-helixtrans-77.3-49.1-173-67-64000111.5L124 I127 L131 A138 L145 G146 F432L124-F142 HydrophobicContact CD1-CB 3.76Å; I127-F142 HydrophobicContact CG2-CD2 4.41Å; I127-F142 HydrophobicContact CG2-CE2 4.31Å; L131-F142 HydrophobicContact CD1-CE1 4.46Å; L131-F142 HydrophobicContact CD1-CE2 3.59Å; L131-F142 HydrophobicContact CD1-CZ 3.42Å; L131-F142 VanDerWaalsContact CD1-CZ 3.42Å; A138-F142 HydrophobicContact CB-CD2 4.44Å; A138-F142 WeakPolarHBondContact O-CB 3.45Å; A138-F142 PolarHBondContact O-N 3.01Å; F142-L145 PolarHBondContact O-N 3.01Å; F142-G146 PolarHBondContact O-N 3.45Å; F142-F432 HydrophobicContact CB-CZ 4.3Å; F142-F432 VanDerWaalsContact O-CZ 3.28Å; F142-F432 WeakPolarHBondContact O-CZ 3.34Å
143L81.5Confident76.5Confident0 Ų028.3 Ų28.30%016%0.159CC..Iπ-helixtrans-64.2-50.1-179178.653.3000111.6F120 L124 A138 G139 L145 G146 N147 I484 M492 A496F120-L143 HydrophobicContact CD1-CD1 4.42Å; F120-L143 HydrophobicContact CE1-CD1 3.16Å; F120-L143 HydrophobicContact CZ-CD1 3.4Å; L124-L143 HydrophobicContact CD2-CB 4.06Å; L124-L143 HydrophobicContact CD2-CD1 4.15Å; L124-L143 HydrophobicContact CD2-CD2 4.4Å; L124-L143 HydrophobicContact CD2-CG 4.47Å; A138-L143 PolarHBondContact O-N 3.48Å; G139-L143 WeakPolarHBondContact O-CB 3.04Å; L143-L145 VanDerWaalsContact C-N 3.31Å; L143-L145 PolarHBondContact O-N 3.29Å; L143-G146 PolarHBondContact O-N 2.88Å; L143-N147 PolarHBondContact O-N 3.45Å; L143-I484 HydrophobicContact CD1-CD1 3.77Å; L143-I484 HydrophobicContact CD2-CD1 3.32Å; L143-I484 HydrophobicContact CG-CD1 4.22Å; L143-M492 HydrophobicContact CB-CE 4.34Å; L143-M492 HydrophobicContact CD2-CE 4.14Å; L143-M492 HydrophobicContact CD2-CG 4.26Å; L143-A496 HydrophobicContact CB-CB 3.97Å; L143-A496 HydrophobicContact CD2-CB 3.28Å; L143-A496 HydrophobicContact CG-CB 3.38Å
144A82.4Confident76.4Confident3 Ų328.7 Ų28.73%0.02516%0.162CC..Hα-helixtrans-57.4-41.2176.100000112.9G139 V140 G148G139-A144 PolarHBondContact O-N 3.41Å; V140-A144 VanDerWaalsContact O-CB 3.25Å; V140-A144 WeakPolarHBondContact O-CB 3.44Å; A144-G148 WeakPolarHBondContact O-CA 3.15Å; A144-G148 PolarHBondContact O-N 3.25Å
145L81Confident76.5Confident87 Ų8727.2 Ų27.246%0.45515%0.152SC..Hα-helixtrans-71.6-39.7176.7-174.1150.9000111.9T141 F142 L143 N147 G148 A149 F503T141-L145 WeakPolarHBondContact O-CB 3.21Å; T141-L145 PolarHBondContact O-N 3.3Å; F142-L145 PolarHBondContact O-N 3.01Å; L143-L145 VanDerWaalsContact C-N 3.31Å; L143-L145 PolarHBondContact O-N 3.29Å; L145-N147 VanDerWaalsContact C-N 3.34Å; L145-N147 PolarHBondContact O-N 2.98Å; L145-G148 PolarHBondContact O-N 3.35Å; L145-A149 HydrophobicContact CD2-CB 4.47Å; L145-A149 WeakPolarHBondContact O-CB 3.3Å; L145-A149 PolarHBondContact O-N 3.37Å; L145-F503 HydrophobicContact CB-CE1 4.38Å; L145-F503 HydrophobicContact CG-CE1 4.26Å; L145-F503 HydrophobicContact CG-CZ 4.39Å
146G75.1Confident76.8Confident7 Ų725.4 Ų25.47%0.07215%0.145CC..Hα-helixtrans-60.5-43.3179.300000112.4F142 L143F142-G146 PolarHBondContact O-N 3.45Å; L143-G146 PolarHBondContact O-N 2.88Å
147N76.6Confident76.8Confident16 Ų1626 Ų269%0.08616%0.155CC..Hα-helixtrans-80.1-41.4176.2-66-5.6000112.6L143 L145 P150 D477 S480L143-N147 PolarHBondContact O-N 3.45Å; L145-N147 VanDerWaalsContact C-N 3.34Å; L145-N147 PolarHBondContact O-N 2.98Å; N147-P150 WeakPolarHBondContact O-CD 3.29Å; N147-D477 WeakPolarHBondContact CB-OD1 3.25Å; N147-D477 PolarHBondContact ND2-OD1 3.5Å; N147-S480 PolarHBondContact ND2-OG 3.42Å
148G73.4Confident76.7Confident1 Ų126.9 Ų26.91%0.0116%0.164CC..Hα-helixtrans-83.6-18.1-171.900000115.6A144 L145 D151 I152 N504A144-G148 WeakPolarHBondContact O-CA 3.15Å; A144-G148 PolarHBondContact O-N 3.25Å; L145-G148 PolarHBondContact O-N 3.35Å; G148-D151 PolarHBondContact O-N 3.35Å; G148-I152 WeakPolarHBondContact O-CD1 3.4Å; G148-I152 WeakPolarHBondContact O-CG1 3.44Å; G148-I152 PolarHBondContact O-N 3.26Å; G148-N504 WeakPolarHBondContact CA-OD1 3.31Å; G148-N504 PolarHBondContact O-OD1 2.9Å
149A73.1Confident76.8Confident25 Ų2526.9 Ų26.921%0.20716%0.164CC..Hα-helixtrans-59.9-47.6-178.700000113.7L145 D151 I152 F153L145-A149 HydrophobicContact CD2-CB 4.47Å; L145-A149 WeakPolarHBondContact O-CB 3.3Å; L145-A149 PolarHBondContact O-N 3.37Å; A149-D151 VanDerWaalsContact C-N 3.34Å; A149-D151 PolarHBondContact O-N 3.47Å; A149-I152 PolarHBondContact O-N 3.01Å; A149-F153 HydrophobicContact CB-CE2 4.48Å; A149-F153 WeakPolarHBondContact O-CD2 3.28Å; A149-F153 PolarHBondContact O-N 3.37Å
150P67.8Low76.6Confident16 Ų1628.2 Ų28.210%0.10417%0.174CC..Hα-helixtrans-60.9-39.8173.6-1828.7000113.7N147 I152 F153 S154 S440N147-P150 WeakPolarHBondContact O-CD 3.29Å; P150-I152 VanDerWaalsContact C-N 3.3Å; P150-I152 PolarHBondContact O-N 2.8Å; P150-F153 PolarHBondContact O-N 3.45Å; P150-S154 PolarHBondContact O-N 3.37Å; P150-S154 VanDerWaalsContact O-N 3.12Å; P150-S154 PolarHBondContact O-OG 3.38Å; P150-S440 WeakPolarHBondContact CB-OG 3.46Å; P150-S440 VanDerWaalsContact CG-CB 3.42Å; P150-S440 WeakPolarHBondContact CG-OG 3.35Å
151D73.4Confident76.4Confident27 Ų2732.2 Ų32.214%0.14419%0.191CC..Hα-helixtrans-62.6-39.8178-62.6-22.3000111.1G148 A149 S154 A155 N504G148-D151 PolarHBondContact O-N 3.35Å; A149-D151 VanDerWaalsContact C-N 3.34Å; A149-D151 PolarHBondContact O-N 3.47Å; D151-S154 PolarHBondContact O-N 3.46Å; D151-A155 VanDerWaalsContact O-CB 3.27Å; D151-A155 WeakPolarHBondContact O-CB 2.97Å; D151-A155 PolarHBondContact O-N 3.33Å; D151-N504 WeakPolarHBondContact CB-ND2 3.43Å; D151-N504 PolarHBondContact OD2-ND2 2.87Å
152I78.8Confident75.7Confident5 Ų532.1 Ų32.13%0.02619%0.192CC..Hα-helixtrans-64.8-43.5177.1-77.9158.2000111.9G148 A149 P150 S154 A155 M156 F503 N504 F507G148-I152 WeakPolarHBondContact O-CD1 3.4Å; G148-I152 WeakPolarHBondContact O-CG1 3.44Å; G148-I152 PolarHBondContact O-N 3.26Å; A149-I152 PolarHBondContact O-N 3.01Å; P150-I152 VanDerWaalsContact C-N 3.3Å; P150-I152 PolarHBondContact O-N 2.8Å; I152-S154 PolarHBondContact O-N 3.07Å; I152-A155 PolarHBondContact O-N 3.45Å; I152-M156 WeakPolarHBondContact O-CB 3.22Å; I152-M156 PolarHBondContact O-N 2.85Å; I152-F503 HydrophobicContact CD1-CD1 3.24Å; I152-F503 HydrophobicContact CD1-CD2 3.79Å; I152-F503 HydrophobicContact CD1-CE1 2.98Å; I152-F503 HydrophobicContact CD1-CE2 3.56Å; I152-F503 HydrophobicContact CD1-CG 3.66Å; I152-F503 HydrophobicContact CD1-CZ 3.15Å; I152-F503 HydrophobicContact CG1-CE1 4.42Å; I152-N504 WeakPolarHBondContact CG1-OD1 3.41Å; I152-F507 HydrophobicContact CD1-CD1 4.09Å; I152-F507 HydrophobicContact CG2-CD1 4.13Å; I152-F507 HydrophobicContact CG2-CE1 4.33Å
153F74.1Confident75.1Confident66 Ų6635.7 Ų35.729%0.28921%0.209SC..Hα-helixtrans-62.9-38.3178.2-68.6-61.1000111.3A149 P150 M156 A157 F380A149-F153 HydrophobicContact CB-CE2 4.48Å; A149-F153 WeakPolarHBondContact O-CD2 3.28Å; A149-F153 PolarHBondContact O-N 3.37Å; P150-F153 PolarHBondContact O-N 3.45Å; F153-M156 HydrophobicContact CD1-CE 4.01Å; F153-A157 WeakPolarHBondContact O-CB 3.38Å; F153-A157 PolarHBondContact O-N 3.3Å; F153-A157 VanDerWaalsContact O-N 3.08Å; F153-F380 HydrophobicContact CD2-CZ 4.46Å; F153-F380 HydrophobicContact CE2-CZ 4.46Å
154S71.9Confident74.8Confident52 Ų5236.7 Ų36.736%0.36422%0.215SC..Hα-helixtrans-67.9-47.6176.7-49.30000111.4P150 D151 I152 M156 A157 A158P150-S154 PolarHBondContact O-N 3.37Å; P150-S154 VanDerWaalsContact O-N 3.12Å; P150-S154 PolarHBondContact O-OG 3.38Å; D151-S154 PolarHBondContact O-N 3.46Å; I152-S154 PolarHBondContact O-N 3.07Å; S154-M156 PolarHBondContact O-N 3.39Å; S154-A157 PolarHBondContact O-N 3.18Å; S154-A158 WeakPolarHBondContact O-CB 3.12Å; S154-A158 PolarHBondContact O-N 2.96Å
155A76.2Confident74.6Confident12 Ų1236.6 Ų36.610%0.09921%0.214CC..Hα-helixtrans-63.2-40.9177.100000112D151 I152 A158 I159D151-A155 VanDerWaalsContact O-CB 3.27Å; D151-A155 WeakPolarHBondContact O-CB 2.97Å; D151-A155 PolarHBondContact O-N 3.33Å; I152-A155 PolarHBondContact O-N 3.45Å; A155-A158 PolarHBondContact O-N 2.97Å; A155-I159 WeakPolarHBondContact O-CB 3.43Å; A155-I159 WeakPolarHBondContact O-CD1 3.5Å; A155-I159 WeakPolarHBondContact O-CG1 3.48Å; A155-I159 PolarHBondContact O-N 3.19Å
156M79.1Confident74.4Confident43 Ų4332.6 Ų32.621%0.21219%0.193CC..Hα-helixtrans-62.6-42.6176.8-176.5-176.368.400111.4I152 F153 S154 I159 S160 L511 V515I152-M156 WeakPolarHBondContact O-CB 3.22Å; I152-M156 PolarHBondContact O-N 2.85Å; F153-M156 HydrophobicContact CD1-CE 4.01Å; S154-M156 PolarHBondContact O-N 3.39Å; M156-I159 PolarHBondContact O-N 3.13Å; M156-S160 PolarHBondContact O-N 3.04Å; M156-L511 HydrophobicContact SD-CD2 3.63Å; M156-L511 HydrophobicContact SD-CG 3.78Å; M156-V515 HydrophobicContact CG-CG2 4.36Å; M156-V515 HydrophobicContact SD-CG2 4.13Å
157A73.3Confident74.5Confident54 Ų5434 Ų3445%0.44620%0.199SC..Hα-helixtrans-68.1-34.6175.800000112.9F153 S154 S160 H161F153-A157 WeakPolarHBondContact O-CB 3.38Å; F153-A157 PolarHBondContact O-N 3.3Å; F153-A157 VanDerWaalsContact O-N 3.08Å; S154-A157 PolarHBondContact O-N 3.18Å; A157-S160 PolarHBondContact O-OG 3.42Å; A157-H161 PolarHBondContact O-ND1 3.27Å
158A76Confident74.6Confident35 Ų3533.8 Ų33.829%0.28920%0.2SC..Hα-helixtrans-71.4-35.2175.200000112.1S154 A155 T164 A168S154-A158 WeakPolarHBondContact O-CB 3.12Å; S154-A158 PolarHBondContact O-N 2.96Å; A155-A158 PolarHBondContact O-N 2.97Å; A158-T164 PolarHBondContact O-OG1 3.26Å; A158-A168 HydrophobicContact CB-CB 3.73Å
159I79.8Confident75.2Confident0 Ų033.8 Ų33.80%020%0.2CC..Hα-helixtrans-80.9-23.8179.9-65.7166.6000111.8A155 M156 H161 A165 A168 V509 Q516A155-I159 WeakPolarHBondContact O-CB 3.43Å; A155-I159 WeakPolarHBondContact O-CD1 3.5Å; A155-I159 WeakPolarHBondContact O-CG1 3.48Å; A155-I159 PolarHBondContact O-N 3.19Å; M156-I159 PolarHBondContact O-N 3.13Å; I159-H161 PolarHBondContact O-N 3Å; I159-A165 HydrophobicContact CG2-CB 4.32Å; I159-A168 HydrophobicContact CD1-CB 4.42Å; I159-A168 HydrophobicContact CG1-CB 3.68Å; I159-V509 HydrophobicContact CD1-CB 4.19Å; I159-V509 HydrophobicContact CD1-CG1 4.25Å; I159-V509 HydrophobicContact CD1-CG2 4Å; I159-Q516 PolarHBondContact O-NE2 3.2Å; I159-Q516 PolarHBondContact O-OE1 3.26Å; I159-Q516 VanDerWaalsContact O-OE1 3.05Å
160S72.5Confident75.8Confident28 Ų2832.6 Ų32.620%0.19619%0.19CC..THydrogen-bonded Turntrans-61.8-15.5177.964.30000113.7M156 A157M156-S160 PolarHBondContact O-N 3.04Å; A157-S160 PolarHBondContact O-OG 3.42Å
161H73.6Confident76.6Confident100 Ų10033 Ų3346%0.46319%0.194SC..SBendtrans-105.1128.7176.7-61.393.2000111A157 I159 H163 T164 A165A157-H161 PolarHBondContact O-ND1 3.27Å; I159-H161 PolarHBondContact O-N 3Å; H161-H163 PolarHBondContact O-N 2.83Å; H161-T164 WeakPolarHBondContact CB-OG1 3.1Å; H161-T164 PolarHBondContact O-N 3.49Å; H161-T164 PolarHBondContact O-OG1 3.49Å; H161-A165 PolarHBondContact O-N 3.38Å
162P68.3Low77.3Confident51 Ų5132.6 Ų32.633%0.33119%0.192SC..THydrogen-bonded Turntrans-54.5-44.2-175.6-27.534.5000115.3T164 Q516P162-T164 VanDerWaalsContact C-N 3.32Å; P162-T164 PolarHBondContact O-N 3.14Å; P162-Q516 VanDerWaalsContact N-NE2 3.11Å
163H69.4Low77.9Confident122 Ų12232.4 Ų32.457%0.56519%0.191SC*.THydrogen-bonded Turntrans-74.9-18.1-174.3-60.9-64000114H161 E527H161-H163 PolarHBondContact O-N 2.83Å; H163-E527 IonicContact CE1-OE2 3.87Å; H163-E527 IonicContact CG-OE2 3.9Å; H163-E527 IonicContact ND1-OE1 3.99Å; H163-E527 IonicContact ND1-OE2 2.93Å; H163-E527 PolarHBondContact ND1-OE2 3.26Å
164T74.8Confident78.6Confident21 Ų2129.4 Ų29.413%0.12918%0.179CC..THydrogen-bonded Turntrans-106.4-8.6-176.952.10000113.4M44 A158 H161 P162 G166 L167 A168M44-T164 HydrophobicContact CB-CG2 3.83Å; M44-T164 HydrophobicContact CE-CG2 4.47Å; M44-T164 HydrophobicContact CG-CG2 4.13Å; M44-T164 HydrophobicContact SD-CG2 3.58Å; M44-T164 VanDerWaalsContact SD-CG2 3.58Å; A158-T164 PolarHBondContact O-OG1 3.26Å; H161-T164 WeakPolarHBondContact CB-OG1 3.1Å; H161-T164 PolarHBondContact O-N 3.49Å; H161-T164 PolarHBondContact O-OG1 3.49Å; P162-T164 VanDerWaalsContact C-N 3.32Å; P162-T164 PolarHBondContact O-N 3.14Å; T164-G166 PolarHBondContact O-N 3.41Å; T164-L167 PolarHBondContact O-N 2.86Å; T164-A168 WeakPolarHBondContact O-CB 3.44Å; T164-A168 PolarHBondContact O-N 2.91Å
165A77.6Confident79.5Confident0 Ų027.2 Ų27.20%016%0.164CC..Hα-helixtrans-61.2-41.1-177.300000113I159 H161 A168 V169 F526I159-A165 HydrophobicContact CG2-CB 4.32Å; H161-A165 PolarHBondContact O-N 3.38Å; A165-A168 PolarHBondContact O-N 3.34Å; A165-V169 WeakPolarHBondContact O-CG2 3.17Å; A165-V169 PolarHBondContact O-N 3.4Å; A165-V169 VanDerWaalsContact O-N 3.1Å; A165-F526 HydrophobicContact CB-CD1 4.11Å; A165-F526 HydrophobicContact CB-CE1 4.07Å
166G77.7Confident80.2Confident3 Ų326.7 Ų26.73%0.03116%0.159CC..Hα-helixtrans-63.7-44.7177.400000112.8T164 V169 G170T164-G166 PolarHBondContact O-N 3.41Å; G166-V169 PolarHBondContact O-N 3.08Å; G166-G170 PolarHBondContact O-N 3.46Å
167L76.4Confident80.9Confident37 Ų3724.7 Ų24.719%0.19415%0.15CC..Hα-helixtrans-64.8-40.2176.9-176.165.2000111.7M44 T164 G170 A171 L466M44-L167 HydrophobicContact CE-CD2 3.92Å; M44-L167 HydrophobicContact SD-CD2 4.49Å; T164-L167 PolarHBondContact O-N 2.86Å; L167-G170 PolarHBondContact O-N 2.96Å; L167-A171 PolarHBondContact O-N 2.88Å; L167-L466 HydrophobicContact CD1-CD2 4.23Å; L167-L466 HydrophobicContact CD1-CG 4.41Å
168A80.3Confident81.8Confident12 Ų1222.6 Ų22.610%0.09913%0.13CC..Hα-helixtrans-61.5-44.3177.200000112A158 I159 T164 A165 G170 A171 L172A158-A168 HydrophobicContact CB-CB 3.73Å; I159-A168 HydrophobicContact CD1-CB 4.42Å; I159-A168 HydrophobicContact CG1-CB 3.68Å; T164-A168 WeakPolarHBondContact O-CB 3.44Å; T164-A168 PolarHBondContact O-N 2.91Å; A165-A168 PolarHBondContact O-N 3.34Å; A168-G170 VanDerWaalsContact C-N 3.34Å; A168-A171 PolarHBondContact O-N 3.12Å; A168-L172 WeakPolarHBondContact O-CG 3.38Å; A168-L172 PolarHBondContact O-N 3.31Å
169V85.7Confident82.7Confident1 Ų121 Ų211%0.00612%0.117CC..Hα-helixtrans-64.5-39.9174.6176.20000111.2A165 G166 A171 L172 F173 T214 L218 V509 F526A165-V169 WeakPolarHBondContact O-CG2 3.17Å; A165-V169 PolarHBondContact O-N 3.4Å; A165-V169 VanDerWaalsContact O-N 3.1Å; G166-V169 PolarHBondContact O-N 3.08Å; V169-A171 VanDerWaalsContact C-N 3.35Å; V169-A171 PolarHBondContact O-N 3.46Å; V169-L172 WeakPolarHBondContact O-CB 3.41Å; V169-L172 PolarHBondContact O-N 2.85Å; V169-F173 HydrophobicContact CG1-CD2 4.48Å; V169-F173 HydrophobicContact CG1-CE2 4.04Å; V169-F173 HydrophobicContact CG1-CZ 4.23Å; V169-F173 PolarHBondContact O-N 3.04Å; V169-T214 HydrophobicContact CG1-CG2 3.42Å; V169-T214 VanDerWaalsContact CG1-CG2 3.42Å; V169-L218 HydrophobicContact CB-CD2 4.31Å; V169-L218 HydrophobicContact CG1-CD1 3.81Å; V169-L218 HydrophobicContact CG1-CD2 4.15Å; V169-L218 HydrophobicContact CG1-CG 4.16Å; V169-V509 HydrophobicContact CG2-CG1 4.25Å; V169-V509 HydrophobicContact CG2-CG2 4.36Å; V169-F526 HydrophobicContact CG2-CD1 4.44Å; V169-F526 HydrophobicContact CG2-CE1 3.87Å
170G85.2Confident83.3Confident0 Ų021 Ų210%012%0.117CC..Hα-helixtrans-61.2-42174.300000112.8G166 L167 A168 L172 F173 G174 L466G166-G170 PolarHBondContact O-N 3.46Å; L167-G170 PolarHBondContact O-N 2.96Å; A168-G170 VanDerWaalsContact C-N 3.34Å; G170-L172 VanDerWaalsContact C-N 3.28Å; G170-L172 PolarHBondContact O-N 3.22Å; G170-F173 PolarHBondContact O-N 2.8Å; G170-F173 VanDerWaalsContact O-N 3.13Å; G170-G174 PolarHBondContact O-N 3.39Å; G170-L466 WeakPolarHBondContact O-CD2 3.39Å
171A83.9Confident84.4Confident23 Ų2319.7 Ų19.719%0.1911%0.108CC..Hα-helixtrans-62.8-35.8175.300000111.4L167 A168 V169 G174 A175 A470L167-A171 PolarHBondContact O-N 2.88Å; A168-A171 PolarHBondContact O-N 3.12Å; V169-A171 VanDerWaalsContact C-N 3.35Å; V169-A171 PolarHBondContact O-N 3.46Å; A171-G174 PolarHBondContact O-N 2.95Å; A171-A175 WeakPolarHBondContact O-CB 3.28Å; A171-A175 PolarHBondContact O-N 3.45Å; A171-A470 WeakPolarHBondContact O-CB 2.82Å
172L88.6Confident85.4Confident20 Ų2015.7 Ų15.711%0.1059%0.091CC..Hα-helixtrans-65.6-36172.5-69.7172.4000112.8A168 V169 G170 G176 N504 M505 V509A168-L172 WeakPolarHBondContact O-CG 3.38Å; A168-L172 PolarHBondContact O-N 3.31Å; V169-L172 WeakPolarHBondContact O-CB 3.41Å; V169-L172 PolarHBondContact O-N 2.85Å; G170-L172 VanDerWaalsContact C-N 3.28Å; G170-L172 PolarHBondContact O-N 3.22Å; L172-G176 PolarHBondContact O-N 2.98Å; L172-N504 HydrophobicContact CD2-CB 4.18Å; L172-M505 HydrophobicContact CB-CE 3.97Å; L172-M505 HydrophobicContact CB-SD 4.44Å; L172-V509 HydrophobicContact CD1-CG2 3.21Å
173F90.8Very high86.6Confident0 Ų013.3 Ų13.30%08%0.075CC..Hα-helixtrans-66.5-39.9171.2-66.8-41.8000112.1V169 G170 G176 I177 V211 T214 L218 M505 V536 A537 L540V169-F173 HydrophobicContact CG1-CD2 4.48Å; V169-F173 HydrophobicContact CG1-CE2 4.04Å; V169-F173 HydrophobicContact CG1-CZ 4.23Å; V169-F173 PolarHBondContact O-N 3.04Å; G170-F173 PolarHBondContact O-N 2.8Å; G170-F173 VanDerWaalsContact O-N 3.13Å; F173-G176 PolarHBondContact O-N 2.78Å; F173-I177 PolarHBondContact O-N 3.22Å; F173-V211 HydrophobicContact CE1-CG1 4.16Å; F173-T214 HydrophobicContact CE1-CG2 4.02Å; F173-T214 HydrophobicContact CZ-CG2 3.65Å; F173-L218 HydrophobicContact CD2-CD1 4.48Å; F173-L218 HydrophobicContact CE2-CD1 3.51Å; F173-L218 HydrophobicContact CZ-CD1 4.17Å; F173-M505 HydrophobicContact CD1-CE 3.58Å; F173-M505 HydrophobicContact CE1-CE 3.78Å; F173-M505 HydrophobicContact CE1-SD 4.5Å; F173-V536 HydrophobicContact CB-CG1 3.64Å; F173-A537 HydrophobicContact CD2-CB 3.75Å; F173-A537 HydrophobicContact CE2-CB 3.62Å; F173-A537 HydrophobicContact CG-CB 4.35Å; F173-A537 HydrophobicContact CZ-CB 4.14Å; F173-L540 HydrophobicContact CB-CD2 4.24Å; F173-L540 HydrophobicContact CD1-CD2 3.58Å; F173-L540 HydrophobicContact CE1-CD2 4.37Å; F173-L540 HydrophobicContact CG-CD2 4.32Å
174G89.9Confident87.8Confident3 Ų37.6 Ų7.63%0.0315%0.049CC..Hα-helixtrans-60.5-45174.300000112.7G170 A171 G176 I177 F178 L466G170-G174 PolarHBondContact O-N 3.39Å; A171-G174 PolarHBondContact O-N 2.95Å; G174-G176 VanDerWaalsContact C-N 3.34Å; G174-I177 WeakPolarHBondContact O-CG2 3.35Å; G174-I177 PolarHBondContact O-N 3.46Å; G174-F178 WeakPolarHBondContact O-CB 3.35Å; G174-F178 PolarHBondContact O-N 3.41Å; G174-F178 VanDerWaalsContact O-N 3.08Å; G174-L466 WeakPolarHBondContact CA-O 3.27Å
175A89.8Confident88.7Confident7 Ų76.6 Ų6.66%0.0584%0.043CC..Hα-helixtrans-64.4-42.8174.700000110.3A171 I177 F178 V179A171-A175 WeakPolarHBondContact O-CB 3.28Å; A171-A175 PolarHBondContact O-N 3.45Å; A175-I177 PolarHBondContact O-N 3.47Å; A175-F178 PolarHBondContact O-N 3.43Å; A175-V179 WeakPolarHBondContact O-CG2 3.35Å; A175-V179 PolarHBondContact O-N 2.88Å
176G92.4Very high89.5Confident0 Ų07.7 Ų7.70%05%0.051CC..Hα-helixtrans-57-48.7176.700000113L172 F173 G174 V179 T180 Y207L172-G176 PolarHBondContact O-N 2.98Å; F173-G176 PolarHBondContact O-N 2.78Å; G174-G176 VanDerWaalsContact C-N 3.34Å; G176-V179 PolarHBondContact O-N 3.01Å; G176-T180 WeakPolarHBondContact O-CG2 3.39Å; G176-T180 PolarHBondContact O-N 2.93Å; G176-T180 PolarHBondContact O-OG1 3.1Å; G176-Y207 WeakPolarHBondContact CA-OH 3.48Å
177I93.2Very high90.2Very high2 Ų27.6 Ų7.61%0.015%0.049CC..Hα-helixtrans-66.8-40.9177.8-171.2168000110.7F173 G174 A175 V179 T180 T181 A539 L540 Y570 F573F173-I177 PolarHBondContact O-N 3.22Å; G174-I177 WeakPolarHBondContact O-CG2 3.35Å; G174-I177 PolarHBondContact O-N 3.46Å; A175-I177 PolarHBondContact O-N 3.47Å; I177-V179 PolarHBondContact O-N 3.36Å; I177-T180 PolarHBondContact O-OG1 3.41Å; I177-T181 HydrophobicContact CG1-CG2 4.08Å; I177-T181 VanDerWaalsContact O-CB 3.31Å; I177-T181 WeakPolarHBondContact O-CB 3.32Å; I177-T181 WeakPolarHBondContact O-CG2 3.28Å; I177-T181 PolarHBondContact O-N 3.42Å; I177-T181 PolarHBondContact O-OG1 3.19Å; I177-A539 HydrophobicContact CD1-CB 3.56Å; I177-L540 HydrophobicContact CB-CB 4.41Å; I177-L540 HydrophobicContact CB-CD1 4.44Å; I177-Y570 HydrophobicContact CG1-CD2 4.34Å; I177-Y570 HydrophobicContact CG2-CE2 4.45Å; I177-F573 HydrophobicContact CD1-CB 4.09Å; I177-F573 HydrophobicContact CD1-CD1 3.77Å; I177-F573 HydrophobicContact CD1-CD2 3.91Å; I177-F573 HydrophobicContact CD1-CE1 4.18Å; I177-F573 HydrophobicContact CD1-CE2 4.3Å; I177-F573 HydrophobicContact CD1-CG 3.62Å; I177-F573 HydrophobicContact CD1-CZ 4.43Å; I177-F573 HydrophobicContact CG2-CD1 4.43Å; I177-F573 HydrophobicContact CG2-CE1 3.91Å; I177-F573 HydrophobicContact CG2-CZ 4.14Å
178F93.1Very high91Very high10 Ų105.8 Ų5.84%0.0444%0.04CC..Hα-helixtrans-60.3-46.1177179.5-97.7000112G174 A175 V182 V183 W471 I475 L478 Y570G174-F178 WeakPolarHBondContact O-CB 3.35Å; G174-F178 PolarHBondContact O-N 3.41Å; G174-F178 VanDerWaalsContact O-N 3.08Å; A175-F178 PolarHBondContact O-N 3.43Å; F178-V182 HydrophobicContact CD2-CB 3.86Å; F178-V182 HydrophobicContact CD2-CG1 4.33Å; F178-V182 HydrophobicContact CD2-CG2 3.74Å; F178-V182 HydrophobicContact CE2-CB 3.81Å; F178-V182 HydrophobicContact CE2-CG1 3.76Å; F178-V182 HydrophobicContact CE2-CG2 3.95Å; F178-V182 HydrophobicContact CG-CB 4.39Å; F178-V182 HydrophobicContact CZ-CB 4.29Å; F178-V182 HydrophobicContact CZ-CG1 4.04Å; F178-V182 WeakPolarHBondContact O-CA 3.4Å; F178-V182 VanDerWaalsContact O-CB 3.29Å; F178-V182 WeakPolarHBondContact O-CB 3.41Å; F178-V182 PolarHBondContact O-N 3.48Å; F178-V183 HydrophobicContact CD1-CG2 4.07Å; F178-V183 HydrophobicContact CE1-CG2 3.83Å; F178-V183 PolarHBondContact O-N 2.93Å; F178-W471 HydrophobicContact CD2-CB 3.99Å; F178-W471 HydrophobicContact CE2-CB 4.02Å; F178-W471 HydrophobicContact CE2-CG 4.25Å; F178-W471 HydrophobicContact CG-CB 4.34Å; F178-W471 HydrophobicContact CZ-CB 4.43Å; F178-W471 HydrophobicContact CZ-CG 4.45Å; F178-I475 HydrophobicContact CZ-CD1 4.2Å; F178-L478 HydrophobicContact CE1-CB 4.38Å; F178-L478 HydrophobicContact CZ-CD2 4.23Å; F178-Y570 HydrophobicContact CB-CE2 4.22Å; F178-Y570 HydrophobicContact CD2-CE1 4.43Å; F178-Y570 HydrophobicContact CD2-CE2 4.15Å; F178-Y570 AromaticContact CD2-CZ 3.83Å
179V93.1Very high91.7Very high0 Ų07.7 Ų7.70%05%0.048CC..Iπ-helixtrans-69.5-45-179.3172.90000112A175 G176 I177 T181 V183 A184 S474 D477 C497 I501A175-V179 WeakPolarHBondContact O-CG2 3.35Å; A175-V179 PolarHBondContact O-N 2.88Å; G176-V179 PolarHBondContact O-N 3.01Å; I177-V179 PolarHBondContact O-N 3.36Å; V179-T181 VanDerWaalsContact C-N 3.27Å; V179-T181 PolarHBondContact O-N 2.91Å; V179-V183 HydrophobicContact CB-CG2 4.39Å; V179-V183 HydrophobicContact CG1-CB 4.35Å; V179-V183 HydrophobicContact CG2-CG2 4.15Å; V179-V183 WeakPolarHBondContact O-CB 3.48Å; V179-A184 PolarHBondContact O-N 3.43Å; V179-S474 WeakPolarHBondContact CG2-OG 3.34Å; V179-D477 HydrophobicContact CG2-CB 4.35Å; V179-C497 HydrophobicContact CG1-CB 3.75Å; V179-C497 VanDerWaalsContact CG1-O 3.31Å; V179-C497 WeakPolarHBondContact CG1-O 3.45Å; V179-I501 HydrophobicContact CB-CD1 3.9Å; V179-I501 HydrophobicContact CB-CG1 3.69Å; V179-I501 HydrophobicContact CG1-CD1 4.32Å; V179-I501 HydrophobicContact CG1-CG1 3.68Å; V179-I501 HydrophobicContact CG2-CD1 3.76Å; V179-I501 HydrophobicContact CG2-CG1 4.07Å
180T93.4Very high92.1Very high1 Ų110 Ų101%0.0066%0.062CC..Iπ-helixtrans-73.9-17.5-178.959.90000114.1G176 I177 A184 Y207 F498 L544G176-T180 WeakPolarHBondContact O-CG2 3.39Å; G176-T180 PolarHBondContact O-N 2.93Å; G176-T180 PolarHBondContact O-OG1 3.1Å; I177-T180 PolarHBondContact O-OG1 3.41Å; T180-A184 WeakPolarHBondContact O-CB 3.48Å; T180-Y207 HydrophobicContact CG2-CD1 4.29Å; T180-Y207 HydrophobicContact CG2-CE1 3.68Å; T180-F498 HydrophobicContact CG2-CD1 4.36Å; T180-F498 HydrophobicContact CG2-CE1 3.91Å; T180-F498 HydrophobicContact CG2-CZ 4.4Å; T180-L544 HydrophobicContact CG2-CD2 4.08Å
181T94.3Very high92.3Very high0 Ų014.2 Ų14.20%08%0.08CC..Iπ-helixtrans-107.8-63178.263.70000112.5I177 V179 G185 L566 L569 Y570I177-T181 HydrophobicContact CG1-CG2 4.08Å; I177-T181 VanDerWaalsContact O-CB 3.31Å; I177-T181 WeakPolarHBondContact O-CB 3.32Å; I177-T181 WeakPolarHBondContact O-CG2 3.28Å; I177-T181 PolarHBondContact O-N 3.42Å; I177-T181 PolarHBondContact O-OG1 3.19Å; V179-T181 VanDerWaalsContact C-N 3.27Å; V179-T181 PolarHBondContact O-N 2.91Å; T181-G185 WeakPolarHBondContact O-CA 3.33Å; T181-G185 PolarHBondContact O-N 3.03Å; T181-L566 HydrophobicContact CG2-CD2 4.39Å; T181-L566 WeakPolarHBondContact O-CB 3.47Å; T181-L569 HydrophobicContact CG2-CD2 4.38Å; T181-Y570 WeakPolarHBondContact OG1-CB 3.41Å; T181-Y570 VanDerWaalsContact OG1-CD2 3.26Å; T181-Y570 WeakPolarHBondContact OG1-CD2 3.32Å
182V94.9Very high92.6Very high17 Ų1715.8 Ų15.810%0.1039%0.089CC..Iπ-helixtrans-71.9-49.4-174.7-177.70000111.6F178 S186 L478 L567 Y570F178-V182 HydrophobicContact CD2-CB 3.86Å; F178-V182 HydrophobicContact CD2-CG1 4.33Å; F178-V182 HydrophobicContact CD2-CG2 3.74Å; F178-V182 HydrophobicContact CE2-CB 3.81Å; F178-V182 HydrophobicContact CE2-CG1 3.76Å; F178-V182 HydrophobicContact CE2-CG2 3.95Å; F178-V182 HydrophobicContact CG-CB 4.39Å; F178-V182 HydrophobicContact CZ-CB 4.29Å; F178-V182 HydrophobicContact CZ-CG1 4.04Å; F178-V182 WeakPolarHBondContact O-CA 3.4Å; F178-V182 VanDerWaalsContact O-CB 3.29Å; F178-V182 WeakPolarHBondContact O-CB 3.41Å; F178-V182 PolarHBondContact O-N 3.48Å; V182-S186 WeakPolarHBondContact O-CB 3.37Å; V182-S186 PolarHBondContact O-N 3.37Å; V182-S186 PolarHBondContact O-OG 3.12Å; V182-L478 HydrophobicContact CG1-CD1 4.36Å; V182-L567 HydrophobicContact CB-CD2 4.3Å; V182-L567 HydrophobicContact CG1-CD2 4.14Å; V182-L567 HydrophobicContact CG2-CD2 4.31Å; V182-Y570 HydrophobicContact CG2-CD1 3.37Å; V182-Y570 HydrophobicContact CG2-CD2 3.8Å; V182-Y570 HydrophobicContact CG2-CE1 3.7Å; V182-Y570 HydrophobicContact CG2-CE2 4.11Å; V182-Y570 HydrophobicContact CG2-CG 3.42Å; V182-Y570 VanDerWaalsContact CG2-CG 3.42Å
183V94Very high92.7Very high0 Ų015.7 Ų15.70%09%0.087CC..Iπ-helixtrans-68.9-54.7-178.4-177.10000110.2F178 V179 G185 S186 V187 D477 L478 D481F178-V183 HydrophobicContact CD1-CG2 4.07Å; F178-V183 HydrophobicContact CE1-CG2 3.83Å; F178-V183 PolarHBondContact O-N 2.93Å; V179-V183 HydrophobicContact CB-CG2 4.39Å; V179-V183 HydrophobicContact CG1-CB 4.35Å; V179-V183 HydrophobicContact CG2-CG2 4.15Å; V179-V183 WeakPolarHBondContact O-CB 3.48Å; V183-G185 VanDerWaalsContact C-N 3.31Å; V183-G185 PolarHBondContact O-N 3.34Å; V183-S186 PolarHBondContact O-N 2.95Å; V183-V187 WeakPolarHBondContact O-CG2 3.45Å; V183-V187 PolarHBondContact O-N 3.23Å; V183-D477 HydrophobicContact CG2-CB 4.49Å; V183-L478 HydrophobicContact CB-CD1 4.31Å; V183-L478 HydrophobicContact CG1-CD1 4.48Å; V183-L478 HydrophobicContact CG2-CB 3.86Å; V183-L478 HydrophobicContact CG2-CD1 3.98Å; V183-D481 HydrophobicContact CG1-CB 3.8Å
184A93.8Very high92.5Very high2 Ų218.9 Ų18.92%0.01711%0.107CC..Hα-helixtrans-59.4-40.7177.500000112.8V179 T180 V187 A188 I494 L566V179-A184 PolarHBondContact O-N 3.43Å; T180-A184 WeakPolarHBondContact O-CB 3.48Å; A184-V187 PolarHBondContact O-N 2.9Å; A184-A188 PolarHBondContact O-N 3.16Å; A184-I494 HydrophobicContact CB-CD1 3.44Å; A184-I494 VanDerWaalsContact CB-CD1 3.44Å; A184-L566 HydrophobicContact CB-CD1 4.29Å
185G94.7Very high92.3Very high0 Ų019.6 Ų19.60%011%0.11CC..Hα-helixtrans-64.8-42.1176.200000112.5T181 V183 V187 A188 L189T181-G185 WeakPolarHBondContact O-CA 3.33Å; T181-G185 PolarHBondContact O-N 3.03Å; V183-G185 VanDerWaalsContact C-N 3.31Å; V183-G185 PolarHBondContact O-N 3.34Å; G185-V187 PolarHBondContact O-N 3.4Å; G185-A188 PolarHBondContact O-N 3.11Å; G185-L189 WeakPolarHBondContact O-CG 3.49Å; G185-L189 PolarHBondContact O-N 3.08Å
186S94.1Very high92.1Very high24 Ų2420.9 Ų20.917%0.16812%0.121CC..Hα-helixtrans-63.5-40.5175.4-63.30000112.1V182 V183 L189 V190V182-S186 WeakPolarHBondContact O-CB 3.37Å; V182-S186 PolarHBondContact O-N 3.37Å; V182-S186 PolarHBondContact O-OG 3.12Å; V183-S186 PolarHBondContact O-N 2.95Å; S186-L189 PolarHBondContact O-N 2.94Å; S186-V190 WeakPolarHBondContact O-CB 3.47Å; S186-V190 VanDerWaalsContact O-CG2 3.23Å; S186-V190 WeakPolarHBondContact O-CG2 3.3Å; S186-V190 PolarHBondContact O-N 2.86Å; S186-V190 VanDerWaalsContact O-N 3.07Å
187V93.5Very high91.8Very high0 Ų023.2 Ų23.20%014%0.137CC..Hα-helixtrans-59.8-46.8174168.60000111V183 A184 G185 L189 V190 K191 F193 D481 V482 A485 P490 A493 I494V183-V187 WeakPolarHBondContact O-CG2 3.45Å; V183-V187 PolarHBondContact O-N 3.23Å; A184-V187 PolarHBondContact O-N 2.9Å; G185-V187 PolarHBondContact O-N 3.4Å; V187-L189 VanDerWaalsContact C-N 3.34Å; V187-L189 PolarHBondContact O-N 3.08Å; V187-V190 PolarHBondContact O-N 3.25Å; V187-K191 PolarHBondContact O-N 3.36Å; V187-F193 HydrophobicContact CG1-CE1 4.12Å; V187-D481 HydrophobicContact CG2-CB 3.97Å; V187-V482 HydrophobicContact CG2-CG2 4.45Å; V187-A485 HydrophobicContact CB-CB 4.39Å; V187-A485 HydrophobicContact CG1-CB 3.82Å; V187-A485 HydrophobicContact CG2-CB 4.3Å; V187-P490 HydrophobicContact CG1-CB 4.23Å; V187-A493 HydrophobicContact CG1-CB 4.02Å; V187-A493 HydrophobicContact CG2-CB 4.01Å; V187-I494 HydrophobicContact CB-CD1 4.37Å; V187-I494 HydrophobicContact CG1-CD1 4.29Å; V187-I494 HydrophobicContact CG1-CG1 3.92Å
188A93.2Very high91.5Very high0 Ų031.6 Ų31.60%017%0.169CC..Hα-helixtrans-64.6-34.6178.200000113.2A184 G185 L558A184-A188 PolarHBondContact O-N 3.16Å; G185-A188 PolarHBondContact O-N 3.11Å; A188-L558 HydrophobicContact CB-CB 4.4Å
189L94.8Very high91.2Very high52 Ų5232.4 Ų32.427%0.27218%0.175SC..Hα-helixtrans-67.5-43.1176.1-75.1176.7000112.7G185 S186 V187 R560 V564 L567G185-L189 WeakPolarHBondContact O-CG 3.49Å; G185-L189 PolarHBondContact O-N 3.08Å; S186-L189 PolarHBondContact O-N 2.94Å; V187-L189 VanDerWaalsContact C-N 3.34Å; V187-L189 PolarHBondContact O-N 3.08Å; L189-R560 HydrophobicContact CD2-CB 4.09Å; L189-R560 WeakPolarHBondContact CD2-O 3.37Å; L189-R560 PolarHBondContact O-NE 3.24Å; L189-V564 HydrophobicContact CD2-CG2 3.79Å; L189-L567 HydrophobicContact CD1-CD1 3.5Å; L189-L567 VanDerWaalsContact CD1-CD1 3.5Å
190V92.8Very high91Very high48 Ų4832.6 Ų32.629%0.29118%0.176SC..Hα-helixtrans-66.4-50.7-175.8163.60000111.2S186 V187 V482 A485 R486S186-V190 WeakPolarHBondContact O-CB 3.47Å; S186-V190 VanDerWaalsContact O-CG2 3.23Å; S186-V190 WeakPolarHBondContact O-CG2 3.3Å; S186-V190 PolarHBondContact O-N 2.86Å; S186-V190 VanDerWaalsContact O-N 3.07Å; V187-V190 PolarHBondContact O-N 3.25Å; V190-V482 HydrophobicContact CG2-CG1 4.06Å; V190-A485 HydrophobicContact CG1-CB 4.35Å; V190-R486 HydrophobicContact CG1-CB 4.35Å; V190-R486 HydrophobicContact CG1-CG 3.41Å; V190-R486 VanDerWaalsContact CG1-CG 3.41Å
191K89.6Confident90.8Very high89 Ų8934.8 Ų34.839%0.38719%0.188SC..SBendtrans-141.599.1-177.8-170.5162.5-178.7159.90109.7V187 F193 A485 P490V187-K191 PolarHBondContact O-N 3.36Å; K191-F193 WeakPolarHBondContact O-CD1 3.37Å; K191-A485 WeakPolarHBondContact CD-O 3.47Å; K191-P490 HydrophobicContact CB-CB 4.43Å; K191-P490 HydrophobicContact CB-CG 4.48Å; K191-P490 HydrophobicContact CD-CG 4.26Å; K191-P490 HydrophobicContact CG-CG 4.21Å
192P90.1Very high90.7Very high57 Ų5736.2 Ų36.237%0.3719%0.193SC..  trans-64.7140.9176.928.1-34.4000110.1L558P192-L558 VanDerWaalsContact CA-O 3.31Å; P192-L558 WeakPolarHBondContact CA-O 3.37Å
193F90.7Very high90.5Very high18 Ų1835.6 Ų35.68%0.07919%0.189CC..EExtended strand (participates in β ladder)trans-159.2160.3-171.771-73.4000112.6V187 K191 V195 P490 R491 I494 L558V187-F193 HydrophobicContact CG1-CE1 4.12Å; K191-F193 WeakPolarHBondContact O-CD1 3.37Å; F193-V195 HydrophobicContact CD2-CG2 3.93Å; F193-V195 HydrophobicContact CE2-CB 4.36Å; F193-V195 HydrophobicContact CE2-CG2 3.2Å; F193-V195 HydrophobicContact CZ-CG2 3.58Å; F193-P490 HydrophobicContact CB-CB 4.46Å; F193-P490 HydrophobicContact CB-CG 3.76Å; F193-P490 HydrophobicContact CD1-CB 3.59Å; F193-P490 HydrophobicContact CD1-CG 3.86Å; F193-P490 HydrophobicContact CD2-CB 4.24Å; F193-P490 HydrophobicContact CD2-CG 3.99Å; F193-P490 HydrophobicContact CE1-CB 3.69Å; F193-P490 HydrophobicContact CE1-CG 4.39Å; F193-P490 HydrophobicContact CE2-CB 4.31Å; F193-P490 HydrophobicContact CE2-CG 4.49Å; F193-P490 HydrophobicContact CG-CB 3.85Å; F193-P490 HydrophobicContact CG-CG 3.6Å; F193-P490 HydrophobicContact CZ-CB 4.03Å; F193-P490 VanDerWaalsContact CZ-O 3.26Å; F193-P490 WeakPolarHBondContact CZ-O 3.37Å; F193-R491 HydrophobicContact CD2-CB 4.47Å; F193-R491 HydrophobicContact CD2-CG 3.52Å; F193-R491 HydrophobicContact CE2-CB 4.16Å; F193-R491 HydrophobicContact CE2-CG 3.62Å; F193-I494 HydrophobicContact CE1-CG1 4.12Å; F193-I494 HydrophobicContact CZ-CB 3.99Å; F193-I494 HydrophobicContact CZ-CG1 3.54Å; F193-L558 HydrophobicContact CD1-CB 4.39Å; F193-L558 HydrophobicContact CE1-CB 4.21Å; F193-L558 HydrophobicContact CE1-CD2 4.38Å; F193-L558 HydrophobicContact CZ-CD2 4.36Å; F193-L558 PolarHBondContact N-O 3.11Å; F193-L558 PolarHBondContact O-N 2.9Å
194T87.7Confident90.5Very high66 Ų6635.6 Ų35.641%0.40519%0.189SC..EExtended strand (participates in β ladder)trans-87.4122.9171.652.10000110.1R491 F556 H557T194-R491 PolarHBondContact O-NE 3.28Å; T194-R491 PolarHBondContact O-NH2 3.33Å; T194-R491 PolarHBondContact OG1-NH2 3.37Å; T194-F556 WeakPolarHBondContact CA-O 3.43Å; T194-H557 VanDerWaalsContact CG2-ND1 3.26Å; T194-H557 WeakPolarHBondContact CG2-ND1 3.41Å
195V85.7Confident90.6Very high18 Ų1839.1 Ų39.111%0.10921%0.207CC..PPolyproline II helixtrans-83.7147.7175.8169.10000109.8F193 S197 F200 F556 L558F193-V195 HydrophobicContact CD2-CG2 3.93Å; F193-V195 HydrophobicContact CE2-CB 4.36Å; F193-V195 HydrophobicContact CE2-CG2 3.2Å; F193-V195 HydrophobicContact CZ-CG2 3.58Å; V195-S197 PolarHBondContact O-N 3.33Å; V195-F200 HydrophobicContact CG1-CB 3.39Å; V195-F200 HydrophobicContact CG1-CD2 3.88Å; V195-F200 HydrophobicContact CG1-CG 3.77Å; V195-F556 PolarHBondContact N-O 3.04Å; V195-L558 HydrophobicContact CB-CD1 3.79Å; V195-L558 HydrophobicContact CG2-CD1 3.31Å; V195-L558 HydrophobicContact CG2-CD2 3.9Å; V195-L558 HydrophobicContact CG2-CG 4.07Å
196A84.8Confident90.6Very high35 Ų3540.5 Ų40.529%0.28921%0.213SC..PPolyproline II helixtrans-71.6118.5171.700000109.4R198 P199 F200A196-R198 PolarHBondContact O-N 3.45Å; A196-P199 HydrophobicContact CB-CG 3.88Å; A196-P199 WeakPolarHBondContact O-CD 3.27Å; A196-F200 WeakPolarHBondContact O-CB 3.47Å; A196-F200 PolarHBondContact O-N 3.01Å
197S86.8Confident90.6Very high48 Ų4839.3 Ų39.334%0.33621%0.205SC..Hα-helixtrans-58.9-46.8-172.7540000114V195 L201 F556V195-S197 PolarHBondContact O-N 3.33Å; S197-L201 WeakPolarHBondContact O-CB 3.33Å; S197-L201 WeakPolarHBondContact O-CG 3.42Å; S197-L201 PolarHBondContact O-N 3.3Å; S197-F556 VanDerWaalsContact CA-CD1 3.49Å; S197-F556 VanDerWaalsContact CA-CE1 3.47Å; S197-F556 VanDerWaalsContact CB-CE1 3.41Å; S197-F556 VanDerWaalsContact CB-CE2 3.47Å
198R86.6Confident90.7Very high178 Ų17842 Ų4267%0.67222%0.218SC*.Hα-helixtrans-66.3-51.3-177.5-61179.4178.5173.9-0.8113.3A196 F200 R202A196-R198 PolarHBondContact O-N 3.45Å; R198-F200 PolarHBondContact O-N 3.02Å; R198-R202 WeakPolarHBondContact O-CB 3.44Å; R198-R202 PolarHBondContact O-N 3.25Å
199P86Confident90.8Very high27 Ų2745.7 Ų45.718%0.17524%0.237CC..Hα-helixtrans-60.3-42.7176.8-25.936.3000113.1A196 R202 D203A196-P199 HydrophobicContact CB-CG 3.88Å; A196-P199 WeakPolarHBondContact O-CD 3.27Å; P199-R202 WeakPolarHBondContact O-CB 3.4Å; P199-R202 PolarHBondContact O-N 3.34Å; P199-D203 PolarHBondContact O-N 3.48Å; P199-D203 VanDerWaalsContact O-OD2 3.1Å
200F89.2Confident90.8Very high5 Ų543.2 Ų43.22%0.02222%0.224CC..Hα-helixtrans-64.2-49.5-179.6177.3-93.6000112.7V195 A196 R198 R202 D203 V204 I494 F498 V551V195-F200 HydrophobicContact CG1-CB 3.39Å; V195-F200 HydrophobicContact CG1-CD2 3.88Å; V195-F200 HydrophobicContact CG1-CG 3.77Å; A196-F200 WeakPolarHBondContact O-CB 3.47Å; A196-F200 PolarHBondContact O-N 3.01Å; R198-F200 PolarHBondContact O-N 3.02Å; F200-R202 VanDerWaalsContact C-N 3.3Å; F200-R202 PolarHBondContact O-N 3.17Å; F200-D203 PolarHBondContact O-N 3.08Å; F200-V204 HydrophobicContact CD1-CG2 4.28Å; F200-V204 HydrophobicContact CD2-CG2 4.42Å; F200-V204 HydrophobicContact CE1-CG2 3.83Å; F200-V204 HydrophobicContact CE2-CG2 4.01Å; F200-V204 HydrophobicContact CZ-CG2 3.69Å; F200-V204 WeakPolarHBondContact O-CG2 3.46Å; F200-V204 PolarHBondContact O-N 2.88Å; F200-I494 HydrophobicContact CD2-CG2 4.38Å; F200-F498 HydrophobicContact CD2-CE2 4.37Å; F200-F498 AromaticContact CE2-CE2 3.8Å; F200-F498 HydrophobicContact CE2-CE2 3.8Å; F200-F498 HydrophobicContact CE2-CZ 4.07Å; F200-V551 HydrophobicContact CD1-CB 4.48Å; F200-V551 HydrophobicContact CD1-CG1 3.9Å; F200-V551 HydrophobicContact CE1-CB 3.62Å; F200-V551 HydrophobicContact CE1-CG1 3.48Å; F200-V551 VanDerWaalsContact CE1-CG1 3.48Å; F200-V551 HydrophobicContact CE1-CG2 3.96Å; F200-V551 HydrophobicContact CZ-CB 3.91Å; F200-V551 HydrophobicContact CZ-CG1 3.88Å; F200-V551 HydrophobicContact CZ-CG2 3.69Å
201L90.6Very high90.9Very high47 Ų4741.3 Ų41.325%0.24621%0.212CC..Hα-helixtrans-61.4-40.9177.5-74.1173.6000111.5S197 I205 F548 P552 F556S197-L201 WeakPolarHBondContact O-CB 3.33Å; S197-L201 WeakPolarHBondContact O-CG 3.42Å; S197-L201 PolarHBondContact O-N 3.3Å; L201-I205 WeakPolarHBondContact O-CB 3.38Å; L201-I205 WeakPolarHBondContact O-CD1 3.47Å; L201-I205 WeakPolarHBondContact O-CG1 3.34Å; L201-I205 PolarHBondContact O-N 3.29Å; L201-F548 HydrophobicContact CD2-CD2 3.87Å; L201-F548 HydrophobicContact CD2-CE2 3.55Å; L201-F548 HydrophobicContact CD2-CZ 4.32Å; L201-P552 HydrophobicContact CD2-CG 4.07Å; L201-F556 HydrophobicContact CD1-CE1 4.14Å; L201-F556 HydrophobicContact CD1-CZ 3.95Å; L201-F556 HydrophobicContact CD2-CE1 4.5Å; L201-F556 HydrophobicContact CG-CE1 4.03Å; L201-F556 HydrophobicContact CG-CZ 4.34Å
202R91.3Very high91Very high30 Ų3043.8 Ų43.811%0.11322%0.223CC..Hα-helixtrans-54.9-55.1173174.7-156.365.7-152.3-0.8110.2R198 P199 F200 V204 I205 F206 T241 V242R198-R202 WeakPolarHBondContact O-CB 3.44Å; R198-R202 PolarHBondContact O-N 3.25Å; P199-R202 WeakPolarHBondContact O-CB 3.4Å; P199-R202 PolarHBondContact O-N 3.34Å; F200-R202 VanDerWaalsContact C-N 3.3Å; F200-R202 PolarHBondContact O-N 3.17Å; R202-V204 PolarHBondContact O-N 3.27Å; R202-I205 PolarHBondContact O-N 3.38Å; R202-F206 HydrophobicContact CG-CD2 3.77Å; R202-F206 HydrophobicContact CG-CE2 3.86Å; R202-F206 VanDerWaalsContact O-CD2 3.32Å; R202-F206 WeakPolarHBondContact O-CD2 3.06Å; R202-F206 PolarHBondContact O-N 3.19Å; R202-T241 HydrophobicContact CG-CG2 4.09Å; R202-V242 VanDerWaalsContact CZ-CG2 3.48Å
203D91.7Very high91.2Very high4 Ų444.6 Ų44.62%0.02122%0.219CC..Hα-helixtrans-61.6-44.3-174.9-63.6-23.8000111.6P199 F200 I205 F206 Y207 Y238 F498 I502P199-D203 PolarHBondContact O-N 3.48Å; P199-D203 VanDerWaalsContact O-OD2 3.1Å; F200-D203 PolarHBondContact O-N 3.08Å; D203-I205 PolarHBondContact O-N 3.1Å; D203-F206 PolarHBondContact O-N 3.34Å; D203-Y207 WeakPolarHBondContact O-CB 3.24Å; D203-Y207 PolarHBondContact O-N 2.87Å; D203-Y238 WeakPolarHBondContact OD1-CE2 3.17Å; D203-Y238 PolarHBondContact OD1-OH 3.39Å; D203-F498 HydrophobicContact CB-CB 3.96Å; D203-F498 HydrophobicContact CB-CG 4.42Å; D203-I502 HydrophobicContact CB-CD1 4.35Å; D203-I502 WeakPolarHBondContact O-CD1 3.4Å
204V93.5Very high91.2Very high0 Ų043.9 Ų43.90%022%0.216CC..Hα-helixtrans-64-40.9176.7176.90000112F200 R202 Y207 M208 F498 F548F200-V204 HydrophobicContact CD1-CG2 4.28Å; F200-V204 HydrophobicContact CD2-CG2 4.42Å; F200-V204 HydrophobicContact CE1-CG2 3.83Å; F200-V204 HydrophobicContact CE2-CG2 4.01Å; F200-V204 HydrophobicContact CZ-CG2 3.69Å; F200-V204 WeakPolarHBondContact O-CG2 3.46Å; F200-V204 PolarHBondContact O-N 2.88Å; R202-V204 PolarHBondContact O-N 3.27Å; V204-Y207 PolarHBondContact O-N 2.88Å; V204-M208 HydrophobicContact CG1-CG 4.4Å; V204-M208 WeakPolarHBondContact O-CB 3.32Å; V204-M208 VanDerWaalsContact O-CG 3.27Å; V204-M208 WeakPolarHBondContact O-CG 3.47Å; V204-M208 PolarHBondContact O-N 3.09Å; V204-F498 HydrophobicContact CG2-CD1 4.35Å; V204-F498 HydrophobicContact CG2-CE1 3.8Å; V204-F498 HydrophobicContact CG2-CZ 4.01Å; V204-F548 HydrophobicContact CG1-CB 4.02Å; V204-F548 HydrophobicContact CG1-CD2 3.94Å; V204-F548 HydrophobicContact CG1-CG 4.46Å
205I94.9Very high91.2Very high75 Ų7544.2 Ų44.239%0.38521%0.212SC..Hα-helixtrans-65.4-48.5178.6-71164.7000111L201 R202 D203 Y207 M208 I209 F548L201-I205 WeakPolarHBondContact O-CB 3.38Å; L201-I205 WeakPolarHBondContact O-CD1 3.47Å; L201-I205 WeakPolarHBondContact O-CG1 3.34Å; L201-I205 PolarHBondContact O-N 3.29Å; R202-I205 PolarHBondContact O-N 3.38Å; D203-I205 PolarHBondContact O-N 3.1Å; I205-Y207 VanDerWaalsContact C-N 3.25Å; I205-Y207 PolarHBondContact O-N 2.87Å; I205-M208 PolarHBondContact O-N 3.2Å; I205-I209 HydrophobicContact CG2-CD1 3.95Å; I205-I209 WeakPolarHBondContact O-CG1 3.43Å; I205-I209 PolarHBondContact O-N 3.36Å; I205-F548 HydrophobicContact CD1-CE2 4.04Å; I205-F548 HydrophobicContact CG1-CD2 4.46Å; I205-F548 HydrophobicContact CG1-CE2 3.75Å
206F95.3Very high91.4Very high29 Ų2945.6 Ų45.613%0.12722%0.221CC..Hα-helixtrans-61.7-38.2177.8-87.7-87.1000111.3R202 D203 I209 A210 L234 V237 Y238 T241R202-F206 HydrophobicContact CG-CD2 3.77Å; R202-F206 HydrophobicContact CG-CE2 3.86Å; R202-F206 VanDerWaalsContact O-CD2 3.32Å; R202-F206 WeakPolarHBondContact O-CD2 3.06Å; R202-F206 PolarHBondContact O-N 3.19Å; D203-F206 PolarHBondContact O-N 3.34Å; F206-I209 PolarHBondContact O-N 2.94Å; F206-A210 WeakPolarHBondContact O-CB 3.38Å; F206-A210 PolarHBondContact O-N 3.27Å; F206-L234 HydrophobicContact CD1-CD1 3.95Å; F206-L234 HydrophobicContact CE1-CD1 3.86Å; F206-V237 HydrophobicContact CE1-CG1 4.08Å; F206-V237 HydrophobicContact CZ-CG1 4.11Å; F206-Y238 HydrophobicContact CB-CD2 3.84Å; F206-Y238 HydrophobicContact CB-CE2 4.35Å; F206-Y238 HydrophobicContact CD1-CD2 4.08Å; F206-Y238 HydrophobicContact CD1-CG 4.45Å; F206-Y238 AromaticContact CD2-CD2 3.94Å; F206-Y238 HydrophobicContact CD2-CD2 3.94Å; F206-Y238 AromaticContact CG-CD2 3.69Å; F206-Y238 HydrophobicContact CG-CD2 3.69Å; F206-Y238 HydrophobicContact CG-CG 4.47Å; F206-T241 HydrophobicContact CE2-CG2 4.34Å
207Y94.9Very high91.6Very high0 Ų044.5 Ų44.50%021%0.21CC..Hα-helixtrans-68.7-40.8176.8-169.8-153.1000112.5G176 T180 D203 V204 I205 I209 A210 V211 F498 I501 I502 L540 L544G176-Y207 WeakPolarHBondContact CA-OH 3.48Å; T180-Y207 HydrophobicContact CG2-CD1 4.29Å; T180-Y207 HydrophobicContact CG2-CE1 3.68Å; D203-Y207 WeakPolarHBondContact O-CB 3.24Å; D203-Y207 PolarHBondContact O-N 2.87Å; V204-Y207 PolarHBondContact O-N 2.88Å; I205-Y207 VanDerWaalsContact C-N 3.25Å; I205-Y207 PolarHBondContact O-N 2.87Å; Y207-I209 VanDerWaalsContact C-N 3.32Å; Y207-I209 PolarHBondContact O-N 3.29Å; Y207-A210 HydrophobicContact CD2-CB 4.46Å; Y207-A210 WeakPolarHBondContact O-CB 3.47Å; Y207-A210 PolarHBondContact O-N 3.08Å; Y207-V211 HydrophobicContact CD2-CG2 3.73Å; Y207-V211 HydrophobicContact CE2-CG2 3.33Å; Y207-V211 HydrophobicContact CG-CG2 4.45Å; Y207-V211 WeakPolarHBondContact O-CG2 3.36Å; Y207-V211 PolarHBondContact O-N 2.94Å; Y207-F498 HydrophobicContact CD1-CD1 4.25Å; Y207-F498 HydrophobicContact CD1-CE1 4.49Å; Y207-I501 HydrophobicContact CD2-CG2 4.4Å; Y207-I501 HydrophobicContact CE1-CG2 3.95Å; Y207-I501 HydrophobicContact CE2-CG2 3.53Å; Y207-I501 WeakPolarHBondContact OH-CG2 3.42Å; Y207-I502 HydrophobicContact CD2-CG1 4.14Å; Y207-I502 HydrophobicContact CG-CG1 4.07Å; Y207-L540 HydrophobicContact CE1-CD1 4Å; Y207-L540 WeakPolarHBondContact OH-CD1 3.36Å; Y207-L540 VanDerWaalsContact OH-CD2 3.23Å; Y207-L540 WeakPolarHBondContact OH-CD2 3.45Å; Y207-L544 HydrophobicContact CD1-CD1 3.54Å; Y207-L544 HydrophobicContact CD1-CD2 3.47Å; Y207-L544 VanDerWaalsContact CD1-CD2 3.47Å; Y207-L544 HydrophobicContact CD1-CG 4.12Å; Y207-L544 HydrophobicContact CE1-CD1 3.67Å; Y207-L544 HydrophobicContact CE1-CD2 3.72Å; Y207-L544 HydrophobicContact CE1-CG 4.18Å; Y207-L544 HydrophobicContact CG-CD1 4.05Å
208M95.1Very high91.5Very high57 Ų5742.5 Ų42.528%0.28120%0.195SC..Hα-helixtrans-57.9-43.1172.8-79.6-67.4-67.900112.2V204 I205 F212 L544 V545V204-M208 HydrophobicContact CG1-CG 4.4Å; V204-M208 WeakPolarHBondContact O-CB 3.32Å; V204-M208 VanDerWaalsContact O-CG 3.27Å; V204-M208 WeakPolarHBondContact O-CG 3.47Å; V204-M208 PolarHBondContact O-N 3.09Å; I205-M208 PolarHBondContact O-N 3.2Å; M208-F212 VanDerWaalsContact O-CB 3.27Å; M208-F212 WeakPolarHBondContact O-CB 3.26Å; M208-F212 PolarHBondContact O-N 3.29Å; M208-L544 HydrophobicContact CG-CB 4.04Å; M208-L544 HydrophobicContact CG-CD1 4.29Å; M208-L544 HydrophobicContact SD-CB 3.26Å; M208-L544 WeakPolarHBondContact SD-CB 3.38Å; M208-L544 HydrophobicContact SD-CD1 3.75Å; M208-L544 HydrophobicContact SD-CG 4.15Å; M208-V545 HydrophobicContact CE-CG2 3.42Å; M208-V545 VanDerWaalsContact CE-CG2 3.42Å; M208-V545 HydrophobicContact SD-CG2 4.2Å
209I95.7Very high91.5Very high76 Ų7642.5 Ų42.539%0.3920%0.196SC..Hα-helixtrans-62.6-45.5175.5-66166000110.3I205 F206 Y207 F212 W213 L234I205-I209 HydrophobicContact CG2-CD1 3.95Å; I205-I209 WeakPolarHBondContact O-CG1 3.43Å; I205-I209 PolarHBondContact O-N 3.36Å; F206-I209 PolarHBondContact O-N 2.94Å; Y207-I209 VanDerWaalsContact C-N 3.32Å; Y207-I209 PolarHBondContact O-N 3.29Å; I209-F212 PolarHBondContact O-N 3.49Å; I209-W213 WeakPolarHBondContact O-CB 3.4Å; I209-W213 PolarHBondContact O-N 3.41Å; I209-L234 HydrophobicContact CG2-CD2 3.77Å
210A94.4Very high91.6Very high0 Ų046.9 Ų46.90%021%0.21CC..Hα-helixtrans-61.2-48.2178.900000112.1F206 Y207 W213 T214 M505 L506F206-A210 WeakPolarHBondContact O-CB 3.38Å; F206-A210 PolarHBondContact O-N 3.27Å; Y207-A210 HydrophobicContact CD2-CB 4.46Å; Y207-A210 WeakPolarHBondContact O-CB 3.47Å; Y207-A210 PolarHBondContact O-N 3.08Å; A210-W213 PolarHBondContact O-N 2.93Å; A210-T214 WeakPolarHBondContact O-CB 3.41Å; A210-T214 PolarHBondContact O-N 3.48Å; A210-T214 PolarHBondContact O-OG1 3.36Å; A210-M505 HydrophobicContact CB-CG 4.35Å; A210-L506 HydrophobicContact CB-CD1 4.47Å; A210-L506 HydrophobicContact CB-CD2 3.5Å; A210-L506 HydrophobicContact CB-CG 3.94Å
211V93.7Very high91.3Very high9 Ų947.6 Ų47.66%0.05522%0.218CC..Hα-helixtrans-62.7-44.8178.5172.60000110.8F173 Y207 T214 F215 L540 L544F173-V211 HydrophobicContact CE1-CG1 4.16Å; Y207-V211 HydrophobicContact CD2-CG2 3.73Å; Y207-V211 HydrophobicContact CE2-CG2 3.33Å; Y207-V211 HydrophobicContact CG-CG2 4.45Å; Y207-V211 WeakPolarHBondContact O-CG2 3.36Å; Y207-V211 PolarHBondContact O-N 2.94Å; V211-T214 PolarHBondContact O-N 3.25Å; V211-F215 WeakPolarHBondContact O-CB 3.04Å; V211-F215 PolarHBondContact O-N 3.4Å; V211-L540 HydrophobicContact CG1-CD2 4.16Å; V211-L540 HydrophobicContact CG1-CG 4.41Å; V211-L540 HydrophobicContact CG2-CD2 3.71Å; V211-L540 HydrophobicContact CG2-CG 4.22Å; V211-L544 HydrophobicContact CG2-CD1 4.05Å
212F93.1Very high91Very high141 Ų14147.6 Ų47.662%0.61822%0.22SC*.Hα-helixtrans-63-45.1178.2179.8-100.7000112.2M208 I209 T214 F215 V216M208-F212 VanDerWaalsContact O-CB 3.27Å; M208-F212 WeakPolarHBondContact O-CB 3.26Å; M208-F212 PolarHBondContact O-N 3.29Å; I209-F212 PolarHBondContact O-N 3.49Å; F212-T214 VanDerWaalsContact C-N 3.35Å; F212-T214 PolarHBondContact O-N 2.95Å; F212-F215 WeakPolarHBondContact O-CB 3.24Å; F212-F215 PolarHBondContact O-N 2.94Å; F212-V216 HydrophobicContact CD1-CG2 4.45Å; F212-V216 HydrophobicContact CE1-CG2 4.03Å; F212-V216 HydrophobicContact CE2-CG2 4.49Å; F212-V216 HydrophobicContact CZ-CG2 4.05Å; F212-V216 WeakPolarHBondContact O-CG2 3.44Å; F212-V216 PolarHBondContact O-N 2.81Å
213W93.3Very high90.6Very high74 Ų7446.3 Ų46.328%0.2822%0.216SC..Hα-helixtrans-63.3-43.3177.2-162.8-17.9000111.1I209 A210 F215 V216 I217 Y231 L234I209-W213 WeakPolarHBondContact O-CB 3.4Å; I209-W213 PolarHBondContact O-N 3.41Å; A210-W213 PolarHBondContact O-N 2.93Å; W213-F215 VanDerWaalsContact C-N 3.32Å; W213-F215 PolarHBondContact O-N 3.37Å; W213-V216 WeakPolarHBondContact O-CB 3.37Å; W213-V216 PolarHBondContact O-N 3.4Å; W213-V216 VanDerWaalsContact O-N 3.14Å; W213-I217 PolarHBondContact O-N 2.9Å; W213-Y231 HydrophobicContact CB-CE2 4.37Å; W213-Y231 HydrophobicContact CD2-CD2 4.11Å; W213-Y231 HydrophobicContact CE3-CD2 4.27Å; W213-Y231 HydrophobicContact CG-CD2 4.27Å; W213-Y231 HydrophobicContact CG-CE2 4.45Å; W213-L234 HydrophobicContact CE3-CD2 4.04Å; W213-L234 HydrophobicContact CZ3-CD2 4.19Å
214T90.3Very high90.5Very high2 Ų249.4 Ų49.41%0.01224%0.235CC..Hα-helixtrans-61.6-40.8176.7-49.30000111.7V169 F173 A210 V211 F212 V216 I217 L218 Y231 M505V169-T214 HydrophobicContact CG1-CG2 3.42Å; V169-T214 VanDerWaalsContact CG1-CG2 3.42Å; F173-T214 HydrophobicContact CE1-CG2 4.02Å; F173-T214 HydrophobicContact CZ-CG2 3.65Å; A210-T214 WeakPolarHBondContact O-CB 3.41Å; A210-T214 PolarHBondContact O-N 3.48Å; A210-T214 PolarHBondContact O-OG1 3.36Å; V211-T214 PolarHBondContact O-N 3.25Å; F212-T214 VanDerWaalsContact C-N 3.35Å; F212-T214 PolarHBondContact O-N 2.95Å; T214-V216 VanDerWaalsContact C-N 3.35Å; T214-V216 PolarHBondContact O-N 3.39Å; T214-I217 WeakPolarHBondContact O-CB 3.5Å; T214-I217 PolarHBondContact O-N 3Å; T214-L218 PolarHBondContact O-N 3.44Å; T214-Y231 PolarHBondContact OG1-OH 3.43Å; T214-M505 HydrophobicContact CG2-SD 4.1Å
215F89.3Confident90.3Very high73 Ų7353.7 Ų53.732%0.3226%0.257SS..Hα-helixtrans-60.2-43.3173.8179-86.8000112V211 F212 W213 I217 L218 Y219 W534 A537V211-F215 WeakPolarHBondContact O-CB 3.04Å; V211-F215 PolarHBondContact O-N 3.4Å; F212-F215 WeakPolarHBondContact O-CB 3.24Å; F212-F215 PolarHBondContact O-N 2.94Å; W213-F215 VanDerWaalsContact C-N 3.32Å; W213-F215 PolarHBondContact O-N 3.37Å; F215-I217 VanDerWaalsContact C-N 3.33Å; F215-I217 PolarHBondContact O-N 3.41Å; F215-L218 PolarHBondContact O-N 2.92Å; F215-Y219 WeakPolarHBondContact O-CB 3.4Å; F215-Y219 PolarHBondContact O-N 2.89Å; F215-W534 HydrophobicContact CD2-CE3 4.2Å; F215-W534 AromaticContact CD2-CZ3 3.92Å; F215-W534 HydrophobicContact CD2-CZ3 3.92Å; F215-W534 HydrophobicContact CE1-CZ3 4.28Å; F215-W534 AromaticContact CE2-CE3 3.47Å; F215-W534 HydrophobicContact CE2-CE3 3.47Å; F215-W534 VanDerWaalsContact CE2-CE3 3.47Å; F215-W534 AromaticContact CE2-CZ3 3.41Å; F215-W534 HydrophobicContact CE2-CZ3 3.41Å; F215-W534 VanDerWaalsContact CE2-CZ3 3.41Å; F215-W534 AromaticContact CZ-CE3 3.92Å; F215-W534 HydrophobicContact CZ-CE3 3.92Å; F215-W534 AromaticContact CZ-CZ3 3.59Å; F215-W534 HydrophobicContact CZ-CZ3 3.59Å; F215-A537 HydrophobicContact CD2-CB 4.09Å
216V89.4Confident90Very high48 Ų4852.6 Ų52.629%0.29127%0.265SS..Hα-helixtrans-63.6-39.4176.1171.60000111.5F212 W213 T214 Y219 R220F212-V216 HydrophobicContact CD1-CG2 4.45Å; F212-V216 HydrophobicContact CE1-CG2 4.03Å; F212-V216 HydrophobicContact CE2-CG2 4.49Å; F212-V216 HydrophobicContact CZ-CG2 4.05Å; F212-V216 WeakPolarHBondContact O-CG2 3.44Å; F212-V216 PolarHBondContact O-N 2.81Å; W213-V216 WeakPolarHBondContact O-CB 3.37Å; W213-V216 PolarHBondContact O-N 3.4Å; W213-V216 VanDerWaalsContact O-N 3.14Å; T214-V216 VanDerWaalsContact C-N 3.35Å; T214-V216 PolarHBondContact O-N 3.39Å; V216-Y219 PolarHBondContact O-N 3.18Å; V216-R220 WeakPolarHBondContact O-CG 3.23Å; V216-R220 PolarHBondContact O-N 3.29Å
217I87.8Confident89.7Confident12 Ų1252.7 Ų52.76%0.06227%0.265CS..Hα-helixtrans-59.7-50.2175.1-77.9165.6000110.6W213 T214 F215 Y219 R220 G221 T223 F526W213-I217 PolarHBondContact O-N 2.9Å; T214-I217 WeakPolarHBondContact O-CB 3.5Å; T214-I217 PolarHBondContact O-N 3Å; F215-I217 VanDerWaalsContact C-N 3.33Å; F215-I217 PolarHBondContact O-N 3.41Å; I217-Y219 VanDerWaalsContact C-N 3.34Å; I217-Y219 PolarHBondContact O-N 2.96Å; I217-R220 PolarHBondContact O-N 3.48Å; I217-G221 PolarHBondContact O-N 3.01Å; I217-G221 VanDerWaalsContact O-N 3.08Å; I217-T223 WeakPolarHBondContact CG2-OG1 3.39Å; I217-F526 HydrophobicContact CG2-CD2 3.82Å; I217-F526 HydrophobicContact CG2-CE2 3.51Å; I217-F526 HydrophobicContact CG2-CG 4.48Å; I217-F526 HydrophobicContact CG2-CZ 3.93Å
218L86Confident89.5Confident6 Ų652.9 Ų52.93%0.03127%0.266CS..Hα-helixtrans-63.4-39.8178.1-70.1-179.4000112.2V169 F173 T214 F215 R220 G221 F526 T533 W534V169-L218 HydrophobicContact CB-CD2 4.31Å; V169-L218 HydrophobicContact CG1-CD1 3.81Å; V169-L218 HydrophobicContact CG1-CD2 4.15Å; V169-L218 HydrophobicContact CG1-CG 4.16Å; F173-L218 HydrophobicContact CD2-CD1 4.48Å; F173-L218 HydrophobicContact CE2-CD1 3.51Å; F173-L218 HydrophobicContact CZ-CD1 4.17Å; T214-L218 PolarHBondContact O-N 3.44Å; F215-L218 PolarHBondContact O-N 2.92Å; L218-R220 VanDerWaalsContact C-N 3.29Å; L218-R220 PolarHBondContact O-N 2.85Å; L218-G221 PolarHBondContact O-N 3.05Å; L218-G221 VanDerWaalsContact O-N 3.16Å; L218-F526 HydrophobicContact CD2-CB 4.1Å; L218-F526 HydrophobicContact CD2-CD1 3.85Å; L218-F526 HydrophobicContact CD2-CG 4.12Å; L218-T533 HydrophobicContact CD1-CG2 4.23Å; L218-W534 HydrophobicContact CB-CH2 4.42Å
219Y86.5Confident89.3Confident177 Ų17754.5 Ų54.569%0.69428%0.276SS*.Hα-helixtrans-63.5-34.6177.2-178.2-98.1000113.1F215 V216 I217 W534F215-Y219 WeakPolarHBondContact O-CB 3.4Å; F215-Y219 PolarHBondContact O-N 2.89Å; V216-Y219 PolarHBondContact O-N 3.18Å; I217-Y219 VanDerWaalsContact C-N 3.34Å; I217-Y219 PolarHBondContact O-N 2.96Å; Y219-W534 HydrophobicContact CD2-CH2 4.08Å
220R87.4Confident89.2Confident120 Ų12051.8 Ų51.845%0.45327%0.267SS..Hα-helixtrans-81.5-15.3176.4-72.9-178.759.1-153-13.9113.5V216 I217 L218 T222 E227V216-R220 WeakPolarHBondContact O-CG 3.23Å; V216-R220 PolarHBondContact O-N 3.29Å; I217-R220 PolarHBondContact O-N 3.48Å; L218-R220 VanDerWaalsContact C-N 3.29Å; L218-R220 PolarHBondContact O-N 2.85Å; R220-T222 PolarHBondContact O-N 3.49Å; R220-T222 PolarHBondContact O-OG1 2.99Å; R220-E227 IonicContact CZ-OE1 3.69Å; R220-E227 IonicContact NH1-OE1 2.63Å; R220-E227 PolarHBondContact NH1-OE1 3.22Å; R220-E227 IonicContact NH1-OE2 3.95Å
221G83.4Confident89Confident20 Ų2052 Ų5221%0.20627%0.268CS..THydrogen-bonded Turntrans62.12.6-178.300000115I217 L218 Q525 F526I217-G221 PolarHBondContact O-N 3.01Å; I217-G221 VanDerWaalsContact O-N 3.08Å; L218-G221 PolarHBondContact O-N 3.05Å; L218-G221 VanDerWaalsContact O-N 3.16Å; G221-Q525 WeakPolarHBondContact O-CA 3.43Å; G221-F526 PolarHBondContact O-N 2.97Å
222T83.2Confident89Confident46 Ų4653 Ų5328%0.28227%0.273SS..EExtended strand (participates in β ladder)trans-144.4142.4-175.152.30000110.1R220 Y523 V524R220-T222 PolarHBondContact O-N 3.49Å; R220-T222 PolarHBondContact O-OG1 2.99Å; T222-Y523 HydrophobicContact CG2-CD2 3.93Å; T222-Y523 HydrophobicContact CG2-CE2 4.24Å; T222-V524 WeakPolarHBondContact CA-O 3.46Å
223T84.6Confident89Confident3 Ų352.9 Ų52.92%0.01827%0.272CS..EExtended strand (participates in β ladder)trans-131.1137.8176.8-65.30000112I217 E227 I228 V524 F526I217-T223 WeakPolarHBondContact CG2-OG1 3.39Å; T223-E227 HydrophobicContact CG2-CB 3.91Å; T223-I228 HydrophobicContact CG2-CD1 4.04Å; T223-I228 HydrophobicContact CG2-CG1 3.59Å; T223-V524 PolarHBondContact N-O 2.95Å; T223-V524 VanDerWaalsContact N-O 3.08Å; T223-V524 PolarHBondContact O-N 3.27Å; T223-F526 VanDerWaalsContact OG1-CE2 3.28Å; T223-F526 WeakPolarHBondContact OG1-CE2 3.4Å
224T88.8Confident89.1Confident69 Ų6950.3 Ų50.342%0.42326%0.264SS..  trans-95.5158.2178.5630000112.3G226 E227 I228T224-G226 PolarHBondContact O-N 3.14Å; T224-E227 PolarHBondContact N-OE2 2.88Å; T224-E227 PolarHBondContact O-N 2.61Å; T224-E227 VanDerWaalsContact O-N 3.08Å; T224-E227 WeakPolarHBondContact OG1-CG 3.45Å; T224-E227 PolarHBondContact OG1-N 2.93Å; T224-E227 PolarHBondContact OG1-OE2 3.4Å; T224-I228 PolarHBondContact O-N 3.39Å; T224-I228 VanDerWaalsContact O-N 3.14Å
225L88.4Confident89.2Confident90 Ų9052.5 Ų52.547%0.47127%0.272SS..Hα-helixtrans-53.4-40.2174.4174.662.4000112.5E227 I228 L229 L514 M517L225-E227 VanDerWaalsContact C-N 3.31Å; L225-E227 PolarHBondContact O-N 2.79Å; L225-I228 PolarHBondContact O-N 3.01Å; L225-L229 HydrophobicContact CD1-CD1 4Å; L225-L229 HydrophobicContact CD1-CG 3.97Å; L225-L229 HydrophobicContact CG-CD1 4.02Å; L225-L229 HydrophobicContact CG-CG 4.37Å; L225-L229 WeakPolarHBondContact O-CG 3.11Å; L225-L229 PolarHBondContact O-N 3.4Å; L225-L514 HydrophobicContact CD1-CD1 4.21Å; L225-M517 HydrophobicContact CB-CE 3.98Å; L225-M517 HydrophobicContact CB-SD 3.63Å; L225-M517 HydrophobicContact CD1-CE 3.22Å; L225-M517 HydrophobicContact CD1-SD 3.98Å; L225-M517 HydrophobicContact CG-CE 4.15Å; L225-M517 HydrophobicContact CG-SD 4.34Å
226G89.2Confident89.4Confident53 Ų5352.6 Ų52.655%0.54628%0.278SS..Hα-helixtrans-63-37.3179.300000112.9T224 G230T224-G226 PolarHBondContact O-N 3.14Å; G226-G230 PolarHBondContact O-N 2.95Å
227E90Very high89.6Confident30 Ų3052.3 Ų52.314%0.1428%0.277CS..Hα-helixtrans-69.3-41.9175.9-71.5164.4139.600111.4R220 T223 T224 L225 G230 Y231R220-E227 IonicContact CZ-OE1 3.69Å; R220-E227 IonicContact NH1-OE1 2.63Å; R220-E227 PolarHBondContact NH1-OE1 3.22Å; R220-E227 IonicContact NH1-OE2 3.95Å; T223-E227 HydrophobicContact CG2-CB 3.91Å; T224-E227 PolarHBondContact N-OE2 2.88Å; T224-E227 PolarHBondContact O-N 2.61Å; T224-E227 VanDerWaalsContact O-N 3.08Å; T224-E227 WeakPolarHBondContact OG1-CG 3.45Å; T224-E227 PolarHBondContact OG1-N 2.93Å; T224-E227 PolarHBondContact OG1-OE2 3.4Å; L225-E227 VanDerWaalsContact C-N 3.31Å; L225-E227 PolarHBondContact O-N 2.79Å; E227-G230 PolarHBondContact O-N 3.08Å; E227-Y231 VanDerWaalsContact O-CB 3.3Å; E227-Y231 WeakPolarHBondContact O-CB 3.42Å; E227-Y231 PolarHBondContact O-N 3.2Å
228I89.3Confident89.8Confident4 Ų452 Ų522%0.02128%0.275CS..Hα-helixtrans-62.4-46.4176.9-65163.8000111T223 T224 L225 G230 Y231 L232 G510 C513 L514 M517 V524T223-I228 HydrophobicContact CG2-CD1 4.04Å; T223-I228 HydrophobicContact CG2-CG1 3.59Å; T224-I228 PolarHBondContact O-N 3.39Å; T224-I228 VanDerWaalsContact O-N 3.14Å; L225-I228 PolarHBondContact O-N 3.01Å; I228-G230 VanDerWaalsContact C-N 3.34Å; I228-Y231 WeakPolarHBondContact O-CB 3.39Å; I228-Y231 PolarHBondContact O-N 3.25Å; I228-L232 PolarHBondContact O-N 2.95Å; I228-G510 VanDerWaalsContact CG2-O 3.29Å; I228-G510 WeakPolarHBondContact CG2-O 3.3Å; I228-C513 HydrophobicContact CD1-CB 3.61Å; I228-C513 HydrophobicContact CG1-CB 3.77Å; I228-C513 HydrophobicContact CG2-CB 4.34Å; I228-L514 HydrophobicContact CG2-CB 3.96Å; I228-L514 HydrophobicContact CG2-CD1 4.31Å; I228-M517 HydrophobicContact CD1-CE 3.45Å; I228-M517 VanDerWaalsContact CD1-CE 3.45Å; I228-M517 HydrophobicContact CD1-SD 4.01Å; I228-V524 HydrophobicContact CD1-CG2 4.5Å
229L91.9Very high89.9Confident92 Ų9253.8 Ų53.848%0.48229%0.286SS..Hα-helixtrans-64.6-39.5176-69.4176.9000111.7L225 Y231 L232 F233L225-L229 HydrophobicContact CD1-CD1 4Å; L225-L229 HydrophobicContact CD1-CG 3.97Å; L225-L229 HydrophobicContact CG-CD1 4.02Å; L225-L229 HydrophobicContact CG-CG 4.37Å; L225-L229 WeakPolarHBondContact O-CG 3.11Å; L225-L229 PolarHBondContact O-N 3.4Å; L229-Y231 VanDerWaalsContact C-N 3.27Å; L229-Y231 PolarHBondContact O-N 3.33Å; L229-L232 PolarHBondContact O-N 2.93Å; L229-F233 WeakPolarHBondContact O-CB 3.4Å; L229-F233 PolarHBondContact O-N 3.41Å
230G93.1Very high90.1Very high19 Ų1949.6 Ų49.620%0.19628%0.275CS..Hα-helixtrans-61.2-37.2173.800000112.6G226 E227 I228 F233 L234G226-G230 PolarHBondContact O-N 2.95Å; E227-G230 PolarHBondContact O-N 3.08Å; I228-G230 VanDerWaalsContact C-N 3.34Å; G230-F233 PolarHBondContact O-N 3.25Å; G230-L234 WeakPolarHBondContact O-CB 2.95Å; G230-L234 PolarHBondContact O-N 3.49Å
231Y90.7Very high90.2Very high4 Ų446.3 Ų46.32%0.01627%0.268CS..Hα-helixtrans-69.8-44.7179.1-155.6-106.4000112.3W213 T214 E227 I228 L229 L234 Y235 M505 L506 V509W213-Y231 HydrophobicContact CB-CE2 4.37Å; W213-Y231 HydrophobicContact CD2-CD2 4.11Å; W213-Y231 HydrophobicContact CE3-CD2 4.27Å; W213-Y231 HydrophobicContact CG-CD2 4.27Å; W213-Y231 HydrophobicContact CG-CE2 4.45Å; T214-Y231 PolarHBondContact OG1-OH 3.43Å; E227-Y231 VanDerWaalsContact O-CB 3.3Å; E227-Y231 WeakPolarHBondContact O-CB 3.42Å; E227-Y231 PolarHBondContact O-N 3.2Å; I228-Y231 WeakPolarHBondContact O-CB 3.39Å; I228-Y231 PolarHBondContact O-N 3.25Å; L229-Y231 VanDerWaalsContact C-N 3.27Å; L229-Y231 PolarHBondContact O-N 3.33Å; Y231-L234 WeakPolarHBondContact O-CB 3.49Å; Y231-L234 PolarHBondContact O-N 3.48Å; Y231-Y235 PolarHBondContact O-N 3.31Å; Y231-M505 VanDerWaalsContact CE1-O 3.25Å; Y231-M505 WeakPolarHBondContact CE1-O 3.32Å; Y231-M505 VanDerWaalsContact OH-CG 3.29Å; Y231-M505 WeakPolarHBondContact OH-CG 3.33Å; Y231-M505 PolarHBondContact OH-O 3.21Å; Y231-L506 HydrophobicContact CD1-CD2 4.14Å; Y231-L506 WeakPolarHBondContact CD1-O 3.29Å; Y231-L506 HydrophobicContact CD2-CD2 4.01Å; Y231-L506 HydrophobicContact CE1-CB 4.36Å; Y231-L506 HydrophobicContact CE1-CD2 3.88Å; Y231-L506 WeakPolarHBondContact CE1-O 3.44Å; Y231-L506 HydrophobicContact CE2-CD2 3.72Å; Y231-L506 HydrophobicContact CG-CD2 4.2Å; Y231-V509 HydrophobicContact CE1-CB 3.96Å; Y231-V509 HydrophobicContact CE1-CG1 4.35Å
232L92.7Very high90.4Very high31 Ų3145.6 Ų45.616%0.16226%0.26CS..Hα-helixtrans-65.3-38.6171.3-70.3175000112I228 L229 L234 Y235 V236 F507 L514I228-L232 PolarHBondContact O-N 2.95Å; L229-L232 PolarHBondContact O-N 2.93Å; L232-L234 VanDerWaalsContact C-N 3.33Å; L232-L234 PolarHBondContact O-N 3.25Å; L232-Y235 WeakPolarHBondContact O-CB 2.97Å; L232-Y235 PolarHBondContact O-N 3.05Å; L232-V236 PolarHBondContact O-N 3.2Å; L232-V236 VanDerWaalsContact O-N 3.13Å; L232-F507 HydrophobicContact CD2-CD2 4.14Å; L232-L514 HydrophobicContact CD1-CD2 4.09Å
233F94.6Very high90.4Very high137 Ų13747.2 Ų47.260%0.60127%0.266SS*.Hα-helixtrans-62.2-40.8175176.5-102.4000111.6L229 G230 Y235 V236 V237L229-F233 WeakPolarHBondContact O-CB 3.4Å; L229-F233 PolarHBondContact O-N 3.41Å; G230-F233 PolarHBondContact O-N 3.25Å; F233-Y235 VanDerWaalsContact C-N 3.26Å; F233-Y235 PolarHBondContact O-N 3.3Å; F233-V236 WeakPolarHBondContact O-CB 3.48Å; F233-V236 PolarHBondContact O-N 3.3Å; F233-V236 VanDerWaalsContact O-N 3.11Å; F233-V237 HydrophobicContact CD1-CG2 3.99Å; F233-V237 HydrophobicContact CD2-CG2 4.5Å; F233-V237 HydrophobicContact CE1-CG2 3.52Å; F233-V237 HydrophobicContact CE2-CG2 4.08Å; F233-V237 HydrophobicContact CG-CG2 4.46Å; F233-V237 HydrophobicContact CZ-CG2 3.57Å; F233-V237 WeakPolarHBondContact O-CG2 3.41Å; F233-V237 PolarHBondContact O-N 3.48Å
234L94.6Very high90.5Very high21 Ų2151.7 Ų51.711%0.1129%0.289CS..Hα-helixtrans-59-38175.5-177.162.1000111.8F206 I209 W213 G230 Y231 L232 V237 Y238 L506F206-L234 HydrophobicContact CD1-CD1 3.95Å; F206-L234 HydrophobicContact CE1-CD1 3.86Å; I209-L234 HydrophobicContact CG2-CD2 3.77Å; W213-L234 HydrophobicContact CE3-CD2 4.04Å; W213-L234 HydrophobicContact CZ3-CD2 4.19Å; G230-L234 WeakPolarHBondContact O-CB 2.95Å; G230-L234 PolarHBondContact O-N 3.49Å; Y231-L234 WeakPolarHBondContact O-CB 3.49Å; Y231-L234 PolarHBondContact O-N 3.48Å; L232-L234 VanDerWaalsContact C-N 3.33Å; L232-L234 PolarHBondContact O-N 3.25Å; L234-V237 PolarHBondContact O-N 2.99Å; L234-Y238 WeakPolarHBondContact O-CB 3.42Å; L234-Y238 PolarHBondContact O-N 3.13Å; L234-L506 HydrophobicContact CD2-CD1 4.3Å; L234-L506 HydrophobicContact CD2-CD2 3.87Å; L234-L506 HydrophobicContact CG-CD1 4.07Å; L234-L506 HydrophobicContact CG-CD2 4.38Å
235Y92.1Very high90.3Very high47 Ų4750.1 Ų50.118%0.18428%0.281CS..Hα-helixtrans-64.3-44.2173.1179.5-107.2000112.4Y231 L232 F233 V237 Y238 V239 F503 L506 F507Y231-Y235 PolarHBondContact O-N 3.31Å; L232-Y235 WeakPolarHBondContact O-CB 2.97Å; L232-Y235 PolarHBondContact O-N 3.05Å; F233-Y235 VanDerWaalsContact C-N 3.26Å; F233-Y235 PolarHBondContact O-N 3.3Å; Y235-V237 VanDerWaalsContact C-N 3.32Å; Y235-V237 PolarHBondContact O-N 3.47Å; Y235-Y238 HydrophobicContact CD2-CD1 4.41Å; Y235-Y238 HydrophobicContact CE2-CD1 4.4Å; Y235-Y238 WeakPolarHBondContact O-CB 3.27Å; Y235-Y238 PolarHBondContact O-N 3.37Å; Y235-Y238 VanDerWaalsContact O-N 3.17Å; Y235-V239 HydrophobicContact CD1-CG2 4.36Å; Y235-V239 HydrophobicContact CD2-CG2 4.45Å; Y235-V239 HydrophobicContact CE1-CG2 3.85Å; Y235-V239 HydrophobicContact CE2-CG2 3.95Å; Y235-V239 WeakPolarHBondContact O-CG2 3.24Å; Y235-V239 PolarHBondContact O-N 2.88Å; Y235-F503 HydrophobicContact CE1-CD2 4.29Å; Y235-F503 HydrophobicContact CE1-CE2 4.47Å; Y235-F503 HydrophobicContact CE2-CB 4.18Å; Y235-F503 AromaticContact CE2-CD2 3.66Å; Y235-F503 HydrophobicContact CE2-CD2 3.66Å; Y235-F503 HydrophobicContact CE2-CG 4.38Å; Y235-F503 AromaticContact CZ-CD2 3.45Å; Y235-F503 VanDerWaalsContact CZ-CD2 3.45Å; Y235-F503 AromaticContact CZ-CE2 3.95Å; Y235-F503 WeakPolarHBondContact OH-CD2 3.34Å; Y235-F503 WeakPolarHBondContact OH-CE2 3.42Å; Y235-L506 HydrophobicContact CD2-CB 4.22Å; Y235-L506 HydrophobicContact CD2-CD1 4.5Å; Y235-L506 HydrophobicContact CG-CB 4.42Å; Y235-F507 HydrophobicContact CD1-CB 4.23Å; Y235-F507 AromaticContact CD1-CD2 3.96Å; Y235-F507 HydrophobicContact CD1-CD2 3.96Å; Y235-F507 HydrophobicContact CD1-CG 4.49Å; Y235-F507 HydrophobicContact CD2-CB 4.43Å; Y235-F507 HydrophobicContact CE1-CB 4.34Å; Y235-F507 HydrophobicContact CE1-CD2 4.07Å; Y235-F507 HydrophobicContact CE1-CG 4.43Å; Y235-F507 HydrophobicContact CG-CB 4.27Å
236V92.5Very high89.9Confident75 Ų7547.3 Ų47.346%0.45527%0.269SS..Hα-helixtrans-60-44.3175.7175.20000110.7L232 F233 Y238 V239 L240L232-V236 PolarHBondContact O-N 3.2Å; L232-V236 VanDerWaalsContact O-N 3.13Å; F233-V236 WeakPolarHBondContact O-CB 3.48Å; F233-V236 PolarHBondContact O-N 3.3Å; F233-V236 VanDerWaalsContact O-N 3.11Å; V236-Y238 VanDerWaalsContact C-N 3.33Å; V236-Y238 PolarHBondContact O-N 3.28Å; V236-V239 PolarHBondContact O-N 3.04Å; V236-L240 HydrophobicContact CG1-CD1 3.97Å; V236-L240 HydrophobicContact CG1-CG 4.33Å; V236-L240 WeakPolarHBondContact O-CB 3.24Å; V236-L240 VanDerWaalsContact O-CG 3.29Å; V236-L240 WeakPolarHBondContact O-CG 3.15Å; V236-L240 PolarHBondContact O-N 2.86Å
237V94.4Very high89.5Confident43 Ų4348.7 Ų48.726%0.26127%0.269SS..Hα-helixtrans-60.8-42.1175.5172.50000111.3F206 F233 L234 Y235 L240 T241F206-V237 HydrophobicContact CE1-CG1 4.08Å; F206-V237 HydrophobicContact CZ-CG1 4.11Å; F233-V237 HydrophobicContact CD1-CG2 3.99Å; F233-V237 HydrophobicContact CD2-CG2 4.5Å; F233-V237 HydrophobicContact CE1-CG2 3.52Å; F233-V237 HydrophobicContact CE2-CG2 4.08Å; F233-V237 HydrophobicContact CG-CG2 4.46Å; F233-V237 HydrophobicContact CZ-CG2 3.57Å; F233-V237 WeakPolarHBondContact O-CG2 3.41Å; F233-V237 PolarHBondContact O-N 3.48Å; L234-V237 PolarHBondContact O-N 2.99Å; Y235-V237 VanDerWaalsContact C-N 3.32Å; Y235-V237 PolarHBondContact O-N 3.47Å; V237-L240 PolarHBondContact O-N 3.45Å; V237-T241 WeakPolarHBondContact O-CB 3.4Å; V237-T241 PolarHBondContact O-N 3.14Å; V237-T241 PolarHBondContact O-OG1 3.14Å
238Y91.6Very high89.2Confident5 Ų551.2 Ų51.22%0.0228%0.283CS..Hα-helixtrans-57.9-53.6175170.1-106.7000111.5V140 D203 F206 L234 Y235 V236 L240 T241 V242 I502V140-Y238 HydrophobicContact CG1-CE1 4.11Å; V140-Y238 VanDerWaalsContact CG1-OH 3.24Å; V140-Y238 WeakPolarHBondContact CG1-OH 3.45Å; D203-Y238 WeakPolarHBondContact OD1-CE2 3.17Å; D203-Y238 PolarHBondContact OD1-OH 3.39Å; F206-Y238 HydrophobicContact CB-CD2 3.84Å; F206-Y238 HydrophobicContact CB-CE2 4.35Å; F206-Y238 HydrophobicContact CD1-CD2 4.08Å; F206-Y238 HydrophobicContact CD1-CG 4.45Å; F206-Y238 AromaticContact CD2-CD2 3.94Å; F206-Y238 HydrophobicContact CD2-CD2 3.94Å; F206-Y238 AromaticContact CG-CD2 3.69Å; F206-Y238 HydrophobicContact CG-CD2 3.69Å; F206-Y238 HydrophobicContact CG-CG 4.47Å; L234-Y238 WeakPolarHBondContact O-CB 3.42Å; L234-Y238 PolarHBondContact O-N 3.13Å; Y235-Y238 HydrophobicContact CD2-CD1 4.41Å; Y235-Y238 HydrophobicContact CE2-CD1 4.4Å; Y235-Y238 WeakPolarHBondContact O-CB 3.27Å; Y235-Y238 PolarHBondContact O-N 3.37Å; Y235-Y238 VanDerWaalsContact O-N 3.17Å; V236-Y238 VanDerWaalsContact C-N 3.33Å; V236-Y238 PolarHBondContact O-N 3.28Å; Y238-L240 PolarHBondContact O-N 3.18Å; Y238-T241 WeakPolarHBondContact O-CB 3.45Å; Y238-T241 PolarHBondContact O-N 2.84Å; Y238-T241 VanDerWaalsContact O-N 3.12Å; Y238-V242 HydrophobicContact CD2-CG2 4.35Å; Y238-V242 HydrophobicContact CE1-CG2 4.1Å; Y238-V242 HydrophobicContact CE2-CG2 3.93Å; Y238-V242 VanDerWaalsContact O-CG2 3.31Å; Y238-V242 WeakPolarHBondContact O-CG2 3.17Å; Y238-V242 PolarHBondContact O-N 3.49Å; Y238-I502 HydrophobicContact CD1-CG2 3.9Å; Y238-I502 HydrophobicContact CE1-CG2 3.98Å; Y238-I502 HydrophobicContact CE2-CD1 3.88Å; Y238-I502 HydrophobicContact CG-CG2 4.18Å
239V88.9Confident88.5Confident44 Ų4458.1 Ų58.127%0.26731%0.31SS..Hα-helixtrans-60.1-45.8179.8174.10000111.1Y235 V236 T241 V242 L243Y235-V239 HydrophobicContact CD1-CG2 4.36Å; Y235-V239 HydrophobicContact CD2-CG2 4.45Å; Y235-V239 HydrophobicContact CE1-CG2 3.85Å; Y235-V239 HydrophobicContact CE2-CG2 3.95Å; Y235-V239 WeakPolarHBondContact O-CG2 3.24Å; Y235-V239 PolarHBondContact O-N 2.88Å; V236-V239 PolarHBondContact O-N 3.04Å; V239-T241 VanDerWaalsContact C-N 3.3Å; V239-T241 PolarHBondContact O-N 3.42Å; V239-V242 WeakPolarHBondContact O-CB 3.39Å; V239-V242 PolarHBondContact O-N 3.09Å; V239-V242 VanDerWaalsContact O-N 3.13Å; V239-L243 HydrophobicContact CG1-CD1 4.04Å; V239-L243 HydrophobicContact CG1-CG 4.35Å; V239-L243 WeakPolarHBondContact O-CG 3.4Å; V239-L243 PolarHBondContact O-N 2.9Å
240L90Very high87.7Confident89 Ų8957.5 Ų57.547%0.46631%0.307SS..Hα-helixtrans-59.8-41.4176.1-71.2175.4000111.6V236 V237 Y238 V242 L243 I244V236-L240 HydrophobicContact CG1-CD1 3.97Å; V236-L240 HydrophobicContact CG1-CG 4.33Å; V236-L240 WeakPolarHBondContact O-CB 3.24Å; V236-L240 VanDerWaalsContact O-CG 3.29Å; V236-L240 WeakPolarHBondContact O-CG 3.15Å; V236-L240 PolarHBondContact O-N 2.86Å; V237-L240 PolarHBondContact O-N 3.45Å; Y238-L240 PolarHBondContact O-N 3.18Å; L240-V242 VanDerWaalsContact C-N 3.31Å; L240-V242 PolarHBondContact O-N 3.16Å; L240-L243 PolarHBondContact O-N 3.47Å; L240-I244 WeakPolarHBondContact O-CB 3.26Å; L240-I244 WeakPolarHBondContact O-CD1 3.43Å; L240-I244 WeakPolarHBondContact O-CG1 3.48Å; L240-I244 PolarHBondContact O-N 3.49Å
241T90.2Very high87Confident50 Ų5066 Ų6631%0.30733%0.333SS..Hα-helixtrans-62.9-39176.4-56.40000111.4R202 F206 V237 Y238 V239 S245R202-T241 HydrophobicContact CG-CG2 4.09Å; F206-T241 HydrophobicContact CE2-CG2 4.34Å; V237-T241 WeakPolarHBondContact O-CB 3.4Å; V237-T241 PolarHBondContact O-N 3.14Å; V237-T241 PolarHBondContact O-OG1 3.14Å; Y238-T241 WeakPolarHBondContact O-CB 3.45Å; Y238-T241 PolarHBondContact O-N 2.84Å; Y238-T241 VanDerWaalsContact O-N 3.12Å; V239-T241 VanDerWaalsContact C-N 3.3Å; V239-T241 PolarHBondContact O-N 3.42Å; T241-S245 WeakPolarHBondContact O-CB 3.29Å; T241-S245 PolarHBondContact O-N 3.2Å
242V86.5Confident86.4Confident5 Ų571.2 Ų71.23%0.0336%0.358CS..Hα-helixtrans-62.5-49.5174.7176.20000111.1V140 R202 Y238 V239 L240 S245 S246V140-V242 HydrophobicContact CB-CG1 4.38Å; V140-V242 HydrophobicContact CG1-CG1 4.06Å; V140-V242 HydrophobicContact CG1-CG2 4.02Å; R202-V242 VanDerWaalsContact CZ-CG2 3.48Å; Y238-V242 HydrophobicContact CD2-CG2 4.35Å; Y238-V242 HydrophobicContact CE1-CG2 4.1Å; Y238-V242 HydrophobicContact CE2-CG2 3.93Å; Y238-V242 VanDerWaalsContact O-CG2 3.31Å; Y238-V242 WeakPolarHBondContact O-CG2 3.17Å; Y238-V242 PolarHBondContact O-N 3.49Å; V239-V242 WeakPolarHBondContact O-CB 3.39Å; V239-V242 PolarHBondContact O-N 3.09Å; V239-V242 VanDerWaalsContact O-N 3.13Å; L240-V242 VanDerWaalsContact C-N 3.31Å; L240-V242 PolarHBondContact O-N 3.16Å; V242-S245 PolarHBondContact O-N 2.98Å; V242-S246 PolarHBondContact O-N 3.36Å
243L85.1Confident85.5Confident80 Ų8075.3 Ų75.342%0.41937%0.374SS..Hα-helixtrans-63.5-47.7-179.3-66.5176.1000111.6V239 L240 S245 S246 C247V239-L243 HydrophobicContact CG1-CD1 4.04Å; V239-L243 HydrophobicContact CG1-CG 4.35Å; V239-L243 WeakPolarHBondContact O-CG 3.4Å; V239-L243 PolarHBondContact O-N 2.9Å; L240-L243 PolarHBondContact O-N 3.47Å; L243-S245 PolarHBondContact O-N 3.25Å; L243-S246 WeakPolarHBondContact O-CB 3.19Å; L243-S246 PolarHBondContact O-N 2.91Å; L243-C247 PolarHBondContact O-N 3.39Å; L243-C247 PolarHBondContact O-SG 3.45Å; L243-C247 VanDerWaalsContact O-SG 3.34Å
244I86.8Confident84.3Confident98 Ų9873 Ų7350%0.50337%0.368SS..Hα-helixtrans-61.7-45.1177.9-67.6165.4000110.4L240 S246 C247 I248L240-I244 WeakPolarHBondContact O-CB 3.26Å; L240-I244 WeakPolarHBondContact O-CD1 3.43Å; L240-I244 WeakPolarHBondContact O-CG1 3.48Å; L240-I244 PolarHBondContact O-N 3.49Å; I244-S246 VanDerWaalsContact C-N 3.28Å; I244-S246 PolarHBondContact O-N 3.22Å; I244-C247 PolarHBondContact O-N 2.95Å; I244-I248 HydrophobicContact CG2-CD1 3.69Å; I244-I248 HydrophobicContact CG2-CG1 4.31Å; I244-I248 WeakPolarHBondContact O-CG1 3.16Å; I244-I248 PolarHBondContact O-N 3.02Å
245S83.5Confident83.1Confident36 Ų3676.1 Ų76.125%0.25239%0.392SS..Hα-helixtrans-58.7-41177.6-177.90000111.9T241 V242 L243 Y249T241-S245 WeakPolarHBondContact O-CB 3.29Å; T241-S245 PolarHBondContact O-N 3.2Å; V242-S245 PolarHBondContact O-N 2.98Å; L243-S245 PolarHBondContact O-N 3.25Å; S245-Y249 WeakPolarHBondContact O-CB 3.37Å; S245-Y249 PolarHBondContact O-N 3.02Å
246S80Confident81.9Confident31 Ų3176.8 Ų76.822%0.21741%0.407CS..Hα-helixtrans-65.4-45.8174.9-177.60000112.4V137 V242 L243 I244 I248 Y249 N250V137-S246 VanDerWaalsContact CG2-CB 3.5Å; V137-S246 WeakPolarHBondContact CG2-OG 3.15Å; V242-S246 PolarHBondContact O-N 3.36Å; L243-S246 WeakPolarHBondContact O-CB 3.19Å; L243-S246 PolarHBondContact O-N 2.91Å; I244-S246 VanDerWaalsContact C-N 3.28Å; I244-S246 PolarHBondContact O-N 3.22Å; S246-I248 VanDerWaalsContact C-N 3.34Å; S246-I248 PolarHBondContact O-N 2.93Å; S246-Y249 PolarHBondContact O-N 3.25Å; S246-N250 WeakPolarHBondContact O-CB 3.4Å; S246-N250 PolarHBondContact O-N 2.78Å
247C80.8Confident80.6Confident81 Ų8177 Ų7755%0.54741%0.408SS..Hα-helixtrans-60.2-43.4178.4-72.70000112.1L243 I244 N250 R251L243-C247 PolarHBondContact O-N 3.39Å; L243-C247 PolarHBondContact O-SG 3.45Å; L243-C247 VanDerWaalsContact O-SG 3.34Å; I244-C247 PolarHBondContact O-N 2.95Å; C247-N250 PolarHBondContact O-N 3.49Å; C247-R251 WeakPolarHBondContact O-CB 3.08Å; C247-R251 WeakPolarHBondContact O-CG 3.43Å; C247-R251 PolarHBondContact O-N 3.33Å
248I82.9Confident78.8Confident83 Ų8380.9 Ų80.943%0.42643%0.428SS..Hα-helixtrans-64.4-46.1177.5-66.7168.8000110.5I244 S246 N250 R251 Q252I244-I248 HydrophobicContact CG2-CD1 3.69Å; I244-I248 HydrophobicContact CG2-CG1 4.31Å; I244-I248 WeakPolarHBondContact O-CG1 3.16Å; I244-I248 PolarHBondContact O-N 3.02Å; S246-I248 VanDerWaalsContact C-N 3.34Å; S246-I248 PolarHBondContact O-N 2.93Å; I248-N250 VanDerWaalsContact C-N 3.34Å; I248-N250 PolarHBondContact O-N 3.08Å; I248-R251 PolarHBondContact O-N 3.08Å; I248-Q252 WeakPolarHBondContact O-CG 3.43Å; I248-Q252 PolarHBondContact O-N 3.3Å
249Y76.6Confident77Confident149 Ų14983.5 Ų83.558%0.58446%0.456SS*.Hα-helixtrans-60.1-44.8178.5178.8-101.5000111.8S245 S246 R251 Q252 K253S245-Y249 WeakPolarHBondContact O-CB 3.37Å; S245-Y249 PolarHBondContact O-N 3.02Å; S246-Y249 PolarHBondContact O-N 3.25Å; Y249-R251 PolarHBondContact O-N 3.14Å; Y249-Q252 PolarHBondContact O-N 3.23Å; Y249-K253 WeakPolarHBondContact O-CB 3.29Å; Y249-K253 PolarHBondContact O-N 3.43Å
250N74.5Confident75.3Confident80 Ų8088.3 Ų88.343%0.42848%0.48SS..Hα-helixtrans-67.3-37.9-180-151.628.9000111.9S246 C247 I248 K253 N254S246-N250 WeakPolarHBondContact O-CB 3.4Å; S246-N250 PolarHBondContact O-N 2.78Å; C247-N250 PolarHBondContact O-N 3.49Å; I248-N250 VanDerWaalsContact C-N 3.34Å; I248-N250 PolarHBondContact O-N 3.08Å; N250-K253 PolarHBondContact O-N 2.63Å; N250-N254 PolarHBondContact O-N 3.2Å
251R78.6Confident73.2Confident197 Ų19792.1 Ų92.174%0.74350%0.495SS*.Hα-helixtrans-62-47.9172.6-83.3-178.3143.4-166.4-5.8112.4C247 I248 Y249 K253 N254 S255C247-R251 WeakPolarHBondContact O-CB 3.08Å; C247-R251 WeakPolarHBondContact O-CG 3.43Å; C247-R251 PolarHBondContact O-N 3.33Å; I248-R251 PolarHBondContact O-N 3.08Å; Y249-R251 PolarHBondContact O-N 3.14Å; R251-K253 VanDerWaalsContact C-N 3.32Å; R251-K253 PolarHBondContact O-N 2.88Å; R251-N254 PolarHBondContact O-N 3.07Å; R251-S255 PolarHBondContact O-N 3.42Å; R251-S255 PolarHBondContact O-OG 2.94Å
252Q77.9Confident70.7Confident113 Ų11399.5 Ų99.553%0.52852%0.519SS..Hα-helixtrans-62.3-40.5178.9-75.3-177.2-900112.1I248 Y249 S255 A256I248-Q252 WeakPolarHBondContact O-CG 3.43Å; I248-Q252 PolarHBondContact O-N 3.3Å; Y249-Q252 PolarHBondContact O-N 3.23Å; Q252-S255 PolarHBondContact O-N 3.3Å; Q252-A256 PolarHBondContact O-N 2.61Å
253K73.2Confident68.4Low117 Ų117105.3 Ų105.351%0.50955%0.554SS.*Hα-helixtrans-60.1-49174.8-174-179.5177.1-174.70111.3Y249 N250 R251 S255 A256 T257Y249-K253 WeakPolarHBondContact O-CB 3.29Å; Y249-K253 PolarHBondContact O-N 3.43Å; N250-K253 PolarHBondContact O-N 2.63Å; R251-K253 VanDerWaalsContact C-N 3.32Å; R251-K253 PolarHBondContact O-N 2.88Å; K253-S255 VanDerWaalsContact C-N 3.34Å; K253-S255 PolarHBondContact O-N 3.3Å; K253-A256 PolarHBondContact O-N 3.39Å; K253-T257 PolarHBondContact O-N 3.26Å; K253-T257 PolarHBondContact O-OG1 3.49Å; K253-T257 VanDerWaalsContact O-OG1 3.06Å
254N70.6Confident66.2Low89 Ų89105.7 Ų105.748%0.47656%0.561SS.*Hα-helixtrans-64.2-37.2179.2-74-1000112.5N250 R251 T257 N258N250-N254 PolarHBondContact O-N 3.2Å; R251-N254 PolarHBondContact O-N 3.07Å; N254-T257 PolarHBondContact O-N 3.02Å; N254-N258 WeakPolarHBondContact O-CB 3.36Å; N254-N258 PolarHBondContact O-N 2.93Å
255S69.6Low63.6Low87 Ų87110.3 Ų110.361%0.60858%0.58SS**Hα-helixtrans-65.6-36.9174.1-67.30000112.9R251 Q252 K253 G259R251-S255 PolarHBondContact O-N 3.42Å; R251-S255 PolarHBondContact O-OG 2.94Å; Q252-S255 PolarHBondContact O-N 3.3Å; K253-S255 VanDerWaalsContact C-N 3.34Å; K253-S255 PolarHBondContact O-N 3.3Å; S255-G259 PolarHBondContact O-N 2.9Å
256A66.6Low61.1Low60 Ų60114.5 Ų114.550%0.49660%0.604SS.*Hα-helixtrans-70.5-37.717600000112.5Q252 K253 G259Q252-A256 PolarHBondContact O-N 2.61Å; K253-A256 PolarHBondContact O-N 3.39Å; A256-G259 PolarHBondContact O-N 3.35Å
257T63.4Low58.8Low80 Ų80118.8 Ų118.849%0.49163%0.631SS.*Hα-helixtrans-69-38.9176.7-51.10000112K253 N254 G259 L260K253-T257 PolarHBondContact O-N 3.26Å; K253-T257 PolarHBondContact O-OG1 3.49Å; K253-T257 VanDerWaalsContact O-OG1 3.06Å; N254-T257 PolarHBondContact O-N 3.02Å; T257-G259 PolarHBondContact O-N 3.13Å; T257-L260 PolarHBondContact O-N 3.25Å
258N56.9Low56.3Low125 Ų125124.2 Ų124.267%0.66865%0.648SS**Hα-helixtrans-69.7-19.9174.7-76.40.8000113.4N254N254-N258 WeakPolarHBondContact O-CB 3.36Å; N254-N258 PolarHBondContact O-N 2.93Å
259G53.9Low53.7Low59 Ų59128.3 Ų128.361%0.60867%0.67SS**Hα-helixtrans-78.9-17.2177.100000115S255 A256 T257S255-G259 PolarHBondContact O-N 2.9Å; A256-G259 PolarHBondContact O-N 3.35Å; T257-G259 PolarHBondContact O-N 3.13Å
260L54.7Low51.5Low146 Ų146128.9 Ų128.976%0.76468%0.683SS**THydrogen-bonded Turntrans-95.70.6-178.1-80158.6000113.9T257T257-L260 PolarHBondContact O-N 3.25Å
261Q44.3Very low49.1Very low169 Ų169130.7 Ų130.779%0.7970%0.702SS**SBendtrans-93.613-179-156.2156.60.700113.8
262Y38.4Very low46.7Very low205 Ų205126.2 Ų126.280%0.80470%0.701SS**  trans-116.278.6172-165.6-93000110P264Y262-P264 HydrophobicContact CE1-CG 4.5Å
263V37.3Very low44.2Very low126 Ų126127.6 Ų127.676%0.76471%0.712SS**  trans-120.2116.3160.5-177.70000106H265V263-H265 PolarHBondContact O-N 3.12Å
264P39.9Very low41.9Very low89 Ų89127 Ų12758%0.57872%0.723SS**  trans-66.5135.5178.6-12.626.6000110.1Y262 V266Y262-P264 HydrophobicContact CE1-CG 4.5Å; P264-V266 PolarHBondContact O-N 2.89Å
265H31.7Very low39.7Very low195 Ų195127.2 Ų127.290%0.90373%0.731SS**  trans-47122.3167.1-102.7-78.5000111.1V263V263-H265 PolarHBondContact O-N 3.12Å
266V31.1Very low37.5Very low124 Ų124129.8 Ų129.875%0.75274%0.738SS**  trans-112.4129159.1-174.80000106.6P264 E268P264-V266 PolarHBondContact O-N 2.89Å; V266-E268 PolarHBondContact O-N 3.01Å
267P31.6Very low35.6Very low120 Ų120133.6 Ų133.678%0.77975%0.75SS**PPolyproline II helixtrans-77.1121.4176.878.2000109.4L269P267-L269 PolarHBondContact O-N 3.46Å
268E28.6Very low33.8Very low196 Ų196136.7 Ų136.792%0.91676%0.763SS**PPolyproline II helixtrans-72.8120.5172.5-77178.3151.700110.4V266V266-E268 PolarHBondContact O-N 3.01Å
269L28Very low32.4Very low169 Ų169138.2 Ų138.289%0.88577%0.772SS**PPolyproline II helixtrans-90.5129.5170.1-166.376.2000107.9P267P267-L269 PolarHBondContact O-N 3.46Å
270N30Very low31.1Very low160 Ų160142.1 Ų142.186%0.85678%0.779SS**PPolyproline II helixtrans-53.9135.3177.9-69.6-23.1000113.3
271S25.4Very low29.8Very low118 Ų118143.5 Ų143.583%0.82579%0.785SS**  trans-159.5122.1140.855.80000111.1
272S27.3Very low28.8Very low103 Ų103143.8 Ų143.872%0.7279%0.786SS**  trans-67.1150.5165.9470000112.7
273D24.9Very low28.1Very low143 Ų143145.4 Ų145.477%0.76579%0.791SS**  trans158.7104.9139.4-80.3-6.3000107.9
274S24.8Very low27.6Very low105 Ų105147.3 Ų147.373%0.73479%0.794SS**  47.4124.1103.366.90000113.1
275S25Very low27.1Very low92 Ų92155.6 Ų155.664%0.64381%0.813SS**  cis-179.4147.141.141.40000109.5
276D24.7Very low26.9Very low142 Ų142149.5 Ų149.576%0.75980%0.803SS**  trans49.6130.3130.8-50.8-15.8000118.8
277D25.8Very low26.7Very low139 Ų139147 Ų14774%0.74380%0.802SS**  cis-160.3143.426.4-85.2-45.8000112.2
278D25.8Very low26.6Very low145 Ų145146.9 Ų146.978%0.77580%0.799SS**  trans32.7121.2141.7-63.1-32000124.4
279D27.8Very low26.7Very low158 Ų158145.2 Ų145.285%0.84580%0.795SS**  -155.7109.7126.2-107.8-25.3000111.7
280D26.1Very low26.6Very low141 Ų141146 Ų14675%0.75479%0.794SS**  trans43.190.3155.4-81.5-27.7000122.3
281I26.9Very low26.4Very low175 Ų175147.1 Ų147.190%0.89779%0.794SS**  trans-105.697.6146.8-63.6-179.3000108.7
282Q23.8Very low26.4Very low174 Ų174149.9 Ų149.981%0.81379%0.794SS**  trans-14490.7169-161.8151.4-43.200113.4
283R24.6Very low26.4Very low240 Ų240155.9 Ų155.991%0.90680%0.803SS**  trans172.6124151.1-101.9170.2173.5157.90.7108.3
284M25.4Very low26.5Very low166 Ų166158.4 Ų158.482%0.81881%0.81SS**  cis-143.2118.713.6-83.9-142.8-80.300111G286M284-G286 PolarHBondContact O-N 3.36Å
285R29.5Very low26.9Very low263 Ų263163.1 Ų163.199%0.99282%0.818SS**  trans-70.5105.1145.8-176.8175.1176.6-173.9-0.4106.9
286G28.1Very low27.1Very low66 Ų66166.2 Ų166.268%0.6882%0.822SS**  trans173.754.4-177.900000113M284M284-G286 PolarHBondContact O-N 3.36Å
287G27.7Very low27.4Very low72 Ų72169.4 Ų169.474%0.74283%0.825SS**SBendtrans-176.720.7-179.600000116.9
288T28.4Very low27.6Very low117 Ų117172.3 Ų172.372%0.71883%0.825SS**  trans-146.772179.1-26.90000110
289I30Very low27.9Very low162 Ų162169.8 Ų169.883%0.83182%0.817SS**SBendtrans-130.321.7170.7-54.2176.4000111.1
290Q26.2Very low28.6Very low184 Ų184171 Ų17186%0.8682%0.823SS**SBendtrans-139.425.1-179.3-152.27347.600115
291Q26.9Very low29.2Very low184 Ų184171 Ų17186%0.8682%0.821SS**SBendtrans-130.84.5170.2-89.7-179.9-33.800114.3
292E24.4Very low29.7Very low176 Ų176168.9 Ų168.982%0.82282%0.819SS**SBendtrans-110.621.2-174-144.5169.4-160.400113.9
293Y27.9Very low30.6Very low230 Ų230168.5 Ų168.590%0.90281%0.811SS**SBendtrans-133.429.6179.3-108.5-84.2000113.8
294E27.7Very low31.6Very low196 Ų196162.4 Ų162.492%0.91681%0.806SS**  trans-112.123.3169.2-150.5161.1-148.600112
295F32.1Very low33.2Very low203 Ų203158.6 Ų158.689%0.8979%0.786SS**  trans-111.570.5170.5-145.6-86.2000109.8
296E30.3Very low34.9Very low158 Ų158148.7 Ų148.774%0.73876%0.757SS**SBendtrans-157.4116.5157.4-149.6140.2-162.100113.4
297Y30.8Very low36.9Very low209 Ų209148.1 Ų148.182%0.8274%0.74SS**  trans77.280.5167.7-97.8-96.2000119.3
298R29Very low38.7Very low200 Ų200154.6 Ų154.676%0.75574%0.742SS**  trans-84.4118.4141.2-122.5-171.7-147-139.58107L300 E356R298-L300 PolarHBondContact O-N 2.83Å; R298-E356 IonicContact NH2-OE2 3.91Å
299P32.5Very low40.7Very low91 Ų91153.2 Ų153.259%0.59173%0.727SS**  trans-62.5134.3169.4-15.828.7000109.6L301P299-L301 PolarHBondContact O-N 3.31Å
300L42.6Very low42.7Very low185 Ų185146.2 Ų146.297%0.96969%0.692SS**SBendtrans-70.513.2175.9-77.3161.9000114R298R298-L300 PolarHBondContact O-N 2.83Å
301L37.8Very low44.8Very low139 Ų139139.9 Ų139.973%0.72866%0.664SS**SBendtrans-104.8130.9175.8-72166.4000108.3P299 Y303P299-L301 PolarHBondContact O-N 3.31Å; L301-Y303 PolarHBondContact O-N 2.89Å
302P37.4Very low47Very low131 Ų131137 Ų13785%0.85165%0.653SS**  trans-67.688.9169.828.3-30.2000107.9S304P302-S304 PolarHBondContact O-N 3.44Å
303Y43.2Very low49Very low166 Ų166131.2 Ų131.265%0.65163%0.633SS**  trans-78.8101.6172-171.6-102.7000107.3L301 E305L301-Y303 PolarHBondContact O-N 2.89Å; Y303-E305 HydrophobicContact CD1-CG 3.62Å; Y303-E305 HydrophobicContact CE1-CG 3.76Å; Y303-E305 PolarHBondContact O-N 3.42Å
304S45.7Very low50.8Low112 Ų112121.3 Ų121.378%0.78360%0.597SS**  trans-72.594.5172.868.80000108.5P302 S306P302-S304 PolarHBondContact O-N 3.44Å; S304-S306 PolarHBondContact O-N 2.94Å
305E58.9Low53Low87 Ų87113.6 Ų113.641%0.40756%0.562SS.*  trans-59.9136.5170.5-68.5-166.9162.300109.8Y303 I310Y303-E305 HydrophobicContact CD1-CG 3.62Å; Y303-E305 HydrophobicContact CE1-CG 3.76Å; Y303-E305 PolarHBondContact O-N 3.42Å; E305-I310 HydrophobicContact CB-CD1 4.12Å; E305-I310 HydrophobicContact CB-CG1 3.71Å
306S66.6Low55.1Low54 Ų54107.8 Ų107.838%0.37854%0.54SS..  trans-67.1151175.470.70000110.5S304 R308 E309 I310S304-S306 PolarHBondContact O-N 2.94Å; S306-R308 PolarHBondContact O-N 2.63Å; S306-E309 WeakPolarHBondContact CB-OE2 3.37Å; S306-E309 PolarHBondContact N-OE2 3.12Å; S306-E309 PolarHBondContact O-N 2.7Å; S306-E309 VanDerWaalsContact OG-CG 3.25Å; S306-E309 WeakPolarHBondContact OG-CG 3.39Å; S306-E309 PolarHBondContact OG-N 3.21Å; S306-E309 PolarHBondContact OG-OE2 3.07Å; S306-I310 PolarHBondContact O-N 3.03Å; S306-I310 VanDerWaalsContact O-N 3.07Å
307T68.9Low57Low54 Ų54101.3 Ų101.333%0.33151%0.512SS..Hα-helixtrans-56.5-27.6-178.7-46.70000113.2L311 P363T307-L311 PolarHBondContact O-N 3.07Å; T307-P363 HydrophobicContact CG2-CB 3.78Å; T307-P363 HydrophobicContact CG2-CG 3.81Å
308R65.1Low59Low209 Ų20992.6 Ų92.679%0.78948%0.48SS*.Hα-helixtrans-75.3-39.6176.4-67.2-177.1179.7174.80.1112.5S306 I310 L311 L312S306-R308 PolarHBondContact O-N 2.63Å; R308-I310 VanDerWaalsContact C-N 3.34Å; R308-L311 PolarHBondContact O-N 3Å; R308-L312 WeakPolarHBondContact O-CB 3.38Å; R308-L312 WeakPolarHBondContact O-CG 3.46Å; R308-L312 PolarHBondContact O-N 3.33Å
309E70.8Confident61Low87 Ų8787.2 Ų87.241%0.40747%0.466SS..Hα-helixtrans-66-39.6175.9-72.4162156.100111S306 L311 L312 S313S306-E309 WeakPolarHBondContact CB-OE2 3.37Å; S306-E309 PolarHBondContact N-OE2 3.12Å; S306-E309 PolarHBondContact O-N 2.7Å; S306-E309 VanDerWaalsContact OG-CG 3.25Å; S306-E309 WeakPolarHBondContact OG-CG 3.39Å; S306-E309 PolarHBondContact OG-N 3.21Å; S306-E309 PolarHBondContact OG-OE2 3.07Å; E309-L311 VanDerWaalsContact C-N 3.33Å; E309-L311 PolarHBondContact O-N 2.88Å; E309-L312 PolarHBondContact O-N 2.9Å; E309-S313 VanDerWaalsContact O-CB 3.25Å; E309-S313 WeakPolarHBondContact O-CB 3.44Å; E309-S313 PolarHBondContact O-N 3.48Å; E309-S313 PolarHBondContact O-OG 2.81Å
310I71.3Confident62.9Low16 Ų1688.3 Ų88.38%0.08247%0.467CS..Hα-helixtrans-61.9-40.6174-62.7170.7000111.2E305 S306 R308 S313 S314 P363E305-I310 HydrophobicContact CB-CD1 4.12Å; E305-I310 HydrophobicContact CB-CG1 3.71Å; S306-I310 PolarHBondContact O-N 3.03Å; S306-I310 VanDerWaalsContact O-N 3.07Å; R308-I310 VanDerWaalsContact C-N 3.34Å; I310-S313 WeakPolarHBondContact CA-OG 3.07Å; I310-S313 PolarHBondContact O-OG 2.97Å; I310-S314 VanDerWaalsContact O-CB 3.27Å; I310-S314 WeakPolarHBondContact O-CB 3.45Å; I310-S314 PolarHBondContact O-N 3.42Å; I310-S314 PolarHBondContact O-OG 2.95Å; I310-P363 HydrophobicContact CG2-CG 4.37Å
311L71.9Confident64.2Low51 Ų5189.4 Ų89.427%0.26746%0.458SS..Hα-helixtrans-68.6-47.4177.9-176.470.2000111.7T307 R308 E309 S313 S314 L315 P363 L364T307-L311 PolarHBondContact O-N 3.07Å; R308-L311 PolarHBondContact O-N 3Å; E309-L311 VanDerWaalsContact C-N 3.33Å; E309-L311 PolarHBondContact O-N 2.88Å; L311-S313 VanDerWaalsContact C-N 3.35Å; L311-S313 PolarHBondContact O-N 3.33Å; L311-S314 PolarHBondContact O-N 2.89Å; L311-L315 HydrophobicContact CD1-CD1 4.12Å; L311-L315 HydrophobicContact CD1-CG 4.48Å; L311-L315 HydrophobicContact CG-CD1 3.95Å; L311-L315 WeakPolarHBondContact O-CB 3.41Å; L311-L315 WeakPolarHBondContact O-CG 3.3Å; L311-L315 PolarHBondContact O-N 3.45Å; L311-P363 HydrophobicContact CB-CG 4.24Å; L311-P363 HydrophobicContact CD1-CB 4.33Å; L311-P363 HydrophobicContact CD1-CG 4.48Å; L311-L364 HydrophobicContact CD1-CB 4.26Å; L311-L364 HydrophobicContact CD1-CD1 4.21Å
312L72.9Confident65.9Low122 Ų12288.5 Ų88.564%0.63945%0.449SS*.Hα-helixtrans-66.6-35.7180-72.5171.2000112.3R308 E309 N316R308-L312 WeakPolarHBondContact O-CB 3.38Å; R308-L312 WeakPolarHBondContact O-CG 3.46Å; R308-L312 PolarHBondContact O-N 3.33Å; E309-L312 PolarHBondContact O-N 2.9Å; L312-N316 PolarHBondContact O-N 3.18Å
313S66.7Low67.8Low56 Ų5685.8 Ų85.839%0.39242%0.421SS..Hα-helixtrans-69.3-3617468.50000111.8E309 I310 L311 N316E309-S313 VanDerWaalsContact O-CB 3.25Å; E309-S313 WeakPolarHBondContact O-CB 3.44Å; E309-S313 PolarHBondContact O-N 3.48Å; E309-S313 PolarHBondContact O-OG 2.81Å; I310-S313 WeakPolarHBondContact CA-OG 3.07Å; I310-S313 PolarHBondContact O-OG 2.97Å; L311-S313 VanDerWaalsContact C-N 3.35Å; L311-S313 PolarHBondContact O-N 3.33Å; S313-N316 PolarHBondContact O-N 3.27Å
314S63.8Low69.6Low22 Ų2287.9 Ų87.915%0.15443%0.428CS..Hα-helixtrans-73.8-30.8177.9-57.10000113.5I310 L311 N316 R361I310-S314 VanDerWaalsContact O-CB 3.27Å; I310-S314 WeakPolarHBondContact O-CB 3.45Å; I310-S314 PolarHBondContact O-N 3.42Å; I310-S314 PolarHBondContact O-OG 2.95Å; L311-S314 PolarHBondContact O-N 2.89Å; S314-N316 VanDerWaalsContact C-N 3.35Å; S314-R361 WeakPolarHBondContact OG-CD 3.41Å; S314-R361 VanDerWaalsContact OG-CG 3.31Å; S314-R361 WeakPolarHBondContact OG-CG 3.34Å; S314-R361 PolarHBondContact OG-NE 3.39Å
315L74.4Confident71.4Confident33 Ų3393.4 Ų93.417%0.17343%0.432CS..THydrogen-bonded Turntrans-84.4-4.9176.7-72171.9000113.5L311 P317 L345 L346 L364L311-L315 HydrophobicContact CD1-CD1 4.12Å; L311-L315 HydrophobicContact CD1-CG 4.48Å; L311-L315 HydrophobicContact CG-CD1 3.95Å; L311-L315 WeakPolarHBondContact O-CB 3.41Å; L311-L315 WeakPolarHBondContact O-CG 3.3Å; L311-L315 PolarHBondContact O-N 3.45Å; L315-P317 WeakPolarHBondContact O-CD 3.46Å; L315-L345 HydrophobicContact CD2-CB 4.48Å; L315-L346 HydrophobicContact CD1-CD1 4.38Å; L315-L346 HydrophobicContact CD2-CB 4.48Å; L315-L346 HydrophobicContact CD2-CD1 3.92Å; L315-L364 HydrophobicContact CD2-CD1 4.08Å
316N77Confident72.7Confident81 Ų8194.1 Ų94.143%0.43343%0.433SS..  trans-93.5104.3177.1-178.210.3000111.1L312 S313 S314 V318L312-N316 PolarHBondContact O-N 3.18Å; S313-N316 PolarHBondContact O-N 3.27Å; S314-N316 VanDerWaalsContact C-N 3.35Å; N316-V318 PolarHBondContact O-N 3.26Å; N316-V318 PolarHBondContact OD1-N 2.88Å
317P70.6Confident73.8Confident23 Ų2395.4 Ų95.415%0.14944%0.441CS..  trans-81.40.1-179.834.9-38.4000113.6L315 K334 T338 E341 V342 L345L315-P317 WeakPolarHBondContact O-CD 3.46Å; P317-K334 VanDerWaalsContact O-CE 3.27Å; P317-K334 WeakPolarHBondContact O-CE 3.39Å; P317-K334 PolarHBondContact O-NZ 2.84Å; P317-T338 HydrophobicContact CG-CG2 3.76Å; P317-E341 HydrophobicContact CB-CB 4.42Å; P317-E341 VanDerWaalsContact CB-CD 3.44Å; P317-E341 HydrophobicContact CB-CG 3.85Å; P317-E341 HydrophobicContact CG-CB 4.45Å; P317-E341 HydrophobicContact CG-CG 4.4Å; P317-V342 HydrophobicContact CG-CG2 3.97Å; P317-L345 HydrophobicContact CB-CD1 4.22Å
318V71.3Confident74.6Confident25 Ų25102.2 Ų102.215%0.15246%0.46CS..  trans-103.7103.6-175.2-175.10000110.8N316 N320 W323 K334 T338N316-V318 PolarHBondContact O-N 3.26Å; N316-V318 PolarHBondContact OD1-N 2.88Å; V318-N320 PolarHBondContact O-N 3.46Å; V318-W323 HydrophobicContact CG1-CB 4.12Å; V318-W323 HydrophobicContact CG1-CD2 4.18Å; V318-W323 HydrophobicContact CG1-CE3 3.76Å; V318-W323 HydrophobicContact CG1-CG 4.35Å; V318-K334 HydrophobicContact CG2-CG 4.44Å; V318-T338 HydrophobicContact CG2-CG2 4.29Å
319D72Confident75.5Confident88 Ų8896.9 Ų96.947%0.47145%0.451SS..  trans-68.4109.5167.2-78.6-34000110.5R321 K322 W323D319-R321 PolarHBondContact O-N 3.49Å; D319-R321 VanDerWaalsContact O-N 3.08Å; D319-K322 HydrophobicContact CB-CB 3.95Å; D319-K322 HydrophobicContact CB-CD 4.02Å; D319-K322 HydrophobicContact CB-CG 4Å; D319-K322 PolarHBondContact O-N 2.71Å; D319-K322 WeakPolarHBondContact OD2-CD 3.44Å; D319-K322 WeakPolarHBondContact OD2-CE 3.38Å; D319-K322 IonicContact OD2-NZ 2.76Å; D319-K322 PolarHBondContact OD2-NZ 3.44Å; D319-W323 WeakPolarHBondContact O-CB 3.14Å; D319-W323 PolarHBondContact O-N 2.9Å
320N72.4Confident76.2Confident113 Ų11396.7 Ų96.760%0.60445%0.447SS*.Hα-helixtrans-52.9-33.1178.3-78.9-25.4000113.4V318 R324V318-N320 PolarHBondContact O-N 3.46Å; N320-R324 WeakPolarHBondContact O-CG 3.38Å; N320-R324 PolarHBondContact O-N 2.81Å
321R69.7Low76.8Confident209 Ų20998.5 Ų98.579%0.78945%0.454SS*.Hα-helixtrans-70.8-44.2177.5-65-177.4-176.3-178.91.4112.3D319D319-R321 PolarHBondContact O-N 3.49Å; D319-R321 VanDerWaalsContact O-N 3.08Å
322K73.3Confident77.4Confident120 Ų12098.9 Ų98.952%0.52246%0.458SS..Hα-helixtrans-69.5-37.9176.7-69.2178.9-174.2144.20111.1D319 R324 R325 K326D319-K322 HydrophobicContact CB-CB 3.95Å; D319-K322 HydrophobicContact CB-CD 4.02Å; D319-K322 HydrophobicContact CB-CG 4Å; D319-K322 PolarHBondContact O-N 2.71Å; D319-K322 WeakPolarHBondContact OD2-CD 3.44Å; D319-K322 WeakPolarHBondContact OD2-CE 3.38Å; D319-K322 IonicContact OD2-NZ 2.76Å; D319-K322 PolarHBondContact OD2-NZ 3.44Å; K322-R324 VanDerWaalsContact C-N 3.34Å; K322-R324 PolarHBondContact O-N 3.31Å; K322-R325 PolarHBondContact O-N 3.28Å; K322-K326 WeakPolarHBondContact O-CG 3.47Å; K322-K326 PolarHBondContact O-N 3.47Å
323W78.2Confident77.8Confident73 Ų7396.4 Ų96.428%0.27745%0.448SS..Hα-helixtrans-55.5-46.4176.2-178.8-96000112V318 D319 R325 W330 K331 K334 V335V318-W323 HydrophobicContact CG1-CB 4.12Å; V318-W323 HydrophobicContact CG1-CD2 4.18Å; V318-W323 HydrophobicContact CG1-CE3 3.76Å; V318-W323 HydrophobicContact CG1-CG 4.35Å; D319-W323 WeakPolarHBondContact O-CB 3.14Å; D319-W323 PolarHBondContact O-N 2.9Å; W323-R325 PolarHBondContact O-N 2.93Å; W323-W330 HydrophobicContact CE3-CZ3 4.05Å; W323-K331 HydrophobicContact CD2-CG 4.16Å; W323-K331 HydrophobicContact CE3-CB 4.47Å; W323-K331 HydrophobicContact CE3-CG 4.19Å; W323-K331 HydrophobicContact CH2-CB 3.57Å; W323-K331 HydrophobicContact CH2-CG 3.99Å; W323-K331 HydrophobicContact CZ2-CB 3.94Å; W323-K331 HydrophobicContact CZ2-CD 4.09Å; W323-K331 HydrophobicContact CZ2-CG 4.01Å; W323-K331 HydrophobicContact CZ3-CB 3.89Å; W323-K331 HydrophobicContact CZ3-CG 4.11Å; W323-K331 WeakPolarHBondContact O-CE 3.44Å; W323-K334 HydrophobicContact CZ3-CB 4.21Å; W323-K334 HydrophobicContact CZ3-CG 4.34Å; W323-V335 HydrophobicContact CH2-CG2 3.41Å; W323-V335 VanDerWaalsContact CH2-CG2 3.41Å; W323-V335 HydrophobicContact CZ2-CG2 4.48Å; W323-V335 HydrophobicContact CZ3-CG2 3.91Å
324R79.7Confident78.6Confident211 Ų21195 Ų9580%0.79644%0.435SS*.Hα-helixtrans-64.7-36.8-179.7-74.1179.8-176.7-112.82113.8N320 K322N320-R324 WeakPolarHBondContact O-CG 3.38Å; N320-R324 PolarHBondContact O-N 2.81Å; K322-R324 VanDerWaalsContact C-N 3.34Å; K322-R324 PolarHBondContact O-N 3.31Å
325R84.4Confident79.7Confident227 Ų22798 Ų9886%0.85745%0.452SS*.Hα-helixtrans-84.9-15.1-172.8-66.6-178.1-179.91750.1114.7K322 W323K322-R325 PolarHBondContact O-N 3.28Å; W323-R325 PolarHBondContact O-N 2.93Å
326K85Confident80.1Confident102 Ų102101 Ų10144%0.44347%0.471SS..SBendtrans-92.5150.9-173.2-74.2-71.6-176.8-171.60112.8K322 W330 K331K322-K326 WeakPolarHBondContact O-CG 3.47Å; K322-K326 PolarHBondContact O-N 3.47Å; K326-W330 HydrophobicContact CB-CB 4.06Å; K326-W330 HydrophobicContact CB-CD2 3.69Å; K326-W330 HydrophobicContact CB-CE3 3.46Å; K326-W330 VanDerWaalsContact CB-CE3 3.46Å; K326-W330 HydrophobicContact CB-CG 3.95Å; K326-W330 HydrophobicContact CB-CZ3 4.18Å; K326-W330 HydrophobicContact CD-CD2 4.26Å; K326-W330 HydrophobicContact CD-CG 4.18Å; K326-W330 HydrophobicContact CG-CD2 3.74Å; K326-W330 HydrophobicContact CG-CE3 3.82Å; K326-W330 HydrophobicContact CG-CG 4.11Å; K326-W330 HydrophobicContact CG-CZ3 4.27Å; K326-K331 WeakPolarHBondContact O-CE 3.15Å
327P89.9Confident80.4Confident81 Ų81100.2 Ų100.253%0.52646%0.464SS..  trans-63.9159.6178.328.1-35.4000111.5T329 W330 K331P327-T329 VanDerWaalsContact C-N 3.26Å; P327-T329 PolarHBondContact O-N 2.93Å; P327-W330 HydrophobicContact CG-CB 4.19Å; P327-W330 WeakPolarHBondContact O-CB 3.26Å; P327-W330 PolarHBondContact O-N 2.97Å; P327-W330 VanDerWaalsContact O-N 3.1Å; P327-K331 PolarHBondContact O-N 3.28Å
328W86.1Confident81.1Confident197 Ų197100.5 Ų100.575%0.74647%0.466SS*.Hα-helixtrans-59.2-34.3-176.7-177.779.1000113.3W330 K331 V332W328-W330 PolarHBondContact O-N 3.48Å; W328-K331 WeakPolarHBondContact O-CB 3.29Å; W328-K331 PolarHBondContact O-N 2.88Å; W328-K331 VanDerWaalsContact O-N 3.09Å; W328-V332 HydrophobicContact CD2-CG2 3.86Å; W328-V332 HydrophobicContact CE3-CG2 4.15Å; W328-V332 HydrophobicContact CH2-CG2 3.91Å; W328-V332 HydrophobicContact CZ2-CG2 3.58Å; W328-V332 HydrophobicContact CZ3-CG2 4.17Å; W328-V332 WeakPolarHBondContact O-CG2 3.47Å; W328-V332 PolarHBondContact O-N 3.28Å
329T83.5Confident81.8Confident97 Ų97103.4 Ų103.460%0.59549%0.485SS*.Hα-helixtrans-59.7-42.8174.951.70000112.6P327 K331 V332 V333P327-T329 VanDerWaalsContact C-N 3.26Å; P327-T329 PolarHBondContact O-N 2.93Å; T329-K331 VanDerWaalsContact C-N 3.32Å; T329-K331 PolarHBondContact O-N 3.26Å; T329-V332 PolarHBondContact O-N 3.3Å; T329-V333 WeakPolarHBondContact O-CG2 3.21Å; T329-V333 PolarHBondContact O-N 3.45Å
330W85Confident82.3Confident84 Ų84100.7 Ų100.732%0.31847%0.47SS..Hα-helixtrans-65.1-37.3175-176.193000111.5W323 K326 P327 W328 K334W323-W330 HydrophobicContact CE3-CZ3 4.05Å; K326-W330 HydrophobicContact CB-CB 4.06Å; K326-W330 HydrophobicContact CB-CD2 3.69Å; K326-W330 HydrophobicContact CB-CE3 3.46Å; K326-W330 VanDerWaalsContact CB-CE3 3.46Å; K326-W330 HydrophobicContact CB-CG 3.95Å; K326-W330 HydrophobicContact CB-CZ3 4.18Å; K326-W330 HydrophobicContact CD-CD2 4.26Å; K326-W330 HydrophobicContact CD-CG 4.18Å; K326-W330 HydrophobicContact CG-CD2 3.74Å; K326-W330 HydrophobicContact CG-CE3 3.82Å; K326-W330 HydrophobicContact CG-CG 4.11Å; K326-W330 HydrophobicContact CG-CZ3 4.27Å; P327-W330 HydrophobicContact CG-CB 4.19Å; P327-W330 WeakPolarHBondContact O-CB 3.26Å; P327-W330 PolarHBondContact O-N 2.97Å; P327-W330 VanDerWaalsContact O-N 3.1Å; W328-W330 PolarHBondContact O-N 3.48Å; W330-K334 HydrophobicContact CE3-CB 4.19Å; W330-K334 HydrophobicContact CH2-CB 4.21Å; W330-K334 HydrophobicContact CH2-CD 4.19Å; W330-K334 HydrophobicContact CH2-CG 3.87Å; W330-K334 HydrophobicContact CZ2-CD 4.32Å; W330-K334 HydrophobicContact CZ2-CG 4.38Å; W330-K334 HydrophobicContact CZ3-CB 4.02Å; W330-K334 HydrophobicContact CZ3-CG 4.04Å; W330-K334 VanDerWaalsContact O-CB 3.25Å; W330-K334 WeakPolarHBondContact O-CB 3.49Å; W330-K334 PolarHBondContact O-N 3.41Å
331K84.2Confident82.9Confident53 Ų5396 Ų9623%0.2345%0.445CS..Hα-helixtrans-63.2-47.9176.9-68.3176177.4167.30111.5W323 K326 P327 W328 T329 K334 V335W323-K331 HydrophobicContact CD2-CG 4.16Å; W323-K331 HydrophobicContact CE3-CB 4.47Å; W323-K331 HydrophobicContact CE3-CG 4.19Å; W323-K331 HydrophobicContact CH2-CB 3.57Å; W323-K331 HydrophobicContact CH2-CG 3.99Å; W323-K331 HydrophobicContact CZ2-CB 3.94Å; W323-K331 HydrophobicContact CZ2-CD 4.09Å; W323-K331 HydrophobicContact CZ2-CG 4.01Å; W323-K331 HydrophobicContact CZ3-CB 3.89Å; W323-K331 HydrophobicContact CZ3-CG 4.11Å; W323-K331 WeakPolarHBondContact O-CE 3.44Å; K326-K331 WeakPolarHBondContact O-CE 3.15Å; P327-K331 PolarHBondContact O-N 3.28Å; W328-K331 WeakPolarHBondContact O-CB 3.29Å; W328-K331 PolarHBondContact O-N 2.88Å; W328-K331 VanDerWaalsContact O-N 3.09Å; T329-K331 VanDerWaalsContact C-N 3.32Å; T329-K331 PolarHBondContact O-N 3.26Å; K331-K334 PolarHBondContact O-N 3.46Å; K331-V335 WeakPolarHBondContact O-CG2 3.3Å; K331-V335 PolarHBondContact O-N 3.21Å
332V84.8Confident83.6Confident59 Ų5988.3 Ų88.336%0.35842%0.421SS..Hα-helixtrans-59.1-49.8176.9174.50000110.5W328 T329 K334 V335 V336W328-V332 HydrophobicContact CD2-CG2 3.86Å; W328-V332 HydrophobicContact CE3-CG2 4.15Å; W328-V332 HydrophobicContact CH2-CG2 3.91Å; W328-V332 HydrophobicContact CZ2-CG2 3.58Å; W328-V332 HydrophobicContact CZ3-CG2 4.17Å; W328-V332 WeakPolarHBondContact O-CG2 3.47Å; W328-V332 PolarHBondContact O-N 3.28Å; T329-V332 PolarHBondContact O-N 3.3Å; V332-K334 VanDerWaalsContact C-N 3.28Å; V332-K334 PolarHBondContact O-N 2.98Å; V332-V335 PolarHBondContact O-N 3.23Å; V332-V336 WeakPolarHBondContact O-CG2 3.3Å; V332-V336 PolarHBondContact O-N 2.97Å; V332-V336 VanDerWaalsContact O-N 3.08Å
333V82.1Confident84.3Confident70 Ų7087.3 Ų87.342%0.42442%0.421SS..Hα-helixtrans-60.4-38.7177.4171.90000111.5T329 K337T329-V333 WeakPolarHBondContact O-CG2 3.21Å; T329-V333 PolarHBondContact O-N 3.45Å; V333-K337 HydrophobicContact CG1-CD 3.84Å; V333-K337 VanDerWaalsContact CG1-CE 3.49Å; V333-K337 HydrophobicContact CG1-CG 4.49Å; V333-K337 WeakPolarHBondContact O-CB 3.43Å; V333-K337 WeakPolarHBondContact O-CG 3.29Å; V333-K337 PolarHBondContact O-N 2.96Å
334K83.3Confident84.6Confident27 Ų2784.2 Ų84.212%0.11741%0.41CS..Hα-helixtrans-68.6-39.3178-173.763.6175.6172.50111.6P317 V318 W323 W330 K331 V332 K337 T338 E341P317-K334 VanDerWaalsContact O-CE 3.27Å; P317-K334 WeakPolarHBondContact O-CE 3.39Å; P317-K334 PolarHBondContact O-NZ 2.84Å; V318-K334 HydrophobicContact CG2-CG 4.44Å; W323-K334 HydrophobicContact CZ3-CB 4.21Å; W323-K334 HydrophobicContact CZ3-CG 4.34Å; W330-K334 HydrophobicContact CE3-CB 4.19Å; W330-K334 HydrophobicContact CH2-CB 4.21Å; W330-K334 HydrophobicContact CH2-CD 4.19Å; W330-K334 HydrophobicContact CH2-CG 3.87Å; W330-K334 HydrophobicContact CZ2-CD 4.32Å; W330-K334 HydrophobicContact CZ2-CG 4.38Å; W330-K334 HydrophobicContact CZ3-CB 4.02Å; W330-K334 HydrophobicContact CZ3-CG 4.04Å; W330-K334 VanDerWaalsContact O-CB 3.25Å; W330-K334 WeakPolarHBondContact O-CB 3.49Å; W330-K334 PolarHBondContact O-N 3.41Å; K331-K334 PolarHBondContact O-N 3.46Å; V332-K334 VanDerWaalsContact C-N 3.28Å; V332-K334 PolarHBondContact O-N 2.98Å; K334-K337 PolarHBondContact O-N 3.17Å; K334-T338 WeakPolarHBondContact O-CB 3.3Å; K334-T338 PolarHBondContact O-N 3.41Å; K334-T338 PolarHBondContact O-OG1 2.94Å; K334-E341 IonicContact NZ-OE1 3.5Å; K334-E341 IonicContact NZ-OE2 2.69Å; K334-E341 PolarHBondContact NZ-OE2 3.47Å
335V86.1Confident84.9Confident84 Ų8475.8 Ų75.851%0.50938%0.38SS..Hα-helixtrans-62.2-45.6176.2170.30000111.1W323 K331 V332 K337 T338 P339W323-V335 HydrophobicContact CH2-CG2 3.41Å; W323-V335 VanDerWaalsContact CH2-CG2 3.41Å; W323-V335 HydrophobicContact CZ2-CG2 4.48Å; W323-V335 HydrophobicContact CZ3-CG2 3.91Å; K331-V335 WeakPolarHBondContact O-CG2 3.3Å; K331-V335 PolarHBondContact O-N 3.21Å; V332-V335 PolarHBondContact O-N 3.23Å; V335-K337 VanDerWaalsContact C-N 3.29Å; V335-K337 PolarHBondContact O-N 3.34Å; V335-T338 PolarHBondContact O-N 2.97Å; V335-P339 WeakPolarHBondContact O-CD 3.25Å
336V82.9Confident84.9Confident96 Ų9667.8 Ų67.858%0.58235%0.354SS*.Hα-helixtrans-62.6-37.5177175.20000111.6V332 P339V332-V336 WeakPolarHBondContact O-CG2 3.3Å; V332-V336 PolarHBondContact O-N 2.97Å; V332-V336 VanDerWaalsContact O-N 3.08Å; V336-P339 WeakPolarHBondContact O-CD 3.33Å
337K83.9Confident85Confident65 Ų6563.9 Ų63.928%0.28334%0.339SS..Hα-helixtrans-74.6-30178.2-74176177.5-176.60114.1L110 L114 V333 K334 V335 L340 E341L110-K337 HydrophobicContact CD1-CD 4.31Å; L110-K337 VanDerWaalsContact CD1-CE 3.5Å; L110-K337 HydrophobicContact CD1-CG 3.74Å; L110-K337 HydrophobicContact CD2-CG 3.99Å; L110-K337 HydrophobicContact CG-CG 4.13Å; L114-K337 HydrophobicContact CD1-CB 4.29Å; L114-K337 HydrophobicContact CD1-CG 4.26Å; V333-K337 HydrophobicContact CG1-CD 3.84Å; V333-K337 VanDerWaalsContact CG1-CE 3.49Å; V333-K337 HydrophobicContact CG1-CG 4.49Å; V333-K337 WeakPolarHBondContact O-CB 3.43Å; V333-K337 WeakPolarHBondContact O-CG 3.29Å; V333-K337 PolarHBondContact O-N 2.96Å; K334-K337 PolarHBondContact O-N 3.17Å; V335-K337 VanDerWaalsContact C-N 3.29Å; V335-K337 PolarHBondContact O-N 3.34Å; K337-L340 PolarHBondContact O-N 2.96Å; K337-E341 WeakPolarHBondContact O-CB 3.35Å; K337-E341 PolarHBondContact O-N 2.99Å
338T84.6Confident84.9Confident29 Ų2960.1 Ų60.118%0.17832%0.315CS..Hα-helixtrans-57.6-50.5-171.6-64.90000114.3P317 V318 K334 V335 L340 E341 V342P317-T338 HydrophobicContact CG-CG2 3.76Å; V318-T338 HydrophobicContact CG2-CG2 4.29Å; K334-T338 WeakPolarHBondContact O-CB 3.3Å; K334-T338 PolarHBondContact O-N 3.41Å; K334-T338 PolarHBondContact O-OG1 2.94Å; V335-T338 PolarHBondContact O-N 2.97Å; T338-L340 PolarHBondContact O-N 3.48Å; T338-E341 PolarHBondContact O-N 3.03Å; T338-E341 VanDerWaalsContact O-N 3.13Å; T338-V342 HydrophobicContact CG2-CG2 4.21Å; T338-V342 VanDerWaalsContact O-CG2 3.3Å; T338-V342 WeakPolarHBondContact O-CG2 3.24Å; T338-V342 PolarHBondContact O-N 3.23Å
339P86.1Confident85Confident87 Ų8750.7 Ų50.757%0.56528%0.279SS*.Hα-helixtrans-60.2-38.4-17723.2-33.9000111.8V335 V336 L343V335-P339 WeakPolarHBondContact O-CD 3.25Å; V336-P339 WeakPolarHBondContact O-CD 3.33Å; P339-L343 PolarHBondContact O-N 3.33Å; P339-L343 VanDerWaalsContact O-N 3.11Å
340L83.8Confident85.1Confident30 Ų3047 Ų4716%0.15726%0.256CS..Hα-helixtrans-69.6-44.8175.8174.764.6000112.2L110 I111 L114 K337 T338 V342 L343 L344L110-L340 HydrophobicContact CD2-CD2 3.33Å; I111-L340 HydrophobicContact CB-CD2 4.11Å; I111-L340 HydrophobicContact CD1-CD1 3.97Å; I111-L340 HydrophobicContact CD1-CD2 4.27Å; I111-L340 HydrophobicContact CG1-CD1 3.55Å; I111-L340 HydrophobicContact CG1-CD2 3.21Å; I111-L340 HydrophobicContact CG1-CG 3.93Å; I111-L340 HydrophobicContact CG2-CD1 4.47Å; L114-L340 HydrophobicContact CD1-CD2 3.85Å; L114-L340 HydrophobicContact CD1-CG 4.39Å; K337-L340 PolarHBondContact O-N 2.96Å; T338-L340 PolarHBondContact O-N 3.48Å; L340-V342 VanDerWaalsContact C-N 3.26Å; L340-V342 PolarHBondContact O-N 3.4Å; L340-L343 WeakPolarHBondContact O-CB 3.48Å; L340-L343 PolarHBondContact O-N 3.23Å; L340-L343 VanDerWaalsContact O-N 3.17Å; L340-L344 HydrophobicContact CD1-CD1 4.31Å; L340-L344 HydrophobicContact CD1-CG 4.23Å; L340-L344 HydrophobicContact CG-CD1 4.15Å; L340-L344 HydrophobicContact CG-CG 4.47Å; L340-L344 VanDerWaalsContact O-CG 3.26Å; L340-L344 WeakPolarHBondContact O-CG 3.41Å; L340-L344 PolarHBondContact O-N 3.49Å
341E83.6Confident85Confident14 Ų1443.3 Ų43.37%0.06524%0.243CC..Hα-helixtrans-59.9-38.2177.2-169171.7-172.300111.4P317 K334 K337 T338 L344 L345P317-E341 HydrophobicContact CB-CB 4.42Å; P317-E341 VanDerWaalsContact CB-CD 3.44Å; P317-E341 HydrophobicContact CB-CG 3.85Å; P317-E341 HydrophobicContact CG-CB 4.45Å; P317-E341 HydrophobicContact CG-CG 4.4Å; K334-E341 IonicContact NZ-OE1 3.5Å; K334-E341 IonicContact NZ-OE2 2.69Å; K334-E341 PolarHBondContact NZ-OE2 3.47Å; K337-E341 WeakPolarHBondContact O-CB 3.35Å; K337-E341 PolarHBondContact O-N 2.99Å; T338-E341 PolarHBondContact O-N 3.03Å; T338-E341 VanDerWaalsContact O-N 3.13Å; E341-L344 PolarHBondContact O-N 2.9Å; E341-L345 HydrophobicContact CG-CD1 4.29Å; E341-L345 WeakPolarHBondContact O-CB 3.04Å; E341-L345 WeakPolarHBondContact O-CG 3.33Å; E341-L345 PolarHBondContact O-N 2.89Å
342V85.9Confident84.7Confident48 Ų4842.2 Ų42.229%0.29124%0.24SC..Hα-helixtrans-64.3-45.4174.21740000111.5P317 T338 L340 L344 L345 L346P317-V342 HydrophobicContact CG-CG2 3.97Å; T338-V342 HydrophobicContact CG2-CG2 4.21Å; T338-V342 VanDerWaalsContact O-CG2 3.3Å; T338-V342 WeakPolarHBondContact O-CG2 3.24Å; T338-V342 PolarHBondContact O-N 3.23Å; L340-V342 VanDerWaalsContact C-N 3.26Å; L340-V342 PolarHBondContact O-N 3.4Å; V342-L344 VanDerWaalsContact C-N 3.31Å; V342-L344 PolarHBondContact O-N 2.85Å; V342-L345 PolarHBondContact O-N 3.49Å; V342-L346 PolarHBondContact O-N 3.41Å
343L86.3Confident84Confident100 Ų10041.4 Ų41.452%0.52424%0.236SC..Hα-helixtrans-59.2-44.5176.4-178.965.4000111.1P339 L340 L346 C347P339-L343 PolarHBondContact O-N 3.33Å; P339-L343 VanDerWaalsContact O-N 3.11Å; L340-L343 WeakPolarHBondContact O-CB 3.48Å; L340-L343 PolarHBondContact O-N 3.23Å; L340-L343 VanDerWaalsContact O-N 3.17Å; L343-L346 WeakPolarHBondContact O-CB 3.45Å; L343-L346 PolarHBondContact O-N 3.45Å; L343-C347 PolarHBondContact O-N 2.86Å; L343-C347 PolarHBondContact O-SG 3.08Å; L343-C347 VanDerWaalsContact O-SG 3.34Å
344L85.1Confident83.2Confident7 Ų744.3 Ų44.34%0.03725%0.249CC..Hα-helixtrans-65.8-41.6177.8-63.3177000112.3L114 F119 L340 E341 V342 L346 C347 V348 L438L114-L344 HydrophobicContact CB-CD1 4.1Å; F119-L344 HydrophobicContact CD2-CB 4.32Å; F119-L344 HydrophobicContact CE1-CB 4.16Å; F119-L344 HydrophobicContact CE2-CB 3.44Å; F119-L344 VanDerWaalsContact CE2-CB 3.44Å; F119-L344 HydrophobicContact CE2-CD1 3.87Å; F119-L344 HydrophobicContact CE2-CG 4.27Å; F119-L344 HydrophobicContact CZ-CB 3.35Å; L340-L344 HydrophobicContact CD1-CD1 4.31Å; L340-L344 HydrophobicContact CD1-CG 4.23Å; L340-L344 HydrophobicContact CG-CD1 4.15Å; L340-L344 HydrophobicContact CG-CG 4.47Å; L340-L344 VanDerWaalsContact O-CG 3.26Å; L340-L344 WeakPolarHBondContact O-CG 3.41Å; L340-L344 PolarHBondContact O-N 3.49Å; E341-L344 PolarHBondContact O-N 2.9Å; V342-L344 VanDerWaalsContact C-N 3.31Å; V342-L344 PolarHBondContact O-N 2.85Å; L344-L346 VanDerWaalsContact C-N 3.25Å; L344-L346 PolarHBondContact O-N 2.87Å; L344-C347 PolarHBondContact O-N 3.27Å; L344-V348 WeakPolarHBondContact O-CB 3.22Å; L344-V348 PolarHBondContact O-N 2.91Å; L344-L438 HydrophobicContact CD2-CD2 3.15Å; L344-L438 HydrophobicContact CD2-CG 4.46Å
345L85.7Confident82.5Confident34 Ų3447.9 Ų47.918%0.17827%0.265CS..Hα-helixtrans-61.3-33.1174.9-76.5167.4000112.6F119 L315 P317 E341 V342 C347 H368F119-L345 HydrophobicContact CE1-CD2 3.85Å; F119-L345 HydrophobicContact CE1-CG 4.17Å; F119-L345 HydrophobicContact CZ-CD2 4.04Å; F119-L345 HydrophobicContact CZ-CG 3.98Å; L315-L345 HydrophobicContact CD2-CB 4.48Å; P317-L345 HydrophobicContact CB-CD1 4.22Å; E341-L345 HydrophobicContact CG-CD1 4.29Å; E341-L345 WeakPolarHBondContact O-CB 3.04Å; E341-L345 WeakPolarHBondContact O-CG 3.33Å; E341-L345 PolarHBondContact O-N 2.89Å; V342-L345 PolarHBondContact O-N 3.49Å; L345-C347 VanDerWaalsContact C-N 3.34Å; L345-H368 PolarHBondContact O-NE2 3.21Å
346L85.9Confident81.3Confident60 Ų6052.1 Ų52.131%0.31428%0.279SS..Hα-helixtrans-73-28.8177.7-164.573000112.8L315 V342 L343 L344 L367 H368 T371L315-L346 HydrophobicContact CD1-CD1 4.38Å; L315-L346 HydrophobicContact CD2-CB 4.48Å; L315-L346 HydrophobicContact CD2-CD1 3.92Å; V342-L346 PolarHBondContact O-N 3.41Å; L343-L346 WeakPolarHBondContact O-CB 3.45Å; L343-L346 PolarHBondContact O-N 3.45Å; L344-L346 VanDerWaalsContact C-N 3.25Å; L344-L346 PolarHBondContact O-N 2.87Å; L346-L367 HydrophobicContact CD1-CD2 3.41Å; L346-L367 VanDerWaalsContact CD1-CD2 3.41Å; L346-L367 HydrophobicContact CG-CD2 4.12Å; L346-H368 PolarHBondContact O-CD2 2.85Å; L346-T371 PolarHBondContact O-OG1 3.13Å
347C85.4Confident80.3Confident19 Ų1952 Ų5213%0.12828%0.275CS..Hα-helixtrans-100.1-29.3-171.4-69.60000113.7L343 L344 L345 A372 L375L343-C347 PolarHBondContact O-N 2.86Å; L343-C347 PolarHBondContact O-SG 3.08Å; L343-C347 VanDerWaalsContact O-SG 3.34Å; L344-C347 PolarHBondContact O-N 3.27Å; L345-C347 VanDerWaalsContact C-N 3.34Å; C347-A372 WeakPolarHBondContact O-CB 3.29Å; C347-L375 HydrophobicContact CB-CD2 4Å
348V87.7Confident79.4Confident2 Ų254.9 Ų54.91%0.01228%0.284CS..SBendtrans-116.7118-169.9-170.30000111F119 L344 H368 V434F119-V348 HydrophobicContact CB-CB 4.42Å; F119-V348 HydrophobicContact CB-CG1 3.82Å; F119-V348 HydrophobicContact CD1-CB 3.61Å; F119-V348 HydrophobicContact CD1-CG1 3.82Å; F119-V348 HydrophobicContact CD1-CG2 4.42Å; F119-V348 HydrophobicContact CE1-CB 4.2Å; F119-V348 HydrophobicContact CG-CB 4.19Å; F119-V348 HydrophobicContact CG-CG1 4.13Å; L344-V348 WeakPolarHBondContact O-CB 3.22Å; L344-V348 PolarHBondContact O-N 2.91Å; V348-H368 PolarHBondContact O-CE1 3.37Å; V348-V434 HydrophobicContact CG2-CG1 3.99Å
349P89.3Confident79.1Confident0 Ų055.3 Ų55.30%029%0.285CS..  trans-66.5139.6171.522-25000110.8N123 H368 F427 L430 G431N123-P349 PolarHBondContact ND2-O 3.04Å; N123-P349 PolarHBondContact OD1-O 3.47Å; P349-H368 VanDerWaalsContact CA-CE1 3.47Å; P349-H368 WeakPolarHBondContact CA-CE1 3.48Å; P349-H368 VanDerWaalsContact CA-ND1 3.29Å; P349-H368 WeakPolarHBondContact CA-ND1 3.11Å; P349-H368 HydrophobicContact CB-CB 4.01Å; P349-H368 WeakPolarHBondContact CB-ND1 3.36Å; P349-H368 HydrophobicContact CG-CB 4.1Å; P349-F427 HydrophobicContact CB-CB 4.43Å; P349-F427 HydrophobicContact CB-CD1 4.28Å; P349-L430 HydrophobicContact CG-CB 4.26Å; P349-L430 HydrophobicContact CG-CD2 4.11Å; P349-L430 HydrophobicContact CG-CG 3.99Å; P349-G431 VanDerWaalsContact O-CA 3.31Å; P349-G431 WeakPolarHBondContact O-CA 3.4Å
350V86.1Confident78.8Confident18 Ų1851.8 Ų51.811%0.10926%0.261CS..  trans-125.9119.8177.6-177.30000109.4F119 P122 N123 N359F119-V350 HydrophobicContact CB-CG2 4.33Å; F119-V350 HydrophobicContact CD1-CG2 3.23Å; F119-V350 HydrophobicContact CE1-CG2 3.79Å; F119-V350 HydrophobicContact CG-CG2 4.12Å; P122-V350 HydrophobicContact CB-CG1 4.17Å; N123-V350 WeakPolarHBondContact OD1-CA 3.43Å; V350-N359 PolarHBondContact O-ND2 3.3Å
351V83.1Confident78.7Confident7 Ų754.5 Ų54.54%0.04227%0.269CS..  trans-108.9117.5169.5-178.70000107.6P122 N123 A126 F427 A428P122-V351 CarbonylContact C-O 3.59Å; N123-V351 PolarHBondContact OD1-N 3.39Å; A126-V351 HydrophobicContact CB-CB 4.18Å; A126-V351 HydrophobicContact CB-CG1 3.94Å; V351-F427 HydrophobicContact CG2-CB 3.83Å; V351-A428 HydrophobicContact CB-CB 3.74Å; V351-A428 HydrophobicContact CG1-CB 4.25Å; V351-A428 HydrophobicContact CG2-CB 3.92Å
352D77.5Confident78.6Confident30 Ų3055.9 Ų55.916%0.1627%0.273CS..  trans-112111.6-178.1-171.9-12.3000108.7D354 K355 R358 N359D352-D354 PolarHBondContact O-N 3Å; D352-D354 WeakPolarHBondContact OD1-CB 3.4Å; D352-D354 PolarHBondContact OD1-N 2.91Å; D352-D354 VanDerWaalsContact OD1-N 3.09Å; D352-K355 HydrophobicContact CB-CD 4.37Å; D352-K355 HydrophobicContact CB-CG 4.39Å; D352-K355 WeakPolarHBondContact OD2-CE 3.48Å; D352-R358 VanDerWaalsContact O-CA 3.3Å; D352-R358 WeakPolarHBondContact O-CA 3.38Å; D352-N359 HydrophobicContact CB-CB 4.29Å
353P68.8Low78.5Confident42 Ų4254.5 Ų54.527%0.27327%0.265SS..THydrogen-bonded Turntrans-70.7-17.4-177.930.4-33.3000112.8A126 K355A126-P353 HydrophobicContact CB-CG 4.49Å; P353-K355 VanDerWaalsContact C-N 3.32Å
354D65Low78.4Confident131 Ų13150.1 Ų50.170%0.70124%0.242SC*.THydrogen-bonded Turntrans-82.1-11.6-175.2-62-29.4000112.7D352D352-D354 PolarHBondContact O-N 3Å; D352-D354 WeakPolarHBondContact OD1-CB 3.4Å; D352-D354 PolarHBondContact OD1-N 2.91Å; D352-D354 VanDerWaalsContact OD1-N 3.09Å
355K68.8Low78.5Confident103 Ų10349.9 Ų49.945%0.44824%0.241SC..SBendtrans-96.7140.1175.7-63.5-176.9-172.3176.40111.3D352 P353 D357 R358 N359D352-K355 HydrophobicContact CB-CD 4.37Å; D352-K355 HydrophobicContact CB-CG 4.39Å; D352-K355 WeakPolarHBondContact OD2-CE 3.48Å; P353-K355 VanDerWaalsContact C-N 3.32Å; K355-D357 VanDerWaalsContact C-N 3.29Å; K355-D357 PolarHBondContact O-N 3.32Å; K355-R358 PolarHBondContact O-N 3.46Å; K355-N359 HydrophobicContact CD-CB 4.44Å; K355-N359 PolarHBondContact NZ-OD1 3.26Å
356E62.8Low78.5Confident173 Ų17348.7 Ų48.781%0.80824%0.235SC*.THydrogen-bonded Turntrans-51.8-43.7178.8-67.7-176.3165.800112.9R298 R358R298-E356 IonicContact NH2-OE2 3.91Å; E356-R358 VanDerWaalsContact C-N 3.29Å; E356-R358 PolarHBondContact O-N 3.49Å
357D61.5Low78.6Confident94 Ų9448.4 Ų48.450%0.50323%0.234SC..THydrogen-bonded Turntrans-86.66.3-178.9-58.5-32.3000113.9K355 N359 W360K355-D357 VanDerWaalsContact C-N 3.29Å; K355-D357 PolarHBondContact O-N 3.32Å; D357-N359 PolarHBondContact O-N 3.38Å; D357-W360 WeakPolarHBondContact O-CB 3.43Å; D357-W360 PolarHBondContact O-N 3.17Å
358R65.4Low78.9Confident125 Ų12547.7 Ų47.747%0.47223%0.229SC..THydrogen-bonded Turntrans49.229-172.6-60.2-177.8176.5-179.3-2.4114.4D352 K355 E356 W360 H424D352-R358 VanDerWaalsContact O-CA 3.3Å; D352-R358 WeakPolarHBondContact O-CA 3.38Å; K355-R358 PolarHBondContact O-N 3.46Å; E356-R358 VanDerWaalsContact C-N 3.29Å; E356-R358 PolarHBondContact O-N 3.49Å; R358-W360 VanDerWaalsContact C-N 3.29Å; R358-W360 PolarHBondContact O-N 3.22Å; R358-H424 PolarHBondContact O-NE2 2.84Å
359N77.6Confident78.9Confident38 Ų3848.8 Ų48.820%0.20324%0.235CC..THydrogen-bonded Turntrans59.430.9-175.1-157.560.8000114.5V350 D352 K355 D357 R361V350-N359 PolarHBondContact O-ND2 3.3Å; D352-N359 HydrophobicContact CB-CB 4.29Å; K355-N359 HydrophobicContact CD-CB 4.44Å; K355-N359 PolarHBondContact NZ-OD1 3.26Å; D357-N359 PolarHBondContact O-N 3.38Å; N359-R361 PolarHBondContact O-N 2.84Å
360W80.4Confident79Confident13 Ų1350 Ų505%0.04924%0.241CC..  trans-67.8118.9178.7179.2-113000112.3D357 R358 R362 N365 T415 T416 H419 P420 P421 H424 F427D357-W360 WeakPolarHBondContact O-CB 3.43Å; D357-W360 PolarHBondContact O-N 3.17Å; R358-W360 VanDerWaalsContact C-N 3.29Å; R358-W360 PolarHBondContact O-N 3.22Å; W360-R362 HydrophobicContact CZ2-CB 4.2Å; W360-N365 HydrophobicContact CH2-CB 4.5Å; W360-N365 HydrophobicContact CZ3-CB 4.1Å; W360-N365 WeakPolarHBondContact CZ3-ND2 3.42Å; W360-T415 HydrophobicContact CH2-CG2 4.39Å; W360-T415 HydrophobicContact CZ2-CG2 4.24Å; W360-T416 PolarHBondContact NE1-O 2.8Å; W360-H419 PolarHBondContact NE1-O 3.38Å; W360-P420 HydrophobicContact CB-CB 4.11Å; W360-P420 HydrophobicContact CD2-CB 4.41Å; W360-P420 HydrophobicContact CG-CB 4.18Å; W360-P421 HydrophobicContact CE3-CG 4.41Å; W360-P421 VanDerWaalsContact CH2-CD 3.43Å; W360-P421 HydrophobicContact CH2-CG 3.59Å; W360-P421 HydrophobicContact CZ2-CG 4.1Å; W360-P421 VanDerWaalsContact CZ3-CD 3.46Å; W360-P421 HydrophobicContact CZ3-CG 3.75Å; W360-H424 AromaticContact CE3-CE1 3.61Å; W360-H424 AromaticContact CE3-ND1 3.32Å; W360-H424 VanDerWaalsContact CE3-ND1 3.32Å; W360-H424 AromaticContact CZ3-ND1 3.67Å; W360-F427 HydrophobicContact CZ3-CE2 4.25Å
361R81.3Confident79.1Confident86 Ų8650.6 Ų50.633%0.32524%0.244SC..  trans-136.795.1174.9-61-66.6-170.5179.54.9108.7S314 N359 L364 N365S314-R361 WeakPolarHBondContact OG-CD 3.41Å; S314-R361 VanDerWaalsContact OG-CG 3.31Å; S314-R361 WeakPolarHBondContact OG-CG 3.34Å; S314-R361 PolarHBondContact OG-NE 3.39Å; N359-R361 PolarHBondContact O-N 2.84Å; R361-L364 HydrophobicContact CB-CB 3.97Å; R361-L364 PolarHBondContact O-N 3.4Å; R361-L364 VanDerWaalsContact O-N 3.12Å; R361-N365 PolarHBondContact O-N 2.94Å
362R81.8Confident79.4Confident44 Ų4450.2 Ų50.217%0.16624%0.242CC..Hα-helixtrans-46.3-51.8-175.4-179.6175.9162.6-141.21.2115W360 L364 S366 F412 T415 N417W360-R362 HydrophobicContact CZ2-CB 4.2Å; R362-L364 VanDerWaalsContact C-N 3.35Å; R362-L364 PolarHBondContact O-N 3.4Å; R362-S366 VanDerWaalsContact O-CB 3.3Å; R362-S366 WeakPolarHBondContact O-CB 3.08Å; R362-S366 PolarHBondContact O-N 3.49Å; R362-S366 PolarHBondContact O-OG 3.41Å; R362-F412 HydrophobicContact CG-CD2 4.23Å; R362-F412 HydrophobicContact CG-CE2 4.48Å; R362-F412 PolarHBondContact NE-O 2.8Å; R362-F412 PolarHBondContact NH2-O 2.89Å; R362-T415 WeakPolarHBondContact CD-O 3.31Å; R362-T415 PolarHBondContact NE-O 2.9Å; R362-T415 VanDerWaalsContact NE-O 3.11Å; R362-N417 WeakPolarHBondContact CB-OD1 3.41Å; R362-N417 WeakPolarHBondContact CD-OD1 3.25Å
363P83.2Confident79.9Confident18 Ų1850.6 Ų50.612%0.11725%0.246CC..Hα-helixtrans-67.4-35.9-177.726.3-34.6000112.6T307 I310 L311 L367T307-P363 HydrophobicContact CG2-CB 3.78Å; T307-P363 HydrophobicContact CG2-CG 3.81Å; I310-P363 HydrophobicContact CG2-CG 4.37Å; L311-P363 HydrophobicContact CB-CG 4.24Å; L311-P363 HydrophobicContact CD1-CB 4.33Å; L311-P363 HydrophobicContact CD1-CG 4.48Å; P363-L367 WeakPolarHBondContact O-CB 3.46Å; P363-L367 PolarHBondContact O-N 2.93Å; P363-L367 VanDerWaalsContact O-N 3.07Å
364L84.7Confident80.8Confident9 Ų950.3 Ų50.35%0.04724%0.242CC..Hα-helixtrans-71.9-46.4179.6-173.366.3000111.1L311 L315 R361 R362 S366 L367 H368L311-L364 HydrophobicContact CD1-CB 4.26Å; L311-L364 HydrophobicContact CD1-CD1 4.21Å; L315-L364 HydrophobicContact CD2-CD1 4.08Å; R361-L364 HydrophobicContact CB-CB 3.97Å; R361-L364 PolarHBondContact O-N 3.4Å; R361-L364 VanDerWaalsContact O-N 3.12Å; R362-L364 VanDerWaalsContact C-N 3.35Å; R362-L364 PolarHBondContact O-N 3.4Å; L364-S366 VanDerWaalsContact C-N 3.32Å; L364-S366 PolarHBondContact O-N 2.67Å; L364-L367 WeakPolarHBondContact O-CB 3.43Å; L364-L367 PolarHBondContact O-N 3.31Å; L364-L367 VanDerWaalsContact O-N 3.12Å; L364-H368 VanDerWaalsContact CG-CE1 3.47Å; L364-H368 WeakPolarHBondContact CG-CE1 3.46Å; L364-H368 VanDerWaalsContact O-CG 3.23Å; L364-H368 PolarHBondContact O-N 2.89Å; L364-H368 PolarHBondContact O-ND1 2.96Å
365N86.3Confident81.9Confident2 Ų245.9 Ų45.91%0.01122%0.218CC..Hα-helixtrans-66.5-34177.6-69.1-11.3000112.2W360 R361 L367 H368 L369 F427W360-N365 HydrophobicContact CH2-CB 4.5Å; W360-N365 HydrophobicContact CZ3-CB 4.1Å; W360-N365 WeakPolarHBondContact CZ3-ND2 3.42Å; R361-N365 PolarHBondContact O-N 2.94Å; N365-L367 VanDerWaalsContact C-N 3.34Å; N365-H368 PolarHBondContact O-N 3.49Å; N365-L369 PolarHBondContact O-N 3.02Å; N365-F427 HydrophobicContact CB-CD1 4.33Å; N365-F427 HydrophobicContact CB-CE1 3.98Å; N365-F427 HydrophobicContact CB-CZ 4.31Å; N365-F427 WeakPolarHBondContact O-CE1 3.36Å
366S86.3Confident82.6Confident8 Ų842 Ų426%0.05620%0.204CC..Hα-helixtrans-66.1-39172.5-56.10000111.2R362 L364 H368 L369 A408R362-S366 VanDerWaalsContact O-CB 3.3Å; R362-S366 WeakPolarHBondContact O-CB 3.08Å; R362-S366 PolarHBondContact O-N 3.49Å; R362-S366 PolarHBondContact O-OG 3.41Å; L364-S366 VanDerWaalsContact C-N 3.32Å; L364-S366 PolarHBondContact O-N 2.67Å; S366-H368 VanDerWaalsContact C-N 3.34Å; S366-L369 PolarHBondContact O-N 2.65Å; S366-A408 VanDerWaalsContact O-CB 3.27Å; S366-A408 WeakPolarHBondContact O-CB 3.46Å
367L88.6Confident83.6Confident55 Ų5535 Ų3529%0.28817%0.173SC..Hα-helixtrans-65.2-38173.9-175.864.5000111.7L346 P363 L364 N365 L369 I370 T371L346-L367 HydrophobicContact CD1-CD2 3.41Å; L346-L367 VanDerWaalsContact CD1-CD2 3.41Å; L346-L367 HydrophobicContact CG-CD2 4.12Å; P363-L367 WeakPolarHBondContact O-CB 3.46Å; P363-L367 PolarHBondContact O-N 2.93Å; P363-L367 VanDerWaalsContact O-N 3.07Å; L364-L367 WeakPolarHBondContact O-CB 3.43Å; L364-L367 PolarHBondContact O-N 3.31Å; L364-L367 VanDerWaalsContact O-N 3.12Å; N365-L367 VanDerWaalsContact C-N 3.34Å; L367-L369 PolarHBondContact O-N 2.88Å; L367-I370 WeakPolarHBondContact O-CA 3.44Å; L367-I370 WeakPolarHBondContact O-CB 3.12Å; L367-I370 PolarHBondContact O-N 3.41Å; L367-T371 HydrophobicContact CD1-CG2 3.94Å; L367-T371 HydrophobicContact CG-CG2 3.87Å; L367-T371 PolarHBondContact O-N 3.43Å; L367-T371 PolarHBondContact O-OG1 3.21Å
368H90.2Very high84.7Confident3 Ų334 Ų341%0.01417%0.167CC..Hα-helixtrans-61.8-28.5176.9-65.1151.8000113.7L345 L346 V348 P349 L364 N365 S366 I370 T371 A372 P373L345-H368 PolarHBondContact O-NE2 3.21Å; L346-H368 PolarHBondContact O-CD2 2.85Å; V348-H368 PolarHBondContact O-CE1 3.37Å; P349-H368 VanDerWaalsContact CA-CE1 3.47Å; P349-H368 WeakPolarHBondContact CA-CE1 3.48Å; P349-H368 VanDerWaalsContact CA-ND1 3.29Å; P349-H368 WeakPolarHBondContact CA-ND1 3.11Å; P349-H368 HydrophobicContact CB-CB 4.01Å; P349-H368 WeakPolarHBondContact CB-ND1 3.36Å; P349-H368 HydrophobicContact CG-CB 4.1Å; L364-H368 VanDerWaalsContact CG-CE1 3.47Å; L364-H368 WeakPolarHBondContact CG-CE1 3.46Å; L364-H368 VanDerWaalsContact O-CG 3.23Å; L364-H368 PolarHBondContact O-N 2.89Å; L364-H368 PolarHBondContact O-ND1 2.96Å; N365-H368 PolarHBondContact O-N 3.49Å; S366-H368 VanDerWaalsContact C-N 3.34Å; H368-I370 PolarHBondContact O-N 2.85Å; H368-T371 WeakPolarHBondContact CA-OG1 3.42Å; H368-A372 WeakPolarHBondContact O-CB 3.33Å; H368-A372 PolarHBondContact O-N 3.48Å; H368-P373 WeakPolarHBondContact O-CD 3.44Å
369L88.9Confident85.4Confident26 Ų2629 Ų2914%0.13615%0.151CC..Hα-helixtrans-65.5-20.1172.8-67.3172.1000113N365 S366 L367 P373 G404 A408 V411 F427 L430N365-L369 PolarHBondContact O-N 3.02Å; S366-L369 PolarHBondContact O-N 2.65Å; L367-L369 PolarHBondContact O-N 2.88Å; L369-P373 WeakPolarHBondContact O-CD 3.42Å; L369-P373 WeakPolarHBondContact O-CG 3.48Å; L369-G404 VanDerWaalsContact O-CA 3.32Å; L369-G404 WeakPolarHBondContact O-CA 3.35Å; L369-A408 HydrophobicContact CB-CB 4.2Å; L369-V411 HydrophobicContact CD1-CB 3.8Å; L369-V411 HydrophobicContact CD1-CG1 4.24Å; L369-V411 HydrophobicContact CD1-CG2 3.61Å; L369-F427 HydrophobicContact CD1-CE1 4.34Å; L369-F427 HydrophobicContact CD1-CZ 4.1Å; L369-F427 HydrophobicContact CD2-CE1 3.75Å; L369-F427 HydrophobicContact CD2-CZ 4.01Å; L369-F427 HydrophobicContact CG-CE1 3.84Å; L369-F427 HydrophobicContact CG-CZ 4.1Å; L369-L430 HydrophobicContact CD2-CD2 4.35Å
370I89.9Confident85.3Confident26 Ų2629 Ų2913%0.13315%0.149CC..Hα-helixtrans-96-54.3175.4-57.7153.8000109.4L367 H368 L374 L401 M405 A408L367-I370 WeakPolarHBondContact O-CA 3.44Å; L367-I370 WeakPolarHBondContact O-CB 3.12Å; L367-I370 PolarHBondContact O-N 3.41Å; H368-I370 PolarHBondContact O-N 2.85Å; I370-L374 VanDerWaalsContact O-CB 3.25Å; I370-L374 WeakPolarHBondContact O-CB 3.27Å; I370-L374 PolarHBondContact O-N 3.3Å; I370-L401 HydrophobicContact CG2-CD1 3.69Å; I370-M405 HydrophobicContact CD1-CG 4.43Å; I370-M405 HydrophobicContact CD1-SD 3.31Å; I370-M405 WeakPolarHBondContact CD1-SD 3.39Å; I370-M405 HydrophobicContact CG1-CG 4.27Å; I370-M405 HydrophobicContact CG1-SD 3.76Å; I370-M405 HydrophobicContact CG2-CG 4.48Å; I370-M405 HydrophobicContact CG2-SD 4.15Å; I370-A408 HydrophobicContact CD1-CB 3.73Å; I370-A408 HydrophobicContact CG1-CB 3.79Å
371T89.6Confident84.8Confident29 Ų2931.8 Ų31.818%0.17816%0.163CC..Hα-helixtrans-71.3-37-170.855.80000112.7L346 L367 H368 L375L346-T371 PolarHBondContact O-OG1 3.13Å; L367-T371 HydrophobicContact CD1-CG2 3.94Å; L367-T371 HydrophobicContact CG-CG2 3.87Å; L367-T371 PolarHBondContact O-N 3.43Å; L367-T371 PolarHBondContact O-OG1 3.21Å; H368-T371 WeakPolarHBondContact CA-OG1 3.42Å; T371-L375 VanDerWaalsContact O-CB 3.24Å; T371-L375 WeakPolarHBondContact O-CB 3.46Å; T371-L375 PolarHBondContact O-N 2.87Å
372A88.8Confident84.2Confident0 Ų028.8 Ų28.80%015%0.154CC..Hα-helixtrans-72.9-49-172.100000112.9C347 H368 L374 L375 C376 L430 V434C347-A372 WeakPolarHBondContact O-CB 3.29Å; H368-A372 WeakPolarHBondContact O-CB 3.33Å; H368-A372 PolarHBondContact O-N 3.48Å; A372-L374 VanDerWaalsContact C-N 3.33Å; A372-L374 PolarHBondContact O-N 3.33Å; A372-L375 PolarHBondContact O-N 2.89Å; A372-C376 PolarHBondContact O-N 2.91Å; A372-C376 PolarHBondContact O-SG 3.48Å; A372-C376 VanDerWaalsContact O-SG 3.39Å; A372-L430 HydrophobicContact CB-CD1 4.43Å; A372-L430 HydrophobicContact CB-CD2 4.3Å; A372-L430 HydrophobicContact CB-CG 4.29Å; A372-V434 HydrophobicContact CB-CB 4.43Å; A372-V434 HydrophobicContact CB-CG1 4.22Å; A372-V434 HydrophobicContact CB-CG2 3.55Å
373P88.2Confident83.5Confident37 Ų3727.8 Ų27.824%0.2416%0.158CC..Hα-helixtrans-64.2-37.3174.8-22.435.2000113H368 L369 C376 V377 I400H368-P373 WeakPolarHBondContact O-CD 3.44Å; L369-P373 WeakPolarHBondContact O-CD 3.42Å; L369-P373 WeakPolarHBondContact O-CG 3.48Å; P373-C376 PolarHBondContact O-N 3.26Å; P373-V377 PolarHBondContact O-N 2.94Å; P373-V377 VanDerWaalsContact O-N 3.14Å; P373-I400 HydrophobicContact CB-CG2 3.59Å
374L87.3Confident82.8Confident36 Ų3630 Ų3019%0.18818%0.178CC..Hα-helixtrans-63.7-45.7176.3-177.467.7000111.2I370 A372 C376 V377 L378 W397 L401I370-L374 VanDerWaalsContact O-CB 3.25Å; I370-L374 WeakPolarHBondContact O-CB 3.27Å; I370-L374 PolarHBondContact O-N 3.3Å; A372-L374 VanDerWaalsContact C-N 3.33Å; A372-L374 PolarHBondContact O-N 3.33Å; L374-C376 VanDerWaalsContact C-N 3.34Å; L374-C376 PolarHBondContact O-N 3.45Å; L374-V377 PolarHBondContact O-N 3.44Å; L374-L378 HydrophobicContact CD1-CD1 4.1Å; L374-L378 HydrophobicContact CD1-CG 4.34Å; L374-L378 HydrophobicContact CD2-CD1 4.49Å; L374-L378 HydrophobicContact CG-CD1 3.9Å; L374-L378 HydrophobicContact CG-CG 4.44Å; L374-L378 WeakPolarHBondContact O-CB 3.14Å; L374-L378 WeakPolarHBondContact O-CG 3.23Å; L374-L378 PolarHBondContact O-N 2.89Å; L374-W397 HydrophobicContact CD1-CB 4.05Å; L374-W397 HydrophobicContact CD1-CE3 4.44Å; L374-L401 HydrophobicContact CD2-CD1 4.04Å
375L87.9Confident82Confident38 Ų3834.6 Ų34.620%0.19920%0.195CC..Hα-helixtrans-58.7-47.3175.3-173.180.6000110.5C347 T371 A372 V377 L378 V379 V434C347-L375 HydrophobicContact CB-CD2 4Å; T371-L375 VanDerWaalsContact O-CB 3.24Å; T371-L375 WeakPolarHBondContact O-CB 3.46Å; T371-L375 PolarHBondContact O-N 2.87Å; A372-L375 PolarHBondContact O-N 2.89Å; L375-V377 VanDerWaalsContact C-N 3.29Å; L375-V377 PolarHBondContact O-N 3.14Å; L375-L378 PolarHBondContact O-N 3.2Å; L375-V379 HydrophobicContact CD1-CG2 3.63Å; L375-V379 HydrophobicContact CG-CB 4.48Å; L375-V379 HydrophobicContact CG-CG2 3.83Å; L375-V379 WeakPolarHBondContact O-CB 3.42Å; L375-V379 VanDerWaalsContact O-CG2 3.29Å; L375-V379 WeakPolarHBondContact O-CG2 3.12Å; L375-V379 PolarHBondContact O-N 3.23Å; L375-V434 HydrophobicContact CD2-CG1 3.87Å
376C84.9Confident81Confident23 Ų2335.3 Ų35.316%0.15520%0.203CC..Hα-helixtrans-54.2-46.4178-72.70000111.4A372 P373 L374 V379 F380 V434A372-C376 PolarHBondContact O-N 2.91Å; A372-C376 PolarHBondContact O-SG 3.48Å; A372-C376 VanDerWaalsContact O-SG 3.39Å; P373-C376 PolarHBondContact O-N 3.26Å; L374-C376 VanDerWaalsContact C-N 3.34Å; L374-C376 PolarHBondContact O-N 3.45Å; C376-V379 PolarHBondContact O-N 3.47Å; C376-F380 WeakPolarHBondContact O-CB 3.38Å; C376-F380 PolarHBondContact O-N 3.41Å; C376-V434 VanDerWaalsContact SG-CG2 3.58Å
377V83.9Confident80.2Confident25 Ų2537.9 Ų37.915%0.15223%0.231CC..Hα-helixtrans-71.4-36.2-178.7171.80000113.6P373 L374 L375 V379 V396 W397 I400P373-V377 PolarHBondContact O-N 2.94Å; P373-V377 VanDerWaalsContact O-N 3.14Å; L374-V377 PolarHBondContact O-N 3.44Å; L375-V377 VanDerWaalsContact C-N 3.29Å; L375-V377 PolarHBondContact O-N 3.14Å; V377-V379 VanDerWaalsContact C-N 3.34Å; V377-V396 HydrophobicContact CG1-CG1 4.25Å; V377-W397 HydrophobicContact CG1-CB 4.41Å; V377-I400 HydrophobicContact CB-CD1 4.09Å; V377-I400 HydrophobicContact CG1-CD1 4.25Å; V377-I400 HydrophobicContact CG2-CD1 3.15Å
378L82.8Confident79.7Confident72 Ų7238.1 Ų38.138%0.37724%0.235SC..Hα-helixtrans-75.1-26.3177.6-67.2177.6000112.7L374 L375 G383 W397L374-L378 HydrophobicContact CD1-CD1 4.1Å; L374-L378 HydrophobicContact CD1-CG 4.34Å; L374-L378 HydrophobicContact CD2-CD1 4.49Å; L374-L378 HydrophobicContact CG-CD1 3.9Å; L374-L378 HydrophobicContact CG-CG 4.44Å; L374-L378 WeakPolarHBondContact O-CB 3.14Å; L374-L378 WeakPolarHBondContact O-CG 3.23Å; L374-L378 PolarHBondContact O-N 2.89Å; L375-L378 PolarHBondContact O-N 3.2Å; L378-G383 VanDerWaalsContact O-CA 3.25Å; L378-G383 WeakPolarHBondContact O-CA 3.39Å; L378-W397 HydrophobicContact CD2-CB 4.14Å; L378-W397 HydrophobicContact CD2-CG 4.5Å
379V81.6Confident79.2Confident22 Ų2243.4 Ų43.413%0.13326%0.261CS..Hα-helixtrans-102.1-27.8-172.3175.20000112.8F78 L375 C376 V377 Q381 S382 V437 A441F78-V379 HydrophobicContact CE2-CG1 4.4Å; F78-V379 HydrophobicContact CZ-CB 4.34Å; F78-V379 HydrophobicContact CZ-CG1 4.14Å; F78-V379 WeakPolarHBondContact CZ-O 3.29Å; L375-V379 HydrophobicContact CD1-CG2 3.63Å; L375-V379 HydrophobicContact CG-CB 4.48Å; L375-V379 HydrophobicContact CG-CG2 3.83Å; L375-V379 WeakPolarHBondContact O-CB 3.42Å; L375-V379 VanDerWaalsContact O-CG2 3.29Å; L375-V379 WeakPolarHBondContact O-CG2 3.12Å; L375-V379 PolarHBondContact O-N 3.23Å; C376-V379 PolarHBondContact O-N 3.47Å; V377-V379 VanDerWaalsContact C-N 3.34Å; V379-Q381 PolarHBondContact O-N 3.09Å; V379-S382 PolarHBondContact O-N 3.06Å; V379-V437 HydrophobicContact CG1-CG1 4.31Å; V379-A441 HydrophobicContact CG1-CB 3.21Å
380F74.8Confident78.8Confident36 Ų3645.7 Ų45.716%0.15827%0.272CS..G310 helixtrans-64.2135.3-175.9-170.1-105.5000111.9F6 F153 C376 S382 G383 Y385 V437F6-F380 HydrophobicContact CE2-CE1 4.18Å; F6-F380 HydrophobicContact CE2-CZ 4.07Å; F153-F380 HydrophobicContact CD2-CZ 4.46Å; F153-F380 HydrophobicContact CE2-CZ 4.46Å; C376-F380 WeakPolarHBondContact O-CB 3.38Å; C376-F380 PolarHBondContact O-N 3.41Å; F380-S382 VanDerWaalsContact C-N 3.31Å; F380-S382 PolarHBondContact O-N 2.77Å; F380-G383 PolarHBondContact O-N 3.4Å; F380-Y385 AromaticContact CD1-CD2 3.65Å; F380-Y385 HydrophobicContact CD1-CD2 3.65Å; F380-Y385 AromaticContact CD1-CE2 3.55Å; F380-Y385 HydrophobicContact CD1-CE2 3.55Å; F380-Y385 HydrophobicContact CE1-CD2 4.39Å; F380-Y385 AromaticContact CE1-CE2 3.83Å; F380-Y385 HydrophobicContact CE1-CE2 3.83Å; F380-V437 HydrophobicContact CB-CG1 4.4Å; F380-V437 HydrophobicContact CD2-CG1 4.25Å; F380-V437 HydrophobicContact CD2-CG2 4.17Å
381Q69.8Low78.2Confident73 Ų7353.7 Ų53.734%0.34131%0.309SS..G310 helixtrans50.750.3-176.3-71.6-75.2-13.900111.8V379 G383 A384 Y385V379-Q381 PolarHBondContact O-N 3.09Å; Q381-G383 PolarHBondContact O-N 3.3Å; Q381-A384 HydrophobicContact CB-CB 4.18Å; Q381-A384 VanDerWaalsContact O-CB 3.27Å; Q381-A384 WeakPolarHBondContact O-CB 3.4Å; Q381-A384 PolarHBondContact O-N 3.03Å; Q381-Y385 HydrophobicContact CB-CD2 4.17Å; Q381-Y385 HydrophobicContact CB-CE2 3.97Å; Q381-Y385 HydrophobicContact CG-CE2 4.02Å
382S68.1Low77.6Confident22 Ų2254.5 Ų54.515%0.15432%0.323CS..G310 helixtrans53.930.4176.3-61.40000115.3D76 F78 V379 F380D76-S382 WeakPolarHBondContact O-CB 3.17Å; D76-S382 PolarHBondContact O-OG 2.91Å; F78-S382 WeakPolarHBondContact CE1-O 3.25Å; F78-S382 VanDerWaalsContact CZ-C 3.42Å; F78-S382 VanDerWaalsContact CZ-CA 3.47Å; V379-S382 PolarHBondContact O-N 3.06Å; F380-S382 VanDerWaalsContact C-N 3.31Å; F380-S382 PolarHBondContact O-N 2.77Å
383G67.5Low77.2Confident23 Ų2362.7 Ų62.724%0.23736%0.362CS..G310 helixtrans87.38.3177.800000115.2L378 F380 Q381 Y385 G386L378-G383 VanDerWaalsContact O-CA 3.25Å; L378-G383 WeakPolarHBondContact O-CA 3.39Å; F380-G383 PolarHBondContact O-N 3.4Å; Q381-G383 PolarHBondContact O-N 3.3Å; G383-Y385 PolarHBondContact O-N 3.33Å; G383-G386 PolarHBondContact O-N 2.85Å
384A67.8Low76.8Confident65 Ų6564.6 Ų64.654%0.53737%0.366SS..G310 helixtrans-53.5-37.6175.800000112.6Q381Q381-A384 HydrophobicContact CB-CB 4.18Å; Q381-A384 VanDerWaalsContact O-CB 3.27Å; Q381-A384 WeakPolarHBondContact O-CB 3.4Å; Q381-A384 PolarHBondContact O-N 3.03Å
385Y68.9Low76.7Confident105 Ų10564.2 Ų64.241%0.41237%0.366SS..G310 helixtrans-81.3-13.1-179.7-68.9-87.3000114.3F380 Q381 G383 G387 V388F380-Y385 AromaticContact CD1-CD2 3.65Å; F380-Y385 HydrophobicContact CD1-CD2 3.65Å; F380-Y385 AromaticContact CD1-CE2 3.55Å; F380-Y385 HydrophobicContact CD1-CE2 3.55Å; F380-Y385 HydrophobicContact CE1-CD2 4.39Å; F380-Y385 AromaticContact CE1-CE2 3.83Å; F380-Y385 HydrophobicContact CE1-CE2 3.83Å; Q381-Y385 HydrophobicContact CB-CD2 4.17Å; Q381-Y385 HydrophobicContact CB-CE2 3.97Å; Q381-Y385 HydrophobicContact CG-CE2 4.02Å; G383-Y385 PolarHBondContact O-N 3.33Å; Y385-G387 VanDerWaalsContact C-N 3.27Å; Y385-G387 PolarHBondContact O-N 2.98Å; Y385-V388 HydrophobicContact CD1-CG2 4.24Å; Y385-V388 PolarHBondContact O-N 3.07Å
386G66.1Low76.6Confident17 Ų1764 Ų6418%0.17537%0.366CS..G310 helixtrans-66.2-30.1175.700000112.7G383 W397G383-G386 PolarHBondContact O-N 2.85Å; G386-W397 VanDerWaalsContact O-CD1 3.3Å
387G68.9Low76.6Confident63 Ų6367.6 Ų67.665%0.64938%0.377SS*.G310 helixtrans-93.1-3.2178.800000115.1Y385 M389Y385-G387 VanDerWaalsContact C-N 3.27Å; Y385-G387 PolarHBondContact O-N 2.98Å; G387-M389 PolarHBondContact O-N 3.21Å
388V77.8Confident76.7Confident60 Ų6068.9 Ų68.936%0.36438%0.382SS..  trans-72.2123.2-175.4175.70000110.2Y385 V396Y385-V388 HydrophobicContact CD1-CG2 4.24Å; Y385-V388 PolarHBondContact O-N 3.07Å; V388-V396 HydrophobicContact CB-CG2 4.26Å; V388-V396 HydrophobicContact CG1-CG2 3.97Å; V388-V396 WeakPolarHBondContact O-CG2 3.44Å; V388-V396 PolarHBondContact O-N 3.02Å; V388-V396 VanDerWaalsContact O-N 3.13Å
389M80.8Confident76.9Confident114 Ų11469.5 Ų69.556%0.56239%0.386SS*.EExtended strand (participates in β ladder)trans-104.4127.9176-63.1-168.5-7800110.3G387 Q391 F394G387-M389 PolarHBondContact O-N 3.21Å; M389-Q391 PolarHBondContact O-N 3.47Å; M389-F394 CarbonylContact C-O 3.58Å; M389-F394 WeakPolarHBondContact CA-O 3.36Å
390I78.9Confident77.2Confident73 Ų7370.2 Ų70.237%0.37439%0.388SS..EExtended strand (participates in β ladder)trans-71.3116.9170.5-55.8177.2000107.1G392 E393 F394 V396 L399I390-G392 PolarHBondContact O-N 3.02Å; I390-E393 PolarHBondContact O-N 3.03Å; I390-F394 HydrophobicContact CB-CB 4.49Å; I390-F394 HydrophobicContact CD1-CD1 4.5Å; I390-F394 PolarHBondContact N-O 2.64Å; I390-F394 PolarHBondContact O-N 3.45Å; I390-V396 HydrophobicContact CD1-CG2 4.1Å; I390-V396 HydrophobicContact CG1-CG2 3.67Å; I390-L399 HydrophobicContact CD1-CD2 3.93Å
391Q77.8Confident77.9Confident194 Ų19470.9 Ų70.991%0.90739%0.393SS*.THydrogen-bonded Turntrans55.420.8-178-61.9180-2700114.6M389 E393M389-Q391 PolarHBondContact O-N 3.47Å; Q391-E393 VanDerWaalsContact C-N 3.27Å; Q391-E393 PolarHBondContact O-N 2.85Å
392G77.6Confident79Confident46 Ų4672.1 Ų72.147%0.47440%0.402SS..THydrogen-bonded Turntrans79.5-4179.300000116I390I390-G392 PolarHBondContact O-N 3.02Å
393E79.4Confident80Confident173 Ų17375.9 Ų75.981%0.80842%0.42SS*.THydrogen-bonded Turntrans-114.9-32.7-173.4-69.9-77.8158.800112.8I390 Q391I390-E393 PolarHBondContact O-N 3.03Å; Q391-E393 VanDerWaalsContact C-N 3.27Å; Q391-E393 PolarHBondContact O-N 2.85Å
394F80.9Confident81.1Confident76 Ų7675 Ų7533%0.33341%0.41SS..EExtended strand (participates in β ladder)trans-120.7117.3-171.4-163.1-103.8000113.5M389 I390 L398 L399 L402M389-F394 CarbonylContact C-O 3.58Å; M389-F394 WeakPolarHBondContact CA-O 3.36Å; I390-F394 HydrophobicContact CB-CB 4.49Å; I390-F394 HydrophobicContact CD1-CD1 4.5Å; I390-F394 PolarHBondContact N-O 2.64Å; I390-F394 PolarHBondContact O-N 3.45Å; F394-L398 HydrophobicContact CE2-CD2 3.68Å; F394-L398 HydrophobicContact CE2-CG 4.24Å; F394-L398 HydrophobicContact CZ-CB 4.19Å; F394-L398 HydrophobicContact CZ-CD2 3.87Å; F394-L398 HydrophobicContact CZ-CG 3.89Å; F394-L399 HydrophobicContact CD1-CB 4.33Å; F394-L399 HydrophobicContact CE1-CB 3.64Å; F394-L399 HydrophobicContact CE1-CD1 3.96Å; F394-L399 HydrophobicContact CE1-CG 4.34Å; F394-L402 HydrophobicContact CZ-CD1 4.29Å
395P85.3Confident82.2Confident29 Ų2976.7 Ų76.719%0.18841%0.408CS..EExtended strand (participates in β ladder)trans-72.2135.2-179.325.4-29.5000112.3W397 L398 L399P395-W397 VanDerWaalsContact C-N 3.31Å; P395-W397 HydrophobicContact CB-CG 4.39Å; P395-W397 VanDerWaalsContact CB-NE1 3.33Å; P395-W397 HydrophobicContact CG-CZ2 4.36Å; P395-W397 PolarHBondContact O-N 3.07Å; P395-L398 HydrophobicContact CG-CB 3.83Å; P395-L398 HydrophobicContact CG-CD2 4.24Å; P395-L398 PolarHBondContact O-N 3.49Å; P395-L398 VanDerWaalsContact O-N 3.17Å; P395-L399 PolarHBondContact O-N 2.69Å
396V84.6Confident83.3Confident33 Ų3377.9 Ų77.920%0.242%0.416CS..Hα-helixtrans-60.7-38.1-178174.90000112.3V377 V388 I390 L398 L399 I400V377-V396 HydrophobicContact CG1-CG1 4.25Å; V388-V396 HydrophobicContact CB-CG2 4.26Å; V388-V396 HydrophobicContact CG1-CG2 3.97Å; V388-V396 WeakPolarHBondContact O-CG2 3.44Å; V388-V396 PolarHBondContact O-N 3.02Å; V388-V396 VanDerWaalsContact O-N 3.13Å; I390-V396 HydrophobicContact CD1-CG2 4.1Å; I390-V396 HydrophobicContact CG1-CG2 3.67Å; V396-L398 PolarHBondContact O-N 2.72Å; V396-L399 WeakPolarHBondContact O-CB 3.3Å; V396-L399 PolarHBondContact O-N 3.17Å; V396-I400 HydrophobicContact CG1-CD1 3.77Å; V396-I400 HydrophobicContact CG1-CG1 4.48Å; V396-I400 WeakPolarHBondContact O-CG1 3.46Å; V396-I400 PolarHBondContact O-N 3.28Å
397W85.3Confident84.4Confident99 Ų9980.9 Ų80.938%0.37543%0.427SS..Hα-helixtrans-61.6-33.5179.666.6-97.5000112.5L374 V377 L378 G386 P395 I400 L401L374-W397 HydrophobicContact CD1-CB 4.05Å; L374-W397 HydrophobicContact CD1-CE3 4.44Å; V377-W397 HydrophobicContact CG1-CB 4.41Å; L378-W397 HydrophobicContact CD2-CB 4.14Å; L378-W397 HydrophobicContact CD2-CG 4.5Å; G386-W397 VanDerWaalsContact O-CD1 3.3Å; P395-W397 VanDerWaalsContact C-N 3.31Å; P395-W397 HydrophobicContact CB-CG 4.39Å; P395-W397 VanDerWaalsContact CB-NE1 3.33Å; P395-W397 HydrophobicContact CG-CZ2 4.36Å; P395-W397 PolarHBondContact O-N 3.07Å; W397-I400 PolarHBondContact O-N 3.26Å; W397-L401 HydrophobicContact CZ3-CD2 4.48Å; W397-L401 WeakPolarHBondContact O-CB 3.49Å; W397-L401 PolarHBondContact O-N 3.42Å
398L86.4Confident85.4Confident52 Ų5278.2 Ų78.227%0.27240%0.399SS..Hα-helixtrans-71.6-38.6177.9-176.561.9000111.3F394 P395 V396 I400 L401 L402F394-L398 HydrophobicContact CE2-CD2 3.68Å; F394-L398 HydrophobicContact CE2-CG 4.24Å; F394-L398 HydrophobicContact CZ-CB 4.19Å; F394-L398 HydrophobicContact CZ-CD2 3.87Å; F394-L398 HydrophobicContact CZ-CG 3.89Å; P395-L398 HydrophobicContact CG-CB 3.83Å; P395-L398 HydrophobicContact CG-CD2 4.24Å; P395-L398 PolarHBondContact O-N 3.49Å; P395-L398 VanDerWaalsContact O-N 3.17Å; V396-L398 PolarHBondContact O-N 2.72Å; L398-I400 VanDerWaalsContact C-N 3.28Å; L398-I400 PolarHBondContact O-N 3.44Å; L398-L401 HydrophobicContact CD1-CD2 4.22Å; L398-L401 PolarHBondContact O-N 2.92Å; L398-L402 HydrophobicContact CG-CD1 4.5Å; L398-L402 WeakPolarHBondContact O-CG 3.2Å; L398-L402 PolarHBondContact O-N 3.09Å
399L87.4Confident86Confident85 Ų8577.8 Ų77.845%0.44540%0.402SS..Hα-helixtrans-56-48173.7-17058.7000111.1I390 F394 P395 V396 L402 L403I390-L399 HydrophobicContact CD1-CD2 3.93Å; F394-L399 HydrophobicContact CD1-CB 4.33Å; F394-L399 HydrophobicContact CE1-CB 3.64Å; F394-L399 HydrophobicContact CE1-CD1 3.96Å; F394-L399 HydrophobicContact CE1-CG 4.34Å; P395-L399 PolarHBondContact O-N 2.69Å; V396-L399 WeakPolarHBondContact O-CB 3.3Å; V396-L399 PolarHBondContact O-N 3.17Å; L399-L402 PolarHBondContact O-N 3.04Å; L399-L403 WeakPolarHBondContact O-CB 3.46Å; L399-L403 PolarHBondContact O-N 3.11Å
400I87.6Confident86.3Confident37 Ų3775.8 Ų75.819%0.1939%0.393CS..Hα-helixtrans-71.1-36.7-175-67172.6000110.5P373 V377 V396 W397 L398 L403 G404P373-I400 HydrophobicContact CB-CG2 3.59Å; V377-I400 HydrophobicContact CB-CD1 4.09Å; V377-I400 HydrophobicContact CG1-CD1 4.25Å; V377-I400 HydrophobicContact CG2-CD1 3.15Å; V396-I400 HydrophobicContact CG1-CD1 3.77Å; V396-I400 HydrophobicContact CG1-CG1 4.48Å; V396-I400 WeakPolarHBondContact O-CG1 3.46Å; V396-I400 PolarHBondContact O-N 3.28Å; W397-I400 PolarHBondContact O-N 3.26Å; L398-I400 VanDerWaalsContact C-N 3.28Å; L398-I400 PolarHBondContact O-N 3.44Å; I400-L403 PolarHBondContact O-N 3.08Å; I400-G404 PolarHBondContact O-N 3.49Å
401L89.9Confident86.7Confident49 Ų4973 Ų7326%0.25738%0.38SS..Hα-helixtrans-58.5-49.2171-176.674.8000111.2I370 L374 W397 L398 G404 M405I370-L401 HydrophobicContact CG2-CD1 3.69Å; L374-L401 HydrophobicContact CD2-CD1 4.04Å; W397-L401 HydrophobicContact CZ3-CD2 4.48Å; W397-L401 WeakPolarHBondContact O-CB 3.49Å; W397-L401 PolarHBondContact O-N 3.42Å; L398-L401 HydrophobicContact CD1-CD2 4.22Å; L398-L401 PolarHBondContact O-N 2.92Å; L401-G404 PolarHBondContact O-N 3.31Å; L401-M405 WeakPolarHBondContact O-CB 3.45Å; L401-M405 WeakPolarHBondContact O-CG 3.32Å; L401-M405 PolarHBondContact O-N 3.02Å
402L91.1Very high87.1Confident100 Ų10067.7 Ų67.752%0.52435%0.353SS..Hα-helixtrans-63.7-44.2-179.7-68.3174000112F394 L398 L399 M405 F406F394-L402 HydrophobicContact CZ-CD1 4.29Å; L398-L402 HydrophobicContact CG-CD1 4.5Å; L398-L402 WeakPolarHBondContact O-CG 3.2Å; L398-L402 PolarHBondContact O-N 3.09Å; L399-L402 PolarHBondContact O-N 3.04Å; L402-M405 PolarHBondContact O-N 2.65Å; L402-F406 PolarHBondContact O-N 3.23Å
403L90.8Very high87.5Confident101 Ų10170.6 Ų70.653%0.52937%0.365SS..Hα-helixtrans-63.4-42.9176-177.363.8000111.6L399 I400 F406 L407L399-L403 WeakPolarHBondContact O-CB 3.46Å; L399-L403 PolarHBondContact O-N 3.11Å; I400-L403 PolarHBondContact O-N 3.08Å; L403-F406 PolarHBondContact O-N 2.77Å; L403-L407 HydrophobicContact CG-CD1 4.24Å; L403-L407 WeakPolarHBondContact O-CG 3.25Å; L403-L407 PolarHBondContact O-N 3.45Å
404G89.8Confident87.7Confident4 Ų466.9 Ų66.94%0.04136%0.355CS..Hα-helixtrans-62.4-43176.500000112.3L369 I400 L401 F406 L407 A408L369-G404 VanDerWaalsContact O-CA 3.32Å; L369-G404 WeakPolarHBondContact O-CA 3.35Å; I400-G404 PolarHBondContact O-N 3.49Å; L401-G404 PolarHBondContact O-N 3.31Å; G404-F406 VanDerWaalsContact C-N 3.35Å; G404-F406 PolarHBondContact O-N 3.12Å; G404-L407 PolarHBondContact O-N 3.44Å; G404-A408 WeakPolarHBondContact O-CB 3.27Å; G404-A408 PolarHBondContact O-N 2.63Å
405M91.3Very high87.9Confident100 Ų10063.9 Ų63.949%0.49334%0.342SS..Hα-helixtrans-61.9-41.2174.5-72.7-68.1-62.800111.9I370 L401 L402 A408 A409I370-M405 HydrophobicContact CD1-CG 4.43Å; I370-M405 HydrophobicContact CD1-SD 3.31Å; I370-M405 WeakPolarHBondContact CD1-SD 3.39Å; I370-M405 HydrophobicContact CG1-CG 4.27Å; I370-M405 HydrophobicContact CG1-SD 3.76Å; I370-M405 HydrophobicContact CG2-CG 4.48Å; I370-M405 HydrophobicContact CG2-SD 4.15Å; L401-M405 WeakPolarHBondContact O-CB 3.45Å; L401-M405 WeakPolarHBondContact O-CG 3.32Å; L401-M405 PolarHBondContact O-N 3.02Å; L402-M405 PolarHBondContact O-N 2.65Å; M405-A408 PolarHBondContact O-N 2.85Å; M405-A409 WeakPolarHBondContact O-CB 3.25Å; M405-A409 PolarHBondContact O-N 3.27Å
406F91.6Very high87.7Confident131 Ų13165.4 Ų65.458%0.57535%0.352SS*.Hα-helixtrans-64.3-47.8176.8178.9-106.2000111.9L402 L403 G404 A409 I410L402-F406 PolarHBondContact O-N 3.23Å; L403-F406 PolarHBondContact O-N 2.77Å; G404-F406 VanDerWaalsContact C-N 3.35Å; G404-F406 PolarHBondContact O-N 3.12Å; F406-A409 PolarHBondContact O-N 2.88Å; F406-I410 HydrophobicContact CD1-CD1 3.89Å; F406-I410 HydrophobicContact CE1-CD1 3.42Å; F406-I410 VanDerWaalsContact CE1-CD1 3.42Å; F406-I410 HydrophobicContact CE2-CD1 4.3Å; F406-I410 HydrophobicContact CZ-CD1 3.66Å; F406-I410 WeakPolarHBondContact O-CG1 3.49Å; F406-I410 PolarHBondContact O-N 3.41Å; F406-I410 VanDerWaalsContact O-N 3.08Å
407L89.6Confident87.2Confident79 Ų7966.1 Ų66.141%0.41435%0.354SS..Hα-helixtrans-64.1-40.6176.2-69.6172.7000112L403 G404 A409 I410 V411L403-L407 HydrophobicContact CG-CD1 4.24Å; L403-L407 WeakPolarHBondContact O-CG 3.25Å; L403-L407 PolarHBondContact O-N 3.45Å; G404-L407 PolarHBondContact O-N 3.44Å; L407-A409 VanDerWaalsContact C-N 3.34Å; L407-A409 PolarHBondContact O-N 3.47Å; L407-I410 PolarHBondContact O-N 3.49Å; L407-V411 WeakPolarHBondContact O-CG2 3.25Å; L407-V411 PolarHBondContact O-N 2.66Å
408A89.4Confident86.5Confident8 Ų868.3 Ų68.37%0.06637%0.373CS..Hα-helixtrans-61.2-41.8175.200000111.7S366 L369 I370 G404 M405 V411 F412S366-A408 VanDerWaalsContact O-CB 3.27Å; S366-A408 WeakPolarHBondContact O-CB 3.46Å; L369-A408 HydrophobicContact CB-CB 4.2Å; I370-A408 HydrophobicContact CD1-CB 3.73Å; I370-A408 HydrophobicContact CG1-CB 3.79Å; G404-A408 WeakPolarHBondContact O-CB 3.27Å; G404-A408 PolarHBondContact O-N 2.63Å; M405-A408 PolarHBondContact O-N 2.85Å; A408-V411 PolarHBondContact O-N 3.04Å; A408-F412 WeakPolarHBondContact O-CB 3.27Å; A408-F412 PolarHBondContact O-N 3.34Å
409A89.8Confident86.1Confident51 Ų5171.2 Ų71.242%0.42139%0.385SS..Hα-helixtrans-63-42.7175.500000111.8M405 F406 L407 F412 C413M405-A409 WeakPolarHBondContact O-CB 3.25Å; M405-A409 PolarHBondContact O-N 3.27Å; F406-A409 PolarHBondContact O-N 2.88Å; L407-A409 VanDerWaalsContact C-N 3.34Å; L407-A409 PolarHBondContact O-N 3.47Å; A409-F412 PolarHBondContact O-N 3.42Å; A409-C413 WeakPolarHBondContact O-CB 3.33Å; A409-C413 PolarHBondContact O-N 3.07Å; A409-C413 PolarHBondContact O-SG 3.43Å
410I88.4Confident85.7Confident72 Ų7269.4 Ų69.437%0.36938%0.378SS..Hα-helixtrans-61.9-51.3176.4-67.7167.9000110.7F406 L407 F412 C413 T414F406-I410 HydrophobicContact CD1-CD1 3.89Å; F406-I410 HydrophobicContact CE1-CD1 3.42Å; F406-I410 VanDerWaalsContact CE1-CD1 3.42Å; F406-I410 HydrophobicContact CE2-CD1 4.3Å; F406-I410 HydrophobicContact CZ-CD1 3.66Å; F406-I410 WeakPolarHBondContact O-CG1 3.49Å; F406-I410 PolarHBondContact O-N 3.41Å; F406-I410 VanDerWaalsContact O-N 3.08Å; L407-I410 PolarHBondContact O-N 3.49Å; I410-F412 VanDerWaalsContact C-N 3.31Å; I410-F412 PolarHBondContact O-N 2.83Å; I410-C413 PolarHBondContact O-N 2.96Å; I410-T414 HydrophobicContact CG2-CG2 4.17Å; I410-T414 WeakPolarHBondContact O-CB 3.21Å; I410-T414 VanDerWaalsContact O-CG2 3.24Å; I410-T414 WeakPolarHBondContact O-CG2 3.41Å; I410-T414 PolarHBondContact O-N 2.9Å; I410-T414 PolarHBondContact O-OG1 2.93Å
411V86.4Confident85.6Confident15 Ų1568.6 Ų68.69%0.09138%0.375CS..Hα-helixtrans-64.4-40.2-179.2172.20000110.5L369 L407 A408 C413 T414 T415 Y423 F427L369-V411 HydrophobicContact CD1-CB 3.8Å; L369-V411 HydrophobicContact CD1-CG1 4.24Å; L369-V411 HydrophobicContact CD1-CG2 3.61Å; L407-V411 WeakPolarHBondContact O-CG2 3.25Å; L407-V411 PolarHBondContact O-N 2.66Å; A408-V411 PolarHBondContact O-N 3.04Å; V411-C413 PolarHBondContact O-N 3.37Å; V411-T414 PolarHBondContact O-N 3.34Å; V411-T415 HydrophobicContact CG1-CG2 4.08Å; V411-T415 WeakPolarHBondContact O-CB 3.17Å; V411-T415 WeakPolarHBondContact O-CG2 3.2Å; V411-T415 PolarHBondContact O-N 3.14Å; V411-T415 VanDerWaalsContact O-N 3.12Å; V411-T415 PolarHBondContact O-OG1 3.17Å; V411-Y423 HydrophobicContact CG2-CE2 4.27Å; V411-F427 HydrophobicContact CG1-CZ 4.49Å
412F86.4Confident85.2Confident81 Ų8176.2 Ų76.236%0.35541%0.406SS..Hα-helixtrans-62.1-45.6175.5-165.1-96.2000110.9R362 A408 A409 I410R362-F412 HydrophobicContact CG-CD2 4.23Å; R362-F412 HydrophobicContact CG-CE2 4.48Å; R362-F412 PolarHBondContact NE-O 2.8Å; R362-F412 PolarHBondContact NH2-O 2.89Å; A408-F412 WeakPolarHBondContact O-CB 3.27Å; A408-F412 PolarHBondContact O-N 3.34Å; A409-F412 PolarHBondContact O-N 3.42Å; I410-F412 VanDerWaalsContact C-N 3.31Å; I410-F412 PolarHBondContact O-N 2.83Å
413C85.9Confident84.8Confident107 Ų10775.4 Ų75.472%0.72340%0.397SS*.Hα-helixtrans-72.9-28.2-179.4-69.60000114.4A409 I410 V411A409-C413 WeakPolarHBondContact O-CB 3.33Å; A409-C413 PolarHBondContact O-N 3.07Å; A409-C413 PolarHBondContact O-SG 3.43Å; I410-C413 PolarHBondContact O-N 2.96Å; V411-C413 PolarHBondContact O-N 3.37Å
414T84.2Confident84.5Confident96 Ų9670.6 Ų70.659%0.58937%0.372SS*.Hα-helixtrans-94-14.9-173.855.90000114.5I410 V411I410-T414 HydrophobicContact CG2-CG2 4.17Å; I410-T414 WeakPolarHBondContact O-CB 3.21Å; I410-T414 VanDerWaalsContact O-CG2 3.24Å; I410-T414 WeakPolarHBondContact O-CG2 3.41Å; I410-T414 PolarHBondContact O-N 2.9Å; I410-T414 PolarHBondContact O-OG1 2.93Å; V411-T414 PolarHBondContact O-N 3.34Å
415T85.1Confident84.2Confident12 Ų1272.1 Ų72.17%0.07438%0.381CS..  trans-112.3155.5-174.363.90000113.6W360 R362 V411 P421 Y423W360-T415 HydrophobicContact CH2-CG2 4.39Å; W360-T415 HydrophobicContact CZ2-CG2 4.24Å; R362-T415 WeakPolarHBondContact CD-O 3.31Å; R362-T415 PolarHBondContact NE-O 2.9Å; R362-T415 VanDerWaalsContact NE-O 3.11Å; V411-T415 HydrophobicContact CG1-CG2 4.08Å; V411-T415 WeakPolarHBondContact O-CB 3.17Å; V411-T415 WeakPolarHBondContact O-CG2 3.2Å; V411-T415 PolarHBondContact O-N 3.14Å; V411-T415 VanDerWaalsContact O-N 3.12Å; V411-T415 PolarHBondContact O-OG1 3.17Å; T415-P421 HydrophobicContact CG2-CB 4.14Å; T415-P421 HydrophobicContact CG2-CG 4.19Å; T415-Y423 WeakPolarHBondContact CG2-OH 3.35Å
416T80.9Confident84Confident62 Ų6273.1 Ų73.138%0.3839%0.388SS..  trans-109.7163.1175.446.90000111.3W360 H419W360-T416 PolarHBondContact NE1-O 2.8Å; T416-H419 PolarHBondContact OG1-CE1 2.94Å; T416-H419 PolarHBondContact OG1-ND1 3.17Å; T416-H419 PolarHBondContact OG1-NE2 3.21Å
417N75Confident83.8Confident48 Ų4867.2 Ų67.226%0.25736%0.362SS..SBendtrans-76.4-24.4-179.1-68.2-29.8000113.1R362R362-N417 WeakPolarHBondContact CB-OD1 3.41Å; R362-N417 WeakPolarHBondContact CD-OD1 3.25Å
418D70.1Confident83.7Confident144 Ų14463.4 Ų63.477%0.7734%0.342SS*.SBendtrans-86.7-17.1-164.2-49.8-58.1000114.6
419H76.7Confident83.6Confident114 Ų11466.7 Ų66.753%0.52836%0.355SS..SBendtrans-145.5141.7179.260.4-87.6000112.1W360 T416W360-H419 PolarHBondContact NE1-O 3.38Å; T416-H419 PolarHBondContact OG1-CE1 2.94Å; T416-H419 PolarHBondContact OG1-ND1 3.17Å; T416-H419 PolarHBondContact OG1-NE2 3.21Å
420P80.7Confident83.6Confident46 Ų4666.1 Ų66.130%0.29934%0.344SS..  trans-67.6140.3175.526.1-32.5000111.2W360 H424W360-P420 HydrophobicContact CB-CB 4.11Å; W360-P420 HydrophobicContact CD2-CB 4.41Å; W360-P420 HydrophobicContact CG-CB 4.18Å; P420-H424 HydrophobicContact CB-CB 4.05Å
421P83.7Confident83.7Confident20 Ų2062.7 Ų62.713%0.1333%0.327CS..  trans-69.4160.1174.929.3-34.8000111.6W360 T415 Y423 H424W360-P421 HydrophobicContact CE3-CG 4.41Å; W360-P421 VanDerWaalsContact CH2-CD 3.43Å; W360-P421 HydrophobicContact CH2-CG 3.59Å; W360-P421 HydrophobicContact CZ2-CG 4.1Å; W360-P421 VanDerWaalsContact CZ3-CD 3.46Å; W360-P421 HydrophobicContact CZ3-CG 3.75Å; T415-P421 HydrophobicContact CG2-CB 4.14Å; T415-P421 HydrophobicContact CG2-CG 4.19Å; P421-Y423 HydrophobicContact CB-CD1 4.06Å; P421-Y423 HydrophobicContact CB-CD2 4.25Å; P421-Y423 HydrophobicContact CB-CE1 3.71Å; P421-Y423 HydrophobicContact CB-CE2 3.9Å; P421-Y423 HydrophobicContact CB-CG 4.32Å; P421-Y423 HydrophobicContact CG-CD2 4.01Å; P421-Y423 HydrophobicContact CG-CE1 4.38Å; P421-Y423 HydrophobicContact CG-CE2 3.63Å; P421-Y423 PolarHBondContact O-N 3.42Å; P421-Y423 VanDerWaalsContact O-N 3.14Å; P421-H424 HydrophobicContact CG-CB 4.36Å; P421-H424 WeakPolarHBondContact O-CB 3.42Å; P421-H424 PolarHBondContact O-N 3.46Å
422K82.6Confident83.7Confident209 Ų20962.3 Ų62.391%0.90932%0.324SS*.THydrogen-bonded Turntrans-57.6-31.2179-67.4-176.2179.9179.30113.5H424 P425K422-H424 VanDerWaalsContact C-N 3.3Å; K422-P425 WeakPolarHBondContact O-CD 3.13Å
423Y83.5Confident83.7Confident83 Ų8361 Ų6133%0.32532%0.323SS..THydrogen-bonded Turntrans-87.18.2178.456.1-101.1000113.7V411 T415 P421 P425 L426 F427V411-Y423 HydrophobicContact CG2-CE2 4.27Å; T415-Y423 WeakPolarHBondContact CG2-OH 3.35Å; P421-Y423 HydrophobicContact CB-CD1 4.06Å; P421-Y423 HydrophobicContact CB-CD2 4.25Å; P421-Y423 HydrophobicContact CB-CE1 3.71Å; P421-Y423 HydrophobicContact CB-CE2 3.9Å; P421-Y423 HydrophobicContact CB-CG 4.32Å; P421-Y423 HydrophobicContact CG-CD2 4.01Å; P421-Y423 HydrophobicContact CG-CE1 4.38Å; P421-Y423 HydrophobicContact CG-CE2 3.63Å; P421-Y423 PolarHBondContact O-N 3.42Å; P421-Y423 VanDerWaalsContact O-N 3.14Å; Y423-P425 VanDerWaalsContact C-N 3.25Å; Y423-L426 VanDerWaalsContact O-CB 3.29Å; Y423-L426 WeakPolarHBondContact O-CB 3.44Å; Y423-L426 PolarHBondContact O-N 3.42Å; Y423-F427 HydrophobicContact CD2-CE2 4.12Å; Y423-F427 HydrophobicContact CE2-CE2 4.08Å
424H83.1Confident83.8Confident1 Ų155.9 Ų55.91%0.00529%0.288CS..Hα-helixtrans-50.3-36.6175.3-170.751.6000114.2R358 W360 P420 P421 K422 L426 F427R358-H424 PolarHBondContact O-NE2 2.84Å; W360-H424 AromaticContact CE3-CE1 3.61Å; W360-H424 AromaticContact CE3-ND1 3.32Å; W360-H424 VanDerWaalsContact CE3-ND1 3.32Å; W360-H424 AromaticContact CZ3-ND1 3.67Å; P420-H424 HydrophobicContact CB-CB 4.05Å; P421-H424 HydrophobicContact CG-CB 4.36Å; P421-H424 WeakPolarHBondContact O-CB 3.42Å; P421-H424 PolarHBondContact O-N 3.46Å; K422-H424 VanDerWaalsContact C-N 3.3Å; H424-L426 PolarHBondContact O-N 2.99Å; H424-L426 VanDerWaalsContact O-N 3.13Å; H424-F427 WeakPolarHBondContact O-CB 3.43Å; H424-F427 PolarHBondContact O-N 3.41Å
425P83.8Confident84Confident36 Ų3651.3 Ų51.323%0.23426%0.26CS..Hα-helixtrans-59.7-23174.9-25.235.8000114.8T130 K422 Y423 F427 A428 F429T130-P425 HydrophobicContact CG2-CB 3.89Å; T130-P425 HydrophobicContact CG2-CG 4.27Å; K422-P425 WeakPolarHBondContact O-CD 3.13Å; Y423-P425 VanDerWaalsContact C-N 3.25Å; P425-F427 VanDerWaalsContact C-N 3.25Å; P425-F427 PolarHBondContact O-N 2.93Å; P425-A428 VanDerWaalsContact O-CB 3.22Å; P425-A428 WeakPolarHBondContact O-CB 3.27Å; P425-A428 PolarHBondContact O-N 3.08Å; P425-A428 VanDerWaalsContact O-N 3.08Å; P425-F429 PolarHBondContact O-N 3Å
426L86.8Confident84Confident120 Ų12051.2 Ų51.263%0.62826%0.26SS*.Hα-helixtrans-65.5-29.8174.5-63.1179.7000112.1Y423 H424 A428 F429 L430Y423-L426 VanDerWaalsContact O-CB 3.29Å; Y423-L426 WeakPolarHBondContact O-CB 3.44Å; Y423-L426 PolarHBondContact O-N 3.42Å; H424-L426 PolarHBondContact O-N 2.99Å; H424-L426 VanDerWaalsContact O-N 3.13Å; L426-A428 VanDerWaalsContact C-N 3.26Å; L426-A428 PolarHBondContact O-N 3.39Å; L426-F429 PolarHBondContact O-N 3.06Å; L426-L430 PolarHBondContact O-N 2.94Å
427F88Confident84.2Confident7 Ų749.2 Ų49.23%0.03125%0.248CC..Hα-helixtrans-67.5-28.5172.9-72.8-87.7000112.1P349 V351 W360 N365 L369 V411 Y423 H424 P425 G431P349-F427 HydrophobicContact CB-CB 4.43Å; P349-F427 HydrophobicContact CB-CD1 4.28Å; V351-F427 HydrophobicContact CG2-CB 3.83Å; W360-F427 HydrophobicContact CZ3-CE2 4.25Å; N365-F427 HydrophobicContact CB-CD1 4.33Å; N365-F427 HydrophobicContact CB-CE1 3.98Å; N365-F427 HydrophobicContact CB-CZ 4.31Å; N365-F427 WeakPolarHBondContact O-CE1 3.36Å; L369-F427 HydrophobicContact CD1-CE1 4.34Å; L369-F427 HydrophobicContact CD1-CZ 4.1Å; L369-F427 HydrophobicContact CD2-CE1 3.75Å; L369-F427 HydrophobicContact CD2-CZ 4.01Å; L369-F427 HydrophobicContact CG-CE1 3.84Å; L369-F427 HydrophobicContact CG-CZ 4.1Å; V411-F427 HydrophobicContact CG1-CZ 4.49Å; Y423-F427 HydrophobicContact CD2-CE2 4.12Å; Y423-F427 HydrophobicContact CE2-CE2 4.08Å; H424-F427 WeakPolarHBondContact O-CB 3.43Å; H424-F427 PolarHBondContact O-N 3.41Å; P425-F427 VanDerWaalsContact C-N 3.25Å; P425-F427 PolarHBondContact O-N 2.93Å; F427-G431 PolarHBondContact O-N 3.44Å
428A87.3Confident84.7Confident0 Ų048.2 Ų48.20%024%0.243CC..Hα-helixtrans-65.8-43.2172.600000110.6N123 A126 I127 V351 P425 L426 G431 F432N123-A428 WeakPolarHBondContact CB-O 3.39Å; A126-A428 HydrophobicContact CB-CB 3.7Å; I127-A428 HydrophobicContact CG1-CB 4.17Å; V351-A428 HydrophobicContact CB-CB 3.74Å; V351-A428 HydrophobicContact CG1-CB 4.25Å; V351-A428 HydrophobicContact CG2-CB 3.92Å; P425-A428 VanDerWaalsContact O-CB 3.22Å; P425-A428 WeakPolarHBondContact O-CB 3.27Å; P425-A428 PolarHBondContact O-N 3.08Å; P425-A428 VanDerWaalsContact O-N 3.08Å; L426-A428 VanDerWaalsContact C-N 3.26Å; L426-A428 PolarHBondContact O-N 3.39Å; A428-G431 PolarHBondContact O-N 3.13Å; A428-F432 WeakPolarHBondContact O-CB 3.37Å; A428-F432 PolarHBondContact O-N 3.2Å
429F87.9Confident85.5Confident76 Ų7641.7 Ų41.733%0.33321%0.208SC..Hα-helixtrans-64.2-46.5175.1-173.5-98.2000112.1L13 I127 P425 L426 G431 F432 V433L13-F429 HydrophobicContact CD1-CZ 4.2Å; I127-F429 HydrophobicContact CD1-CD2 4.34Å; P425-F429 PolarHBondContact O-N 3Å; L426-F429 PolarHBondContact O-N 3.06Å; F429-G431 VanDerWaalsContact C-N 3.32Å; F429-G431 PolarHBondContact O-N 3.33Å; F429-F432 WeakPolarHBondContact O-CB 3.07Å; F429-F432 PolarHBondContact O-N 3.37Å; F429-V433 HydrophobicContact CD1-CG2 4.29Å; F429-V433 HydrophobicContact CE1-CG2 3.83Å; F429-V433 HydrophobicContact CZ-CG2 3.95Å; F429-V433 WeakPolarHBondContact O-CG2 3.48Å; F429-V433 PolarHBondContact O-N 3.02Å
430L89.5Confident85.7Confident39 Ų3937.5 Ų37.520%0.20419%0.191CC..Hα-helixtrans-58.1-45.8175-178.761000111.2P349 L369 A372 L426 F432 V433 V434P349-L430 HydrophobicContact CG-CB 4.26Å; P349-L430 HydrophobicContact CG-CD2 4.11Å; P349-L430 HydrophobicContact CG-CG 3.99Å; L369-L430 HydrophobicContact CD2-CD2 4.35Å; A372-L430 HydrophobicContact CB-CD1 4.43Å; A372-L430 HydrophobicContact CB-CD2 4.3Å; A372-L430 HydrophobicContact CB-CG 4.29Å; L426-L430 PolarHBondContact O-N 2.94Å; L430-F432 VanDerWaalsContact C-N 3.34Å; L430-F432 PolarHBondContact O-N 2.86Å; L430-V433 PolarHBondContact O-N 2.92Å; L430-V434 HydrophobicContact CD1-CG2 3.97Å; L430-V434 HydrophobicContact CG-CG2 4.27Å; L430-V434 WeakPolarHBondContact O-CB 3.35Å; L430-V434 WeakPolarHBondContact O-CG2 3.39Å; L430-V434 PolarHBondContact O-N 3.25Å
431G89.1Confident85.8Confident0 Ų035.7 Ų35.70%018%0.18CC..Hα-helixtrans-65.3-37.2179.300000112.9N123 P349 F427 A428 F429 S435N123-G431 VanDerWaalsContact ND2-CA 3.34Å; N123-G431 WeakPolarHBondContact ND2-CA 3.36Å; P349-G431 VanDerWaalsContact O-CA 3.31Å; P349-G431 WeakPolarHBondContact O-CA 3.4Å; F427-G431 PolarHBondContact O-N 3.44Å; A428-G431 PolarHBondContact O-N 3.13Å; F429-G431 VanDerWaalsContact C-N 3.32Å; F429-G431 PolarHBondContact O-N 3.33Å; G431-S435 VanDerWaalsContact O-CB 3.29Å; G431-S435 WeakPolarHBondContact O-CB 3.45Å; G431-S435 PolarHBondContact O-N 3.48Å; G431-S435 PolarHBondContact O-OG 3.49Å
432F87.3Confident86Confident8 Ų835.1 Ų35.14%0.03518%0.177CC..Hα-helixtrans-61.4-50.7172.4173.1-97000111.7F120 N123 L124 I127 F142 A428 F429 L430 V434 S435 A436F120-F432 AromaticContact CD2-CD2 3.95Å; F120-F432 HydrophobicContact CD2-CD2 3.95Å; F120-F432 AromaticContact CD2-CE2 3.97Å; F120-F432 HydrophobicContact CD2-CE2 3.97Å; F120-F432 AromaticContact CE2-CD2 3.68Å; F120-F432 HydrophobicContact CE2-CD2 3.68Å; F120-F432 AromaticContact CE2-CE2 3.22Å; F120-F432 HydrophobicContact CE2-CE2 3.22Å; F120-F432 AromaticContact CE2-CZ 3.92Å; F120-F432 HydrophobicContact CE2-CZ 3.92Å; F120-F432 HydrophobicContact CZ-CD2 4.4Å; F120-F432 AromaticContact CZ-CE2 3.63Å; F120-F432 HydrophobicContact CZ-CE2 3.63Å; F120-F432 HydrophobicContact CZ-CZ 4.32Å; N123-F432 HydrophobicContact CB-CB 4.19Å; L124-F432 HydrophobicContact CB-CD2 4.17Å; L124-F432 HydrophobicContact CB-CE2 4.44Å; L124-F432 HydrophobicContact CD1-CD2 4.2Å; L124-F432 HydrophobicContact CD1-CE2 3.87Å; I127-F432 HydrophobicContact CD1-CB 3.48Å; I127-F432 VanDerWaalsContact CD1-CB 3.48Å; I127-F432 HydrophobicContact CD1-CD1 4.23Å; I127-F432 HydrophobicContact CD1-CD2 4.27Å; I127-F432 HydrophobicContact CD1-CG 3.73Å; F142-F432 HydrophobicContact CB-CZ 4.3Å; F142-F432 VanDerWaalsContact O-CZ 3.28Å; F142-F432 WeakPolarHBondContact O-CZ 3.34Å; A428-F432 WeakPolarHBondContact O-CB 3.37Å; A428-F432 PolarHBondContact O-N 3.2Å; F429-F432 WeakPolarHBondContact O-CB 3.07Å; F429-F432 PolarHBondContact O-N 3.37Å; L430-F432 VanDerWaalsContact C-N 3.34Å; L430-F432 PolarHBondContact O-N 2.86Å; F432-V434 PolarHBondContact O-N 3.5Å; F432-S435 PolarHBondContact O-N 2.55Å; F432-S435 PolarHBondContact O-OG 2.82Å; F432-A436 WeakPolarHBondContact O-CB 3.31Å; F432-A436 PolarHBondContact O-N 3.4Å
433V86.3Confident86Confident53 Ų5325.5 Ų25.532%0.32114%0.137SC..Hα-helixtrans-61.8-46.8179.1172.80000111.4F429 L430 S435 A436 V437F429-V433 HydrophobicContact CD1-CG2 4.29Å; F429-V433 HydrophobicContact CE1-CG2 3.83Å; F429-V433 HydrophobicContact CZ-CG2 3.95Å; F429-V433 WeakPolarHBondContact O-CG2 3.48Å; F429-V433 PolarHBondContact O-N 3.02Å; L430-V433 PolarHBondContact O-N 2.92Å; V433-S435 PolarHBondContact O-N 3.03Å; V433-A436 PolarHBondContact O-N 3.18Å; V433-V437 WeakPolarHBondContact O-CG2 3.29Å; V433-V437 PolarHBondContact O-N 2.8Å
434V88.9Confident86Confident0 Ų023.1 Ų23.10%013%0.132CC..Hα-helixtrans-66.5-40.8-177178.90000110.9V348 A372 L375 C376 L430 F432 L438V348-V434 HydrophobicContact CG2-CG1 3.99Å; A372-V434 HydrophobicContact CB-CB 4.43Å; A372-V434 HydrophobicContact CB-CG1 4.22Å; A372-V434 HydrophobicContact CB-CG2 3.55Å; L375-V434 HydrophobicContact CD2-CG1 3.87Å; C376-V434 VanDerWaalsContact SG-CG2 3.58Å; L430-V434 HydrophobicContact CD1-CG2 3.97Å; L430-V434 HydrophobicContact CG-CG2 4.27Å; L430-V434 WeakPolarHBondContact O-CB 3.35Å; L430-V434 WeakPolarHBondContact O-CG2 3.39Å; L430-V434 PolarHBondContact O-N 3.25Å; F432-V434 PolarHBondContact O-N 3.5Å; V434-L438 WeakPolarHBondContact O-CB 3.37Å; V434-L438 PolarHBondContact O-N 3.44Å
435S88.6Confident86.1Confident0 Ų023.5 Ų23.50%013%0.134CC..Hα-helixtrans-67.8-36.3175.153.60000112.8F120 G431 F432 V433 L438 I439F120-S435 WeakPolarHBondContact CA-OG 3.42Å; F120-S435 WeakPolarHBondContact CD2-OG 3.34Å; G431-S435 VanDerWaalsContact O-CB 3.29Å; G431-S435 WeakPolarHBondContact O-CB 3.45Å; G431-S435 PolarHBondContact O-N 3.48Å; G431-S435 PolarHBondContact O-OG 3.49Å; F432-S435 PolarHBondContact O-N 2.55Å; F432-S435 PolarHBondContact O-OG 2.82Å; V433-S435 PolarHBondContact O-N 3.03Å; S435-L438 PolarHBondContact O-N 3.07Å; S435-I439 WeakPolarHBondContact O-CB 3.26Å; S435-I439 VanDerWaalsContact O-CG1 3.22Å; S435-I439 WeakPolarHBondContact O-CG1 3.42Å; S435-I439 PolarHBondContact O-N 3.25Å
436A84.3Confident86.3Confident9 Ų921.8 Ų21.87%0.07412%0.123CC..Hα-helixtrans-62.1-48.7173.300000111.9F120 F432 V433 L438 I439 S440F120-A436 HydrophobicContact CD2-CB 4.5Å; F120-A436 HydrophobicContact CE2-CB 4.08Å; F432-A436 WeakPolarHBondContact O-CB 3.31Å; F432-A436 PolarHBondContact O-N 3.4Å; V433-A436 PolarHBondContact O-N 3.18Å; A436-L438 VanDerWaalsContact C-N 3.29Å; A436-L438 PolarHBondContact O-N 3.47Å; A436-I439 PolarHBondContact O-N 2.86Å; A436-S440 WeakPolarHBondContact O-CB 3.3Å; A436-S440 PolarHBondContact O-N 3Å
437V84.7Confident86.2Confident21 Ų2117 Ų1713%0.12710%0.098CC..Hα-helixtrans-59.9-40.3176.4171.50000111.3V379 F380 V433 S440 A441V379-V437 HydrophobicContact CG1-CG1 4.31Å; F380-V437 HydrophobicContact CB-CG1 4.4Å; F380-V437 HydrophobicContact CD2-CG1 4.25Å; F380-V437 HydrophobicContact CD2-CG2 4.17Å; V433-V437 WeakPolarHBondContact O-CG2 3.29Å; V433-V437 PolarHBondContact O-N 2.8Å; V437-S440 WeakPolarHBondContact O-CB 3.38Å; V437-S440 PolarHBondContact O-N 2.95Å; V437-A441 WeakPolarHBondContact O-CB 3.32Å; V437-A441 PolarHBondContact O-N 2.68Å
438L86.8Confident86.1Confident27 Ų2717.3 Ų17.314%0.14110%0.101CC..Hα-helixtrans-69.5-41.8178.2-177.672.1000112.9A115 L344 V434 S435 A436 S440 A441 A442A115-L438 HydrophobicContact CB-CD2 4.24Å; L344-L438 HydrophobicContact CD2-CD2 3.15Å; L344-L438 HydrophobicContact CD2-CG 4.46Å; V434-L438 WeakPolarHBondContact O-CB 3.37Å; V434-L438 PolarHBondContact O-N 3.44Å; S435-L438 PolarHBondContact O-N 3.07Å; A436-L438 VanDerWaalsContact C-N 3.29Å; A436-L438 PolarHBondContact O-N 3.47Å; L438-S440 VanDerWaalsContact C-N 3.27Å; L438-S440 PolarHBondContact O-N 3.08Å; L438-A441 PolarHBondContact O-N 3.16Å; L438-A442 WeakPolarHBondContact O-CB 3.29Å; L438-A442 PolarHBondContact O-N 2.91Å
439I85.6Confident86.1Confident7 Ų717.4 Ų17.44%0.03610%0.102CC..Hα-helixtrans-58.9-45.3174.3-73.8166.5000109.2L112 A115 A116 F120 S435 A436 A442 A443L112-I439 HydrophobicContact CD2-CB 4.4Å; L112-I439 HydrophobicContact CD2-CG2 3.89Å; L112-I439 VanDerWaalsContact CD2-O 3.25Å; L112-I439 WeakPolarHBondContact CD2-O 3.35Å; A115-I439 HydrophobicContact CB-CD1 4.44Å; A115-I439 HydrophobicContact CB-CG1 3.81Å; A116-I439 HydrophobicContact CB-CD1 4.3Å; F120-I439 HydrophobicContact CB-CD1 3.93Å; F120-I439 HydrophobicContact CD1-CD1 4.35Å; F120-I439 HydrophobicContact CD2-CD1 4.13Å; F120-I439 HydrophobicContact CG-CD1 3.92Å; S435-I439 WeakPolarHBondContact O-CB 3.26Å; S435-I439 VanDerWaalsContact O-CG1 3.22Å; S435-I439 WeakPolarHBondContact O-CG1 3.42Å; S435-I439 PolarHBondContact O-N 3.25Å; A436-I439 PolarHBondContact O-N 2.86Å; I439-A442 PolarHBondContact O-N 3.47Å; I439-A443 WeakPolarHBondContact O-CB 3.28Å; I439-A443 PolarHBondContact O-N 2.89Å
440S80.5Confident86Confident25 Ų2514.1 Ų14.118%0.1759%0.088CC..Hα-helixtrans-59.8-51.1176.3174.60000112.7P150 A436 V437 L438 A442 A443 S444P150-S440 WeakPolarHBondContact CB-OG 3.46Å; P150-S440 VanDerWaalsContact CG-CB 3.42Å; P150-S440 WeakPolarHBondContact CG-OG 3.35Å; A436-S440 WeakPolarHBondContact O-CB 3.3Å; A436-S440 PolarHBondContact O-N 3Å; V437-S440 WeakPolarHBondContact O-CB 3.38Å; V437-S440 PolarHBondContact O-N 2.95Å; L438-S440 VanDerWaalsContact C-N 3.27Å; L438-S440 PolarHBondContact O-N 3.08Å; S440-A442 VanDerWaalsContact C-N 3.32Å; S440-A442 PolarHBondContact O-N 2.95Å; S440-A443 CarbonylContact O-C 3.37Å; S440-A443 WeakPolarHBondContact O-CA 3.32Å; S440-A443 WeakPolarHBondContact O-CB 3.31Å; S440-A443 PolarHBondContact O-N 3.44Å; S440-S444 PolarHBondContact O-N 2.94Å; S440-S444 PolarHBondContact O-OG 3.13Å
441A83.9Confident85.7Confident9 Ų912.9 Ų12.97%0.0748%0.081CC..Hα-helixtrans-61-41.517900000112.3F78 V379 V437 L438 A443 S444 E445F78-A441 HydrophobicContact CE2-CB 4.2Å; V379-A441 HydrophobicContact CG1-CB 3.21Å; V437-A441 WeakPolarHBondContact O-CB 3.32Å; V437-A441 PolarHBondContact O-N 2.68Å; L438-A441 PolarHBondContact O-N 3.16Å; A441-A443 VanDerWaalsContact C-N 3.31Å; A441-A443 PolarHBondContact O-N 3.36Å; A441-S444 PolarHBondContact O-N 2.93Å; A441-E445 WeakPolarHBondContact O-CG 3.39Å; A441-E445 PolarHBondContact O-N 2.95Å
442A87Confident85.5Confident7 Ų712.9 Ų12.96%0.0588%0.081CC..Hα-helixtrans-64.6-35.4174.600000112.1L108 I111 L112 L438 I439 S440 V446L108-A442 HydrophobicContact CD2-CB 4.45Å; I111-A442 HydrophobicContact CG2-CB 4.28Å; L112-A442 HydrophobicContact CD2-CB 3.76Å; L112-A442 HydrophobicContact CG-CB 3.95Å; L438-A442 WeakPolarHBondContact O-CB 3.29Å; L438-A442 PolarHBondContact O-N 2.91Å; I439-A442 PolarHBondContact O-N 3.47Å; S440-A442 VanDerWaalsContact C-N 3.32Å; S440-A442 PolarHBondContact O-N 2.95Å; A442-V446 WeakPolarHBondContact O-CG2 3.46Å; A442-V446 PolarHBondContact O-N 2.97Å; A442-V446 VanDerWaalsContact O-N 3.08Å
443A83.9Confident85.5Confident8 Ų814.1 Ų14.17%0.0669%0.088CC..Hα-helixtrans-67.2-42173.900000111.8L112 I439 S440 A441 E445 V446 V447 I475L112-A443 HydrophobicContact CD2-CB 4.43Å; I439-A443 WeakPolarHBondContact O-CB 3.28Å; I439-A443 PolarHBondContact O-N 2.89Å; S440-A443 CarbonylContact O-C 3.37Å; S440-A443 WeakPolarHBondContact O-CA 3.32Å; S440-A443 WeakPolarHBondContact O-CB 3.31Å; S440-A443 PolarHBondContact O-N 3.44Å; A441-A443 VanDerWaalsContact C-N 3.31Å; A441-A443 PolarHBondContact O-N 3.36Å; A443-E445 VanDerWaalsContact C-N 3.31Å; A443-E445 PolarHBondContact O-N 3.17Å; A443-V446 WeakPolarHBondContact O-CA 3.25Å; A443-V446 WeakPolarHBondContact O-CB 3.4Å; A443-V446 PolarHBondContact O-N 3.4Å; A443-V446 VanDerWaalsContact O-N 3.08Å; A443-V447 VanDerWaalsContact O-CG2 3.26Å; A443-V447 WeakPolarHBondContact O-CG2 3.45Å; A443-V447 PolarHBondContact O-N 3.44Å; A443-I475 HydrophobicContact CB-CG2 4.08Å
444S82.2Confident85.3Confident32 Ų3211.6 Ų11.622%0.2247%0.072CC..Hα-helixtrans-59.8-39.4174.3-58.70000112.4S440 A441 V447 S448S440-S444 PolarHBondContact O-N 2.94Å; S440-S444 PolarHBondContact O-OG 3.13Å; A441-S444 PolarHBondContact O-N 2.93Å; S444-V447 PolarHBondContact O-N 3.4Å; S444-S448 WeakPolarHBondContact O-CB 3.23Å; S444-S448 PolarHBondContact O-N 2.85Å; S444-S448 PolarHBondContact O-OG 3.11Å
445E86.8Confident85Confident10 Ų1011.7 Ų11.75%0.0477%0.073CC..Hα-helixtrans-65.5-40.1173.1-68.7-56.6108.800112.3G77 F78 Y81 L108 A441 A443 S448 L449G77-E445 VanDerWaalsContact CA-OE1 3.25Å; G77-E445 WeakPolarHBondContact CA-OE1 3.31Å; F78-E445 HydrophobicContact CD2-CG 4.24Å; F78-E445 WeakPolarHBondContact CD2-OE1 3.05Å; F78-E445 PolarHBondContact N-OE1 3.17Å; Y81-E445 VanDerWaalsContact CE2-OE2 3.29Å; Y81-E445 WeakPolarHBondContact CE2-OE2 3.45Å; Y81-E445 VanDerWaalsContact CZ-OE2 3.27Å; Y81-E445 PolarHBondContact OH-OE2 3.31Å; L108-E445 HydrophobicContact CD1-CB 3.66Å; L108-E445 HydrophobicContact CD2-CB 4Å; A441-E445 WeakPolarHBondContact O-CG 3.39Å; A441-E445 PolarHBondContact O-N 2.95Å; A443-E445 VanDerWaalsContact C-N 3.31Å; A443-E445 PolarHBondContact O-N 3.17Å; E445-S448 PolarHBondContact O-N 3.42Å; E445-L449 PolarHBondContact O-N 2.89Å
446V88Confident84.9Confident0 Ų013.1 Ų13.10%08%0.081CC..Hα-helixtrans-60.5-47.4173.8165.90000110.5L105 L108 F109 L112 A442 A443 S448 L449 L450 I475L105-V446 HydrophobicContact CD1-CB 4.28Å; L105-V446 HydrophobicContact CD1-CG1 3.96Å; L105-V446 HydrophobicContact CD1-CG2 4.1Å; L108-V446 HydrophobicContact CB-CG2 3.73Å; L108-V446 HydrophobicContact CD1-CG2 4.14Å; F109-V446 HydrophobicContact CD1-CG2 4.31Å; F109-V446 HydrophobicContact CE1-CG1 3.72Å; F109-V446 HydrophobicContact CE1-CG2 4.01Å; F109-V446 HydrophobicContact CZ-CG1 3.89Å; L112-V446 HydrophobicContact CD1-CG2 4.03Å; A442-V446 WeakPolarHBondContact O-CG2 3.46Å; A442-V446 PolarHBondContact O-N 2.97Å; A442-V446 VanDerWaalsContact O-N 3.08Å; A443-V446 WeakPolarHBondContact O-CA 3.25Å; A443-V446 WeakPolarHBondContact O-CB 3.4Å; A443-V446 PolarHBondContact O-N 3.4Å; A443-V446 VanDerWaalsContact O-N 3.08Å; V446-S448 VanDerWaalsContact C-N 3.31Å; V446-S448 PolarHBondContact O-N 2.87Å; V446-L449 PolarHBondContact O-N 3.34Å; V446-L450 HydrophobicContact CG1-CD1 3.69Å; V446-L450 HydrophobicContact CG1-CG 4.16Å; V446-L450 VanDerWaalsContact O-CB 3.26Å; V446-L450 WeakPolarHBondContact O-CB 3.42Å; V446-L450 VanDerWaalsContact O-CG 3.23Å; V446-L450 WeakPolarHBondContact O-CG 3.19Å; V446-L450 PolarHBondContact O-N 2.92Å; V446-I475 HydrophobicContact CB-CG2 4.4Å; V446-I475 HydrophobicContact CG1-CG2 4.04Å
447V83.8Confident84.8Confident18 Ų1818.1 Ų18.111%0.10911%0.107CC..Hα-helixtrans-57.6-45.1177.1174.70000110.6A443 S444 L449 L450 H451 L469 G472 N473A443-V447 VanDerWaalsContact O-CG2 3.26Å; A443-V447 WeakPolarHBondContact O-CG2 3.45Å; A443-V447 PolarHBondContact O-N 3.44Å; S444-V447 PolarHBondContact O-N 3.4Å; V447-L449 PolarHBondContact O-N 2.9Å; V447-L450 WeakPolarHBondContact O-CB 3.35Å; V447-L450 PolarHBondContact O-N 3.41Å; V447-H451 WeakPolarHBondContact O-CB 3.44Å; V447-H451 PolarHBondContact O-N 3.19Å; V447-L469 HydrophobicContact CG1-CD2 3.7Å; V447-G472 WeakPolarHBondContact CG2-O 3.38Å; V447-N473 VanDerWaalsContact CG2-OD1 3.24Å; V447-N473 WeakPolarHBondContact CG2-OD1 3.12Å
448S85Confident84.7Confident15 Ų1520.4 Ų20.411%0.10512%0.123CC..Hα-helixtrans-65.5-37.1-179.3-59.80000112.9S444 E445 V446 M452S444-S448 WeakPolarHBondContact O-CB 3.23Å; S444-S448 PolarHBondContact O-N 2.85Å; S444-S448 PolarHBondContact O-OG 3.11Å; E445-S448 PolarHBondContact O-N 3.42Å; V446-S448 VanDerWaalsContact C-N 3.31Å; V446-S448 PolarHBondContact O-N 2.87Å; S448-M452 PolarHBondContact O-N 2.96Å
449L88.4Confident84.2Confident1 Ų120 Ų201%0.00512%0.121CC..Hα-helixtrans-68.8-42172.3-80.2162.3000112.4Y81 C101 L105 L108 E445 V446 V447 H451 M452 L453Y81-L449 HydrophobicContact CD1-CD2 3.24Å; Y81-L449 HydrophobicContact CD1-CG 3.8Å; Y81-L449 HydrophobicContact CD2-CD2 4.36Å; Y81-L449 HydrophobicContact CD2-CG 4.1Å; Y81-L449 HydrophobicContact CE1-CD1 4.13Å; Y81-L449 HydrophobicContact CE1-CD2 3.39Å; Y81-L449 HydrophobicContact CE1-CG 3.64Å; Y81-L449 HydrophobicContact CE2-CD2 4.48Å; Y81-L449 HydrophobicContact CE2-CG 3.96Å; Y81-L449 HydrophobicContact CG-CD2 3.76Å; Y81-L449 HydrophobicContact CG-CG 4.02Å; C101-L449 HydrophobicContact CB-CD2 3.77Å; L105-L449 HydrophobicContact CB-CD1 3.97Å; L105-L449 HydrophobicContact CD1-CB 4.06Å; L105-L449 HydrophobicContact CD1-CD1 4.01Å; L108-L449 HydrophobicContact CD1-CD1 3.45Å; L108-L449 VanDerWaalsContact CD1-CD1 3.45Å; E445-L449 PolarHBondContact O-N 2.89Å; V446-L449 PolarHBondContact O-N 3.34Å; V447-L449 PolarHBondContact O-N 2.9Å; L449-H451 VanDerWaalsContact C-N 3.33Å; L449-M452 HydrophobicContact CD2-CE 4.21Å; L449-M452 PolarHBondContact O-N 2.88Å; L449-L453 WeakPolarHBondContact O-CG 3.24Å; L449-L453 PolarHBondContact O-N 3.25Å
450L85.4Confident83.7Confident7 Ų720.8 Ų20.84%0.03713%0.127CC..Hα-helixtrans-61.9-41.4176.8-80.7-179.7000111V446 V447 L453 G454 L468 W471V446-L450 HydrophobicContact CG1-CD1 3.69Å; V446-L450 HydrophobicContact CG1-CG 4.16Å; V446-L450 VanDerWaalsContact O-CB 3.26Å; V446-L450 WeakPolarHBondContact O-CB 3.42Å; V446-L450 VanDerWaalsContact O-CG 3.23Å; V446-L450 WeakPolarHBondContact O-CG 3.19Å; V446-L450 PolarHBondContact O-N 2.92Å; V447-L450 WeakPolarHBondContact O-CB 3.35Å; V447-L450 PolarHBondContact O-N 3.41Å; L450-L453 PolarHBondContact O-N 3.26Å; L450-G454 PolarHBondContact O-N 3.28Å; L450-L468 VanDerWaalsContact C-CD2 3.46Å; L450-L468 HydrophobicContact CB-CD2 3.5Å; L450-L468 HydrophobicContact CD2-CD2 4.17Å; L450-L468 HydrophobicContact CG-CD2 4.29Å; L450-L468 WeakPolarHBondContact O-CD2 3.41Å; L450-W471 HydrophobicContact CD1-CD2 4.37Å; L450-W471 HydrophobicContact CD1-CZ2 3.95Å; L450-W471 HydrophobicContact CD2-CH2 4.21Å; L450-W471 HydrophobicContact CD2-CZ2 3.77Å
451H82.8Confident83.3Confident13 Ų1322.2 Ų22.26%0.0613%0.133CC..Hα-helixtrans-56.1-52.1171.2-176.6-106.3000111.9V447 L449 L453 G454 V455 L464 L469V447-H451 WeakPolarHBondContact O-CB 3.44Å; V447-H451 PolarHBondContact O-N 3.19Å; L449-H451 VanDerWaalsContact C-N 3.33Å; H451-L453 VanDerWaalsContact C-N 3.3Å; H451-L453 PolarHBondContact O-N 3.02Å; H451-G454 WeakPolarHBondContact O-CA 3.43Å; H451-G454 PolarHBondContact O-N 3.08Å; H451-V455 PolarHBondContact O-N 3.04Å; H451-L464 WeakPolarHBondContact CD2-CD2 3.37Å; H451-L469 HydrophobicContact CB-CD2 3.8Å
452M86.3Confident82.7Confident1 Ų123.6 Ų23.61%0.00514%0.14CC..Hα-helixtrans-57.6-43.3177.9177.6-80.2-62.900111.6L82 A85 C101 S448 L449 G454 V455 V456L82-M452 HydrophobicContact CD2-CB 4.39Å; L82-M452 HydrophobicContact CD2-CG 4.14Å; L82-M452 HydrophobicContact CG-CB 4.41Å; L82-M452 HydrophobicContact CG-CG 4.43Å; A85-M452 HydrophobicContact CB-CG 4.04Å; A85-M452 HydrophobicContact CB-SD 4Å; C101-M452 HydrophobicContact CB-CE 3.7Å; S448-M452 PolarHBondContact O-N 2.96Å; L449-M452 HydrophobicContact CD2-CE 4.21Å; L449-M452 PolarHBondContact O-N 2.88Å; M452-G454 VanDerWaalsContact C-N 3.33Å; M452-G454 PolarHBondContact O-N 3.4Å; M452-V455 PolarHBondContact O-N 3.43Å; M452-V456 VanDerWaalsContact O-CG2 3.31Å; M452-V456 WeakPolarHBondContact O-CG2 3.36Å; M452-V456 PolarHBondContact O-N 3.1Å; M452-V456 HydrophobicContact SD-CG2 3.77Å
453L86.4Confident82.1Confident34 Ų3423.3 Ų23.318%0.17814%0.138CC..Hα-helixtrans-63.1-38.9175.1-70.9173.6000111.9I102 L105 L449 L450 H451 V456 L457I102-L453 HydrophobicContact CG1-CD2 4.33Å; L105-L453 HydrophobicContact CD2-CD1 4Å; L449-L453 WeakPolarHBondContact O-CG 3.24Å; L449-L453 PolarHBondContact O-N 3.25Å; L450-L453 PolarHBondContact O-N 3.26Å; H451-L453 VanDerWaalsContact C-N 3.3Å; H451-L453 PolarHBondContact O-N 3.02Å; L453-V456 PolarHBondContact O-N 2.88Å; L453-L457 WeakPolarHBondContact O-CB 3.35Å; L453-L457 VanDerWaalsContact O-CG 3.23Å; L453-L457 WeakPolarHBondContact O-CG 3.47Å; L453-L457 PolarHBondContact O-N 2.99Å
454G82.6Confident81.7Confident0 Ų023 Ų230%014%0.135CC..Hα-helixtrans-60.1-44.4174.800000113L450 H451 M452 L457 S458 L459L450-G454 PolarHBondContact O-N 3.28Å; H451-G454 WeakPolarHBondContact O-CA 3.43Å; H451-G454 PolarHBondContact O-N 3.08Å; M452-G454 VanDerWaalsContact C-N 3.33Å; M452-G454 PolarHBondContact O-N 3.4Å; G454-L457 CarbonylContact O-C 3.53Å; G454-L457 PolarHBondContact O-N 3.44Å; G454-S458 PolarHBondContact O-N 3.24Å; G454-S458 VanDerWaalsContact O-N 3.16Å; G454-L459 PolarHBondContact O-N 3.27Å; G454-L459 VanDerWaalsContact O-N 3.08Å
455V83.1Confident81.2Confident1 Ų121.8 Ų21.81%0.00613%0.128CC..Hα-helixtrans-64.9-41.4174.8174.80000111.4C51 V54 M55 L82 H451 M452 L457 S458 L464C51-V455 WeakPolarHBondContact O-CG1 3.3Å; V54-V455 HydrophobicContact CB-CG1 4.31Å; M55-V455 WeakPolarHBondContact CG-O 3.37Å; L82-V455 HydrophobicContact CD2-CB 4.07Å; L82-V455 HydrophobicContact CD2-CG1 3.97Å; L82-V455 HydrophobicContact CD2-CG2 4.32Å; H451-V455 PolarHBondContact O-N 3.04Å; M452-V455 PolarHBondContact O-N 3.43Å; V455-L457 VanDerWaalsContact C-N 3.26Å; V455-L457 PolarHBondContact O-N 3.3Å; V455-S458 PolarHBondContact O-N 3.5Å; V455-S458 VanDerWaalsContact O-N 3.09Å; V455-L464 HydrophobicContact CG2-CD2 4.41Å
456V84.6Confident80.6Confident30 Ų3021.3 Ų21.318%0.18213%0.125CC..Hα-helixtrans-63.9-32.3175.9169.70000111.9F86 I98 M452 L453 S458F86-V456 HydrophobicContact CE2-CG2 4.42Å; F86-V456 HydrophobicContact CZ-CG2 3.82Å; I98-V456 HydrophobicContact CD1-CG1 4.25Å; M452-V456 VanDerWaalsContact O-CG2 3.31Å; M452-V456 WeakPolarHBondContact O-CG2 3.36Å; M452-V456 PolarHBondContact O-N 3.1Å; M452-V456 HydrophobicContact SD-CG2 3.77Å; L453-V456 PolarHBondContact O-N 2.88Å; V456-S458 VanDerWaalsContact C-N 3.28Å
457L84.1Confident80.4Confident115 Ų11522.1 Ų22.160%0.60213%0.13SC*.THydrogen-bonded Turntrans-84.11.5175.7-67.7173.6000113.5L453 G454 V455 L459L453-L457 WeakPolarHBondContact O-CB 3.35Å; L453-L457 VanDerWaalsContact O-CG 3.23Å; L453-L457 WeakPolarHBondContact O-CG 3.47Å; L453-L457 PolarHBondContact O-N 2.99Å; G454-L457 CarbonylContact O-C 3.53Å; G454-L457 PolarHBondContact O-N 3.44Å; V455-L457 VanDerWaalsContact C-N 3.26Å; V455-L457 PolarHBondContact O-N 3.3Å; L457-L459 VanDerWaalsContact C-N 3.32Å; L457-L459 HydrophobicContact CB-CG 4.14Å; L457-L459 PolarHBondContact O-N 2.95Å
458S81.1Confident80.1Confident69 Ų6922.5 Ų22.548%0.48313%0.132SC..THydrogen-bonded Turntrans55.640.5-178.1-55.20000114G454 V455 V456G454-S458 PolarHBondContact O-N 3.24Å; G454-S458 VanDerWaalsContact O-N 3.16Å; V455-S458 PolarHBondContact O-N 3.5Å; V455-S458 VanDerWaalsContact O-N 3.09Å; V456-S458 VanDerWaalsContact C-N 3.28Å
459L77.6Confident79.7Confident17 Ų1723.3 Ų23.39%0.08914%0.135CC..  trans-80.4146172.9-59.5178.7000110.9G454 L457 L468 F582G454-L459 PolarHBondContact O-N 3.27Å; G454-L459 VanDerWaalsContact O-N 3.08Å; L457-L459 VanDerWaalsContact C-N 3.32Å; L457-L459 HydrophobicContact CB-CG 4.14Å; L457-L459 PolarHBondContact O-N 2.95Å; L459-L468 HydrophobicContact CD1-CD1 4.47Å; L459-F582 HydrophobicContact CD2-CZ 4.38Å
460S75.3Confident79.3Confident24 Ų2423.2 Ų23.217%0.16813%0.134CC..  trans-63.2151.7172.766.90000112.4T462 V463 L464 E581S460-T462 PolarHBondContact O-N 3.06Å; S460-V463 PolarHBondContact O-N 3Å; S460-V463 PolarHBondContact OG-N 3.06Å; S460-L464 VanDerWaalsContact O-CB 3.24Å; S460-L464 WeakPolarHBondContact O-CB 3.35Å; S460-L464 PolarHBondContact O-N 2.92Å; S460-E581 WeakPolarHBondContact CB-OE1 3.47Å; S460-E581 PolarHBondContact N-OE1 3.39Å; S460-E581 PolarHBondContact OG-OE1 3.39Å; S460-E581 PolarHBondContact OG-OE2 2.99Å
461N72Confident79.3Confident55 Ų5526.5 Ų26.529%0.29415%0.146SC..Hα-helixtrans-56.9-31.9174.4-63.7-41000112.2G465N461-G465 PolarHBondContact O-N 3.12Å
462T70.3Confident79.2Confident38 Ų3825.9 Ų25.923%0.23314%0.143CC..Hα-helixtrans-69.5-46.7178.4-47.20000111.7S460 L466 L532S460-T462 PolarHBondContact O-N 3.06Å; T462-L466 HydrophobicContact CG2-CD1 3.71Å; T462-L466 HydrophobicContact CG2-CG 4.34Å; T462-L466 VanDerWaalsContact O-CB 3.28Å; T462-L466 WeakPolarHBondContact O-CB 3.41Å; T462-L466 VanDerWaalsContact O-CG 3.22Å; T462-L466 WeakPolarHBondContact O-CG 3.47Å; T462-L466 PolarHBondContact O-N 3.45Å; T462-L532 HydrophobicContact CG2-CB 4.33Å; T462-L532 HydrophobicContact CG2-CD2 4.26Å
463V74.5Confident78.9Confident1 Ų128.9 Ų28.91%0.00616%0.16CC..Hα-helixtrans-67.1-42.5174.91700000111S460 G465 T467 L532 L578 E581S460-V463 PolarHBondContact O-N 3Å; S460-V463 PolarHBondContact OG-N 3.06Å; V463-G465 VanDerWaalsContact C-N 3.34Å; V463-G465 PolarHBondContact O-N 3.34Å; V463-T467 WeakPolarHBondContact O-CB 3.5Å; V463-T467 PolarHBondContact O-N 3.44Å; V463-T467 PolarHBondContact O-OG1 2.69Å; V463-L532 HydrophobicContact CB-CD2 4.34Å; V463-L532 HydrophobicContact CG2-CD2 3.59Å; V463-L578 HydrophobicContact CG1-CD2 4.38Å; V463-E581 HydrophobicContact CB-CG 4.44Å; V463-E581 HydrophobicContact CG2-CB 3.7Å; V463-E581 VanDerWaalsContact CG2-CD 3.49Å; V463-E581 HydrophobicContact CG2-CG 3.65Å; V463-E581 WeakPolarHBondContact CG2-OE2 3.48Å
464L75.3Confident79Confident2 Ų227.3 Ų27.31%0.0115%0.151CC..Iπ-helixtrans-56.9-50.2177.3-168.952.7000110.2H451 V455 S460 L468 L469H451-L464 WeakPolarHBondContact CD2-CD2 3.37Å; V455-L464 HydrophobicContact CG2-CD2 4.41Å; S460-L464 VanDerWaalsContact O-CB 3.24Å; S460-L464 WeakPolarHBondContact O-CB 3.35Å; S460-L464 PolarHBondContact O-N 2.92Å; L464-L468 HydrophobicContact CD1-CB 4.07Å; L464-L468 HydrophobicContact CD1-CD2 3.57Å; L464-L468 HydrophobicContact CD1-CG 4.36Å; L464-L468 PolarHBondContact O-N 2.88Å; L464-L468 VanDerWaalsContact O-N 3.14Å; L464-L469 HydrophobicContact CD1-CG 4.39Å; L464-L469 HydrophobicContact CG-CD1 4.24Å; L464-L469 HydrophobicContact CG-CG 4.1Å; L464-L469 WeakPolarHBondContact O-CB 3.48Å; L464-L469 VanDerWaalsContact O-CG 3.3Å; L464-L469 WeakPolarHBondContact O-CG 3.35Å; L464-L469 PolarHBondContact O-N 3.22Å
465G71.6Confident79.2Confident6 Ų627.7 Ų27.76%0.06215%0.153CC..Iπ-helixtrans-63.5-51.9177.800000114.4N461 V463 T467 A470N461-G465 PolarHBondContact O-N 3.12Å; V463-G465 VanDerWaalsContact C-N 3.34Å; V463-G465 PolarHBondContact O-N 3.34Å; G465-T467 PolarHBondContact O-N 3.2Å; G465-A470 PolarHBondContact O-N 2.97Å
466L75.1Confident79.2Confident0 Ų027.9 Ų27.90%016%0.156CC..Iπ-helixtrans-79.8-16.7-172-61.2-179000114.1L167 G170 G174 T462 A470 L532 T533 V536L167-L466 HydrophobicContact CD1-CD2 4.23Å; L167-L466 HydrophobicContact CD1-CG 4.41Å; G170-L466 WeakPolarHBondContact O-CD2 3.39Å; G174-L466 WeakPolarHBondContact CA-O 3.27Å; T462-L466 HydrophobicContact CG2-CD1 3.71Å; T462-L466 HydrophobicContact CG2-CG 4.34Å; T462-L466 VanDerWaalsContact O-CB 3.28Å; T462-L466 WeakPolarHBondContact O-CB 3.41Å; T462-L466 VanDerWaalsContact O-CG 3.22Å; T462-L466 WeakPolarHBondContact O-CG 3.47Å; T462-L466 PolarHBondContact O-N 3.45Å; L466-A470 WeakPolarHBondContact O-CB 3.44Å; L466-L532 HydrophobicContact CB-CD2 4.17Å; L466-L532 HydrophobicContact CB-CG 4.49Å; L466-L532 HydrophobicContact CD1-CB 3.87Å; L466-L532 HydrophobicContact CD1-CD2 3.86Å; L466-L532 HydrophobicContact CD1-CG 3.72Å; L466-T533 WeakPolarHBondContact CD1-OG1 3.26Å; L466-V536 HydrophobicContact CB-CG2 4.39Å
467T82.6Confident79.3Confident17 Ų1727 Ų2710%0.10415%0.15CC..Iπ-helixtrans-120.9-63.5-178.369.70000113V463 G465 W471 A577V463-T467 WeakPolarHBondContact O-CB 3.5Å; V463-T467 PolarHBondContact O-N 3.44Å; V463-T467 PolarHBondContact O-OG1 2.69Å; G465-T467 PolarHBondContact O-N 3.2Å; T467-W471 WeakPolarHBondContact O-CB 3.39Å; T467-W471 PolarHBondContact O-N 3.43Å; T467-A577 HydrophobicContact CG2-CB 4.24Å
468L79.1Confident79.6Confident26 Ų2623 Ų2314%0.13613%0.129CC..Iπ-helixtrans-83.7-38.1-164.3-168.5139.6000112.1L450 L459 L464 G472L450-L468 VanDerWaalsContact C-CD2 3.46Å; L450-L468 HydrophobicContact CB-CD2 3.5Å; L450-L468 HydrophobicContact CD2-CD2 4.17Å; L450-L468 HydrophobicContact CG-CD2 4.29Å; L450-L468 WeakPolarHBondContact O-CD2 3.41Å; L459-L468 HydrophobicContact CD1-CD1 4.47Å; L464-L468 HydrophobicContact CD1-CB 4.07Å; L464-L468 HydrophobicContact CD1-CD2 3.57Å; L464-L468 HydrophobicContact CD1-CG 4.36Å; L464-L468 PolarHBondContact O-N 2.88Å; L464-L468 VanDerWaalsContact O-N 3.14Å; L468-G472 PolarHBondContact O-N 3Å
469L76.6Confident79.9Confident32 Ų3222.4 Ų22.417%0.16812%0.118CC..Iπ-helixtrans-71.4-39168.6-60.8-177.3000111.3V447 H451 L464 W471 G472 N473V447-L469 HydrophobicContact CG1-CD2 3.7Å; H451-L469 HydrophobicContact CB-CD2 3.8Å; L464-L469 HydrophobicContact CD1-CG 4.39Å; L464-L469 HydrophobicContact CG-CD1 4.24Å; L464-L469 HydrophobicContact CG-CG 4.1Å; L464-L469 WeakPolarHBondContact O-CB 3.48Å; L464-L469 VanDerWaalsContact O-CG 3.3Å; L464-L469 WeakPolarHBondContact O-CG 3.35Å; L464-L469 PolarHBondContact O-N 3.22Å; L469-W471 PolarHBondContact O-N 2.91Å; L469-G472 WeakPolarHBondContact O-CA 3.49Å; L469-G472 PolarHBondContact O-N 3.46Å; L469-N473 PolarHBondContact O-N 2.96Å
470A80.2Confident80.2Confident0 Ų021.7 Ų21.70%011%0.114CC..Hα-helixtrans-61-42.1175.300000112.6A171 G465 L466A171-A470 WeakPolarHBondContact O-CB 2.82Å; G465-A470 PolarHBondContact O-N 2.97Å; L466-A470 WeakPolarHBondContact O-CB 3.44Å
471W83.7Confident81Confident75 Ų7520.6 Ų20.628%0.28411%0.106SC..Hα-helixtrans-59-52.8166.3129.226.4000109.3F178 L450 T467 L469 N473 S474 I475F178-W471 HydrophobicContact CD2-CB 3.99Å; F178-W471 HydrophobicContact CE2-CB 4.02Å; F178-W471 HydrophobicContact CE2-CG 4.25Å; F178-W471 HydrophobicContact CG-CB 4.34Å; F178-W471 HydrophobicContact CZ-CB 4.43Å; F178-W471 HydrophobicContact CZ-CG 4.45Å; L450-W471 HydrophobicContact CD1-CD2 4.37Å; L450-W471 HydrophobicContact CD1-CZ2 3.95Å; L450-W471 HydrophobicContact CD2-CH2 4.21Å; L450-W471 HydrophobicContact CD2-CZ2 3.77Å; T467-W471 WeakPolarHBondContact O-CB 3.39Å; T467-W471 PolarHBondContact O-N 3.43Å; L469-W471 PolarHBondContact O-N 2.91Å; W471-N473 PolarHBondContact O-N 2.91Å; W471-S474 CarbonylContact O-C 3.5Å; W471-S474 PolarHBondContact O-N 3.26Å; W471-I475 PolarHBondContact O-N 3.5Å
472G82.3Confident81.8Confident0 Ų018.6 Ų18.60%010%0.096CC..Hα-helixtrans-51.3-43.5-171.100000112.3V447 L468 L469 I475V447-G472 WeakPolarHBondContact CG2-O 3.38Å; L468-G472 PolarHBondContact O-N 3Å; L469-G472 WeakPolarHBondContact O-CA 3.49Å; L469-G472 PolarHBondContact O-N 3.46Å; G472-I475 WeakPolarHBondContact O-CB 3.38Å; G472-I475 WeakPolarHBondContact O-CG2 3.46Å; G472-I475 PolarHBondContact O-N 3.32Å
473N80.1Confident82.5Confident65 Ų6517.4 Ų17.435%0.3489%0.089SC..Hα-helixtrans-63.1-45.3178.1-69-20.3000111.6V447 L469 W471 I475V447-N473 VanDerWaalsContact CG2-OD1 3.24Å; V447-N473 WeakPolarHBondContact CG2-OD1 3.12Å; L469-N473 PolarHBondContact O-N 2.96Å; W471-N473 PolarHBondContact O-N 2.91Å; N473-I475 VanDerWaalsContact C-N 3.27Å; N473-I475 PolarHBondContact O-N 3.39Å
474S87.8Confident82.9Confident0 Ų017.5 Ų17.50%09%0.089CC..THydrogen-bonded Turntrans-85.111.9178.9-67.90000114.7V179 W471 G476 D477 L478V179-S474 WeakPolarHBondContact CG2-OG 3.34Å; W471-S474 CarbonylContact O-C 3.5Å; W471-S474 PolarHBondContact O-N 3.26Å; S474-G476 VanDerWaalsContact C-N 3.28Å; S474-G476 PolarHBondContact O-N 3.35Å; S474-D477 WeakPolarHBondContact O-CB 3.46Å; S474-D477 PolarHBondContact O-N 3.16Å; S474-D477 PolarHBondContact OG-OD2 3.33Å; S474-L478 PolarHBondContact O-N 2.95Å
475I86Confident83.6Confident8 Ų817.4 Ų17.44%0.0419%0.089CC..Hα-helixtrans-69.9-31.1177.4-15446.5000111.2F109 L112 F178 A443 V446 W471 G472 N473 D477 L478 F479F109-I475 HydrophobicContact CD1-CG1 4.31Å; F109-I475 HydrophobicContact CE1-CD1 4.33Å; F109-I475 HydrophobicContact CE1-CG1 3.59Å; F109-I475 HydrophobicContact CZ-CG1 4.49Å; L112-I475 HydrophobicContact CD1-CG2 4.04Å; F178-I475 HydrophobicContact CZ-CD1 4.2Å; A443-I475 HydrophobicContact CB-CG2 4.08Å; V446-I475 HydrophobicContact CB-CG2 4.4Å; V446-I475 HydrophobicContact CG1-CG2 4.04Å; W471-I475 PolarHBondContact O-N 3.5Å; G472-I475 WeakPolarHBondContact O-CB 3.38Å; G472-I475 WeakPolarHBondContact O-CG2 3.46Å; G472-I475 PolarHBondContact O-N 3.32Å; N473-I475 VanDerWaalsContact C-N 3.27Å; N473-I475 PolarHBondContact O-N 3.39Å; I475-D477 VanDerWaalsContact C-N 3.31Å; I475-L478 HydrophobicContact CD1-CB 4.29Å; I475-L478 HydrophobicContact CD1-CD2 3.83Å; I475-L478 WeakPolarHBondContact O-CB 3.16Å; I475-L478 PolarHBondContact O-N 3.18Å; I475-F479 HydrophobicContact CD1-CE2 4.15Å; I475-F479 HydrophobicContact CG1-CD2 4.3Å; I475-F479 HydrophobicContact CG1-CE2 4.08Å; I475-F479 WeakPolarHBondContact O-CD2 3.49Å; I475-F479 PolarHBondContact O-N 2.89Å
476G82.9Confident84.3Confident6 Ų625.4 Ų25.46%0.06212%0.117CC..Hα-helixtrans-60.9-40171.900000112.1S474 F479 S480S474-G476 VanDerWaalsContact C-N 3.28Å; S474-G476 PolarHBondContact O-N 3.35Å; G476-F479 PolarHBondContact O-N 2.83Å; G476-S480 WeakPolarHBondContact O-CB 3.34Å; G476-S480 PolarHBondContact O-N 3.14Å; G476-S480 PolarHBondContact O-OG 3.37Å
477D88.1Confident84.6Confident11 Ų1129.3 Ų29.36%0.05914%0.135CC..Hα-helixtrans-60.6-46.7173.9-63-38.7000111.2N147 V179 V183 S474 I475 F479 S480 D481N147-D477 WeakPolarHBondContact CB-OD1 3.25Å; N147-D477 PolarHBondContact ND2-OD1 3.5Å; V179-D477 HydrophobicContact CG2-CB 4.35Å; V183-D477 HydrophobicContact CG2-CB 4.49Å; S474-D477 WeakPolarHBondContact O-CB 3.46Å; S474-D477 PolarHBondContact O-N 3.16Å; S474-D477 PolarHBondContact OG-OD2 3.33Å; I475-D477 VanDerWaalsContact C-N 3.31Å; D477-F479 PolarHBondContact O-N 3.33Å; D477-S480 WeakPolarHBondContact CA-OG 3.16Å; D477-S480 PolarHBondContact O-N 2.93Å; D477-S480 PolarHBondContact O-OG 2.9Å; D477-S480 VanDerWaalsContact O-OG 3.07Å; D477-D481 VanDerWaalsContact O-CB 3.3Å; D477-D481 WeakPolarHBondContact O-CB 3.16Å; D477-D481 PolarHBondContact O-N 3.23Å
478L90.1Very high84.6Confident30 Ų3029.7 Ų29.716%0.15714%0.142CC..Hα-helixtrans-55-51178.5-178.162.4000111.8F178 V182 V183 S474 I475 V482F178-L478 HydrophobicContact CE1-CB 4.38Å; F178-L478 HydrophobicContact CZ-CD2 4.23Å; V182-L478 HydrophobicContact CG1-CD1 4.36Å; V183-L478 HydrophobicContact CB-CD1 4.31Å; V183-L478 HydrophobicContact CG1-CD1 4.48Å; V183-L478 HydrophobicContact CG2-CB 3.86Å; V183-L478 HydrophobicContact CG2-CD1 3.98Å; S474-L478 PolarHBondContact O-N 2.95Å; I475-L478 HydrophobicContact CD1-CB 4.29Å; I475-L478 HydrophobicContact CD1-CD2 3.83Å; I475-L478 WeakPolarHBondContact O-CB 3.16Å; I475-L478 PolarHBondContact O-N 3.18Å; L478-V482 HydrophobicContact CD1-CG2 3.9Å; L478-V482 WeakPolarHBondContact O-CB 3.28Å; L478-V482 WeakPolarHBondContact O-CG2 3.3Å; L478-V482 PolarHBondContact O-N 2.93Å; L478-V482 VanDerWaalsContact O-N 3.14Å
479F86.6Confident84.8Confident58 Ų5831.9 Ų31.925%0.25415%0.15SC..Hα-helixtrans-71.9-38.5-176.2-80-79.6000112.7F109 L112 I475 G476 D477 T483F109-F479 HydrophobicContact CB-CE2 4.42Å; F109-F479 HydrophobicContact CB-CZ 4.02Å; F109-F479 AromaticContact CD1-CE2 3.53Å; F109-F479 HydrophobicContact CD1-CE2 3.53Å; F109-F479 AromaticContact CD1-CZ 3.92Å; F109-F479 HydrophobicContact CD1-CZ 3.92Å; F109-F479 HydrophobicContact CE1-CE2 4.19Å; F109-F479 HydrophobicContact CG-CE2 4.28Å; F109-F479 HydrophobicContact CG-CZ 4.21Å; L112-F479 HydrophobicContact CB-CB 4.37Å; L112-F479 HydrophobicContact CB-CD2 4.23Å; L112-F479 HydrophobicContact CB-CG 4.24Å; L112-F479 HydrophobicContact CD1-CD2 4.36Å; I475-F479 HydrophobicContact CD1-CE2 4.15Å; I475-F479 HydrophobicContact CG1-CD2 4.3Å; I475-F479 HydrophobicContact CG1-CE2 4.08Å; I475-F479 WeakPolarHBondContact O-CD2 3.49Å; I475-F479 PolarHBondContact O-N 2.89Å; G476-F479 PolarHBondContact O-N 2.83Å; D477-F479 PolarHBondContact O-N 3.33Å; F479-T483 WeakPolarHBondContact O-CB 3.17Å; F479-T483 PolarHBondContact O-N 2.94Å; F479-T483 PolarHBondContact O-OG1 2.94Å
480S85.3Confident85.4Confident1 Ų130.8 Ų30.81%0.00714%0.144CC..Hα-helixtrans-67.2-51.8178.257.30000111.5N147 G476 D477 T483 I484N147-S480 PolarHBondContact ND2-OG 3.42Å; G476-S480 WeakPolarHBondContact O-CB 3.34Å; G476-S480 PolarHBondContact O-N 3.14Å; G476-S480 PolarHBondContact O-OG 3.37Å; D477-S480 WeakPolarHBondContact CA-OG 3.16Å; D477-S480 PolarHBondContact O-N 2.93Å; D477-S480 PolarHBondContact O-OG 2.9Å; D477-S480 VanDerWaalsContact O-OG 3.07Å; S480-T483 WeakPolarHBondContact O-CB 3.37Å; S480-T483 PolarHBondContact O-N 3.28Å; S480-I484 VanDerWaalsContact O-CG1 3.3Å; S480-I484 WeakPolarHBondContact O-CG1 3.48Å; S480-I484 PolarHBondContact O-N 3.03Å
481D90.5Very high85.8Confident1 Ų136.7 Ų36.71%0.00517%0.167CC..Hα-helixtrans-68.4-42.3-176-74.3-27.9000112.8V183 V187 D477 T483 I484 A485 A493 C497V183-D481 HydrophobicContact CG1-CB 3.8Å; V187-D481 HydrophobicContact CG2-CB 3.97Å; D477-D481 VanDerWaalsContact O-CB 3.3Å; D477-D481 WeakPolarHBondContact O-CB 3.16Å; D477-D481 PolarHBondContact O-N 3.23Å; D481-T483 PolarHBondContact O-N 3.29Å; D481-I484 PolarHBondContact O-N 2.96Å; D481-A485 WeakPolarHBondContact O-CB 3.44Å; D481-A485 PolarHBondContact O-N 3.16Å; D481-A493 HydrophobicContact CB-CB 3.99Å; D481-A493 VanDerWaalsContact O-CB 3.3Å; D481-A493 WeakPolarHBondContact O-CB 3.29Å; D481-C497 PolarHBondContact OD2-SG 3.13Å
482V90.3Very high85.9Confident14 Ų1433.6 Ų33.69%0.08516%0.155CC..Hα-helixtrans-60.4-39.1174.4164.30000110.9V187 V190 L478 A485 R486V187-V482 HydrophobicContact CG2-CG2 4.45Å; V190-V482 HydrophobicContact CG2-CG1 4.06Å; L478-V482 HydrophobicContact CD1-CG2 3.9Å; L478-V482 WeakPolarHBondContact O-CB 3.28Å; L478-V482 WeakPolarHBondContact O-CG2 3.3Å; L478-V482 PolarHBondContact O-N 2.93Å; L478-V482 VanDerWaalsContact O-N 3.14Å; V482-A485 PolarHBondContact O-N 3.06Å; V482-R486 WeakPolarHBondContact O-CG 3.3Å; V482-R486 PolarHBondContact O-N 2.94Å
483T84Confident86.2Confident12 Ų1233.6 Ų33.67%0.07416%0.155CC..Hα-helixtrans-69.1-43.1-180-66.40000111.8A116 F479 S480 D481 A485 R486 Q487A116-T483 HydrophobicContact CB-CG2 4.48Å; F479-T483 WeakPolarHBondContact O-CB 3.17Å; F479-T483 PolarHBondContact O-N 2.94Å; F479-T483 PolarHBondContact O-OG1 2.94Å; S480-T483 WeakPolarHBondContact O-CB 3.37Å; S480-T483 PolarHBondContact O-N 3.28Å; D481-T483 PolarHBondContact O-N 3.29Å; T483-A485 VanDerWaalsContact C-N 3.29Å; T483-A485 PolarHBondContact O-N 3.09Å; T483-R486 WeakPolarHBondContact O-CB 3.4Å; T483-R486 PolarHBondContact O-N 3.01Å; T483-R486 VanDerWaalsContact O-N 3.12Å; T483-Q487 WeakPolarHBondContact O-CG 3.22Å; T483-Q487 PolarHBondContact O-N 3.34Å
484I83.4Confident86.7Confident3 Ų330.7 Ų30.72%0.01514%0.14CC..Hα-helixtrans-62.6-40175.7-69.4173.5000110.6F120 C121 L124 L143 S480 D481 R486 Q487 G488 Y489 M492 A493F120-I484 HydrophobicContact CE1-CD1 4.44Å; C121-I484 HydrophobicContact CB-CG1 4.26Å; C121-I484 WeakPolarHBondContact SG-CG1 3.48Å; L124-I484 HydrophobicContact CD2-CD1 4.22Å; L143-I484 HydrophobicContact CD1-CD1 3.77Å; L143-I484 HydrophobicContact CD2-CD1 3.32Å; L143-I484 HydrophobicContact CG-CD1 4.22Å; S480-I484 VanDerWaalsContact O-CG1 3.3Å; S480-I484 WeakPolarHBondContact O-CG1 3.48Å; S480-I484 PolarHBondContact O-N 3.03Å; D481-I484 PolarHBondContact O-N 2.96Å; I484-R486 PolarHBondContact O-N 3.32Å; I484-Q487 PolarHBondContact O-N 3.34Å; I484-G488 PolarHBondContact O-N 3.27Å; I484-Y489 PolarHBondContact O-N 2.95Å; I484-Y489 VanDerWaalsContact O-N 3.09Å; I484-M492 HydrophobicContact CG2-CB 4.33Å; I484-M492 HydrophobicContact CG2-CG 4.33Å; I484-M492 HydrophobicContact CG2-SD 4.46Å; I484-A493 HydrophobicContact CB-CB 4.42Å; I484-A493 HydrophobicContact CG2-CB 4.27Å
485A88.9Confident86.8Confident0 Ų031.2 Ų31.20%014%0.144CC..Hα-helixtrans-61.3-41.9172.900000112.2V187 V190 K191 D481 V482 T483 Q487 G488 P490 A493V187-A485 HydrophobicContact CB-CB 4.39Å; V187-A485 HydrophobicContact CG1-CB 3.82Å; V187-A485 HydrophobicContact CG2-CB 4.3Å; V190-A485 HydrophobicContact CG1-CB 4.35Å; K191-A485 WeakPolarHBondContact CD-O 3.47Å; D481-A485 WeakPolarHBondContact O-CB 3.44Å; D481-A485 PolarHBondContact O-N 3.16Å; V482-A485 PolarHBondContact O-N 3.06Å; T483-A485 VanDerWaalsContact C-N 3.29Å; T483-A485 PolarHBondContact O-N 3.09Å; A485-Q487 VanDerWaalsContact C-N 3.31Å; A485-Q487 PolarHBondContact O-N 3.22Å; A485-G488 PolarHBondContact O-N 3.26Å; A485-G488 VanDerWaalsContact O-N 3.07Å; A485-P490 HydrophobicContact CB-CB 4.05Å; A485-A493 HydrophobicContact CB-CB 4.31Å
486R86.5Confident86.9Confident175 Ų17531 Ų3166%0.6614%0.143SC*.Hα-helixtrans-62.1-36.7174.7-74.4178.9-179165.81.6112.7V190 V482 T483 I484 G488V190-R486 HydrophobicContact CG1-CB 4.35Å; V190-R486 HydrophobicContact CG1-CG 3.41Å; V190-R486 VanDerWaalsContact CG1-CG 3.41Å; V482-R486 WeakPolarHBondContact O-CG 3.3Å; V482-R486 PolarHBondContact O-N 2.94Å; T483-R486 WeakPolarHBondContact O-CB 3.4Å; T483-R486 PolarHBondContact O-N 3.01Å; T483-R486 VanDerWaalsContact O-N 3.12Å; I484-R486 PolarHBondContact O-N 3.32Å; R486-G488 PolarHBondContact O-N 2.94Å
487Q80.9Confident87.3Confident81 Ų8130.9 Ų30.938%0.37914%0.142SC..Hα-helixtrans-72.7-10.5176.3-69.1-178.3-0.200113.2S117 T483 I484 A485 Y489S117-Q487 PolarHBondContact O-NE2 3.37Å; T483-Q487 WeakPolarHBondContact O-CG 3.22Å; T483-Q487 PolarHBondContact O-N 3.34Å; I484-Q487 PolarHBondContact O-N 3.34Å; A485-Q487 VanDerWaalsContact C-N 3.31Å; A485-Q487 PolarHBondContact O-N 3.22Å; Q487-Y489 HydrophobicContact CB-CD2 4.21Å; Q487-Y489 HydrophobicContact CB-CE2 4.47Å
488G82.6Confident87.4Confident25 Ų2530.5 Ų30.526%0.25814%0.14SC..THydrogen-bonded Turntrans105.712.7172.200000115.2I484 A485 R486 P490I484-G488 PolarHBondContact O-N 3.27Å; A485-G488 PolarHBondContact O-N 3.26Å; A485-G488 VanDerWaalsContact O-N 3.07Å; R486-G488 PolarHBondContact O-N 2.94Å; G488-P490 WeakPolarHBondContact O-CD 3.48Å
489Y84.9Confident87.4Confident73 Ų7329.2 Ų29.229%0.28613%0.133SC..  trans-110.452.7175.4-52.6-78000112.4H135 I484 Q487 R491 M492 A493H135-Y489 AromaticContact CD2-CD1 3.38Å; H135-Y489 WeakPolarHBondContact CD2-CD1 3.22Å; H135-Y489 AromaticContact CD2-CE1 3.45Å; H135-Y489 VanDerWaalsContact CD2-CE1 3.45Å; H135-Y489 WeakPolarHBondContact CD2-CE1 3.25Å; H135-Y489 AromaticContact CE1-CE1 3.97Å; H135-Y489 AromaticContact CG-CD1 3.99Å; H135-Y489 AromaticContact NE2-CD1 3.68Å; H135-Y489 AromaticContact NE2-CE1 3.21Å; H135-Y489 WeakPolarHBondContact NE2-CE1 3.44Å; I484-Y489 PolarHBondContact O-N 2.95Å; I484-Y489 VanDerWaalsContact O-N 3.09Å; Q487-Y489 HydrophobicContact CB-CD2 4.21Å; Q487-Y489 HydrophobicContact CB-CE2 4.47Å; Y489-R491 PolarHBondContact O-N 3.3Å; Y489-M492 WeakPolarHBondContact O-CB 3.37Å; Y489-M492 PolarHBondContact O-N 3.43Å; Y489-A493 PolarHBondContact O-N 2.92Å
490P88.9Confident87.5Confident9 Ų926.7 Ų26.76%0.05812%0.123CC..Hα-helixtrans-67.2-24.7-17531.7-38.1000113.3V187 K191 F193 A485 G488 M492 A493 I494V187-P490 HydrophobicContact CG1-CB 4.23Å; K191-P490 HydrophobicContact CB-CB 4.43Å; K191-P490 HydrophobicContact CB-CG 4.48Å; K191-P490 HydrophobicContact CD-CG 4.26Å; K191-P490 HydrophobicContact CG-CG 4.21Å; F193-P490 HydrophobicContact CB-CB 4.46Å; F193-P490 HydrophobicContact CB-CG 3.76Å; F193-P490 HydrophobicContact CD1-CB 3.59Å; F193-P490 HydrophobicContact CD1-CG 3.86Å; F193-P490 HydrophobicContact CD2-CB 4.24Å; F193-P490 HydrophobicContact CD2-CG 3.99Å; F193-P490 HydrophobicContact CE1-CB 3.69Å; F193-P490 HydrophobicContact CE1-CG 4.39Å; F193-P490 HydrophobicContact CE2-CB 4.31Å; F193-P490 HydrophobicContact CE2-CG 4.49Å; F193-P490 HydrophobicContact CG-CB 3.85Å; F193-P490 HydrophobicContact CG-CG 3.6Å; F193-P490 HydrophobicContact CZ-CB 4.03Å; F193-P490 VanDerWaalsContact CZ-O 3.26Å; F193-P490 WeakPolarHBondContact CZ-O 3.37Å; A485-P490 HydrophobicContact CB-CB 4.05Å; G488-P490 WeakPolarHBondContact O-CD 3.48Å; P490-M492 VanDerWaalsContact C-N 3.31Å; P490-A493 PolarHBondContact O-N 2.9Å; P490-I494 PolarHBondContact O-N 2.87Å
491R87.3Confident87.7Confident124 Ų12426.9 Ų26.947%0.46812%0.124SC..Hα-helixtrans-63.6-38.4172.2-67179175.5165.51.5112.4N136 F193 T194 Y489 A495N136-R491 WeakPolarHBondContact OD1-CB 3.47Å; F193-R491 HydrophobicContact CD2-CB 4.47Å; F193-R491 HydrophobicContact CD2-CG 3.52Å; F193-R491 HydrophobicContact CE2-CB 4.16Å; F193-R491 HydrophobicContact CE2-CG 3.62Å; T194-R491 PolarHBondContact O-NE 3.28Å; T194-R491 PolarHBondContact O-NH2 3.33Å; T194-R491 PolarHBondContact OG1-NH2 3.37Å; Y489-R491 PolarHBondContact O-N 3.3Å; R491-A495 VanDerWaalsContact O-CB 3.31Å; R491-A495 WeakPolarHBondContact O-CB 3.4Å; R491-A495 PolarHBondContact O-N 3.01Å; R491-A495 VanDerWaalsContact O-N 3.16Å
492M86.9Confident87.8Confident9 Ų926.8 Ų26.84%0.04412%0.124CC..Hα-helixtrans-69.6-43.1177.3178.3169.8177.300111L124 H135 A138 L143 I484 Y489 P490 A495 A496L124-M492 HydrophobicContact CD1-CE 4.08Å; L124-M492 HydrophobicContact CD2-CE 3.19Å; L124-M492 HydrophobicContact CG-CE 3.55Å; H135-M492 HydrophobicContact CB-CB 4.26Å; H135-M492 HydrophobicContact CB-SD 4.22Å; H135-M492 WeakPolarHBondContact O-CG 3.49Å; A138-M492 HydrophobicContact CB-CE 3.82Å; A138-M492 HydrophobicContact CB-SD 4.45Å; L143-M492 HydrophobicContact CB-CE 4.34Å; L143-M492 HydrophobicContact CD2-CE 4.14Å; L143-M492 HydrophobicContact CD2-CG 4.26Å; I484-M492 HydrophobicContact CG2-CB 4.33Å; I484-M492 HydrophobicContact CG2-CG 4.33Å; I484-M492 HydrophobicContact CG2-SD 4.46Å; Y489-M492 WeakPolarHBondContact O-CB 3.37Å; Y489-M492 PolarHBondContact O-N 3.43Å; P490-M492 VanDerWaalsContact C-N 3.31Å; M492-A495 PolarHBondContact O-N 2.89Å; M492-A496 PolarHBondContact O-N 3Å
493A89.2Confident87.8Confident0 Ų027 Ų270%012%0.124CC..Hα-helixtrans-58.2-53.9176.100000112V187 D481 I484 A485 Y489 P490 A495 A496 C497V187-A493 HydrophobicContact CG1-CB 4.02Å; V187-A493 HydrophobicContact CG2-CB 4.01Å; D481-A493 HydrophobicContact CB-CB 3.99Å; D481-A493 VanDerWaalsContact O-CB 3.3Å; D481-A493 WeakPolarHBondContact O-CB 3.29Å; I484-A493 HydrophobicContact CB-CB 4.42Å; I484-A493 HydrophobicContact CG2-CB 4.27Å; A485-A493 HydrophobicContact CB-CB 4.31Å; Y489-A493 PolarHBondContact O-N 2.92Å; P490-A493 PolarHBondContact O-N 2.9Å; A493-A495 VanDerWaalsContact C-N 3.28Å; A493-A495 PolarHBondContact O-N 3.34Å; A493-A496 WeakPolarHBondContact O-CB 3.49Å; A493-A496 PolarHBondContact O-N 2.92Å; A493-A496 VanDerWaalsContact O-N 3.09Å; A493-C497 PolarHBondContact O-N 3.04Å; A493-C497 PolarHBondContact O-SG 3.38Å
494I90.6Very high88Confident5 Ų526.6 Ų26.63%0.02612%0.121CC..Hα-helixtrans-59.9-38.9176.8-80.9-59.9000112.4A184 V187 F193 F200 P490 A496 C497 F498 L558A184-I494 HydrophobicContact CB-CD1 3.44Å; A184-I494 VanDerWaalsContact CB-CD1 3.44Å; V187-I494 HydrophobicContact CB-CD1 4.37Å; V187-I494 HydrophobicContact CG1-CD1 4.29Å; V187-I494 HydrophobicContact CG1-CG1 3.92Å; F193-I494 HydrophobicContact CE1-CG1 4.12Å; F193-I494 HydrophobicContact CZ-CB 3.99Å; F193-I494 HydrophobicContact CZ-CG1 3.54Å; F200-I494 HydrophobicContact CD2-CG2 4.38Å; P490-I494 PolarHBondContact O-N 2.87Å; I494-A496 VanDerWaalsContact C-N 3.28Å; I494-A496 PolarHBondContact O-N 3.48Å; I494-C497 WeakPolarHBondContact O-CB 3.32Å; I494-C497 PolarHBondContact O-N 2.94Å; I494-F498 HydrophobicContact CG2-CD2 4.15Å; I494-F498 HydrophobicContact CG2-CE2 4.19Å; I494-F498 WeakPolarHBondContact O-CD2 3.4Å; I494-F498 PolarHBondContact O-N 3.34Å; I494-L558 HydrophobicContact CD1-CD2 4.43Å; I494-L558 HydrophobicContact CG1-CD2 4.25Å
495A88.4Confident88.3Confident10 Ų1026.6 Ų26.68%0.08312%0.121CC..Hα-helixtrans-65.3-34.5178.700000111.9V140 R491 M492 A493 G499V140-A495 HydrophobicContact CG2-CB 3.66Å; R491-A495 VanDerWaalsContact O-CB 3.31Å; R491-A495 WeakPolarHBondContact O-CB 3.4Å; R491-A495 PolarHBondContact O-N 3.01Å; R491-A495 VanDerWaalsContact O-N 3.16Å; M492-A495 PolarHBondContact O-N 2.89Å; A493-A495 VanDerWaalsContact C-N 3.28Å; A493-A495 PolarHBondContact O-N 3.34Å; A495-G499 PolarHBondContact O-N 3.41Å
496A89Confident88.5Confident4 Ų426.6 Ų26.63%0.03312%0.121CC..Hα-helixtrans-71-39.3172.100000113.5L143 M492 A493 I494 F498 G499 G500L143-A496 HydrophobicContact CB-CB 3.97Å; L143-A496 HydrophobicContact CD2-CB 3.28Å; L143-A496 HydrophobicContact CG-CB 3.38Å; M492-A496 PolarHBondContact O-N 3Å; A493-A496 WeakPolarHBondContact O-CB 3.49Å; A493-A496 PolarHBondContact O-N 2.92Å; A493-A496 VanDerWaalsContact O-N 3.09Å; I494-A496 VanDerWaalsContact C-N 3.28Å; I494-A496 PolarHBondContact O-N 3.48Å; A496-F498 VanDerWaalsContact C-N 3.28Å; A496-F498 PolarHBondContact O-N 2.96Å; A496-G499 PolarHBondContact O-N 3.49Å; A496-G500 PolarHBondContact O-N 3.43Å
497C90.9Very high88.6Confident3 Ų321.3 Ų21.32%0.0210%0.103CC..Hα-helixtrans-52.3-48.8175.2-580000111.3V179 D481 A493 I494V179-C497 HydrophobicContact CG1-CB 3.75Å; V179-C497 VanDerWaalsContact CG1-O 3.31Å; V179-C497 WeakPolarHBondContact CG1-O 3.45Å; D481-C497 PolarHBondContact OD2-SG 3.13Å; A493-C497 PolarHBondContact O-N 3.04Å; A493-C497 PolarHBondContact O-SG 3.38Å; I494-C497 WeakPolarHBondContact O-CB 3.32Å; I494-C497 PolarHBondContact O-N 2.94Å
498F90.4Very high88.9Confident4 Ų417.4 Ų17.42%0.0189%0.085CC..Hα-helixtrans-76-42.8178.8-74.3-82.6000112.4T180 F200 D203 V204 Y207 I494 A496 G500 I501 I502 L544T180-F498 HydrophobicContact CG2-CD1 4.36Å; T180-F498 HydrophobicContact CG2-CE1 3.91Å; T180-F498 HydrophobicContact CG2-CZ 4.4Å; F200-F498 HydrophobicContact CD2-CE2 4.37Å; F200-F498 AromaticContact CE2-CE2 3.8Å; F200-F498 HydrophobicContact CE2-CE2 3.8Å; F200-F498 HydrophobicContact CE2-CZ 4.07Å; D203-F498 HydrophobicContact CB-CB 3.96Å; D203-F498 HydrophobicContact CB-CG 4.42Å; V204-F498 HydrophobicContact CG2-CD1 4.35Å; V204-F498 HydrophobicContact CG2-CE1 3.8Å; V204-F498 HydrophobicContact CG2-CZ 4.01Å; Y207-F498 HydrophobicContact CD1-CD1 4.25Å; Y207-F498 HydrophobicContact CD1-CE1 4.49Å; I494-F498 HydrophobicContact CG2-CD2 4.15Å; I494-F498 HydrophobicContact CG2-CE2 4.19Å; I494-F498 WeakPolarHBondContact O-CD2 3.4Å; I494-F498 PolarHBondContact O-N 3.34Å; A496-F498 VanDerWaalsContact C-N 3.28Å; A496-F498 PolarHBondContact O-N 2.96Å; F498-G500 PolarHBondContact O-N 3.26Å; F498-I501 PolarHBondContact O-N 2.96Å; F498-I502 WeakPolarHBondContact O-CB 3.38Å; F498-I502 WeakPolarHBondContact O-CD1 3.26Å; F498-I502 WeakPolarHBondContact O-CG1 3.37Å; F498-I502 PolarHBondContact O-N 2.94Å; F498-L544 HydrophobicContact CE1-CD2 4.08Å
499G89.4Confident89.2Confident2 Ų216.6 Ų16.62%0.0218%0.075CC..Hα-helixtrans-60.5-42.2-179.600000113A495 A496 F503A495-G499 PolarHBondContact O-N 3.41Å; A496-G499 PolarHBondContact O-N 3.49Å; G499-F503 VanDerWaalsContact O-CB 3.24Å; G499-F503 WeakPolarHBondContact O-CB 3.27Å; G499-F503 PolarHBondContact O-N 3.12Å
500G88.6Confident89.4Confident5 Ų513.1 Ų13.15%0.0526%0.062CC..Hα-helixtrans-64.5-46.4179.700000112.2A496 F498 F503 N504A496-G500 PolarHBondContact O-N 3.43Å; F498-G500 PolarHBondContact O-N 3.26Å; G500-F503 WeakPolarHBondContact O-CB 3.24Å; G500-F503 PolarHBondContact O-N 3.38Å; G500-N504 VanDerWaalsContact O-CG 3.32Å; G500-N504 PolarHBondContact O-N 3.4Å; G500-N504 PolarHBondContact O-OD1 3.28Å
501I90.8Very high89.4Confident5 Ų514.9 Ų14.93%0.0267%0.07CC..Hα-helixtrans-69.9-38.7178.5-63.8-63000112.2V179 Y207 F498 F503 N504 M505V179-I501 HydrophobicContact CB-CD1 3.9Å; V179-I501 HydrophobicContact CB-CG1 3.69Å; V179-I501 HydrophobicContact CG1-CD1 4.32Å; V179-I501 HydrophobicContact CG1-CG1 3.68Å; V179-I501 HydrophobicContact CG2-CD1 3.76Å; V179-I501 HydrophobicContact CG2-CG1 4.07Å; Y207-I501 HydrophobicContact CD2-CG2 4.4Å; Y207-I501 HydrophobicContact CE1-CG2 3.95Å; Y207-I501 HydrophobicContact CE2-CG2 3.53Å; Y207-I501 WeakPolarHBondContact OH-CG2 3.42Å; F498-I501 PolarHBondContact O-N 2.96Å; I501-F503 PolarHBondContact O-N 3.49Å; I501-N504 PolarHBondContact O-N 3.45Å; I501-M505 WeakPolarHBondContact O-CB 3.46Å; I501-M505 PolarHBondContact O-N 3.29Å
502I92.5Very high89.5Confident0 Ų09 Ų90%05%0.048CC..Hα-helixtrans-61.2-39.4173.6-68.2166000110.4D203 Y207 Y238 F498 L506D203-I502 HydrophobicContact CB-CD1 4.35Å; D203-I502 WeakPolarHBondContact O-CD1 3.4Å; Y207-I502 HydrophobicContact CD2-CG1 4.14Å; Y207-I502 HydrophobicContact CG-CG1 4.07Å; Y238-I502 HydrophobicContact CD1-CG2 3.9Å; Y238-I502 HydrophobicContact CE1-CG2 3.98Å; Y238-I502 HydrophobicContact CE2-CD1 3.88Å; Y238-I502 HydrophobicContact CG-CG2 4.18Å; F498-I502 WeakPolarHBondContact O-CB 3.38Å; F498-I502 WeakPolarHBondContact O-CD1 3.26Å; F498-I502 WeakPolarHBondContact O-CG1 3.37Å; F498-I502 PolarHBondContact O-N 2.94Å; I502-L506 HydrophobicContact CG2-CD1 3.72Å; I502-L506 HydrophobicContact CG2-CG 4.28Å; I502-L506 VanDerWaalsContact O-CB 3.3Å; I502-L506 WeakPolarHBondContact O-CB 3.35Å; I502-L506 PolarHBondContact O-N 2.99Å
503F89.5Confident89.5Confident17 Ų178.8 Ų8.88%0.0755%0.047CC..Iπ-helixtrans-64.4-52176178.4-133.2000111.7L145 I152 Y235 G499 G500 I501 M505 F507 G508L145-F503 HydrophobicContact CB-CE1 4.38Å; L145-F503 HydrophobicContact CG-CE1 4.26Å; L145-F503 HydrophobicContact CG-CZ 4.39Å; I152-F503 HydrophobicContact CD1-CD1 3.24Å; I152-F503 HydrophobicContact CD1-CD2 3.79Å; I152-F503 HydrophobicContact CD1-CE1 2.98Å; I152-F503 HydrophobicContact CD1-CE2 3.56Å; I152-F503 HydrophobicContact CD1-CG 3.66Å; I152-F503 HydrophobicContact CD1-CZ 3.15Å; I152-F503 HydrophobicContact CG1-CE1 4.42Å; Y235-F503 HydrophobicContact CE1-CD2 4.29Å; Y235-F503 HydrophobicContact CE1-CE2 4.47Å; Y235-F503 HydrophobicContact CE2-CB 4.18Å; Y235-F503 AromaticContact CE2-CD2 3.66Å; Y235-F503 HydrophobicContact CE2-CD2 3.66Å; Y235-F503 HydrophobicContact CE2-CG 4.38Å; Y235-F503 AromaticContact CZ-CD2 3.45Å; Y235-F503 VanDerWaalsContact CZ-CD2 3.45Å; Y235-F503 AromaticContact CZ-CE2 3.95Å; Y235-F503 WeakPolarHBondContact OH-CD2 3.34Å; Y235-F503 WeakPolarHBondContact OH-CE2 3.42Å; G499-F503 VanDerWaalsContact O-CB 3.24Å; G499-F503 WeakPolarHBondContact O-CB 3.27Å; G499-F503 PolarHBondContact O-N 3.12Å; G500-F503 WeakPolarHBondContact O-CB 3.24Å; G500-F503 PolarHBondContact O-N 3.38Å; I501-F503 PolarHBondContact O-N 3.49Å; F503-M505 VanDerWaalsContact C-N 3.31Å; F503-M505 PolarHBondContact O-N 2.76Å; F503-F507 HydrophobicContact CD2-CB 3.67Å; F503-F507 HydrophobicContact CD2-CD1 4.25Å; F503-F507 HydrophobicContact CD2-CG 4.12Å; F503-F507 HydrophobicContact CE2-CB 3.85Å; F503-F507 AromaticContact CE2-CD1 3.56Å; F503-F507 HydrophobicContact CE2-CD1 3.56Å; F503-F507 HydrophobicContact CE2-CE1 4.25Å; F503-F507 AromaticContact CE2-CG 3.76Å; F503-F507 HydrophobicContact CE2-CG 3.76Å; F503-F507 HydrophobicContact CZ-CD1 4.19Å; F503-F507 WeakPolarHBondContact O-CA 3.26Å; F503-F507 VanDerWaalsContact O-CB 3.23Å; F503-F507 WeakPolarHBondContact O-CB 3.37Å; F503-F507 PolarHBondContact O-N 2.92Å; F503-G508 PolarHBondContact O-N 2.93Å
504N88.8Confident89.5Confident5 Ų511.3 Ų11.33%0.0276%0.061CC..Iπ-helixtrans-61.4-40.8178.9-68.8-1.3000111.9G148 D151 I152 L172 G500 I501 G508 V509G148-N504 WeakPolarHBondContact CA-OD1 3.31Å; G148-N504 PolarHBondContact O-OD1 2.9Å; D151-N504 WeakPolarHBondContact CB-ND2 3.43Å; D151-N504 PolarHBondContact OD2-ND2 2.87Å; I152-N504 WeakPolarHBondContact CG1-OD1 3.41Å; L172-N504 HydrophobicContact CD2-CB 4.18Å; G500-N504 VanDerWaalsContact O-CG 3.32Å; G500-N504 PolarHBondContact O-N 3.4Å; G500-N504 PolarHBondContact O-OD1 3.28Å; I501-N504 PolarHBondContact O-N 3.45Å; N504-G508 WeakPolarHBondContact O-CA 3.35Å; N504-G508 PolarHBondContact O-N 3.39Å; N504-V509 PolarHBondContact O-N 2.72Å
505M89.8Confident89.2Confident2 Ų213.5 Ų13.51%0.017%0.074CC..Iπ-helixtrans-69.6-64.1178.6-17063.277.600110.3L172 F173 A210 T214 Y231 I501 F503 V509L172-M505 HydrophobicContact CB-CE 3.97Å; L172-M505 HydrophobicContact CB-SD 4.44Å; F173-M505 HydrophobicContact CD1-CE 3.58Å; F173-M505 HydrophobicContact CE1-CE 3.78Å; F173-M505 HydrophobicContact CE1-SD 4.5Å; A210-M505 HydrophobicContact CB-CG 4.35Å; T214-M505 HydrophobicContact CG2-SD 4.1Å; Y231-M505 VanDerWaalsContact CE1-O 3.25Å; Y231-M505 WeakPolarHBondContact CE1-O 3.32Å; Y231-M505 VanDerWaalsContact OH-CG 3.29Å; Y231-M505 WeakPolarHBondContact OH-CG 3.33Å; Y231-M505 PolarHBondContact OH-O 3.21Å; I501-M505 WeakPolarHBondContact O-CB 3.46Å; I501-M505 PolarHBondContact O-N 3.29Å; F503-M505 VanDerWaalsContact C-N 3.31Å; F503-M505 PolarHBondContact O-N 2.76Å; M505-V509 WeakPolarHBondContact O-CB 3.33Å; M505-V509 VanDerWaalsContact O-CG2 3.29Å; M505-V509 WeakPolarHBondContact O-CG2 3.42Å; M505-V509 PolarHBondContact O-N 3.35Å; M505-V509 VanDerWaalsContact O-N 3.16Å; M505-V509 HydrophobicContact SD-CG2 4.26Å
506L92.1Very high88.9Confident0 Ų013.2 Ų13.20%07%0.071CC..Iπ-helixtrans-69.3-50.3-173.3-66.2179.2000113.7A210 Y231 L234 Y235 I502 G510A210-L506 HydrophobicContact CB-CD1 4.47Å; A210-L506 HydrophobicContact CB-CD2 3.5Å; A210-L506 HydrophobicContact CB-CG 3.94Å; Y231-L506 HydrophobicContact CD1-CD2 4.14Å; Y231-L506 WeakPolarHBondContact CD1-O 3.29Å; Y231-L506 HydrophobicContact CD2-CD2 4.01Å; Y231-L506 HydrophobicContact CE1-CB 4.36Å; Y231-L506 HydrophobicContact CE1-CD2 3.88Å; Y231-L506 WeakPolarHBondContact CE1-O 3.44Å; Y231-L506 HydrophobicContact CE2-CD2 3.72Å; Y231-L506 HydrophobicContact CG-CD2 4.2Å; L234-L506 HydrophobicContact CD2-CD1 4.3Å; L234-L506 HydrophobicContact CD2-CD2 3.87Å; L234-L506 HydrophobicContact CG-CD1 4.07Å; L234-L506 HydrophobicContact CG-CD2 4.38Å; Y235-L506 HydrophobicContact CD2-CB 4.22Å; Y235-L506 HydrophobicContact CD2-CD1 4.5Å; Y235-L506 HydrophobicContact CG-CB 4.42Å; I502-L506 HydrophobicContact CG2-CD1 3.72Å; I502-L506 HydrophobicContact CG2-CG 4.28Å; I502-L506 VanDerWaalsContact O-CB 3.3Å; I502-L506 WeakPolarHBondContact O-CB 3.35Å; I502-L506 PolarHBondContact O-N 2.99Å; L506-G510 WeakPolarHBondContact O-CA 3.4Å; L506-G510 PolarHBondContact O-N 3.09Å
507F89.6Confident88.7Confident64 Ų6414.3 Ų14.328%0.2818%0.076SC..Iπ-helixtrans-81.3-42.9-176.6-172.8-96.4000111.3I152 L232 Y235 F503 L511I152-F507 HydrophobicContact CD1-CD1 4.09Å; I152-F507 HydrophobicContact CG2-CD1 4.13Å; I152-F507 HydrophobicContact CG2-CE1 4.33Å; L232-F507 HydrophobicContact CD2-CD2 4.14Å; Y235-F507 HydrophobicContact CD1-CB 4.23Å; Y235-F507 AromaticContact CD1-CD2 3.96Å; Y235-F507 HydrophobicContact CD1-CD2 3.96Å; Y235-F507 HydrophobicContact CD1-CG 4.49Å; Y235-F507 HydrophobicContact CD2-CB 4.43Å; Y235-F507 HydrophobicContact CE1-CB 4.34Å; Y235-F507 HydrophobicContact CE1-CD2 4.07Å; Y235-F507 HydrophobicContact CE1-CG 4.43Å; Y235-F507 HydrophobicContact CG-CB 4.27Å; F503-F507 HydrophobicContact CD2-CB 3.67Å; F503-F507 HydrophobicContact CD2-CD1 4.25Å; F503-F507 HydrophobicContact CD2-CG 4.12Å; F503-F507 HydrophobicContact CE2-CB 3.85Å; F503-F507 AromaticContact CE2-CD1 3.56Å; F503-F507 HydrophobicContact CE2-CD1 3.56Å; F503-F507 HydrophobicContact CE2-CE1 4.25Å; F503-F507 AromaticContact CE2-CG 3.76Å; F503-F507 HydrophobicContact CE2-CG 3.76Å; F503-F507 HydrophobicContact CZ-CD1 4.19Å; F503-F507 WeakPolarHBondContact O-CA 3.26Å; F503-F507 VanDerWaalsContact O-CB 3.23Å; F503-F507 WeakPolarHBondContact O-CB 3.37Å; F503-F507 PolarHBondContact O-N 2.92Å; F507-L511 HydrophobicContact CE1-CD2 3.87Å; F507-L511 HydrophobicContact CZ-CD2 3.98Å; F507-L511 WeakPolarHBondContact O-CB 3.48Å; F507-L511 PolarHBondContact O-N 3.44Å
508G87.3Confident88.3Confident0 Ų021.2 Ų21.20%010%0.102CC..Iπ-helixtrans-63.9-53.5179.800000113.2F503 N504 G512F503-G508 PolarHBondContact O-N 2.93Å; N504-G508 WeakPolarHBondContact O-CA 3.35Å; N504-G508 PolarHBondContact O-N 3.39Å; G508-G512 PolarHBondContact O-N 3.07Å
509V88.3Confident87.7Confident7 Ų726 Ų264%0.04213%0.128CC..Iπ-helixtrans-66.2-43176.8-179.10000110.9I159 V169 L172 Y231 N504 M505 L511 G512 C513I159-V509 HydrophobicContact CD1-CB 4.19Å; I159-V509 HydrophobicContact CD1-CG1 4.25Å; I159-V509 HydrophobicContact CD1-CG2 4Å; V169-V509 HydrophobicContact CG2-CG1 4.25Å; V169-V509 HydrophobicContact CG2-CG2 4.36Å; L172-V509 HydrophobicContact CD1-CG2 3.21Å; Y231-V509 HydrophobicContact CE1-CB 3.96Å; Y231-V509 HydrophobicContact CE1-CG1 4.35Å; N504-V509 PolarHBondContact O-N 2.72Å; M505-V509 WeakPolarHBondContact O-CB 3.33Å; M505-V509 VanDerWaalsContact O-CG2 3.29Å; M505-V509 WeakPolarHBondContact O-CG2 3.42Å; M505-V509 PolarHBondContact O-N 3.35Å; M505-V509 VanDerWaalsContact O-N 3.16Å; M505-V509 HydrophobicContact SD-CG2 4.26Å; V509-L511 PolarHBondContact O-N 3.23Å; V509-G512 PolarHBondContact O-N 3.37Å; V509-C513 WeakPolarHBondContact O-CB 3.4Å; V509-C513 PolarHBondContact O-N 3.44Å; V509-C513 PolarHBondContact O-SG 2.93Å
510G90.3Very high86.8Confident1 Ų129.1 Ų29.11%0.0115%0.147CC..Hα-helixtrans-59.2-46.4179.800000112.8I228 L506 L514I228-G510 VanDerWaalsContact CG2-O 3.29Å; I228-G510 WeakPolarHBondContact CG2-O 3.3Å; L506-G510 WeakPolarHBondContact O-CA 3.4Å; L506-G510 PolarHBondContact O-N 3.09Å; G510-L514 WeakPolarHBondContact O-CB 3.23Å; G510-L514 PolarHBondContact O-N 3.2Å; G510-L514 VanDerWaalsContact O-N 3.11Å
511L88.9Confident85.6Confident46 Ų4636.9 Ų36.924%0.24118%0.181CC..Hα-helixtrans-72.3-39.9178.6-170.563.6000111.8M156 F507 V509 C513 L514 V515M156-L511 HydrophobicContact SD-CD2 3.63Å; M156-L511 HydrophobicContact SD-CG 3.78Å; F507-L511 HydrophobicContact CE1-CD2 3.87Å; F507-L511 HydrophobicContact CZ-CD2 3.98Å; F507-L511 WeakPolarHBondContact O-CB 3.48Å; F507-L511 PolarHBondContact O-N 3.44Å; V509-L511 PolarHBondContact O-N 3.23Å; L511-C513 PolarHBondContact O-N 3.33Å; L511-L514 HydrophobicContact CD1-CD2 4.37Å; L511-L514 WeakPolarHBondContact O-CB 3.38Å; L511-L514 PolarHBondContact O-N 3.47Å; L511-V515 WeakPolarHBondContact O-CG2 3.48Å; L511-V515 PolarHBondContact O-N 3.07Å
512G87.6Confident84.2Confident0 Ų039.7 Ų39.70%020%0.201CC..Hα-helixtrans-56.3-49.1174.400000112.7G508 V509 L514 V515 Q516G508-G512 PolarHBondContact O-N 3.07Å; V509-G512 PolarHBondContact O-N 3.37Å; G512-L514 VanDerWaalsContact C-N 3.31Å; G512-L514 PolarHBondContact O-N 3.39Å; G512-V515 PolarHBondContact O-N 3.33Å; G512-Q516 PolarHBondContact O-N 2.97Å
513C87.3Confident83Confident4 Ų446.4 Ų46.43%0.02723%0.228CC..Hα-helixtrans-65.3-35.8177.3-62.60000112I228 V509 L511 M517 V524I228-C513 HydrophobicContact CD1-CB 3.61Å; I228-C513 HydrophobicContact CG1-CB 3.77Å; I228-C513 HydrophobicContact CG2-CB 4.34Å; V509-C513 WeakPolarHBondContact O-CB 3.4Å; V509-C513 PolarHBondContact O-N 3.44Å; V509-C513 PolarHBondContact O-SG 2.93Å; L511-C513 PolarHBondContact O-N 3.33Å; C513-M517 VanDerWaalsContact O-CB 3.32Å; C513-M517 WeakPolarHBondContact O-CB 3.34Å; C513-M517 PolarHBondContact O-N 3.23Å; C513-V524 HydrophobicContact CB-CG2 4.39Å
514L89Confident82Confident54 Ų5445.8 Ų45.828%0.28323%0.225SC..Hα-helixtrans-65.2-43.5177.2-173.266.2000111.6L225 I228 L232 G510 L511 G512 M517 Y518L225-L514 HydrophobicContact CD1-CD1 4.21Å; I228-L514 HydrophobicContact CG2-CB 3.96Å; I228-L514 HydrophobicContact CG2-CD1 4.31Å; L232-L514 HydrophobicContact CD1-CD2 4.09Å; G510-L514 WeakPolarHBondContact O-CB 3.23Å; G510-L514 PolarHBondContact O-N 3.2Å; G510-L514 VanDerWaalsContact O-N 3.11Å; L511-L514 HydrophobicContact CD1-CD2 4.37Å; L511-L514 WeakPolarHBondContact O-CB 3.38Å; L511-L514 PolarHBondContact O-N 3.47Å; G512-L514 VanDerWaalsContact C-N 3.31Å; G512-L514 PolarHBondContact O-N 3.39Å; L514-M517 HydrophobicContact CD1-CE 3.8Å; L514-M517 PolarHBondContact O-N 3.2Å; L514-Y518 PolarHBondContact O-N 3.07Å
515V84.9Confident81.2Confident51 Ų5150 Ų5031%0.30925%0.245SC..Hα-helixtrans-62.1-48.4176.4170.50000110.3M156 L511 G512 M517 Y518 D519M156-V515 HydrophobicContact CG-CG2 4.36Å; M156-V515 HydrophobicContact SD-CG2 4.13Å; L511-V515 WeakPolarHBondContact O-CG2 3.48Å; L511-V515 PolarHBondContact O-N 3.07Å; G512-V515 PolarHBondContact O-N 3.33Å; V515-M517 VanDerWaalsContact C-N 3.31Å; V515-M517 PolarHBondContact O-N 3.34Å; V515-Y518 WeakPolarHBondContact O-CB 3.45Å; V515-Y518 PolarHBondContact O-N 3.09Å; V515-Y518 VanDerWaalsContact O-N 3.15Å; V515-D519 PolarHBondContact O-N 3.28Å; V515-D519 VanDerWaalsContact O-N 3.11Å
516Q83.1Confident80.3Confident3 Ų350.3 Ų50.31%0.01425%0.246CC..Hα-helixtrans-57.9-43.1178.8-172.417528.500113.3I159 P162 G512 Y518 D519 T520 V524I159-Q516 PolarHBondContact O-NE2 3.2Å; I159-Q516 PolarHBondContact O-OE1 3.26Å; I159-Q516 VanDerWaalsContact O-OE1 3.05Å; P162-Q516 VanDerWaalsContact N-NE2 3.11Å; G512-Q516 PolarHBondContact O-N 2.97Å; Q516-Y518 VanDerWaalsContact C-N 3.34Å; Q516-D519 PolarHBondContact O-N 3.04Å; Q516-T520 WeakPolarHBondContact O-CB 3.4Å; Q516-T520 PolarHBondContact O-N 3.39Å; Q516-T520 PolarHBondContact O-OG1 3.38Å; Q516-V524 HydrophobicContact CB-CG2 4.27Å; Q516-V524 HydrophobicContact CG-CG2 4.21Å; Q516-V524 VanDerWaalsContact OE1-CG2 3.29Å
517M83.6Confident79.1Confident27 Ų2754.4 Ų54.413%0.13327%0.265CS..Hα-helixtrans-70.8-31.5179.7-178.117444.700112.3L225 I228 C513 L514 V515 D519 H521 V524L225-M517 HydrophobicContact CB-CE 3.98Å; L225-M517 HydrophobicContact CB-SD 3.63Å; L225-M517 HydrophobicContact CD1-CE 3.22Å; L225-M517 HydrophobicContact CD1-SD 3.98Å; L225-M517 HydrophobicContact CG-CE 4.15Å; L225-M517 HydrophobicContact CG-SD 4.34Å; I228-M517 HydrophobicContact CD1-CE 3.45Å; I228-M517 VanDerWaalsContact CD1-CE 3.45Å; I228-M517 HydrophobicContact CD1-SD 4.01Å; C513-M517 VanDerWaalsContact O-CB 3.32Å; C513-M517 WeakPolarHBondContact O-CB 3.34Å; C513-M517 PolarHBondContact O-N 3.23Å; L514-M517 HydrophobicContact CD1-CE 3.8Å; L514-M517 PolarHBondContact O-N 3.2Å; V515-M517 VanDerWaalsContact C-N 3.31Å; V515-M517 PolarHBondContact O-N 3.34Å; M517-D519 VanDerWaalsContact C-N 3.32Å; M517-H521 WeakPolarHBondContact O-CA 3.42Å; M517-H521 PolarHBondContact O-N 3.32Å; M517-V524 HydrophobicContact CB-CG2 4.45Å
518Y83.6Confident77.6Confident149 Ų14953.8 Ų53.858%0.58427%0.269SS*.Hα-helixtrans-62.9-41.9171.9-176.8-96.9000111.1M1 L514 V515 Q516M1-Y518 HydrophobicContact CE-CE1 4.4Å; M1-Y518 HydrophobicContact SD-CD1 4.44Å; M1-Y518 HydrophobicContact SD-CE1 3.76Å; L514-Y518 PolarHBondContact O-N 3.07Å; V515-Y518 WeakPolarHBondContact O-CB 3.45Å; V515-Y518 PolarHBondContact O-N 3.09Å; V515-Y518 VanDerWaalsContact O-N 3.15Å; Q516-Y518 VanDerWaalsContact C-N 3.34Å
519D76.9Confident76.3Confident103 Ų10358.7 Ų58.755%0.55129%0.292SS*.Hα-helixtrans-77.7-35-178-69.1-21.7000113.1V515 Q516 M517V515-D519 PolarHBondContact O-N 3.28Å; V515-D519 VanDerWaalsContact O-N 3.11Å; Q516-D519 PolarHBondContact O-N 3.04Å; M517-D519 VanDerWaalsContact C-N 3.32Å
520T70.1Confident75.4Confident69 Ų6960.4 Ų60.442%0.42331%0.311SS..Hα-helixtrans-100.1-8.5-171.7-38.30000113.4Q516 S522Q516-T520 WeakPolarHBondContact O-CB 3.4Å; Q516-T520 PolarHBondContact O-N 3.39Å; Q516-T520 PolarHBondContact O-OG1 3.38Å; T520-S522 WeakPolarHBondContact O-CB 3.34Å; T520-S522 PolarHBondContact O-N 3.01Å; T520-S522 PolarHBondContact O-OG 3.41Å; T520-S522 VanDerWaalsContact O-OG 3.08Å
521H63.3Low74.8Confident167 Ų16764 Ų6477%0.77333%0.329SS*.SBendtrans48.418.5-176.3-70.6-55.5000115.5M517M517-H521 WeakPolarHBondContact O-CA 3.42Å; M517-H521 PolarHBondContact O-N 3.32Å
522S62.7Low74.2Confident64 Ų6462.4 Ų62.445%0.44832%0.321SS..SBendtrans-137.2170.4-172-58.80000110.6T520T520-S522 WeakPolarHBondContact O-CB 3.34Å; T520-S522 PolarHBondContact O-N 3.01Å; T520-S522 PolarHBondContact O-OG 3.41Å; T520-S522 VanDerWaalsContact O-OG 3.08Å
523Y66.1Low73.9Confident142 Ų14262.6 Ų62.656%0.55732%0.322SS*.PPolyproline II helixtrans-60.2142.4176.754.5-83.8000111.2T222 Q525T222-Y523 HydrophobicContact CG2-CD2 3.93Å; T222-Y523 HydrophobicContact CG2-CE2 4.24Å; Y523-Q525 HydrophobicContact CD2-CG 3.7Å; Y523-Q525 HydrophobicContact CE2-CG 3.4Å; Y523-Q525 PolarHBondContact O-N 2.77Å
524V69.9Low73.8Confident3 Ų366 Ų662%0.01834%0.335CS..EExtended strand (participates in β ladder)trans-75.8119.9174.4173.80000108.2T222 T223 I228 C513 Q516 M517 F526T222-V524 WeakPolarHBondContact CA-O 3.46Å; T223-V524 PolarHBondContact N-O 2.95Å; T223-V524 VanDerWaalsContact N-O 3.08Å; T223-V524 PolarHBondContact O-N 3.27Å; I228-V524 HydrophobicContact CD1-CG2 4.5Å; C513-V524 HydrophobicContact CB-CG2 4.39Å; Q516-V524 HydrophobicContact CB-CG2 4.27Å; Q516-V524 HydrophobicContact CG-CG2 4.21Å; Q516-V524 VanDerWaalsContact OE1-CG2 3.29Å; M517-V524 HydrophobicContact CB-CG2 4.45Å; V524-F526 HydrophobicContact CB-CE2 4.26Å; V524-F526 HydrophobicContact CG1-CD2 4.07Å; V524-F526 HydrophobicContact CG1-CE1 4.48Å; V524-F526 HydrophobicContact CG1-CE2 3.56Å; V524-F526 HydrophobicContact CG1-CZ 3.81Å
525Q70.3Confident73.7Confident94 Ų9465.5 Ų65.544%0.43933%0.332SS..EExtended strand (participates in β ladder)trans-88.8133170.3-71.4-167.3-41.100109.8G221 Y523G221-Q525 WeakPolarHBondContact O-CA 3.43Å; Y523-Q525 HydrophobicContact CD2-CG 3.7Å; Y523-Q525 HydrophobicContact CE2-CG 3.4Å; Y523-Q525 PolarHBondContact O-N 2.77Å
526F72.1Confident73.8Confident9 Ų963.1 Ų63.14%0.03932%0.317CS..  trans-106.6106.5170.9-70.3-88.4000108A165 V169 I217 L218 G221 T223 V524 S528A165-F526 HydrophobicContact CB-CD1 4.11Å; A165-F526 HydrophobicContact CB-CE1 4.07Å; V169-F526 HydrophobicContact CG2-CD1 4.44Å; V169-F526 HydrophobicContact CG2-CE1 3.87Å; I217-F526 HydrophobicContact CG2-CD2 3.82Å; I217-F526 HydrophobicContact CG2-CE2 3.51Å; I217-F526 HydrophobicContact CG2-CG 4.48Å; I217-F526 HydrophobicContact CG2-CZ 3.93Å; L218-F526 HydrophobicContact CD2-CB 4.1Å; L218-F526 HydrophobicContact CD2-CD1 3.85Å; L218-F526 HydrophobicContact CD2-CG 4.12Å; G221-F526 PolarHBondContact O-N 2.97Å; T223-F526 VanDerWaalsContact OG1-CE2 3.28Å; T223-F526 WeakPolarHBondContact OG1-CE2 3.4Å; V524-F526 HydrophobicContact CB-CE2 4.26Å; V524-F526 HydrophobicContact CG1-CD2 4.07Å; V524-F526 HydrophobicContact CG1-CE1 4.48Å; V524-F526 HydrophobicContact CG1-CE2 3.56Å; V524-F526 HydrophobicContact CG1-CZ 3.81Å; F526-S528 PolarHBondContact O-N 3.16Å
527E66.4Low74.1Confident86 Ų8663.1 Ų63.140%0.40232%0.318SS..  trans-77.2101.6165.7-70.6-179.6154.800107.3H163 E529H163-E527 IonicContact CE1-OE2 3.87Å; H163-E527 IonicContact CG-OE2 3.9Å; H163-E527 IonicContact ND1-OE1 3.99Å; H163-E527 IonicContact ND1-OE2 2.93Å; H163-E527 PolarHBondContact ND1-OE2 3.26Å; E527-E529 PolarHBondContact O-N 2.85Å; E527-E529 VanDerWaalsContact O-N 3.08Å
528S59.2Low74.5Confident51 Ų5163.9 Ų63.936%0.35733%0.332SS..  trans-76.693.7174.569.80000108.9F526 G530F526-S528 PolarHBondContact O-N 3.16Å; S528-G530 PolarHBondContact O-N 3.5Å
529E59.5Low74.8Confident103 Ų10357.6 Ų57.648%0.48131%0.311SS..  trans-76.3117.3172.6-66.6-166.4169.500110.4E527 T533E527-E529 PolarHBondContact O-N 2.85Å; E527-E529 VanDerWaalsContact O-N 3.08Å; E529-T533 PolarHBondContact O-OG1 3.16Å; E529-T533 VanDerWaalsContact O-OG1 3.04Å
530G69.3Low75.6Confident42 Ų4252.7 Ų52.743%0.43329%0.285SS..  trans88.6150.8159.300000117.5S528 L532 T533S528-G530 PolarHBondContact O-N 3.5Å; G530-L532 PolarHBondContact O-N 3.38Å; G530-T533 PolarHBondContact O-N 2.95Å
531L76.6Confident76.7Confident77 Ų7750.2 Ų50.240%0.40327%0.273SS..Hα-helixtrans-57.5-31.5172.5179.671.2000112.4T533 W534 I535 T580 T587L531-T533 VanDerWaalsContact C-N 3.33Å; L531-T533 PolarHBondContact O-N 3.29Å; L531-W534 WeakPolarHBondContact O-CB 3.19Å; L531-W534 PolarHBondContact O-N 2.87Å; L531-I535 HydrophobicContact CD2-CD1 4.08Å; L531-I535 HydrophobicContact CG-CD1 3.9Å; L531-I535 HydrophobicContact CG-CG1 4.34Å; L531-I535 PolarHBondContact O-N 3.04Å; L531-I535 VanDerWaalsContact O-N 3.14Å; L531-T580 HydrophobicContact CD2-CG2 4.14Å; L531-T587 HydrophobicContact CD2-CG2 3.5Å
532L76.9Confident78.1Confident12 Ų1245 Ų456%0.06326%0.255CS..Hα-helixtrans-62.5-38.5-175.2-170.960.9000112.2T462 V463 L466 G530 W534 I535 V536 A577T462-L532 HydrophobicContact CG2-CB 4.33Å; T462-L532 HydrophobicContact CG2-CD2 4.26Å; V463-L532 HydrophobicContact CB-CD2 4.34Å; V463-L532 HydrophobicContact CG2-CD2 3.59Å; L466-L532 HydrophobicContact CB-CD2 4.17Å; L466-L532 HydrophobicContact CB-CG 4.49Å; L466-L532 HydrophobicContact CD1-CB 3.87Å; L466-L532 HydrophobicContact CD1-CD2 3.86Å; L466-L532 HydrophobicContact CD1-CG 3.72Å; G530-L532 PolarHBondContact O-N 3.38Å; L532-W534 VanDerWaalsContact C-N 3.27Å; L532-W534 PolarHBondContact O-N 3.25Å; L532-I535 PolarHBondContact O-N 3.15Å; L532-I535 VanDerWaalsContact O-N 3.14Å; L532-V536 HydrophobicContact CD1-CG2 4.32Å; L532-V536 HydrophobicContact CG-CG2 4.2Å; L532-V536 WeakPolarHBondContact O-CG2 3.37Å; L532-V536 PolarHBondContact O-N 3.41Å; L532-A577 HydrophobicContact CD1-CB 3.95Å
533T82.1Confident79.6Confident5 Ų542 Ų423%0.03123%0.234CC..Hα-helixtrans-57.9-40.6177.1-55.70000111.7L218 L466 E529 G530 L531 V536 A537L218-T533 HydrophobicContact CD1-CG2 4.23Å; L466-T533 WeakPolarHBondContact CD1-OG1 3.26Å; E529-T533 PolarHBondContact O-OG1 3.16Å; E529-T533 VanDerWaalsContact O-OG1 3.04Å; G530-T533 PolarHBondContact O-N 2.95Å; L531-T533 VanDerWaalsContact C-N 3.33Å; L531-T533 PolarHBondContact O-N 3.29Å; T533-V536 PolarHBondContact O-N 2.91Å; T533-A537 WeakPolarHBondContact O-CB 3.31Å; T533-A537 PolarHBondContact O-N 2.97Å
534W85.5Confident81Confident76 Ų7635.2 Ų35.229%0.28821%0.208SC..Hα-helixtrans-68.5-41.6176.4-62.3102.8000112.5F215 L218 Y219 L531 L532 A537 G538F215-W534 HydrophobicContact CD2-CE3 4.2Å; F215-W534 AromaticContact CD2-CZ3 3.92Å; F215-W534 HydrophobicContact CD2-CZ3 3.92Å; F215-W534 HydrophobicContact CE1-CZ3 4.28Å; F215-W534 AromaticContact CE2-CE3 3.47Å; F215-W534 HydrophobicContact CE2-CE3 3.47Å; F215-W534 VanDerWaalsContact CE2-CE3 3.47Å; F215-W534 AromaticContact CE2-CZ3 3.41Å; F215-W534 HydrophobicContact CE2-CZ3 3.41Å; F215-W534 VanDerWaalsContact CE2-CZ3 3.41Å; F215-W534 AromaticContact CZ-CE3 3.92Å; F215-W534 HydrophobicContact CZ-CE3 3.92Å; F215-W534 AromaticContact CZ-CZ3 3.59Å; F215-W534 HydrophobicContact CZ-CZ3 3.59Å; L218-W534 HydrophobicContact CB-CH2 4.42Å; Y219-W534 HydrophobicContact CD2-CH2 4.08Å; L531-W534 WeakPolarHBondContact O-CB 3.19Å; L531-W534 PolarHBondContact O-N 2.87Å; L532-W534 VanDerWaalsContact C-N 3.27Å; L532-W534 PolarHBondContact O-N 3.25Å; W534-A537 PolarHBondContact O-N 2.92Å; W534-G538 PolarHBondContact O-N 3.08Å
535I86.1Confident82.2Confident43 Ų4338.1 Ų38.122%0.22123%0.225CC..Hα-helixtrans-60.8-46.3175.7-66.5171.1000110.2L531 L532 G538 A539 I576 T580L531-I535 HydrophobicContact CD2-CD1 4.08Å; L531-I535 HydrophobicContact CG-CD1 3.9Å; L531-I535 HydrophobicContact CG-CG1 4.34Å; L531-I535 PolarHBondContact O-N 3.04Å; L531-I535 VanDerWaalsContact O-N 3.14Å; L532-I535 PolarHBondContact O-N 3.15Å; L532-I535 VanDerWaalsContact O-N 3.14Å; I535-G538 PolarHBondContact O-N 2.91Å; I535-A539 VanDerWaalsContact O-CB 3.27Å; I535-A539 WeakPolarHBondContact O-CB 3.31Å; I535-A539 PolarHBondContact O-N 3.21Å; I535-I576 HydrophobicContact CG2-CG2 4.36Å; I535-T580 HydrophobicContact CD1-CG2 4.27Å
536V87.5Confident83.3Confident0 Ų036.5 Ų36.50%022%0.22CC..Hα-helixtrans-65.3-44.7-179.3-178.90000110.8F173 L466 L532 T533 G538 A539 L540 F573F173-V536 HydrophobicContact CB-CG1 3.64Å; L466-V536 HydrophobicContact CB-CG2 4.39Å; L532-V536 HydrophobicContact CD1-CG2 4.32Å; L532-V536 HydrophobicContact CG-CG2 4.2Å; L532-V536 WeakPolarHBondContact O-CG2 3.37Å; L532-V536 PolarHBondContact O-N 3.41Å; T533-V536 PolarHBondContact O-N 2.91Å; V536-G538 PolarHBondContact O-N 3.21Å; V536-A539 PolarHBondContact O-N 3.03Å; V536-L540 WeakPolarHBondContact O-CB 3.47Å; V536-L540 PolarHBondContact O-N 3.46Å; V536-F573 HydrophobicContact CB-CE2 4.35Å; V536-F573 HydrophobicContact CG1-CZ 4.32Å; V536-F573 HydrophobicContact CG2-CE2 3.87Å; V536-F573 HydrophobicContact CG2-CZ 3.9Å
537A89.6Confident84.2Confident4 Ų436.2 Ų36.23%0.03322%0.218CC..Hα-helixtrans-60.6-44.2176.200000112.1F173 F215 T533 W534 L540 G541F173-A537 HydrophobicContact CD2-CB 3.75Å; F173-A537 HydrophobicContact CE2-CB 3.62Å; F173-A537 HydrophobicContact CG-CB 4.35Å; F173-A537 HydrophobicContact CZ-CB 4.14Å; F215-A537 HydrophobicContact CD2-CB 4.09Å; T533-A537 WeakPolarHBondContact O-CB 3.31Å; T533-A537 PolarHBondContact O-N 2.97Å; W534-A537 PolarHBondContact O-N 2.92Å; A537-L540 PolarHBondContact O-N 3.36Å; A537-G541 PolarHBondContact O-N 3.45Å
538G90Very high85.5Confident42 Ų4235.8 Ų35.843%0.43322%0.216SC..Hα-helixtrans-66.1-39.9176.200000113.3W534 I535 V536 G541 S542W534-G538 PolarHBondContact O-N 3.08Å; I535-G538 PolarHBondContact O-N 2.91Å; V536-G538 PolarHBondContact O-N 3.21Å; G538-G541 PolarHBondContact O-N 2.82Å; G538-S542 WeakPolarHBondContact O-CB 3.31Å; G538-S542 PolarHBondContact O-N 3.19Å; G538-S542 PolarHBondContact O-OG 3.21Å
539A91.3Very high87.1Confident18 Ų1837.8 Ų37.815%0.14922%0.222CC..Hα-helixtrans-64.2-42.817600000111.5I177 I535 V536 S542 S543 F573I177-A539 HydrophobicContact CD1-CB 3.56Å; I535-A539 VanDerWaalsContact O-CB 3.27Å; I535-A539 WeakPolarHBondContact O-CB 3.31Å; I535-A539 PolarHBondContact O-N 3.21Å; V536-A539 PolarHBondContact O-N 3.03Å; A539-S542 WeakPolarHBondContact CA-OG 3.21Å; A539-S542 PolarHBondContact O-OG 3.38Å; A539-S543 WeakPolarHBondContact O-CB 3.33Å; A539-S543 PolarHBondContact O-N 3.1Å; A539-F573 HydrophobicContact CB-CD2 3.47Å; A539-F573 VanDerWaalsContact CB-CD2 3.47Å; A539-F573 HydrophobicContact CB-CE2 3.97Å; A539-F573 HydrophobicContact CB-CG 4.25Å
540L93.8Very high88.7Confident0 Ų035.3 Ų35.30%021%0.211CC..Hα-helixtrans-62.3-52173.7173.260000111.4F173 I177 Y207 V211 V536 A537 S542 S543 L544F173-L540 HydrophobicContact CB-CD2 4.24Å; F173-L540 HydrophobicContact CD1-CD2 3.58Å; F173-L540 HydrophobicContact CE1-CD2 4.37Å; F173-L540 HydrophobicContact CG-CD2 4.32Å; I177-L540 HydrophobicContact CB-CB 4.41Å; I177-L540 HydrophobicContact CB-CD1 4.44Å; Y207-L540 HydrophobicContact CE1-CD1 4Å; Y207-L540 WeakPolarHBondContact OH-CD1 3.36Å; Y207-L540 VanDerWaalsContact OH-CD2 3.23Å; Y207-L540 WeakPolarHBondContact OH-CD2 3.45Å; V211-L540 HydrophobicContact CG1-CD2 4.16Å; V211-L540 HydrophobicContact CG1-CG 4.41Å; V211-L540 HydrophobicContact CG2-CD2 3.71Å; V211-L540 HydrophobicContact CG2-CG 4.22Å; V536-L540 WeakPolarHBondContact O-CB 3.47Å; V536-L540 PolarHBondContact O-N 3.46Å; A537-L540 PolarHBondContact O-N 3.36Å; L540-S542 VanDerWaalsContact C-N 3.33Å; L540-S542 PolarHBondContact O-N 3.28Å; L540-S543 PolarHBondContact O-N 3.4Å; L540-S543 VanDerWaalsContact O-N 3.16Å; L540-S543 PolarHBondContact O-OG 2.86Å; L540-L544 HydrophobicContact CD1-CD1 4.17Å; L540-L544 HydrophobicContact CD1-CG 4.21Å; L540-L544 HydrophobicContact CG-CD1 4.34Å; L540-L544 WeakPolarHBondContact O-CG 3.22Å; L540-L544 PolarHBondContact O-N 3.29Å; L540-L544 VanDerWaalsContact O-N 3.08Å
541G93.4Very high89.7Confident17 Ų1733.3 Ų33.318%0.17519%0.191CC..Hα-helixtrans-57-45179.200000112.5A537 G538 L544 V545A537-G541 PolarHBondContact O-N 3.45Å; G538-G541 PolarHBondContact O-N 2.82Å; G541-L544 PolarHBondContact O-N 2.96Å; G541-V545 WeakPolarHBondContact O-CG2 3.32Å; G541-V545 PolarHBondContact O-N 2.94Å
542S92.2Very high90.5Very high56 Ų5631.6 Ų31.639%0.39218%0.184SC..Hα-helixtrans-65-39.8176.559.60000112.8G538 A539 L540 L544 V545 L546G538-S542 WeakPolarHBondContact O-CB 3.31Å; G538-S542 PolarHBondContact O-N 3.19Å; G538-S542 PolarHBondContact O-OG 3.21Å; A539-S542 WeakPolarHBondContact CA-OG 3.21Å; A539-S542 PolarHBondContact O-OG 3.38Å; L540-S542 VanDerWaalsContact C-N 3.33Å; L540-S542 PolarHBondContact O-N 3.28Å; S542-L544 VanDerWaalsContact C-N 3.29Å; S542-L544 PolarHBondContact O-N 3.43Å; S542-V545 PolarHBondContact O-N 3.39Å; S542-L546 WeakPolarHBondContact O-CB 3.31Å; S542-L546 VanDerWaalsContact O-CG 3.26Å; S542-L546 WeakPolarHBondContact O-CG 3.34Å; S542-L546 PolarHBondContact O-N 2.93Å
543S94.1Very high91.1Very high1 Ų137.7 Ų37.71%0.00722%0.216CC..Hα-helixtrans-60.5-37.7175.878.10000112.9A539 L540 S547A539-S543 WeakPolarHBondContact O-CB 3.33Å; A539-S543 PolarHBondContact O-N 3.1Å; L540-S543 PolarHBondContact O-N 3.4Å; L540-S543 VanDerWaalsContact O-N 3.16Å; L540-S543 PolarHBondContact O-OG 2.86Å; S543-S547 WeakPolarHBondContact O-CB 3.44Å; S543-S547 PolarHBondContact O-N 3.04Å; S543-S547 PolarHBondContact O-OG 3.4Å
544L94.4Very high91.4Very high0 Ų039.6 Ų39.60%023%0.229CC..Hα-helixtrans-72.2-43.2178.1-68.8176.2000111.8T180 Y207 M208 V211 F498 L540 G541 S542 S547 F548T180-L544 HydrophobicContact CG2-CD2 4.08Å; Y207-L544 HydrophobicContact CD1-CD1 3.54Å; Y207-L544 HydrophobicContact CD1-CD2 3.47Å; Y207-L544 VanDerWaalsContact CD1-CD2 3.47Å; Y207-L544 HydrophobicContact CD1-CG 4.12Å; Y207-L544 HydrophobicContact CE1-CD1 3.67Å; Y207-L544 HydrophobicContact CE1-CD2 3.72Å; Y207-L544 HydrophobicContact CE1-CG 4.18Å; Y207-L544 HydrophobicContact CG-CD1 4.05Å; M208-L544 HydrophobicContact CG-CB 4.04Å; M208-L544 HydrophobicContact CG-CD1 4.29Å; M208-L544 HydrophobicContact SD-CB 3.26Å; M208-L544 WeakPolarHBondContact SD-CB 3.38Å; M208-L544 HydrophobicContact SD-CD1 3.75Å; M208-L544 HydrophobicContact SD-CG 4.15Å; V211-L544 HydrophobicContact CG2-CD1 4.05Å; F498-L544 HydrophobicContact CE1-CD2 4.08Å; L540-L544 HydrophobicContact CD1-CD1 4.17Å; L540-L544 HydrophobicContact CD1-CG 4.21Å; L540-L544 HydrophobicContact CG-CD1 4.34Å; L540-L544 WeakPolarHBondContact O-CG 3.22Å; L540-L544 PolarHBondContact O-N 3.29Å; L540-L544 VanDerWaalsContact O-N 3.08Å; G541-L544 PolarHBondContact O-N 2.96Å; S542-L544 VanDerWaalsContact C-N 3.29Å; S542-L544 PolarHBondContact O-N 3.43Å; L544-S547 PolarHBondContact O-N 3.24Å; L544-F548 WeakPolarHBondContact O-CB 3.38Å; L544-F548 PolarHBondContact O-N 3.02Å
545V95.1Very high91.6Very high64 Ų6443.4 Ų43.439%0.38825%0.25SS..Hα-helixtrans-60.3-47.1174.3173.10000110.6M208 G541 S542 S547 F548 L549M208-V545 HydrophobicContact CE-CG2 3.42Å; M208-V545 VanDerWaalsContact CE-CG2 3.42Å; M208-V545 HydrophobicContact SD-CG2 4.2Å; G541-V545 WeakPolarHBondContact O-CG2 3.32Å; G541-V545 PolarHBondContact O-N 2.94Å; S542-V545 PolarHBondContact O-N 3.39Å; V545-S547 VanDerWaalsContact C-N 3.31Å; V545-S547 PolarHBondContact O-N 3.47Å; V545-F548 WeakPolarHBondContact O-CB 3.11Å; V545-F548 PolarHBondContact O-N 3.41Å; V545-L549 HydrophobicContact CG1-CD1 4.2Å; V545-L549 WeakPolarHBondContact O-CG 3.34Å; V545-L549 PolarHBondContact O-N 3.04Å
546L93.6Very high91.8Very high61 Ų6143.3 Ų43.332%0.31925%0.248SC..Hα-helixtrans-59.3-43.6177.2-73.7170.6000111.3S542 L549 I550 F565 L569S542-L546 WeakPolarHBondContact O-CB 3.31Å; S542-L546 VanDerWaalsContact O-CG 3.26Å; S542-L546 WeakPolarHBondContact O-CG 3.34Å; S542-L546 PolarHBondContact O-N 2.93Å; L546-L549 PolarHBondContact O-N 2.84Å; L546-I550 HydrophobicContact CB-CD1 4.33Å; L546-I550 VanDerWaalsContact O-CB 3.31Å; L546-I550 WeakPolarHBondContact O-CB 3.12Å; L546-I550 VanDerWaalsContact O-CG1 3.22Å; L546-I550 WeakPolarHBondContact O-CG1 3.32Å; L546-I550 PolarHBondContact O-N 2.94Å; L546-F565 HydrophobicContact CB-CZ 4.36Å; L546-F565 HydrophobicContact CD1-CZ 4.19Å; L546-L569 HydrophobicContact CD1-CD1 4.16Å; L546-L569 HydrophobicContact CD1-CD2 4.18Å
547S92Very high91.9Very high2 Ų247.9 Ų47.91%0.01427%0.269CS..Hα-helixtrans-65.5-39176.5-63.90000112.6S543 L544 V545 L549 V551 Y562S543-S547 WeakPolarHBondContact O-CB 3.44Å; S543-S547 PolarHBondContact O-N 3.04Å; S543-S547 PolarHBondContact O-OG 3.4Å; L544-S547 PolarHBondContact O-N 3.24Å; V545-S547 VanDerWaalsContact C-N 3.31Å; V545-S547 PolarHBondContact O-N 3.47Å; S547-L549 VanDerWaalsContact C-N 3.25Å; S547-L549 PolarHBondContact O-N 3.34Å; S547-V551 WeakPolarHBondContact O-CB 3.34Å; S547-V551 VanDerWaalsContact O-CG2 3.31Å; S547-V551 WeakPolarHBondContact O-CG2 3.46Å; S547-V551 PolarHBondContact O-N 3.31Å; S547-V551 VanDerWaalsContact O-N 3.1Å; S547-Y562 VanDerWaalsContact CB-OH 3.31Å; S547-Y562 WeakPolarHBondContact CB-OH 3.45Å; S547-Y562 PolarHBondContact OG-OH 2.92Å
548F93.6Very high91.8Very high78 Ų7847.7 Ų47.734%0.34227%0.268SS..Hα-helixtrans-62.9-30.9176-174.6-98.2000112.6L201 V204 I205 L544 V545 P552L201-F548 HydrophobicContact CD2-CD2 3.87Å; L201-F548 HydrophobicContact CD2-CE2 3.55Å; L201-F548 HydrophobicContact CD2-CZ 4.32Å; V204-F548 HydrophobicContact CG1-CB 4.02Å; V204-F548 HydrophobicContact CG1-CD2 3.94Å; V204-F548 HydrophobicContact CG1-CG 4.46Å; I205-F548 HydrophobicContact CD1-CE2 4.04Å; I205-F548 HydrophobicContact CG1-CD2 4.46Å; I205-F548 HydrophobicContact CG1-CE2 3.75Å; L544-F548 WeakPolarHBondContact O-CB 3.38Å; L544-F548 PolarHBondContact O-N 3.02Å; V545-F548 WeakPolarHBondContact O-CB 3.11Å; V545-F548 PolarHBondContact O-N 3.41Å; F548-P552 WeakPolarHBondContact O-CD 3.38Å; F548-P552 WeakPolarHBondContact O-CG 3.21Å
549L93.5Very high91.8Very high93 Ų9346.2 Ų46.249%0.48725%0.253SS..Hα-helixtrans-86-48.9176.8-62.7176.2000112.2V545 L546 S547 P552 L553V545-L549 HydrophobicContact CG1-CD1 4.2Å; V545-L549 WeakPolarHBondContact O-CG 3.34Å; V545-L549 PolarHBondContact O-N 3.04Å; L546-L549 PolarHBondContact O-N 2.84Å; S547-L549 VanDerWaalsContact C-N 3.25Å; S547-L549 PolarHBondContact O-N 3.34Å; L549-P552 WeakPolarHBondContact O-CD 3.08Å; L549-L553 WeakPolarHBondContact O-CB 3.45Å; L549-L553 WeakPolarHBondContact O-CD1 3.21Å; L549-L553 WeakPolarHBondContact O-CG 3.18Å; L549-L553 PolarHBondContact O-N 3.44Å
550I92Very high91.9Very high51 Ų5152.8 Ų52.826%0.26227%0.274SS..Hα-helixtrans-70.2-38.3-171.8-67.1167.3000112L546 L553 S554 Y562 F565L546-I550 HydrophobicContact CB-CD1 4.33Å; L546-I550 VanDerWaalsContact O-CB 3.31Å; L546-I550 WeakPolarHBondContact O-CB 3.12Å; L546-I550 VanDerWaalsContact O-CG1 3.22Å; L546-I550 WeakPolarHBondContact O-CG1 3.32Å; L546-I550 PolarHBondContact O-N 2.94Å; I550-L553 PolarHBondContact O-N 2.94Å; I550-S554 WeakPolarHBondContact O-CB 3.31Å; I550-S554 PolarHBondContact O-N 3.23Å; I550-S554 PolarHBondContact O-OG 3.21Å; I550-Y562 HydrophobicContact CG2-CD2 3.84Å; I550-Y562 HydrophobicContact CG2-CE2 4.13Å; I550-F565 HydrophobicContact CD1-CD1 4.15Å; I550-F565 HydrophobicContact CD1-CE1 3.44Å; I550-F565 VanDerWaalsContact CD1-CE1 3.44Å; I550-F565 HydrophobicContact CD1-CE2 4.11Å; I550-F565 HydrophobicContact CD1-CZ 3.41Å; I550-F565 VanDerWaalsContact CD1-CZ 3.41Å
551V91.5Very high91.9Very high0 Ų058.4 Ų58.40%031%0.308CS..Hα-helixtrans-67.9-43.9-175.9175.20000112.4F200 S547 S554 F556 L558 Y562F200-V551 HydrophobicContact CD1-CB 4.48Å; F200-V551 HydrophobicContact CD1-CG1 3.9Å; F200-V551 HydrophobicContact CE1-CB 3.62Å; F200-V551 HydrophobicContact CE1-CG1 3.48Å; F200-V551 VanDerWaalsContact CE1-CG1 3.48Å; F200-V551 HydrophobicContact CE1-CG2 3.96Å; F200-V551 HydrophobicContact CZ-CB 3.91Å; F200-V551 HydrophobicContact CZ-CG1 3.88Å; F200-V551 HydrophobicContact CZ-CG2 3.69Å; S547-V551 WeakPolarHBondContact O-CB 3.34Å; S547-V551 VanDerWaalsContact O-CG2 3.31Å; S547-V551 WeakPolarHBondContact O-CG2 3.46Å; S547-V551 PolarHBondContact O-N 3.31Å; S547-V551 VanDerWaalsContact O-N 3.1Å; V551-S554 WeakPolarHBondContact CA-OG 3.4Å; V551-S554 PolarHBondContact O-N 2.79Å; V551-S554 PolarHBondContact O-OG 3.18Å; V551-F556 HydrophobicContact CG1-CD1 3.94Å; V551-F556 WeakPolarHBondContact O-CA 3.45Å; V551-F556 PolarHBondContact O-N 3.03Å; V551-L558 HydrophobicContact CG1-CD1 3.88Å; V551-L558 HydrophobicContact CG2-CD1 4.47Å; V551-Y562 HydrophobicContact CG2-CE1 4.09Å; V551-Y562 HydrophobicContact CG2-CE2 3.84Å
552P91.8Very high91.8Very high40 Ų4058.2 Ų58.226%0.2630%0.302SS..Hα-helixtrans-65.1-39.3171.1-26.638.1000113.5L201 F548 L549 S554 Q555 F556L201-P552 HydrophobicContact CD2-CG 4.07Å; F548-P552 WeakPolarHBondContact O-CD 3.38Å; F548-P552 WeakPolarHBondContact O-CG 3.21Å; L549-P552 WeakPolarHBondContact O-CD 3.08Å; P552-S554 PolarHBondContact O-N 3.45Å; P552-Q555 PolarHBondContact O-N 3.01Å; P552-F556 HydrophobicContact CB-CZ 4.12Å; P552-F556 HydrophobicContact CG-CE1 4.24Å; P552-F556 HydrophobicContact CG-CZ 4.14Å
553L90.3Very high91.8Very high141 Ų14155.6 Ų55.674%0.73828%0.284SS*.Hα-helixtrans-61.9-33.3176.6-72.3172.2000112.1L549 I550 Q555L549-L553 WeakPolarHBondContact O-CB 3.45Å; L549-L553 WeakPolarHBondContact O-CD1 3.21Å; L549-L553 WeakPolarHBondContact O-CG 3.18Å; L549-L553 PolarHBondContact O-N 3.44Å; I550-L553 PolarHBondContact O-N 2.94Å; L553-Q555 PolarHBondContact O-N 3.21Å
554S88.5Confident91.9Very high44 Ų4459.2 Ų59.231%0.30831%0.306SS..THydrogen-bonded Turntrans-84.217.7173.855.20000114I550 V551 P552 F556 H557I550-S554 WeakPolarHBondContact O-CB 3.31Å; I550-S554 PolarHBondContact O-N 3.23Å; I550-S554 PolarHBondContact O-OG 3.21Å; V551-S554 WeakPolarHBondContact CA-OG 3.4Å; V551-S554 PolarHBondContact O-N 2.79Å; V551-S554 PolarHBondContact O-OG 3.18Å; P552-S554 PolarHBondContact O-N 3.45Å; S554-F556 PolarHBondContact O-N 3.24Å; S554-H557 WeakPolarHBondContact O-CB 3.37Å; S554-H557 PolarHBondContact O-N 3.26Å
555Q89.1Confident91.9Very high156 Ų15662.6 Ų62.673%0.72932%0.321SS*.THydrogen-bonded Turntrans55.335.6178.9-60.1-65.4-52.700112.9P552 L553 H557P552-Q555 PolarHBondContact O-N 3.01Å; L553-Q555 PolarHBondContact O-N 3.21Å; Q555-H557 PolarHBondContact O-N 2.87Å; Q555-H557 VanDerWaalsContact O-N 3.17Å
556F89.8Confident91.9Very high41 Ų4159.6 Ų59.618%0.1830%0.302CS..THydrogen-bonded Turntrans59.521-177.3-56.5-87.4000114.4T194 V195 S197 L201 V551 P552 S554T194-F556 WeakPolarHBondContact CA-O 3.43Å; V195-F556 PolarHBondContact N-O 3.04Å; S197-F556 VanDerWaalsContact CA-CD1 3.49Å; S197-F556 VanDerWaalsContact CA-CE1 3.47Å; S197-F556 VanDerWaalsContact CB-CE1 3.41Å; S197-F556 VanDerWaalsContact CB-CE2 3.47Å; L201-F556 HydrophobicContact CD1-CE1 4.14Å; L201-F556 HydrophobicContact CD1-CZ 3.95Å; L201-F556 HydrophobicContact CD2-CE1 4.5Å; L201-F556 HydrophobicContact CG-CE1 4.03Å; L201-F556 HydrophobicContact CG-CZ 4.34Å; V551-F556 HydrophobicContact CG1-CD1 3.94Å; V551-F556 WeakPolarHBondContact O-CA 3.45Å; V551-F556 PolarHBondContact O-N 3.03Å; P552-F556 HydrophobicContact CB-CZ 4.12Å; P552-F556 HydrophobicContact CG-CE1 4.24Å; P552-F556 HydrophobicContact CG-CZ 4.14Å; S554-F556 PolarHBondContact O-N 3.24Å
557H89.8Confident91.9Very high96 Ų9659 Ų5944%0.44430%0.299SS..EExtended strand (participates in β ladder)trans-93.1103.7174.4-161.287.9000110T194 S554 Q555 G559T194-H557 VanDerWaalsContact CG2-ND1 3.26Å; T194-H557 WeakPolarHBondContact CG2-ND1 3.41Å; S554-H557 WeakPolarHBondContact O-CB 3.37Å; S554-H557 PolarHBondContact O-N 3.26Å; Q555-H557 PolarHBondContact O-N 2.87Å; Q555-H557 VanDerWaalsContact O-N 3.17Å; H557-G559 VanDerWaalsContact C-N 3.35Å; H557-G559 PolarHBondContact O-N 2.94Å
558L88.2Confident92.1Very high1 Ų162.4 Ų62.41%0.00532%0.32CS..EExtended strand (participates in β ladder)trans-80.588.6174.4-82.970.8000108.8A188 P192 F193 V195 I494 V551 Y562A188-L558 HydrophobicContact CB-CB 4.4Å; P192-L558 VanDerWaalsContact CA-O 3.31Å; P192-L558 WeakPolarHBondContact CA-O 3.37Å; F193-L558 HydrophobicContact CD1-CB 4.39Å; F193-L558 HydrophobicContact CE1-CB 4.21Å; F193-L558 HydrophobicContact CE1-CD2 4.38Å; F193-L558 HydrophobicContact CZ-CD2 4.36Å; F193-L558 PolarHBondContact N-O 3.11Å; F193-L558 PolarHBondContact O-N 2.9Å; V195-L558 HydrophobicContact CB-CD1 3.79Å; V195-L558 HydrophobicContact CG2-CD1 3.31Å; V195-L558 HydrophobicContact CG2-CD2 3.9Å; V195-L558 HydrophobicContact CG2-CG 4.07Å; I494-L558 HydrophobicContact CD1-CD2 4.43Å; I494-L558 HydrophobicContact CG1-CD2 4.25Å; V551-L558 HydrophobicContact CG1-CD1 3.88Å; V551-L558 HydrophobicContact CG2-CD1 4.47Å; L558-Y562 HydrophobicContact CB-CD1 4.4Å; L558-Y562 HydrophobicContact CD2-CD1 4.04Å; L558-Y562 HydrophobicContact CD2-CE1 3.85Å; L558-Y562 HydrophobicContact CG-CD1 3.81Å; L558-Y562 HydrophobicContact CG-CE1 3.98Å
559G90.3Very high92.1Very high11 Ų1160.4 Ų60.411%0.11331%0.313CS..  trans-81.1170.517400000112.9H557 T561 Y562 G563H557-G559 VanDerWaalsContact C-N 3.35Å; H557-G559 PolarHBondContact O-N 2.94Å; G559-T561 PolarHBondContact O-N 3.18Å; G559-Y562 PolarHBondContact O-N 3.38Å; G559-G563 PolarHBondContact O-N 3.36Å
560R93.7Very high92Very high156 Ų15657 Ų5759%0.58929%0.293SS*.Hα-helixtrans-60.2-31.3174.7-65.4-174.9175.5156.52.9112.7L189 G563 V564L189-R560 HydrophobicContact CD2-CB 4.09Å; L189-R560 WeakPolarHBondContact CD2-O 3.37Å; L189-R560 PolarHBondContact O-NE 3.24Å; R560-G563 PolarHBondContact O-N 2.8Å; R560-V564 WeakPolarHBondContact O-CG2 3.39Å; R560-V564 PolarHBondContact O-N 3.24Å
561T92.1Very high92Very high118 Ų11858 Ų5872%0.72431%0.305SS*.Hα-helixtrans-61.1-43.1177.1480000112.1G559 G563 V564 F565G559-T561 PolarHBondContact O-N 3.18Å; T561-G563 VanDerWaalsContact C-N 3.34Å; T561-V564 PolarHBondContact O-N 3.28Å; T561-F565 WeakPolarHBondContact O-CB 3Å; T561-F565 PolarHBondContact O-N 3.42Å
562Y92.2Very high92Very high13 Ų1362.2 Ų62.25%0.05133%0.327CS..Hα-helixtrans-63.8-40.5174.1178-110000111.5S547 I550 V551 L558 G559 F565 L566S547-Y562 VanDerWaalsContact CB-OH 3.31Å; S547-Y562 WeakPolarHBondContact CB-OH 3.45Å; S547-Y562 PolarHBondContact OG-OH 2.92Å; I550-Y562 HydrophobicContact CG2-CD2 3.84Å; I550-Y562 HydrophobicContact CG2-CE2 4.13Å; V551-Y562 HydrophobicContact CG2-CE1 4.09Å; V551-Y562 HydrophobicContact CG2-CE2 3.84Å; L558-Y562 HydrophobicContact CB-CD1 4.4Å; L558-Y562 HydrophobicContact CD2-CD1 4.04Å; L558-Y562 HydrophobicContact CD2-CE1 3.85Å; L558-Y562 HydrophobicContact CG-CD1 3.81Å; L558-Y562 HydrophobicContact CG-CE1 3.98Å; G559-Y562 PolarHBondContact O-N 3.38Å; Y562-F565 HydrophobicContact CD2-CD1 4.29Å; Y562-F565 HydrophobicContact CE2-CD1 4.38Å; Y562-F565 WeakPolarHBondContact O-CB 3.46Å; Y562-F565 PolarHBondContact O-N 2.93Å; Y562-L566 HydrophobicContact CD1-CD1 4.11Å; Y562-L566 HydrophobicContact CE1-CD1 3.5Å; Y562-L566 HydrophobicContact CE1-CG 4.18Å; Y562-L566 HydrophobicContact CE2-CD1 4.38Å; Y562-L566 HydrophobicContact CE2-CD2 4.28Å; Y562-L566 HydrophobicContact CE2-CG 4.2Å; Y562-L566 PolarHBondContact O-N 3.47Å
563G93.1Very high91.9Very high0 Ų060.9 Ų60.90%032%0.317CS..Hα-helixtrans-60.9-44.8174.400000113.4G559 R560 T561 L566 L567G559-G563 PolarHBondContact O-N 3.36Å; R560-G563 PolarHBondContact O-N 2.8Å; T561-G563 VanDerWaalsContact C-N 3.34Å; G563-L566 PolarHBondContact O-N 3.02Å; G563-L567 WeakPolarHBondContact O-CG 3.32Å; G563-L567 PolarHBondContact O-N 3.2Å; G563-L567 VanDerWaalsContact O-N 3.16Å
564V95.1Very high91.7Very high77 Ų7756.9 Ų56.947%0.46730%0.296SS..Hα-helixtrans-61.7-44173.9176.50000110.9L189 R560 T561 L566 L567 V568L189-V564 HydrophobicContact CD2-CG2 3.79Å; R560-V564 WeakPolarHBondContact O-CG2 3.39Å; R560-V564 PolarHBondContact O-N 3.24Å; T561-V564 PolarHBondContact O-N 3.28Å; V564-L566 VanDerWaalsContact C-N 3.34Å; V564-L566 PolarHBondContact O-N 3.42Å; V564-L567 PolarHBondContact O-N 3.28Å; V564-V568 HydrophobicContact CG1-CG2 4.2Å; V564-V568 WeakPolarHBondContact O-CG2 3.37Å; V564-V568 PolarHBondContact O-N 3.05Å
565F94.8Very high91.7Very high72 Ų7259.5 Ų59.532%0.31631%0.306SS..Hα-helixtrans-55.9-46.7177.5165.9-96.9000112.2L546 I550 T561 Y562 L567 V568 L569L546-F565 HydrophobicContact CB-CZ 4.36Å; L546-F565 HydrophobicContact CD1-CZ 4.19Å; I550-F565 HydrophobicContact CD1-CD1 4.15Å; I550-F565 HydrophobicContact CD1-CE1 3.44Å; I550-F565 VanDerWaalsContact CD1-CE1 3.44Å; I550-F565 HydrophobicContact CD1-CE2 4.11Å; I550-F565 HydrophobicContact CD1-CZ 3.41Å; I550-F565 VanDerWaalsContact CD1-CZ 3.41Å; T561-F565 WeakPolarHBondContact O-CB 3Å; T561-F565 PolarHBondContact O-N 3.42Å; Y562-F565 HydrophobicContact CD2-CD1 4.29Å; Y562-F565 HydrophobicContact CE2-CD1 4.38Å; Y562-F565 WeakPolarHBondContact O-CB 3.46Å; Y562-F565 PolarHBondContact O-N 2.93Å; F565-L567 PolarHBondContact O-N 3.36Å; F565-V568 PolarHBondContact O-N 2.99Å; F565-L569 WeakPolarHBondContact O-CB 3.16Å; F565-L569 PolarHBondContact O-N 3.2Å
566L94.3Very high91.6Very high0 Ų055.5 Ų55.50%029%0.289CS..Hα-helixtrans-63-41.2177.7-72.1178.8000112.7T181 A184 Y562 G563 V564 L569 Y570T181-L566 HydrophobicContact CG2-CD2 4.39Å; T181-L566 WeakPolarHBondContact O-CB 3.47Å; A184-L566 HydrophobicContact CB-CD1 4.29Å; Y562-L566 HydrophobicContact CD1-CD1 4.11Å; Y562-L566 HydrophobicContact CE1-CD1 3.5Å; Y562-L566 HydrophobicContact CE1-CG 4.18Å; Y562-L566 HydrophobicContact CE2-CD1 4.38Å; Y562-L566 HydrophobicContact CE2-CD2 4.28Å; Y562-L566 HydrophobicContact CE2-CG 4.2Å; Y562-L566 PolarHBondContact O-N 3.47Å; G563-L566 PolarHBondContact O-N 3.02Å; V564-L566 VanDerWaalsContact C-N 3.34Å; V564-L566 PolarHBondContact O-N 3.42Å; L566-L569 WeakPolarHBondContact O-CB 3.45Å; L566-L569 PolarHBondContact O-N 2.93Å; L566-Y570 PolarHBondContact O-N 2.8Å
567L94.9Very high91.2Very high49 Ų4953.6 Ų53.626%0.25728%0.281SS..Hα-helixtrans-66.3-37.8176.8-68.8-178.5000112.7V182 L189 G563 V564 F565 Y570 S571V182-L567 HydrophobicContact CB-CD2 4.3Å; V182-L567 HydrophobicContact CG1-CD2 4.14Å; V182-L567 HydrophobicContact CG2-CD2 4.31Å; L189-L567 HydrophobicContact CD1-CD1 3.5Å; L189-L567 VanDerWaalsContact CD1-CD1 3.5Å; G563-L567 WeakPolarHBondContact O-CG 3.32Å; G563-L567 PolarHBondContact O-N 3.2Å; G563-L567 VanDerWaalsContact O-N 3.16Å; V564-L567 PolarHBondContact O-N 3.28Å; F565-L567 PolarHBondContact O-N 3.36Å; L567-Y570 PolarHBondContact O-N 3.17Å; L567-S571 WeakPolarHBondContact O-CB 3.26Å; L567-S571 PolarHBondContact O-N 3.34Å; L567-S571 PolarHBondContact O-OG 3.33Å
568V95.1Very high90.8Very high74 Ų7451.6 Ų51.645%0.44827%0.273SS..Hα-helixtrans-65-44.1174.4170.90000110.2V564 F565 Y570 S571 I572V564-V568 HydrophobicContact CG1-CG2 4.2Å; V564-V568 WeakPolarHBondContact O-CG2 3.37Å; V564-V568 PolarHBondContact O-N 3.05Å; F565-V568 PolarHBondContact O-N 2.99Å; V568-Y570 VanDerWaalsContact C-N 3.33Å; V568-Y570 PolarHBondContact O-N 3.03Å; V568-S571 PolarHBondContact O-N 2.99Å; V568-S571 VanDerWaalsContact O-N 3.17Å; V568-I572 HydrophobicContact CG1-CD1 3.91Å; V568-I572 HydrophobicContact CG1-CG1 4.48Å; V568-I572 WeakPolarHBondContact O-CG1 3.39Å; V568-I572 PolarHBondContact O-N 3.04Å
569L93.1Very high90.6Very high36 Ų3654 Ų5419%0.18829%0.286CS..Hα-helixtrans-57.8-45.6176.4-174.669000111.6T181 L546 F565 L566 I572 F573T181-L569 HydrophobicContact CG2-CD2 4.38Å; L546-L569 HydrophobicContact CD1-CD1 4.16Å; L546-L569 HydrophobicContact CD1-CD2 4.18Å; F565-L569 WeakPolarHBondContact O-CB 3.16Å; F565-L569 PolarHBondContact O-N 3.2Å; L566-L569 WeakPolarHBondContact O-CB 3.45Å; L566-L569 PolarHBondContact O-N 2.93Å; L569-I572 PolarHBondContact O-N 3.49Å; L569-F573 PolarHBondContact O-N 3.45Å
570Y92.8Very high90Very high21 Ų2154.9 Ų54.98%0.08229%0.289CS..Hα-helixtrans-63.4-41.9175.3-175.2-101.3000112.7I177 F178 T181 V182 L566 L567 V568 I572 F573 L574I177-Y570 HydrophobicContact CG1-CD2 4.34Å; I177-Y570 HydrophobicContact CG2-CE2 4.45Å; F178-Y570 HydrophobicContact CB-CE2 4.22Å; F178-Y570 HydrophobicContact CD2-CE1 4.43Å; F178-Y570 HydrophobicContact CD2-CE2 4.15Å; F178-Y570 AromaticContact CD2-CZ 3.83Å; T181-Y570 WeakPolarHBondContact OG1-CB 3.41Å; T181-Y570 VanDerWaalsContact OG1-CD2 3.26Å; T181-Y570 WeakPolarHBondContact OG1-CD2 3.32Å; V182-Y570 HydrophobicContact CG2-CD1 3.37Å; V182-Y570 HydrophobicContact CG2-CD2 3.8Å; V182-Y570 HydrophobicContact CG2-CE1 3.7Å; V182-Y570 HydrophobicContact CG2-CE2 4.11Å; V182-Y570 HydrophobicContact CG2-CG 3.42Å; V182-Y570 VanDerWaalsContact CG2-CG 3.42Å; L566-Y570 PolarHBondContact O-N 2.8Å; L567-Y570 PolarHBondContact O-N 3.17Å; V568-Y570 VanDerWaalsContact C-N 3.33Å; V568-Y570 PolarHBondContact O-N 3.03Å; Y570-I572 VanDerWaalsContact C-N 3.31Å; Y570-I572 PolarHBondContact O-N 3.21Å; Y570-F573 HydrophobicContact CD2-CD1 4.07Å; Y570-F573 HydrophobicContact CE2-CD1 4.02Å; Y570-F573 HydrophobicContact CE2-CE1 4.14Å; Y570-F573 WeakPolarHBondContact O-CB 3.16Å; Y570-F573 PolarHBondContact O-N 3.32Å; Y570-L574 HydrophobicContact CE1-CB 4.48Å; Y570-L574 HydrophobicContact CE1-CD1 3.72Å; Y570-L574 WeakPolarHBondContact O-CB 3.42Å; Y570-L574 PolarHBondContact O-N 3.48Å
571S91.9Very high89.2Confident72 Ų7250.5 Ų50.550%0.50328%0.275SS..Hα-helixtrans-63-38.8179.1-57.90000111.8L567 V568 L575L567-S571 WeakPolarHBondContact O-CB 3.26Å; L567-S571 PolarHBondContact O-N 3.34Å; L567-S571 PolarHBondContact O-OG 3.33Å; V568-S571 PolarHBondContact O-N 2.99Å; V568-S571 VanDerWaalsContact O-N 3.17Å; S571-L575 WeakPolarHBondContact O-CB 3.44Å; S571-L575 PolarHBondContact O-N 2.99Å
572I91.3Very high88.5Confident89 Ų8951.2 Ų51.246%0.45627%0.268SS..Hα-helixtrans-64.2-46.4173.9-68.1165.5000110.4V568 L569 Y570 L575 I576V568-I572 HydrophobicContact CG1-CD1 3.91Å; V568-I572 HydrophobicContact CG1-CG1 4.48Å; V568-I572 WeakPolarHBondContact O-CG1 3.39Å; V568-I572 PolarHBondContact O-N 3.04Å; L569-I572 PolarHBondContact O-N 3.49Å; Y570-I572 VanDerWaalsContact C-N 3.31Å; Y570-I572 PolarHBondContact O-N 3.21Å; I572-L575 PolarHBondContact O-N 3.37Å; I572-I576 HydrophobicContact CG2-CD1 3.86Å; I572-I576 VanDerWaalsContact O-CG1 3.32Å; I572-I576 WeakPolarHBondContact O-CG1 3.44Å; I572-I576 PolarHBondContact O-N 3.32Å
573F89.1Confident87.6Confident12 Ų1252 Ų525%0.05328%0.28CS..Hα-helixtrans-58.4-48.4176.2156.7-100.9000112.1I177 V536 A539 L569 Y570 L575 I576 A577I177-F573 HydrophobicContact CD1-CB 4.09Å; I177-F573 HydrophobicContact CD1-CD1 3.77Å; I177-F573 HydrophobicContact CD1-CD2 3.91Å; I177-F573 HydrophobicContact CD1-CE1 4.18Å; I177-F573 HydrophobicContact CD1-CE2 4.3Å; I177-F573 HydrophobicContact CD1-CG 3.62Å; I177-F573 HydrophobicContact CD1-CZ 4.43Å; I177-F573 HydrophobicContact CG2-CD1 4.43Å; I177-F573 HydrophobicContact CG2-CE1 3.91Å; I177-F573 HydrophobicContact CG2-CZ 4.14Å; V536-F573 HydrophobicContact CB-CE2 4.35Å; V536-F573 HydrophobicContact CG1-CZ 4.32Å; V536-F573 HydrophobicContact CG2-CE2 3.87Å; V536-F573 HydrophobicContact CG2-CZ 3.9Å; A539-F573 HydrophobicContact CB-CD2 3.47Å; A539-F573 VanDerWaalsContact CB-CD2 3.47Å; A539-F573 HydrophobicContact CB-CE2 3.97Å; A539-F573 HydrophobicContact CB-CG 4.25Å; L569-F573 PolarHBondContact O-N 3.45Å; Y570-F573 HydrophobicContact CD2-CD1 4.07Å; Y570-F573 HydrophobicContact CE2-CD1 4.02Å; Y570-F573 HydrophobicContact CE2-CE1 4.14Å; Y570-F573 WeakPolarHBondContact O-CB 3.16Å; Y570-F573 PolarHBondContact O-N 3.32Å; F573-L575 VanDerWaalsContact C-N 3.3Å; F573-L575 PolarHBondContact O-N 3.5Å; F573-I576 PolarHBondContact O-N 2.99Å; F573-I576 VanDerWaalsContact O-N 3.17Å; F573-A577 PolarHBondContact O-N 2.94Å
574L87.3Confident86.9Confident56 Ų5657.5 Ų57.529%0.29331%0.309SS..Hα-helixtrans-62.9-39.8-179.7-170.9152.3000110.9Y570 A577 L578Y570-L574 HydrophobicContact CE1-CB 4.48Å; Y570-L574 HydrophobicContact CE1-CD1 3.72Å; Y570-L574 WeakPolarHBondContact O-CB 3.42Å; Y570-L574 PolarHBondContact O-N 3.48Å; L574-A577 PolarHBondContact O-N 2.91Å; L574-L578 HydrophobicContact CD2-CD1 3.53Å; L574-L578 HydrophobicContact CD2-CG 4.12Å; L574-L578 WeakPolarHBondContact O-CG 3.47Å; L574-L578 PolarHBondContact O-N 3.06Å
575L87.7Confident85.7Confident100 Ų10057.2 Ų57.252%0.52430%0.303SS..Hα-helixtrans-60.9-46.6173.7-178.865.6000111.6S571 I572 F573 L578 L579S571-L575 WeakPolarHBondContact O-CB 3.44Å; S571-L575 PolarHBondContact O-N 2.99Å; I572-L575 PolarHBondContact O-N 3.37Å; F573-L575 VanDerWaalsContact C-N 3.3Å; F573-L575 PolarHBondContact O-N 3.5Å; L575-L578 PolarHBondContact O-N 3.03Å; L575-L579 HydrophobicContact CD1-CD1 4.08Å; L575-L579 HydrophobicContact CD1-CG 4.17Å; L575-L579 HydrophobicContact CG-CD1 3.88Å; L575-L579 HydrophobicContact CG-CG 4.36Å; L575-L579 WeakPolarHBondContact O-CB 3.41Å; L575-L579 VanDerWaalsContact O-CG 3.23Å; L575-L579 WeakPolarHBondContact O-CG 3.45Å; L575-L579 PolarHBondContact O-N 3.29Å
576I86.3Confident83.9Confident72 Ų7261.9 Ų61.937%0.36933%0.326SS..Hα-helixtrans-60.3-47.9177.4-68.7165.2000110.3I535 I572 F573 L578 L579 T580I535-I576 HydrophobicContact CG2-CG2 4.36Å; I572-I576 HydrophobicContact CG2-CD1 3.86Å; I572-I576 VanDerWaalsContact O-CG1 3.32Å; I572-I576 WeakPolarHBondContact O-CG1 3.44Å; I572-I576 PolarHBondContact O-N 3.32Å; F573-I576 PolarHBondContact O-N 2.99Å; F573-I576 VanDerWaalsContact O-N 3.17Å; I576-L578 VanDerWaalsContact C-N 3.35Å; I576-L578 PolarHBondContact O-N 3.46Å; I576-L579 PolarHBondContact O-N 3Å; I576-T580 PolarHBondContact O-N 3.2Å; I576-T580 PolarHBondContact O-OG1 3.43Å; I576-T580 VanDerWaalsContact O-OG1 3.08Å
577A81.6Confident81.6Confident1 Ų169.8 Ų69.81%0.00837%0.374CS..Hα-helixtrans-57.9-45179.400000112.3T467 L532 F573 L574 E581T467-A577 HydrophobicContact CG2-CB 4.24Å; L532-A577 HydrophobicContact CD1-CB 3.95Å; F573-A577 PolarHBondContact O-N 2.94Å; L574-A577 PolarHBondContact O-N 2.91Å; A577-E581 PolarHBondContact O-N 3.45Å
578L81.5Confident81Confident54 Ų5470.8 Ų70.828%0.28338%0.38SS..Hα-helixtrans-68.4-39.2177-69.3179.9000112.6V463 L574 L575 I576 E581 F582V463-L578 HydrophobicContact CG1-CD2 4.38Å; L574-L578 HydrophobicContact CD2-CD1 3.53Å; L574-L578 HydrophobicContact CD2-CG 4.12Å; L574-L578 WeakPolarHBondContact O-CG 3.47Å; L574-L578 PolarHBondContact O-N 3.06Å; L575-L578 PolarHBondContact O-N 3.03Å; I576-L578 VanDerWaalsContact C-N 3.35Å; I576-L578 PolarHBondContact O-N 3.46Å; L578-E581 WeakPolarHBondContact O-CB 3.43Å; L578-E581 PolarHBondContact O-N 3.26Å; L578-F582 HydrophobicContact CB-CD2 4.5Å; L578-F582 HydrophobicContact CB-CE2 4.31Å; L578-F582 WeakPolarHBondContact O-CD2 3.49Å; L578-F582 PolarHBondContact O-N 3Å
579L83.9Confident80.2Confident52 Ų5270.6 Ų70.627%0.27238%0.377SS..Hα-helixtrans-68.6-34.1179.3-73.1175.4000112.8L575 I576 E581 I584 I585L575-L579 HydrophobicContact CD1-CD1 4.08Å; L575-L579 HydrophobicContact CD1-CG 4.17Å; L575-L579 HydrophobicContact CG-CD1 3.88Å; L575-L579 HydrophobicContact CG-CG 4.36Å; L575-L579 WeakPolarHBondContact O-CB 3.41Å; L575-L579 VanDerWaalsContact O-CG 3.23Å; L575-L579 WeakPolarHBondContact O-CG 3.45Å; L575-L579 PolarHBondContact O-N 3.29Å; I576-L579 PolarHBondContact O-N 3Å; L579-E581 VanDerWaalsContact C-N 3.34Å; L579-I584 HydrophobicContact CD2-CB 4.34Å; L579-I584 HydrophobicContact CD2-CD1 3.91Å; L579-I584 HydrophobicContact CD2-CG2 4.36Å; L579-I584 PolarHBondContact O-N 3.25Å; L579-I585 HydrophobicContact CB-CD1 3.49Å; L579-I585 VanDerWaalsContact CB-CD1 3.49Å; L579-I585 HydrophobicContact CB-CG1 3.89Å; L579-I585 HydrophobicContact CD1-CD1 4.14Å; L579-I585 HydrophobicContact CG-CD1 4.48Å; L579-I585 PolarHBondContact O-N 3.27Å
580T79.2Confident79.5Confident29 Ų2972.6 Ų72.618%0.17839%0.387CS..Hα-helixtrans-64-41.6171.1-60.90000110.8L531 I535 I576 G583L531-T580 HydrophobicContact CD2-CG2 4.14Å; I535-T580 HydrophobicContact CD1-CG2 4.27Å; I576-T580 PolarHBondContact O-N 3.2Å; I576-T580 PolarHBondContact O-OG1 3.43Å; I576-T580 VanDerWaalsContact O-OG1 3.08Å; T580-G583 PolarHBondContact O-N 3.35Å
581E75.4Confident78.8Confident64 Ų6475.6 Ų75.630%0.29941%0.405SS..Hα-helixtrans-65.1-46.8179.517861.7-171.200113.4S460 V463 A577 L578 L579 G583S460-E581 WeakPolarHBondContact CB-OE1 3.47Å; S460-E581 PolarHBondContact N-OE1 3.39Å; S460-E581 PolarHBondContact OG-OE1 3.39Å; S460-E581 PolarHBondContact OG-OE2 2.99Å; V463-E581 HydrophobicContact CB-CG 4.44Å; V463-E581 HydrophobicContact CG2-CB 3.7Å; V463-E581 VanDerWaalsContact CG2-CD 3.49Å; V463-E581 HydrophobicContact CG2-CG 3.65Å; V463-E581 WeakPolarHBondContact CG2-OE2 3.48Å; A577-E581 PolarHBondContact O-N 3.45Å; L578-E581 WeakPolarHBondContact O-CB 3.43Å; L578-E581 PolarHBondContact O-N 3.26Å; L579-E581 VanDerWaalsContact C-N 3.34Å; E581-G583 PolarHBondContact O-N 2.95Å
582F79.1Confident77.9Confident133 Ų13375.8 Ų75.858%0.58340%0.399SS*.THydrogen-bonded Turntrans-71.46.3179.1-67.6-61.6000113.2L459 L578 I584L459-F582 HydrophobicContact CD2-CZ 4.38Å; L578-F582 HydrophobicContact CB-CD2 4.5Å; L578-F582 HydrophobicContact CB-CE2 4.31Å; L578-F582 WeakPolarHBondContact O-CD2 3.49Å; L578-F582 PolarHBondContact O-N 3Å; F582-I584 HydrophobicContact CB-CD1 4.13Å; F582-I584 HydrophobicContact CB-CG1 4.11Å; F582-I584 PolarHBondContact O-N 3.41Å; F582-I584 VanDerWaalsContact O-N 3.13Å
583G72.3Confident77Confident30 Ų3074.9 Ų74.931%0.30940%0.395SS..THydrogen-bonded Turntrans64.416179.200000113.5T580 E581 H586T580-G583 PolarHBondContact O-N 3.35Å; E581-G583 PolarHBondContact O-N 2.95Å; G583-H586 PolarHBondContact O-CE1 3.33Å; G583-H586 PolarHBondContact O-ND1 3.36Å; G583-H586 PolarHBondContact O-NE2 3.42Å
584I78.4Confident76.2Confident115 Ų11579.4 Ų79.459%0.5942%0.419SS*.SBendtrans-74.7-38.7178.1-62.1174.7000109.4L579 F582 H586L579-I584 HydrophobicContact CD2-CB 4.34Å; L579-I584 HydrophobicContact CD2-CD1 3.91Å; L579-I584 HydrophobicContact CD2-CG2 4.36Å; L579-I584 PolarHBondContact O-N 3.25Å; F582-I584 HydrophobicContact CB-CD1 4.13Å; F582-I584 HydrophobicContact CB-CG1 4.11Å; F582-I584 PolarHBondContact O-N 3.41Å; F582-I584 VanDerWaalsContact O-N 3.13Å; I584-H586 PolarHBondContact O-N 3.5Å
585I70.2Confident75.3Confident70 Ų7081.2 Ų81.236%0.35943%0.429SS..SBendtrans-89.793.5168.1-59.6170.8000106.8L579 T587L579-I585 HydrophobicContact CB-CD1 3.49Å; L579-I585 VanDerWaalsContact CB-CD1 3.49Å; L579-I585 HydrophobicContact CB-CG1 3.89Å; L579-I585 HydrophobicContact CD1-CD1 4.14Å; L579-I585 HydrophobicContact CG-CD1 4.48Å; L579-I585 PolarHBondContact O-N 3.27Å; I585-T587 PolarHBondContact O-N 3.47Å
586H55.6Low74.3Confident170 Ų17079.7 Ų79.779%0.78742%0.421SS*.  trans-70.5124.9167.5-65.1-58.4000109.1G583 I584G583-H586 PolarHBondContact O-CE1 3.33Å; G583-H586 PolarHBondContact O-ND1 3.36Å; G583-H586 PolarHBondContact O-NE2 3.42Å; I584-H586 PolarHBondContact O-N 3.5Å
587T48Very low73.2Confident166 Ų16680.4 Ų80.4100%1.01843%0.426SS*.  trans-98.90164.150.20000111L531 I585L531-T587 HydrophobicContact CD2-CG2 3.5Å; I585-T587 PolarHBondContact O-N 3.47Å

Retrieved 587 of 587 residues in 290.4 ms (Link to these results)